*HEADER PROTEIN BINDING 01-NOV-10 2L5F
*TITLE SOLUTION STRUCTURE OF THE TANDEM WW DOMAINS FROM HYPA/FBP11
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: PRE-MRNA-PROCESSING FACTOR 40 HOMOLOG A;
*COMPND 3 CHAIN: A;
*COMPND 4 FRAGMENT: WW DOMAINS (UNP RESIDUES 133-220);
*COMPND 5 SYNONYM: FAS LIGAND-ASSOCIATED FACTOR 1, FORMIN-BINDING PROTEIN 11,
*COMPND 6 FORMIN-BINDING PROTEIN 3, HUNTINGTIN YEAST PARTNER A, HUNTINGTIN-
*COMPND 7 INTERACTING PROTEIN 10, HIP-10, HUNTINGTIN-INTERACTING PROTEIN A,
*COMPND 8 RENAL CARCINOMA ANTIGEN NY-REN-6;
*COMPND 9 ENGINEERED: YES;
*COMPND 10 MUTATION: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
*SOURCE 3 ORGANISM_COMMON: HUMAN;
*SOURCE 4 ORGANISM_TAXID: 9606;
*SOURCE 5 GENE: PRPF40A, FBP11, FLAF1, FNBP3, HIP10, HYPA, HSPC225;
*SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562;
*SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;
*SOURCE 9 EXPRESSION_SYSTEM_VECTOR: PET-22B
*KEYWDS 2WW, HYPA, FBP11, PROTEIN BINDING
*EXPDTA SOLUTION NMR
*NUMMDL 10
*AUTHOR Y.JIANG, H.HU
*REVDAT 1 11-MAY-11 2L5F 0
# dihedral #
assign (resid 14 and name C ) (resid 15 and name N )
(resid 15 and name CA) (resid 15 and name C ) 1.0 -80.310 26.980 2
assign (resid 15 and name N ) (resid 15 and name CA)
(resid 15 and name C ) (resid 16 and name N ) 1.0 138.970 28.080 2
assign (resid 15 and name C ) (resid 16 and name N )
(resid 16 and name CA) (resid 16 and name C ) 1.0 -113.750 23.880 2
assign (resid 16 and name N ) (resid 16 and name CA)
(resid 16 and name C ) (resid 17 and name N ) 1.0 148.870 13.730 2
assign (resid 16 and name C ) (resid 17 and name N )
(resid 17 and name CA) (resid 17 and name C ) 1.0 -115.990 25.940 2
assign (resid 17 and name N ) (resid 17 and name CA)
(resid 17 and name C ) (resid 18 and name N ) 1.0 139.840 12.620 2
assign (resid 17 and name C ) (resid 18 and name N )
(resid 18 and name CA) (resid 18 and name C ) 1.0 -96.690 21.870 2
assign (resid 18 and name N ) (resid 18 and name CA)
(resid 18 and name C ) (resid 19 and name N ) 1.0 138.950 11.470 2
assign (resid 18 and name C ) (resid 19 and name N )
(resid 19 and name CA) (resid 19 and name C ) 1.0 -121.750 26.640 2
assign (resid 19 and name N ) (resid 19 and name CA)
(resid 19 and name C ) (resid 20 and name N ) 1.0 150.080 14.280 2
assign (resid 19 and name C ) (resid 20 and name N )
(resid 20 and name CA) (resid 20 and name C ) 1.0 -123.180 20.760 2
assign (resid 20 and name N ) (resid 20 and name CA)
(resid 20 and name C ) (resid 21 and name N ) 1.0 132.120 13.600 2
assign (resid 20 and name C ) (resid 21 and name N )
(resid 21 and name CA) (resid 21 and name C ) 1.0 -78.830 22.550 2
assign (resid 21 and name N ) (resid 21 and name CA)
(resid 21 and name C ) (resid 22 and name N ) 1.0 135.120 12.990 2
assign (resid 21 and name C ) (resid 22 and name N )
(resid 22 and name CA) (resid 22 and name C ) 1.0 -62.660 17.220 2
assign (resid 22 and name N ) (resid 22 and name CA)
(resid 22 and name C ) (resid 23 and name N ) 1.0 -31.380 16.180 2
assign (resid 22 and name C ) (resid 23 and name N )
(resid 23 and name CA) (resid 23 and name C ) 1.0 -86.040 9.450 2
assign (resid 23 and name N ) (resid 23 and name CA)
(resid 23 and name C ) (resid 24 and name N ) 1.0 1.760 8.800 2
assign (resid 23 and name C ) (resid 24 and name N )
(resid 24 and name CA) (resid 24 and name C ) 1.0 85.890 20.720 2
assign (resid 24 and name N ) (resid 24 and name CA)
(resid 24 and name C ) (resid 25 and name N ) 1.0 2.540 20.910 2
assign (resid 24 and name C ) (resid 25 and name N )
(resid 25 and name CA) (resid 25 and name C ) 1.0 -72.600 13.930 2
assign (resid 25 and name N ) (resid 25 and name CA)
(resid 25 and name C ) (resid 26 and name N ) 1.0 135.080 14.290 2
assign (resid 25 and name C ) (resid 26 and name N )
(resid 26 and name CA) (resid 26 and name C ) 1.0 -99.100 20.630 2
assign (resid 26 and name N ) (resid 26 and name CA)
(resid 26 and name C ) (resid 27 and name N ) 1.0 134.330 12.550 2
assign (resid 26 and name C ) (resid 27 and name N )
(resid 27 and name CA) (resid 27 and name C ) 1.0 -142.320 15.580 2
assign (resid 27 and name N ) (resid 27 and name CA)
(resid 27 and name C ) (resid 28 and name N ) 1.0 165.160 15.330 2
assign (resid 27 and name C ) (resid 28 and name N )
(resid 28 and name CA) (resid 28 and name C ) 1.0 -125.320 9.340 2
assign (resid 28 and name N ) (resid 28 and name CA)
(resid 28 and name C ) (resid 29 and name N ) 1.0 136.970 12.240 2
assign (resid 28 and name C ) (resid 29 and name N )
(resid 29 and name CA) (resid 29 and name C ) 1.0 -134.470 16.840 2
assign (resid 29 and name N ) (resid 29 and name CA)
(resid 29 and name C ) (resid 30 and name N ) 1.0 134.410 9.820 2
assign (resid 29 and name C ) (resid 30 and name N )
(resid 30 and name CA) (resid 30 and name C ) 1.0 -94.910 24.970 2
assign (resid 30 and name N ) (resid 30 and name CA)
(resid 30 and name C ) (resid 31 and name N ) 1.0 125.800 16.640 2
assign (resid 30 and name C ) (resid 31 and name N )
(resid 31 and name CA) (resid 31 and name C ) 1.0 -65.250 3.780 2
assign (resid 31 and name N ) (resid 31 and name CA)
(resid 31 and name C ) (resid 32 and name N ) 1.0 -29.080 15.480 2
assign (resid 31 and name C ) (resid 32 and name N )
(resid 32 and name CA) (resid 32 and name C ) 1.0 -70.050 15.530 2
assign (resid 32 and name N ) (resid 32 and name CA)
(resid 32 and name C ) (resid 33 and name N ) 1.0 -36.430 12.140 2
assign (resid 32 and name C ) (resid 33 and name N )
(resid 33 and name CA) (resid 33 and name C ) 1.0 -88.250 21.620 2
assign (resid 33 and name N ) (resid 33 and name CA)
(resid 33 and name C ) (resid 34 and name N ) 1.0 -1.560 18.300 2
assign (resid 33 and name C ) (resid 34 and name N )
(resid 34 and name CA) (resid 34 and name C ) 1.0 59.790 7.070 2
assign (resid 34 and name N ) (resid 34 and name CA)
(resid 34 and name C ) (resid 35 and name N ) 1.0 30.200 16.850 2
assign (resid 34 and name C ) (resid 35 and name N )
(resid 35 and name CA) (resid 35 and name C ) 1.0 -91.560 18.550 2
assign (resid 35 and name N ) (resid 35 and name CA)
(resid 35 and name C ) (resid 36 and name N ) 1.0 150.190 13.640 2
assign (resid 35 and name C ) (resid 36 and name N )
(resid 36 and name CA) (resid 36 and name C ) 1.0 -127.410 17.210 2
assign (resid 36 and name N ) (resid 36 and name CA)
(resid 36 and name C ) (resid 37 and name N ) 1.0 146.320 17.380 2
assign (resid 36 and name C ) (resid 37 and name N )
(resid 37 and name CA) (resid 37 and name C ) 1.0 -131.240 19.640 2
assign (resid 37 and name N ) (resid 37 and name CA)
(resid 37 and name C ) (resid 38 and name N ) 1.0 141.810 19.360 2
assign (resid 37 and name C ) (resid 38 and name N )
(resid 38 and name CA) (resid 38 and name C ) 1.0 -91.210 22.670 2
assign (resid 38 and name N ) (resid 38 and name CA)
(resid 38 and name C ) (resid 39 and name N ) 1.0 160.910 12.510 2
assign (resid 38 and name C ) (resid 39 and name N )
(resid 39 and name CA) (resid 39 and name C ) 1.0 -69.020 15.320 2
assign (resid 39 and name N ) (resid 39 and name CA)
(resid 39 and name C ) (resid 40 and name N ) 1.0 134.720 18.490 2
assign (resid 39 and name C ) (resid 40 and name N )
(resid 40 and name CA) (resid 40 and name C ) 1.0 -97.920 23.700 2
assign (resid 40 and name N ) (resid 40 and name CA)
(resid 40 and name C ) (resid 41 and name N ) 1.0 151.680 18.030 2
assign (resid 40 and name C ) (resid 41 and name N )
(resid 41 and name CA) (resid 41 and name C ) 1.0 -50.530 3.710 2
assign (resid 41 and name N ) (resid 41 and name CA)
(resid 41 and name C ) (resid 42 and name N ) 1.0 175.450 7.880 2
assign (resid 41 and name C ) (resid 42 and name N )
(resid 42 and name CA) (resid 42 and name C ) 1.0 -41.070 8.620 2
assign (resid 42 and name N ) (resid 42 and name CA)
(resid 42 and name C ) (resid 43 and name N ) 1.0 -7.590 12.830 2
assign (resid 42 and name C ) (resid 43 and name N )
(resid 43 and name CA) (resid 43 and name C ) 1.0 -68.020 8.540 2
assign (resid 43 and name N ) (resid 43 and name CA)
(resid 43 and name C ) (resid 44 and name N ) 1.0 -26.680 6.900 2
assign (resid 46 and name C ) (resid 47 and name N )
(resid 47 and name CA) (resid 47 and name C ) 1.0 -57.880 7.500 2
assign (resid 47 and name N ) (resid 47 and name CA)
(resid 47 and name C ) (resid 48 and name N ) 1.0 -32.510 9.660 2
assign (resid 47 and name C ) (resid 48 and name N )
(resid 48 and name CA) (resid 48 and name C ) 1.0 -65.480 8.520 2
assign (resid 48 and name N ) (resid 48 and name CA)
(resid 48 and name C ) (resid 49 and name N ) 1.0 -37.110 9.520 2
assign (resid 48 and name C ) (resid 49 and name N )
(resid 49 and name CA) (resid 49 and name C ) 1.0 -65.170 6.380 2
assign (resid 49 and name N ) (resid 49 and name CA)
(resid 49 and name C ) (resid 50 and name N ) 1.0 -42.210 4.830 2
assign (resid 49 and name C ) (resid 50 and name N )
(resid 50 and name CA) (resid 50 and name C ) 1.0 -64.690 7.610 2
assign (resid 50 and name N ) (resid 50 and name CA)
(resid 50 and name C ) (resid 51 and name N ) 1.0 -39.850 2.720 2
assign (resid 50 and name C ) (resid 51 and name N )
(resid 51 and name CA) (resid 51 and name C ) 1.0 -62.930 8.850 2
assign (resid 51 and name N ) (resid 51 and name CA)
(resid 51 and name C ) (resid 52 and name N ) 1.0 -40.210 5.810 2
assign (resid 51 and name C ) (resid 52 and name N )
(resid 52 and name CA) (resid 52 and name C ) 1.0 -65.880 11.810 2
assign (resid 52 and name N ) (resid 52 and name CA)
(resid 52 and name C ) (resid 53 and name N ) 1.0 -38.240 12.000 2
assign (resid 52 and name C ) (resid 53 and name N )
(resid 53 and name CA) (resid 53 and name C ) 1.0 -66.410 12.170 2
assign (resid 53 and name N ) (resid 53 and name CA)
(resid 53 and name C ) (resid 54 and name N ) 1.0 -57.800 14.950 2
assign (resid 54 and name C ) (resid 55 and name N )
(resid 55 and name CA) (resid 55 and name C ) 1.0 -80.410 18.270 2
assign (resid 55 and name N ) (resid 55 and name CA)
(resid 55 and name C ) (resid 56 and name N ) 1.0 144.320 18.130 2
assign (resid 56 and name C ) (resid 57 and name N )
(resid 57 and name CA) (resid 57 and name C ) 1.0 -98.150 31.650 2
assign (resid 57 and name N ) (resid 57 and name CA)
(resid 57 and name C ) (resid 58 and name N ) 1.0 140.560 19.720 2
assign (resid 57 and name C ) (resid 58 and name N )
(resid 58 and name CA) (resid 58 and name C ) 1.0 -131.610 11.770 2
assign (resid 58 and name N ) (resid 58 and name CA)
(resid 58 and name C ) (resid 59 and name N ) 1.0 151.880 10.620 2
assign (resid 58 and name C ) (resid 59 and name N )
(resid 59 and name CA) (resid 59 and name C ) 1.0 -101.180 27.520 2
assign (resid 59 and name N ) (resid 59 and name CA)
(resid 59 and name C ) (resid 60 and name N ) 1.0 133.810 11.010 2
assign (resid 59 and name C ) (resid 60 and name N )
(resid 60 and name CA) (resid 60 and name C ) 1.0 -121.660 16.320 2
assign (resid 60 and name N ) (resid 60 and name CA)
(resid 60 and name C ) (resid 61 and name N ) 1.0 148.520 16.030 2
assign (resid 60 and name C ) (resid 61 and name N )
(resid 61 and name CA) (resid 61 and name C ) 1.0 -113.800 14.660 2
assign (resid 61 and name N ) (resid 61 and name CA)
(resid 61 and name C ) (resid 62 and name N ) 1.0 132.900 14.680 2
assign (resid 61 and name C ) (resid 62 and name N )
(resid 62 and name CA) (resid 62 and name C ) 1.0 -83.910 14.950 2
assign (resid 62 and name N ) (resid 62 and name CA)
(resid 62 and name C ) (resid 63 and name N ) 1.0 174.420 7.250 2
assign (resid 62 and name C ) (resid 63 and name N )
(resid 63 and name CA) (resid 63 and name C ) 1.0 -61.120 4.970 2
assign (resid 63 and name N ) (resid 63 and name CA)
(resid 63 and name C ) (resid 64 and name N ) 1.0 -24.030 9.330 2
assign (resid 63 and name C ) (resid 64 and name N )
(resid 64 and name CA) (resid 64 and name C ) 1.0 -90.330 13.950 2
assign (resid 64 and name N ) (resid 64 and name CA)
(resid 64 and name C ) (resid 65 and name N ) 1.0 2.040 13.690 2
assign (resid 64 and name C ) (resid 65 and name N )
(resid 65 and name CA) (resid 65 and name C ) 1.0 78.500 13.190 2
assign (resid 65 and name N ) (resid 65 and name CA)
(resid 65 and name C ) (resid 66 and name N ) 1.0 12.500 9.650 2
assign (resid 65 and name C ) (resid 66 and name N )
(resid 66 and name CA) (resid 66 and name C ) 1.0 -83.720 20.430 2
assign (resid 66 and name N ) (resid 66 and name CA)
(resid 66 and name C ) (resid 67 and name N ) 1.0 133.310 17.000 2
assign (resid 66 and name C ) (resid 67 and name N )
(resid 67 and name CA) (resid 67 and name C ) 1.0 -102.330 19.760 2
assign (resid 67 and name N ) (resid 67 and name CA)
(resid 67 and name C ) (resid 68 and name N ) 1.0 131.100 11.840 2
assign (resid 67 and name C ) (resid 68 and name N )
(resid 68 and name CA) (resid 68 and name C ) 1.0 -136.600 20.940 2
assign (resid 68 and name N ) (resid 68 and name CA)
(resid 68 and name C ) (resid 69 and name N ) 1.0 164.700 17.000 2
assign (resid 68 and name C ) (resid 69 and name N )
(resid 69 and name CA) (resid 69 and name C ) 1.0 -125.080 10.070 2
assign (resid 69 and name N ) (resid 69 and name CA)
(resid 69 and name C ) (resid 70 and name N ) 1.0 138.320 12.150 2
assign (resid 69 and name C ) (resid 70 and name N )
(resid 70 and name CA) (resid 70 and name C ) 1.0 -131.470 16.460 2
assign (resid 70 and name N ) (resid 70 and name CA)
(resid 70 and name C ) (resid 71 and name N ) 1.0 132.110 12.400 2
assign (resid 70 and name C ) (resid 71 and name N )
(resid 71 and name CA) (resid 71 and name C ) 1.0 -97.180 21.270 2
assign (resid 71 and name N ) (resid 71 and name CA)
(resid 71 and name C ) (resid 72 and name N ) 1.0 123.710 17.030 2
assign (resid 71 and name C ) (resid 72 and name N )
(resid 72 and name CA) (resid 72 and name C ) 1.0 -65.300 4.080 2
assign (resid 72 and name N ) (resid 72 and name CA)
(resid 72 and name C ) (resid 73 and name N ) 1.0 -25.540 12.750 2
assign (resid 72 and name C ) (resid 73 and name N )
(resid 73 and name CA) (resid 73 and name C ) 1.0 -76.540 13.480 2
assign (resid 73 and name N ) (resid 73 and name CA)
(resid 73 and name C ) (resid 74 and name N ) 1.0 -33.540 10.440 2
assign (resid 73 and name C ) (resid 74 and name N )
(resid 74 and name CA) (resid 74 and name C ) 1.0 -90.440 21.080 2
assign (resid 74 and name N ) (resid 74 and name CA)
(resid 74 and name C ) (resid 75 and name N ) 1.0 -2.110 17.450 2
assign (resid 74 and name C ) (resid 75 and name N )
(resid 75 and name CA) (resid 75 and name C ) 1.0 61.200 7.400 2
assign (resid 75 and name N ) (resid 75 and name CA)
(resid 75 and name C ) (resid 76 and name N ) 1.0 26.340 15.230 2
assign (resid 75 and name C ) (resid 76 and name N )
(resid 76 and name CA) (resid 76 and name C ) 1.0 -84.810 20.920 2
assign (resid 76 and name N ) (resid 76 and name CA)
(resid 76 and name C ) (resid 77 and name N ) 1.0 149.690 12.360 2
assign (resid 76 and name C ) (resid 77 and name N )
(resid 77 and name CA) (resid 77 and name C ) 1.0 -118.110 15.560 2
assign (resid 77 and name N ) (resid 77 and name CA)
(resid 77 and name C ) (resid 78 and name N ) 1.0 141.940 14.950 2
assign (resid 77 and name C ) (resid 78 and name N )
(resid 78 and name CA) (resid 78 and name C ) 1.0 -143.740 14.140 2
assign (resid 78 and name N ) (resid 78 and name CA)
(resid 78 and name C ) (resid 79 and name N ) 1.0 154.760 14.400 2
assign (resid 78 and name C ) (resid 79 and name N )
(resid 79 and name CA) (resid 79 and name C ) 1.0 -93.100 25.420 2
assign (resid 79 and name N ) (resid 79 and name CA)
(resid 79 and name C ) (resid 80 and name N ) 1.0 137.580 25.380 2
assign (resid 81 and name C ) (resid 82 and name N )
(resid 82 and name CA) (resid 82 and name C ) 1.0 -61.060 5.130 2
assign (resid 82 and name N ) (resid 82 and name CA)
(resid 82 and name C ) (resid 83 and name N ) 1.0 142.780 7.570 2
assign (resid 82 and name C ) (resid 83 and name N )
(resid 83 and name CA) (resid 83 and name C ) 1.0 -58.990 4.030 2
assign (resid 83 and name N ) (resid 83 and name CA)
(resid 83 and name C ) (resid 84 and name N ) 1.0 -29.420 12.250 2
assign (resid 83 and name C ) (resid 84 and name N )
(resid 84 and name CA) (resid 84 and name C ) 1.0 -71.610 14.330 2
assign (resid 84 and name N ) (resid 84 and name CA)
(resid 84 and name C ) (resid 85 and name N ) 1.0 -25.290 24.530 2
assign (resid 84 and name C ) (resid 85 and name N )
(resid 85 and name CA) (resid 85 and name C ) 1.0 -66.480 8.860 2
assign (resid 85 and name N ) (resid 85 and name CA)
(resid 85 and name C ) (resid 86 and name N ) 1.0 -45.280 6.370 2
assign (resid 85 and name C ) (resid 86 and name N )
(resid 86 and name CA) (resid 86 and name C ) 1.0 -64.490 5.290 2
assign (resid 86 and name N ) (resid 86 and name CA)
(resid 86 and name C ) (resid 87 and name N ) 1.0 -36.930 18.900 2
# H bond #
assign ( residue 17 and name HN ) ( residue 29 and name O ) 1.80 0.00 0.50
assign ( residue 17 and name N ) ( residue 29 and name O ) 2.80 0.00 0.50
assign ( residue 19 and name HN ) ( residue 27 and name O ) 1.80 0.00 0.50
assign ( residue 19 and name N ) ( residue 27 and name O ) 2.80 0.00 0.50
assign ( residue 21 and name HN ) ( residue 25 and name O ) 1.80 0.00 0.50
assign ( residue 21 and name N ) ( residue 25 and name O ) 2.80 0.00 0.50
assign ( residue 24 and name HN ) ( residue 21 and name O ) 1.80 0.00 0.50
assign ( residue 24 and name N ) ( residue 21 and name O ) 2.80 0.00 0.50
assign ( residue 27 and name HN ) ( residue 19 and name O ) 1.80 0.00 0.50
assign ( residue 27 and name N ) ( residue 19 and name O ) 2.80 0.00 0.50
assign ( residue 28 and name HN ) ( residue 37 and name O ) 1.80 0.00 0.50
assign ( residue 28 and name N ) ( residue 37 and name O ) 2.80 0.00 0.50
assign ( residue 29 and name HN ) ( residue 17 and name O ) 1.80 0.00 0.50
assign ( residue 29 and name N ) ( residue 17 and name O ) 2.80 0.00 0.50
assign ( residue 30 and name HN ) ( residue 35 and name O ) 1.80 0.00 0.50
assign ( residue 30 and name N ) ( residue 35 and name O ) 2.80 0.00 0.50
assign ( residue 31 and name HN ) ( residue 15 and name O ) 1.80 0.00 0.50
assign ( residue 31 and name N ) ( residue 15 and name O ) 2.80 0.00 0.50
assign ( residue 35 and name HN ) ( residue 30 and name O ) 1.80 0.00 0.50
assign ( residue 35 and name N ) ( residue 30 and name O ) 2.80 0.00 0.50
assign ( residue 37 and name HN ) ( residue 28 and name O ) 1.80 0.00 0.50
assign ( residue 37 and name N ) ( residue 28 and name O ) 2.80 0.00 0.50
assign ( residue 58 and name HN ) ( residue 70 and name O ) 1.80 0.00 0.50
assign ( residue 58 and name N ) ( residue 70 and name O ) 2.80 0.00 0.50
assign ( residue 60 and name HN ) ( residue 68 and name O ) 1.80 0.00 0.50
assign ( residue 60 and name N ) ( residue 68 and name O ) 2.80 0.00 0.50
assign ( residue 62 and name HN ) ( residue 66 and name O ) 1.80 0.00 0.50
assign ( residue 62 and name N ) ( residue 66 and name O ) 2.80 0.00 0.50
assign ( residue 65 and name HN ) ( residue 62 and name O ) 1.80 0.00 0.50
assign ( residue 65 and name N ) ( residue 62 and name O ) 2.80 0.00 0.50
assign ( residue 68 and name HN ) ( residue 60 and name O ) 1.80 0.00 0.50
assign ( residue 68 and name N ) ( residue 60 and name O ) 2.80 0.00 0.50
assign ( residue 69 and name HN ) ( residue 78 and name O ) 1.80 0.00 0.50
assign ( residue 69 and name N ) ( residue 78 and name O ) 2.80 0.00 0.50
assign ( residue 70 and name HN ) ( residue 58 and name O ) 1.80 0.00 0.50
assign ( residue 70 and name N ) ( residue 58 and name O ) 2.80 0.00 0.50
assign ( residue 71 and name HN ) ( residue 76 and name O ) 1.80 0.00 0.50
assign ( residue 71 and name N ) ( residue 76 and name O ) 2.80 0.00 0.50
assign ( residue 76 and name HN ) ( residue 71 and name O ) 1.80 0.00 0.50
assign ( residue 76 and name N ) ( residue 71 and name O ) 2.80 0.00 0.50
assign ( residue 72 and name HN ) ( residue 56 and name O ) 1.80 0.00 0.50
assign ( residue 72 and name N ) ( residue 56 and name O ) 2.80 0.00 0.50
assign ( residue 78 and name HN ) ( residue 69 and name O ) 1.80 0.00 0.50
assign ( residue 78 and name N ) ( residue 69 and name O ) 2.80 0.00 0.50
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H1 GLY 1 21.137 8.045 -0.918
2 H2 GLY 1 H2 GLY 1 21.585 8.969 -2.266
3 H3 GLY 1 H3 GLY 1 22.762 8.106 -1.403
4 HA2 GLY 1 HA3 GLY 1 22.289 6.930 -3.415
5 HA3 GLY 1 HA2 GLY 1 21.692 6.011 -2.040
6 H SER 2 H SER 2 20.940 6.644 -5.050
7 HA SER 2 HA SER 2 18.099 7.224 -4.591
8 HB2 SER 2 HB2 SER 2 19.679 7.317 -7.173
9 HB3 SER 2 HB3 SER 2 18.009 7.843 -6.953
10 HG SER 2 HG SER 2 20.300 8.950 -5.663
11 H ASP 3 H ASP 3 17.352 5.205 -4.022
12 HA ASP 3 HA ASP 3 17.574 3.124 -6.095
13 HB2 ASP 3 HB2 ASP 3 18.502 2.539 -3.834
14 HB3 ASP 3 HB3 ASP 3 16.882 2.731 -3.176
15 H VAL 4 H VAL 4 15.802 2.836 -7.249
16 HA VAL 4 HA VAL 4 13.194 3.055 -5.903
17 HB VAL 4 HB VAL 4 12.208 3.945 -8.011
18 HG11 VAL 4 HG11 VAL 4 14.348 5.658 -6.761
19 HG12 VAL 4 HG12 VAL 4 12.693 5.459 -6.185
20 HG13 VAL 4 HG13 VAL 4 12.999 6.250 -7.730
21 HG21 VAL 4 HG21 VAL 4 15.093 4.265 -8.833
22 HG22 VAL 4 HG22 VAL 4 13.717 4.986 -9.665
23 HG23 VAL 4 HG23 VAL 4 13.884 3.233 -9.600
24 H ALA 5 H ALA 5 15.133 0.873 -6.834
25 HA ALA 5 HA ALA 5 13.192 -0.911 -7.918
26 HB1 ALA 5 HB1 ALA 5 13.750 0.310 -9.959
27 HB2 ALA 5 HB2 ALA 5 14.286 -1.368 -10.051
28 HB3 ALA 5 HB3 ALA 5 15.454 -0.086 -9.733
29 H ALA 6 H ALA 6 14.609 -1.136 -5.622
30 HA ALA 6 HA ALA 6 16.934 -2.772 -5.953
31 HB1 ALA 6 HB1 ALA 6 15.155 -2.410 -3.541
32 HB2 ALA 6 HB2 ALA 6 16.594 -1.462 -3.917
33 HB3 ALA 6 HB3 ALA 6 16.742 -3.180 -3.547
34 H GLY 7 H GLY 7 16.610 -4.583 -7.115
35 HA2 GLY 7 HA2 GLY 7 16.103 -6.853 -7.251
36 HA3 GLY 7 HA3 GLY 7 15.004 -6.667 -5.891
37 H THR 8 H THR 8 13.349 -4.676 -6.783
38 HA THR 8 HA THR 8 11.564 -4.180 -8.099
39 HB THR 8 HB THR 8 12.815 -5.993 -10.177
40 HG1 THR 8 HG1 THR 8 14.189 -4.325 -10.100
41 HG21 THR 8 HG21 THR 8 11.361 -4.798 -11.764
42 HG22 THR 8 HG22 THR 8 10.617 -3.929 -10.421
43 HG23 THR 8 HG23 THR 8 10.422 -5.676 -10.558
44 H ALA 9 H ALA 9 12.295 -7.610 -8.815
45 HA ALA 9 HA ALA 9 9.557 -8.338 -8.175
46 HB1 ALA 9 HB1 ALA 9 10.203 -10.584 -8.870
47 HB2 ALA 9 HB2 ALA 9 11.888 -10.081 -8.985
48 HB3 ALA 9 HB3 ALA 9 10.687 -9.395 -10.080
49 H SER 10 H SER 10 11.282 -7.227 -6.102
50 HA SER 10 HA SER 10 12.202 -9.223 -4.334
51 HB2 SER 10 HB2 SER 10 12.685 -6.690 -4.312
52 HB3 SER 10 HB3 SER 10 11.137 -6.526 -3.483
53 HG SER 10 HG SER 10 12.177 -8.284 -2.051
54 H GLY 11 H GLY 11 9.165 -7.390 -4.530
55 HA2 GLY 11 HA2 GLY 11 7.788 -9.787 -3.568
56 HA3 GLY 11 HA3 GLY 11 7.519 -8.287 -2.692
57 H ALA 12 H ALA 12 5.819 -10.109 -4.491
58 HA ALA 12 HA ALA 12 4.898 -7.999 -6.326
59 HB1 ALA 12 HB1 ALA 12 4.456 -10.975 -6.536
60 HB2 ALA 12 HB2 ALA 12 5.653 -10.053 -7.444
61 HB3 ALA 12 HB3 ALA 12 3.934 -9.753 -7.696
62 H LYS 13 H LYS 13 2.368 -9.148 -6.846
63 HA LYS 13 HA LYS 13 0.217 -9.147 -6.099
64 HB2 LYS 13 HB2 LYS 13 1.353 -9.680 -3.347
65 HB3 LYS 13 HB3 LYS 13 -0.274 -10.045 -3.915
66 HG2 LYS 13 HG2 LYS 13 0.533 -11.761 -5.365
67 HG3 LYS 13 HG3 LYS 13 2.215 -11.270 -5.089
68 HD2 LYS 13 HD2 LYS 13 0.478 -12.168 -2.814
69 HD3 LYS 13 HD3 LYS 13 1.297 -13.343 -3.849
70 HE2 LYS 13 HE2 LYS 13 2.679 -11.084 -2.398
71 HE3 LYS 13 HE3 LYS 13 2.578 -12.742 -1.804
72 HZ1 LYS 13 HZ1 LYS 13 3.762 -12.036 -4.430
73 HZ2 LYS 13 HZ2 LYS 13 3.838 -13.524 -3.633
74 HZ3 LYS 13 HZ3 LYS 13 4.675 -12.187 -3.012
75 H SER 14 H SER 14 2.461 -7.045 -5.346
76 HA SER 14 HA SER 14 1.024 -4.740 -5.111
77 HB2 SER 14 HB2 SER 14 1.442 -4.181 -2.663
78 HB3 SER 14 HB3 SER 14 0.180 -5.376 -2.945
79 HG SER 14 HG SER 14 2.182 -6.876 -2.693
80 H MET 15 H MET 15 2.640 -3.944 -6.380
81 HA MET 15 HA MET 15 5.186 -5.054 -6.471
82 HB2 MET 15 HB2 MET 15 4.346 -2.310 -7.430
83 HB3 MET 15 HB3 MET 15 5.781 -3.183 -7.948
84 HG2 MET 15 HG2 MET 15 4.378 -4.924 -8.920
85 HG3 MET 15 HG3 MET 15 2.938 -4.057 -8.391
86 HE1 MET 15 HE1 MET 15 1.942 -4.098 -10.832
87 HE2 MET 15 HE2 MET 15 3.354 -4.994 -11.392
88 HE3 MET 15 HE3 MET 15 2.819 -3.555 -12.262
89 H TRP 16 H TRP 16 6.590 -5.037 -4.856
90 HA TRP 16 HA TRP 16 7.353 -2.452 -3.763
91 HB2 TRP 16 HB2 TRP 16 7.219 -3.133 -1.484
92 HB3 TRP 16 HB3 TRP 16 5.685 -3.549 -2.218
93 HD1 TRP 16 HD1 TRP 16 5.059 -6.127 -2.363
94 HE1 TRP 16 HE1 TRP 16 6.008 -8.210 -1.171
95 HE3 TRP 16 HE3 TRP 16 9.437 -4.144 -0.623
96 HZ2 TRP 16 HZ2 TRP 16 8.301 -8.908 0.306
97 HZ3 TRP 16 HZ3 TRP 16 10.952 -5.589 0.673
98 HH2 TRP 16 HH2 TRP 16 10.395 -7.920 1.128
99 H THR 17 H THR 17 9.426 -2.180 -3.454
100 HA THR 17 HA THR 17 11.201 -4.488 -3.906
101 HB THR 17 HB THR 17 12.909 -2.881 -4.560
102 HG1 THR 17 HG1 THR 17 11.494 -1.183 -3.130
103 HG21 THR 17 HG21 THR 17 10.817 -3.553 -6.045
104 HG22 THR 17 HG22 THR 17 12.069 -2.461 -6.639
105 HG23 THR 17 HG23 THR 17 10.551 -1.810 -6.014
106 H GLU 18 H GLU 18 12.755 -4.959 -2.372
107 HA GLU 18 HA GLU 18 12.185 -4.049 0.285
108 HB2 GLU 18 HB2 GLU 18 12.841 -6.375 -0.223
109 HB3 GLU 18 HB3 GLU 18 14.429 -5.810 -0.718
110 HG2 GLU 18 HG2 GLU 18 14.901 -5.058 1.527
111 HG3 GLU 18 HG3 GLU 18 13.276 -5.512 2.043
112 H HIS 19 H HIS 19 13.050 -2.401 1.318
113 HA HIS 19 HA HIS 19 15.662 -1.345 0.438
114 HB2 HIS 19 HB2 HIS 19 13.106 0.124 1.031
115 HB3 HIS 19 HB3 HIS 19 14.654 0.907 1.305
116 HD1 HIS 19 HD1 HIS 19 13.867 2.641 -0.508
117 HD2 HIS 19 HD2 HIS 19 14.533 -1.218 -1.901
118 HE1 HIS 19 HE1 HIS 19 13.989 2.834 -3.006
119 HE2 HIS 19 HE2 HIS 19 14.730 0.556 -3.775
120 H LYS 20 H LYS 20 17.101 -1.095 2.084
121 HA LYS 20 HA LYS 20 15.982 -0.769 4.769
122 HB2 LYS 20 HB2 LYS 20 16.998 -2.583 5.588
123 HB3 LYS 20 HB3 LYS 20 17.239 -3.065 3.922
124 HG2 LYS 20 HG2 LYS 20 19.253 -1.521 5.538
125 HG3 LYS 20 HG3 LYS 20 19.239 -3.274 5.382
126 HD2 LYS 20 HD2 LYS 20 19.982 -1.187 3.409
127 HD3 LYS 20 HD3 LYS 20 20.742 -2.740 3.748
128 HE2 LYS 20 HE2 LYS 20 18.733 -3.830 2.689
129 HE3 LYS 20 HE3 LYS 20 18.223 -2.230 2.179
130 HZ1 LYS 20 HZ1 LYS 20 19.357 -3.098 0.366
131 HZ2 LYS 20 HZ2 LYS 20 20.597 -3.759 1.314
132 HZ3 LYS 20 HZ3 LYS 20 20.502 -2.077 1.094
133 H SER 21 H SER 21 16.950 0.704 6.041
134 HA SER 21 HA SER 21 18.899 2.476 4.854
135 HB2 SER 21 HB2 SER 21 17.737 2.460 7.658
136 HB3 SER 21 HB3 SER 21 18.603 3.793 6.892
137 HG SER 21 HG SER 21 16.553 4.332 6.496
138 HA PRO 22 HA PRO 22 22.638 0.593 6.110
139 HB2 PRO 22 HB2 PRO 22 23.346 3.223 7.330
140 HB3 PRO 22 HB3 PRO 22 24.265 2.219 6.202
141 HG2 PRO 22 HG2 PRO 22 23.005 4.377 5.330
142 HG3 PRO 22 HG3 PRO 22 22.993 2.884 4.373
143 HD2 PRO 22 HD2 PRO 22 20.834 4.073 6.060
144 HD3 PRO 22 HD3 PRO 22 20.712 3.202 4.518
145 H ASP 23 H ASP 23 20.656 2.091 8.526
146 HA ASP 23 HA ASP 23 22.214 1.119 10.757
147 HB2 ASP 23 HB2 ASP 23 19.551 2.501 10.539
148 HB3 ASP 23 HB3 ASP 23 20.097 1.812 12.062
149 H GLY 24 H GLY 24 20.188 -0.390 8.591
150 HA2 GLY 24 HA2 GLY 24 19.920 -2.747 8.720
151 HA3 GLY 24 HA3 GLY 24 19.935 -2.632 10.471
152 H ARG 25 H ARG 25 17.932 -0.227 9.333
153 HA ARG 25 HA ARG 25 15.565 -1.785 9.984
154 HB2 ARG 25 HB2 ARG 25 15.636 0.428 10.912
155 HB3 ARG 25 HB3 ARG 25 15.959 1.140 9.337
156 HG2 ARG 25 HG2 ARG 25 13.632 1.467 10.118
157 HG3 ARG 25 HG3 ARG 25 13.742 0.618 8.576
158 HD2 ARG 25 HD2 ARG 25 13.476 -1.523 9.780
159 HD3 ARG 25 HD3 ARG 25 13.268 -0.630 11.282
160 HE ARG 25 HE ARG 25 11.385 0.406 9.562
161 HH11 ARG 25 HH11 ARG 25 12.106 -2.745 10.904
162 HH12 ARG 25 HH12 ARG 25 10.475 -3.324 10.772
163 HH21 ARG 25 HH21 ARG 25 9.236 -0.351 9.374
164 HH22 ARG 25 HH22 ARG 25 8.842 -1.977 9.853
165 H THR 26 H THR 26 14.496 -2.883 8.503
166 HA THR 26 HA THR 26 14.719 -2.071 5.692
167 HB THR 26 HB THR 26 13.800 -4.723 6.819
168 HG1 THR 26 HG1 THR 26 15.838 -5.297 6.825
169 HG21 THR 26 HG21 THR 26 14.522 -3.874 4.010
170 HG22 THR 26 HG22 THR 26 12.913 -4.295 4.599
171 HG23 THR 26 HG23 THR 26 14.172 -5.528 4.515
172 H TYR 27 H TYR 27 13.013 -1.352 4.629
173 HA TYR 27 HA TYR 27 10.327 -1.872 5.686
174 HB2 TYR 27 HB2 TYR 27 9.848 0.513 4.658
175 HB3 TYR 27 HB3 TYR 27 10.437 0.347 6.306
176 HD1 TYR 27 HD1 TYR 27 11.767 0.751 2.830
177 HD2 TYR 27 HD2 TYR 27 12.221 1.654 6.960
178 HE1 TYR 27 HE1 TYR 27 13.668 2.216 2.295
179 HE2 TYR 27 HE2 TYR 27 14.126 3.115 6.436
180 HH TYR 27 HH TYR 27 15.706 3.554 4.782
181 H TYR 28 H TYR 28 8.739 -0.951 3.811
182 HA TYR 28 HA TYR 28 9.682 -2.354 1.393
183 HB2 TYR 28 HB2 TYR 28 6.836 -2.121 2.399
184 HB3 TYR 28 HB3 TYR 28 7.358 -2.992 0.966
185 HD1 TYR 28 HD2 TYR 28 9.920 -3.906 2.861
186 HD2 TYR 28 HD1 TYR 28 5.686 -4.306 2.921
187 HE1 TYR 28 HE2 TYR 28 10.139 -5.950 4.203
188 HE2 TYR 28 HE1 TYR 28 5.896 -6.354 4.265
189 HH TYR 28 HH TYR 28 8.778 -7.242 5.801
190 H TYR 29 H TYR 29 9.535 -1.272 -0.518
191 HA TYR 29 HA TYR 29 8.095 1.291 -0.449
192 HB2 TYR 29 HB2 TYR 29 10.246 1.974 -0.861
193 HB3 TYR 29 HB3 TYR 29 10.668 0.490 -1.696
194 HD1 TYR 29 HD1 TYR 29 8.167 3.254 -2.303
195 HD2 TYR 29 HD2 TYR 29 11.271 0.818 -3.823
196 HE1 TYR 29 HE1 TYR 29 7.974 4.394 -4.486
197 HE2 TYR 29 HE2 TYR 29 11.109 1.934 -6.008
198 HH TYR 29 HH TYR 29 9.595 3.232 -7.306
199 H ASN 30 H ASN 30 6.344 1.366 -1.566
200 HA ASN 30 HA ASN 30 5.881 -0.682 -3.602
201 HB2 ASN 30 HB2 ASN 30 4.087 0.896 -1.803
202 HB3 ASN 30 HB3 ASN 30 3.450 0.343 -3.349
203 HD21 ASN 30 HD21 ASN 30 3.178 -1.840 -3.714
204 HD22 ASN 30 HD22 ASN 30 3.228 -3.013 -2.451
205 H THR 31 H THR 31 6.144 -0.144 -5.601
206 HA THR 31 HA THR 31 6.825 2.500 -6.372
207 HB THR 31 HB THR 31 7.085 1.557 -8.605
208 HG1 THR 31 HG1 THR 31 5.899 -0.097 -9.183
209 HG21 THR 31 HG21 THR 31 7.989 -0.217 -6.342
210 HG22 THR 31 HG22 THR 31 8.890 1.098 -7.107
211 HG23 THR 31 HG23 THR 31 8.570 -0.391 -8.000
212 H GLU 32 H GLU 32 3.909 0.837 -6.089
213 HA GLU 32 HA GLU 32 2.345 1.946 -8.132
214 HB2 GLU 32 HB2 GLU 32 0.716 1.541 -5.867
215 HB3 GLU 32 HB3 GLU 32 0.915 0.480 -7.253
216 HG2 GLU 32 HG2 GLU 32 3.059 -0.279 -5.957
217 HG3 GLU 32 HG3 GLU 32 2.190 0.371 -4.571
218 H THR 33 H THR 33 2.775 2.878 -4.761
219 HA THR 33 HA THR 33 1.506 5.463 -5.295
220 HB THR 33 HB THR 33 1.441 5.702 -2.829
221 HG1 THR 33 HG1 THR 33 1.942 3.434 -1.827
222 HG21 THR 33 HG21 THR 33 0.372 3.051 -3.835
223 HG22 THR 33 HG22 THR 33 -0.437 4.617 -3.985
224 HG23 THR 33 HG23 THR 33 -0.182 3.906 -2.391
225 H LYS 34 H LYS 34 4.466 4.037 -5.186
226 HA LYS 34 HA LYS 34 6.606 4.753 -5.198
227 HB2 LYS 34 HB2 LYS 34 5.276 7.441 -5.468
228 HB3 LYS 34 HB3 LYS 34 7.021 7.215 -5.524
229 HG2 LYS 34 HG2 LYS 34 5.206 5.674 -7.307
230 HG3 LYS 34 HG3 LYS 34 5.734 7.308 -7.738
231 HD2 LYS 34 HD2 LYS 34 8.078 6.549 -7.519
232 HD3 LYS 34 HD3 LYS 34 7.497 4.918 -7.172
233 HE2 LYS 34 HE2 LYS 34 6.398 4.866 -9.369
234 HE3 LYS 34 HE3 LYS 34 7.026 6.478 -9.709
235 HZ1 LYS 34 HZ1 LYS 34 8.375 4.736 -10.715
236 HZ2 LYS 34 HZ2 LYS 34 8.675 4.064 -9.192
237 HZ3 LYS 34 HZ3 LYS 34 9.267 5.607 -9.566
238 H GLN 35 H GLN 35 5.133 4.388 -2.717
239 HA GLN 35 HA GLN 35 6.535 6.311 -0.981
240 HB2 GLN 35 HB2 GLN 35 3.962 4.815 -0.521
241 HB3 GLN 35 HB3 GLN 35 4.796 5.734 0.726
242 HG2 GLN 35 HG2 GLN 35 4.612 7.738 -0.753
243 HG3 GLN 35 HG3 GLN 35 3.581 6.777 -1.813
244 HE21 GLN 35 HE21 GLN 35 3.022 9.187 -0.219
245 HE22 GLN 35 HE22 GLN 35 1.673 8.769 0.784
246 H SER 36 H SER 36 7.261 5.564 1.075
247 HA SER 36 HA SER 36 8.015 2.726 1.104
248 HB2 SER 36 HB2 SER 36 9.912 4.299 1.152
249 HB3 SER 36 HB3 SER 36 9.228 5.094 2.569
250 HG SER 36 HG SER 36 10.282 3.678 3.677
251 H THR 37 H THR 37 7.266 1.474 2.736
252 HA THR 37 HA THR 37 5.603 2.697 4.803
253 HB THR 37 HB THR 37 4.185 2.290 2.763
254 HG1 THR 37 HG1 THR 37 3.022 2.305 4.614
255 HG21 THR 37 HG21 THR 37 4.819 -0.601 3.379
256 HG22 THR 37 HG22 THR 37 5.236 0.285 1.910
257 HG23 THR 37 HG23 THR 37 3.546 -0.055 2.284
258 H TRP 38 H TRP 38 4.778 1.026 6.339
259 HA TRP 38 HA TRP 38 6.945 -0.660 7.155
260 HB2 TRP 38 HB2 TRP 38 4.977 -1.439 8.803
261 HB3 TRP 38 HB3 TRP 38 5.899 0.037 9.045
262 HD1 TRP 38 HD1 TRP 38 4.395 1.948 9.715
263 HE1 TRP 38 HE1 TRP 38 2.008 2.739 9.169
264 HE3 TRP 38 HE3 TRP 38 3.040 -1.751 6.446
265 HZ2 TRP 38 HZ2 TRP 38 -0.165 1.900 7.560
266 HZ3 TRP 38 HZ3 TRP 38 0.794 -1.684 5.453
267 HH2 TRP 38 HH2 TRP 38 -0.775 0.106 5.996
268 H GLU 39 H GLU 39 6.353 -2.995 7.923
269 HA GLU 39 HA GLU 39 5.836 -4.633 5.746
270 HB2 GLU 39 HB2 GLU 39 5.016 -6.245 7.769
271 HB3 GLU 39 HB3 GLU 39 6.696 -5.979 7.337
272 HG2 GLU 39 HG2 GLU 39 5.378 -4.197 9.335
273 HG3 GLU 39 HG3 GLU 39 5.943 -5.797 9.813
274 H LYS 40 H LYS 40 4.092 -5.064 4.627
275 HA LYS 40 HA LYS 40 1.657 -3.759 5.319
276 HB2 LYS 40 HB2 LYS 40 2.385 -5.478 2.947
277 HB3 LYS 40 HB3 LYS 40 0.866 -4.606 3.120
278 HG2 LYS 40 HG2 LYS 40 2.260 -2.504 3.332
279 HG3 LYS 40 HG3 LYS 40 3.631 -3.481 2.804
280 HD2 LYS 40 HD2 LYS 40 1.054 -3.257 1.259
281 HD3 LYS 40 HD3 LYS 40 2.450 -2.215 0.981
282 HE2 LYS 40 HE2 LYS 40 2.574 -5.223 0.846
283 HE3 LYS 40 HE3 LYS 40 2.246 -4.202 -0.554
284 HZ1 LYS 40 HZ1 LYS 40 4.576 -4.753 -0.446
285 HZ2 LYS 40 HZ2 LYS 40 4.695 -4.130 1.122
286 HZ3 LYS 40 HZ3 LYS 40 4.375 -3.091 -0.177
287 HA PRO 41 HA PRO 41 -0.935 -7.036 6.936
288 HB2 PRO 41 HB2 PRO 41 -3.197 -6.156 5.552
289 HB3 PRO 41 HB3 PRO 41 -2.701 -5.637 7.166
290 HG2 PRO 41 HG2 PRO 41 -2.280 -4.313 4.531
291 HG3 PRO 41 HG3 PRO 41 -2.622 -3.588 6.113
292 HD2 PRO 41 HD2 PRO 41 -0.166 -3.534 5.068
293 HD3 PRO 41 HD3 PRO 41 -0.418 -3.768 6.809
294 H ASP 42 H ASP 42 -3.010 -8.137 5.730
295 HA ASP 42 HA ASP 42 -2.088 -10.254 4.239
296 HB2 ASP 42 HB2 ASP 42 -4.862 -9.065 4.305
297 HB3 ASP 42 HB3 ASP 42 -4.459 -10.683 3.732
298 H ASP 43 H ASP 43 -1.877 -7.270 2.892
299 HA ASP 43 HA ASP 43 -2.962 -7.520 0.311
300 HB2 ASP 43 HB2 ASP 43 -0.392 -6.191 1.163
301 HB3 ASP 43 HB3 ASP 43 -1.204 -5.921 -0.371
302 H LEU 44 H LEU 44 -0.041 -8.721 1.771
303 HA LEU 44 HA LEU 44 1.121 -9.596 -0.711
304 HB2 LEU 44 HB2 LEU 44 1.948 -10.331 2.092
305 HB3 LEU 44 HB3 LEU 44 2.925 -10.397 0.633
306 HG LEU 44 HG LEU 44 1.823 -7.754 1.396
307 HD11 LEU 44 HD11 LEU 44 4.062 -9.119 2.878
308 HD12 LEU 44 HD12 LEU 44 2.548 -8.501 3.548
309 HD13 LEU 44 HD13 LEU 44 3.758 -7.382 2.917
310 HD21 LEU 44 HD21 LEU 44 4.133 -7.087 0.651
311 HD22 LEU 44 HD22 LEU 44 3.119 -7.823 -0.586
312 HD23 LEU 44 HD23 LEU 44 4.385 -8.772 0.195
313 H LYS 45 H LYS 45 -1.154 -10.743 1.490
314 HA LYS 45 HA LYS 45 -0.834 -13.544 1.022
315 HB2 LYS 45 HB2 LYS 45 -3.329 -12.126 1.949
316 HB3 LYS 45 HB3 LYS 45 -2.826 -13.777 2.296
317 HG2 LYS 45 HG2 LYS 45 -1.114 -11.509 3.203
318 HG3 LYS 45 HG3 LYS 45 -2.583 -11.909 4.092
319 HD2 LYS 45 HD2 LYS 45 -0.666 -14.064 3.377
320 HD3 LYS 45 HD3 LYS 45 -0.335 -13.015 4.761
321 HE2 LYS 45 HE2 LYS 45 -2.332 -13.593 5.825
322 HE3 LYS 45 HE3 LYS 45 -2.978 -14.362 4.380
323 HZ1 LYS 45 HZ1 LYS 45 -0.677 -15.347 5.989
324 HZ2 LYS 45 HZ2 LYS 45 -1.314 -16.102 4.612
325 HZ3 LYS 45 HZ3 LYS 45 -2.249 -15.991 6.018
326 H THR 46 H THR 46 -3.771 -11.690 0.393
327 HA THR 46 HA THR 46 -3.880 -12.191 -2.416
328 HB THR 46 HB THR 46 -6.003 -13.658 -0.867
329 HG1 THR 46 HG1 THR 46 -4.305 -14.872 -0.223
330 HG21 THR 46 HG21 THR 46 -4.920 -13.914 -3.658
331 HG22 THR 46 HG22 THR 46 -6.474 -13.226 -3.188
332 HG23 THR 46 HG23 THR 46 -6.170 -14.949 -2.970
333 HA PRO 47 HA PRO 47 -6.333 -8.546 -2.029
334 HB2 PRO 47 HB2 PRO 47 -8.110 -9.797 -4.065
335 HB3 PRO 47 HB3 PRO 47 -7.412 -8.171 -4.033
336 HG2 PRO 47 HG2 PRO 47 -6.332 -9.994 -5.606
337 HG3 PRO 47 HG3 PRO 47 -5.280 -8.940 -4.642
338 HD2 PRO 47 HD2 PRO 47 -6.045 -11.796 -4.180
339 HD3 PRO 47 HD3 PRO 47 -4.480 -11.004 -3.941
340 H ALA 48 H ALA 48 -8.329 -11.485 -2.356
341 HA ALA 48 HA ALA 48 -10.553 -10.351 -1.019
342 HB1 ALA 48 HB1 ALA 48 -10.504 -12.324 -2.643
343 HB2 ALA 48 HB2 ALA 48 -11.598 -12.382 -1.267
344 HB3 ALA 48 HB3 ALA 48 -10.091 -13.296 -1.225
345 H GLU 49 H GLU 49 -7.708 -12.017 0.111
346 HA GLU 49 HA GLU 49 -8.706 -12.571 2.716
347 HB2 GLU 49 HB2 GLU 49 -5.872 -12.254 1.706
348 HB3 GLU 49 HB3 GLU 49 -6.278 -12.743 3.347
349 HG2 GLU 49 HG2 GLU 49 -7.538 -14.668 2.369
350 HG3 GLU 49 HG3 GLU 49 -6.878 -14.221 0.797
351 H GLN 50 H GLN 50 -7.273 -9.808 1.144
352 HA GLN 50 HA GLN 50 -6.546 -8.295 3.388
353 HB2 GLN 50 HB2 GLN 50 -7.534 -7.185 0.771
354 HB3 GLN 50 HB3 GLN 50 -6.422 -6.431 1.903
355 HG2 GLN 50 HG2 GLN 50 -4.742 -8.098 1.397
356 HG3 GLN 50 HG3 GLN 50 -5.870 -8.917 0.312
357 HE21 GLN 50 HE21 GLN 50 -4.557 -8.658 -1.470
358 HE22 GLN 50 HE22 GLN 50 -4.269 -7.126 -2.218
359 H LEU 51 H LEU 51 -9.665 -8.672 1.778
360 HA LEU 51 HA LEU 51 -10.721 -6.174 2.304
361 HB2 LEU 51 HB2 LEU 51 -12.859 -7.051 1.750
362 HB3 LEU 51 HB3 LEU 51 -11.656 -7.818 0.735
363 HG LEU 51 HG LEU 51 -11.819 -9.678 2.650
364 HD11 LEU 51 HD11 LEU 51 -14.587 -8.484 2.526
365 HD12 LEU 51 HD12 LEU 51 -13.523 -8.476 3.932
366 HD13 LEU 51 HD13 LEU 51 -14.140 -10.005 3.304
367 HD21 LEU 51 HD21 LEU 51 -13.331 -10.860 1.123
368 HD22 LEU 51 HD22 LEU 51 -12.022 -10.027 0.276
369 HD23 LEU 51 HD23 LEU 51 -13.650 -9.339 0.282
370 H LEU 52 H LEU 52 -10.644 -8.960 4.432
371 HA LEU 52 HA LEU 52 -12.467 -7.826 6.352
372 HB2 LEU 52 HB2 LEU 52 -10.483 -10.031 6.883
373 HB3 LEU 52 HB3 LEU 52 -11.993 -9.720 7.715
374 HG LEU 52 HG LEU 52 -13.039 -10.214 5.342
375 HD11 LEU 52 HD11 LEU 52 -10.505 -11.842 5.228
376 HD12 LEU 52 HD12 LEU 52 -10.786 -10.379 4.281
377 HD13 LEU 52 HD13 LEU 52 -11.809 -11.801 4.039
378 HD21 LEU 52 HD21 LEU 52 -11.973 -12.365 7.169
379 HD22 LEU 52 HD22 LEU 52 -13.273 -12.559 5.992
380 HD23 LEU 52 HD23 LEU 52 -13.486 -11.482 7.372
381 H SER 53 H SER 53 -9.030 -7.996 5.886
382 HA SER 53 HA SER 53 -8.285 -6.939 8.451
383 HB2 SER 53 HB2 SER 53 -6.637 -6.994 5.919
384 HB3 SER 53 HB3 SER 53 -6.049 -7.071 7.582
385 HG SER 53 HG SER 53 -6.001 -9.139 6.803
386 H LYS 54 H LYS 54 -7.843 -5.772 5.155
387 HA LYS 54 HA LYS 54 -8.518 -3.039 5.918
388 HB2 LYS 54 HB2 LYS 54 -5.839 -3.869 4.778
389 HB3 LYS 54 HB3 LYS 54 -6.424 -2.212 4.773
390 HG2 LYS 54 HG2 LYS 54 -6.004 -3.875 7.244
391 HG3 LYS 54 HG3 LYS 54 -4.863 -2.681 6.620
392 HD2 LYS 54 HD2 LYS 54 -6.457 -0.916 6.941
393 HD3 LYS 54 HD3 LYS 54 -7.713 -2.068 7.383
394 HE2 LYS 54 HE2 LYS 54 -6.812 -0.963 9.356
395 HE3 LYS 54 HE3 LYS 54 -6.450 -2.687 9.378
396 HZ1 LYS 54 HZ1 LYS 54 -4.584 -1.193 10.046
397 HZ2 LYS 54 HZ2 LYS 54 -4.518 -0.631 8.446
398 HZ3 LYS 54 HZ3 LYS 54 -4.209 -2.265 8.786
399 H CYS 55 H CYS 55 -9.446 -1.940 4.265
400 HA CYS 55 HA CYS 55 -10.584 -3.424 2.179
401 HB2 CYS 55 HB2 CYS 55 -11.185 -1.039 1.349
402 HB3 CYS 55 HB3 CYS 55 -11.817 -1.578 2.903
403 HG CYS 55 HG CYS 55 -9.631 0.872 2.208
404 HA PRO 56 HA PRO 56 -7.562 -3.544 -1.019
405 HB2 PRO 56 HB2 PRO 56 -9.883 -3.141 -2.839
406 HB3 PRO 56 HB3 PRO 56 -8.673 -4.430 -2.826
407 HG2 PRO 56 HG2 PRO 56 -11.121 -4.912 -1.941
408 HG3 PRO 56 HG3 PRO 56 -9.710 -5.562 -1.080
409 HD2 PRO 56 HD2 PRO 56 -11.413 -3.188 -0.400
410 HD3 PRO 56 HD3 PRO 56 -10.767 -4.454 0.668
411 H TRP 57 H TRP 57 -9.964 -0.983 -1.000
412 HA TRP 57 HA TRP 57 -8.047 0.821 -2.281
413 HB2 TRP 57 HB2 TRP 57 -10.821 1.292 -1.154
414 HB3 TRP 57 HB3 TRP 57 -9.832 2.530 -1.921
415 HD1 TRP 57 HD1 TRP 57 -9.474 2.337 -4.574
416 HE1 TRP 57 HE1 TRP 57 -10.912 1.204 -6.396
417 HE3 TRP 57 HE3 TRP 57 -12.306 -0.714 -1.597
418 HZ2 TRP 57 HZ2 TRP 57 -12.962 -0.738 -6.539
419 HZ3 TRP 57 HZ3 TRP 57 -13.976 -2.179 -2.653
420 HH2 TRP 57 HH2 TRP 57 -14.297 -2.190 -5.073
421 H LYS 58 H LYS 58 -6.544 1.786 -0.976
422 HA LYS 58 HA LYS 58 -7.170 1.801 1.888
423 HB2 LYS 58 HB2 LYS 58 -5.422 0.014 0.614
424 HB3 LYS 58 HB3 LYS 58 -4.428 1.144 1.521
425 HG2 LYS 58 HG2 LYS 58 -5.476 0.603 3.564
426 HG3 LYS 58 HG3 LYS 58 -6.787 -0.253 2.746
427 HD2 LYS 58 HD2 LYS 58 -4.906 -1.636 3.837
428 HD3 LYS 58 HD3 LYS 58 -5.432 -2.065 2.205
429 HE2 LYS 58 HE2 LYS 58 -3.606 -0.779 1.265
430 HE3 LYS 58 HE3 LYS 58 -3.066 -0.334 2.890
431 HZ1 LYS 58 HZ1 LYS 58 -1.735 -2.122 2.183
432 HZ2 LYS 58 HZ2 LYS 58 -3.053 -3.018 1.630
433 HZ3 LYS 58 HZ3 LYS 58 -2.820 -2.791 3.291
434 H GLU 59 H GLU 59 -5.903 3.082 3.209
435 HA GLU 59 HA GLU 59 -4.389 5.215 1.878
436 HB2 GLU 59 HB2 GLU 59 -6.499 6.175 2.447
437 HB3 GLU 59 HB3 GLU 59 -6.518 5.378 4.012
438 HG2 GLU 59 HG2 GLU 59 -4.219 7.013 3.931
439 HG3 GLU 59 HG3 GLU 59 -5.576 7.967 3.329
440 H TYR 60 H TYR 60 -2.329 5.186 2.607
441 HA TYR 60 HA TYR 60 -1.924 4.818 5.477
442 HB2 TYR 60 HB2 TYR 60 0.092 3.389 5.112
443 HB3 TYR 60 HB3 TYR 60 -1.415 2.605 4.639
444 HD1 TYR 60 HD1 TYR 60 1.561 4.384 3.285
445 HD2 TYR 60 HD2 TYR 60 -1.688 1.751 2.482
446 HE1 TYR 60 HE1 TYR 60 2.531 3.851 1.099
447 HE2 TYR 60 HE2 TYR 60 -0.714 1.214 0.292
448 HH TYR 60 HH TYR 60 2.447 1.979 -0.546
449 H LYS 61 H LYS 61 0.263 5.533 6.143
450 HA LYS 61 HA LYS 61 1.119 7.754 4.428
451 HB2 LYS 61 HB2 LYS 61 1.511 7.400 7.391
452 HB3 LYS 61 HB3 LYS 61 2.057 8.774 6.444
453 HG2 LYS 61 HG2 LYS 61 -0.421 9.019 5.802
454 HG3 LYS 61 HG3 LYS 61 -0.713 7.985 7.194
455 HD2 LYS 61 HD2 LYS 61 0.624 10.681 7.142
456 HD3 LYS 61 HD3 LYS 61 -0.900 10.250 7.921
457 HE2 LYS 61 HE2 LYS 61 1.822 9.205 8.685
458 HE3 LYS 61 HE3 LYS 61 0.951 10.487 9.524
459 HZ1 LYS 61 HZ1 LYS 61 -0.868 8.816 9.879
460 HZ2 LYS 61 HZ2 LYS 61 0.572 8.513 10.724
461 HZ3 LYS 61 HZ3 LYS 61 0.204 7.622 9.333
462 H SER 62 H SER 62 3.144 7.893 3.782
463 HA SER 62 HA SER 62 4.879 5.675 3.860
464 HB2 SER 62 HB2 SER 62 6.380 7.881 3.113
465 HB3 SER 62 HB3 SER 62 5.490 6.818 2.018
466 HG SER 62 HG SER 62 3.825 8.245 1.975
467 H ASP 63 H ASP 63 7.366 6.261 4.390
468 HA ASP 63 HA ASP 63 7.620 6.774 7.154
469 HB2 ASP 63 HB2 ASP 63 10.012 6.798 6.783
470 HB3 ASP 63 HB3 ASP 63 9.302 5.523 5.801
471 H SER 64 H SER 64 7.636 8.834 4.331
472 HA SER 64 HA SER 64 8.353 11.223 5.759
473 HB2 SER 64 HB2 SER 64 6.863 11.036 3.133
474 HB3 SER 64 HB3 SER 64 7.856 12.372 3.717
475 HG SER 64 HG SER 64 9.615 10.695 3.714
476 H GLY 65 H GLY 65 5.584 9.300 5.484
477 HA2 GLY 65 HA2 GLY 65 3.670 9.477 6.780
478 HA3 GLY 65 HA3 GLY 65 4.126 11.113 7.212
479 H LYS 66 H LYS 66 4.113 10.344 3.858
480 HA LYS 66 HA LYS 66 1.865 12.108 3.402
481 HB2 LYS 66 HB2 LYS 66 3.429 10.405 1.452
482 HB3 LYS 66 HB3 LYS 66 2.275 11.660 1.026
483 HG2 LYS 66 HG2 LYS 66 4.807 12.155 2.563
484 HG3 LYS 66 HG3 LYS 66 4.663 12.314 0.816
485 HD2 LYS 66 HD2 LYS 66 4.359 14.498 1.575
486 HD3 LYS 66 HD3 LYS 66 2.713 13.912 1.339
487 HE2 LYS 66 HE2 LYS 66 2.523 13.455 3.727
488 HE3 LYS 66 HE3 LYS 66 4.177 14.018 3.972
489 HZ1 LYS 66 HZ1 LYS 66 2.066 15.731 2.791
490 HZ2 LYS 66 HZ2 LYS 66 3.574 16.202 3.409
491 HZ3 LYS 66 HZ3 LYS 66 2.361 15.666 4.460
492 H THR 67 H THR 67 -0.221 11.465 3.260
493 HA THR 67 HA THR 67 -0.809 8.633 3.229
494 HB THR 67 HB THR 67 -3.238 9.936 2.927
495 HG1 THR 67 HG1 THR 67 -2.145 11.947 3.353
496 HG21 THR 67 HG21 THR 67 -2.480 8.022 4.374
497 HG22 THR 67 HG22 THR 67 -3.636 9.140 5.114
498 HG23 THR 67 HG23 THR 67 -1.924 9.230 5.539
499 H TYR 68 H TYR 68 -1.383 7.472 1.567
500 HA TYR 68 HA TYR 68 -2.358 8.837 -0.839
501 HB2 TYR 68 HB2 TYR 68 0.006 7.185 -0.597
502 HB3 TYR 68 HB3 TYR 68 -1.136 6.486 -1.744
503 HD1 TYR 68 HD2 TYR 68 0.793 9.536 -0.938
504 HD2 TYR 68 HD1 TYR 68 -1.455 7.443 -3.880
505 HE1 TYR 68 HE2 TYR 68 1.528 11.154 -2.647
506 HE2 TYR 68 HE1 TYR 68 -0.735 9.051 -5.594
507 HH TYR 68 HH TYR 68 1.815 11.124 -5.217
508 H TYR 69 H TYR 69 -3.885 7.727 -2.048
509 HA TYR 69 HA TYR 69 -5.146 5.445 -0.667
510 HB2 TYR 69 HB2 TYR 69 -6.331 7.749 -0.612
511 HB3 TYR 69 HB3 TYR 69 -6.641 7.478 -2.321
512 HD1 TYR 69 HD1 TYR 69 -7.287 6.239 1.078
513 HD2 TYR 69 HD2 TYR 69 -8.370 5.976 -3.041
514 HE1 TYR 69 HE1 TYR 69 -9.299 4.958 1.691
515 HE2 TYR 69 HE2 TYR 69 -10.383 4.694 -2.429
516 HH TYR 69 HH TYR 69 -11.091 3.194 -0.453
517 H TYR 70 H TYR 70 -5.347 3.653 -1.941
518 HA TYR 70 HA TYR 70 -5.106 4.062 -4.834
519 HB2 TYR 70 HB2 TYR 70 -3.337 2.448 -5.056
520 HB3 TYR 70 HB3 TYR 70 -2.834 3.651 -3.873
521 HD1 TYR 70 HD2 TYR 70 -2.977 3.038 -1.403
522 HD2 TYR 70 HD1 TYR 70 -3.465 0.171 -4.507
523 HE1 TYR 70 HE2 TYR 70 -2.571 1.220 0.206
524 HE2 TYR 70 HE1 TYR 70 -3.061 -1.645 -2.896
525 HH TYR 70 HH TYR 70 -2.229 -2.114 -0.849
526 H ASN 71 H ASN 71 -5.900 2.498 -6.129
527 HA ASN 71 HA ASN 71 -7.774 0.577 -4.978
528 HB2 ASN 71 HB2 ASN 71 -7.062 1.194 -7.869
529 HB3 ASN 71 HB3 ASN 71 -8.374 0.156 -7.346
530 HD21 ASN 71 HD21 ASN 71 -7.527 3.293 -5.954
531 HD22 ASN 71 HD22 ASN 71 -8.972 4.092 -6.458
532 H SER 72 H SER 72 -6.669 -1.280 -4.244
533 HA SER 72 HA SER 72 -4.098 -1.895 -5.314
534 HB2 SER 72 HB2 SER 72 -4.852 -2.284 -2.927
535 HB3 SER 72 HB3 SER 72 -5.690 -3.713 -3.522
536 HG SER 72 HG SER 72 -3.757 -4.523 -3.034
537 H GLN 73 H GLN 73 -7.294 -3.358 -5.803
538 HA GLN 73 HA GLN 73 -6.403 -5.743 -6.997
539 HB2 GLN 73 HB2 GLN 73 -8.667 -5.981 -7.856
540 HB3 GLN 73 HB3 GLN 73 -8.717 -5.418 -6.191
541 HG2 GLN 73 HG2 GLN 73 -9.012 -3.667 -8.619
542 HG3 GLN 73 HG3 GLN 73 -10.354 -4.330 -7.691
543 HE21 GLN 73 HE21 GLN 73 -9.009 -1.580 -8.243
544 HE22 GLN 73 HE22 GLN 73 -9.092 -0.838 -6.680
545 H THR 74 H THR 74 -7.080 -2.581 -8.359
546 HA THR 74 HA THR 74 -6.474 -3.605 -11.041
547 HB THR 74 HB THR 74 -7.573 -1.432 -11.772
548 HG1 THR 74 HG1 THR 74 -9.040 -0.639 -10.018
549 HG21 THR 74 HG21 THR 74 -9.112 -3.501 -10.192
550 HG22 THR 74 HG22 THR 74 -8.798 -3.488 -11.934
551 HG23 THR 74 HG23 THR 74 -9.877 -2.286 -11.224
552 H LYS 75 H LYS 75 -5.289 -1.857 -8.501
553 HA LYS 75 HA LYS 75 -3.355 -0.816 -8.075
554 HB2 LYS 75 HB2 LYS 75 -2.625 -1.982 -10.746
555 HB3 LYS 75 HB3 LYS 75 -1.484 -1.062 -9.765
556 HG2 LYS 75 HG2 LYS 75 -2.946 -3.543 -8.886
557 HG3 LYS 75 HG3 LYS 75 -1.253 -3.475 -9.403
558 HD2 LYS 75 HD2 LYS 75 -0.750 -1.963 -7.540
559 HD3 LYS 75 HD3 LYS 75 -2.443 -2.002 -7.045
560 HE2 LYS 75 HE2 LYS 75 -2.187 -4.495 -6.778
561 HE3 LYS 75 HE3 LYS 75 -0.454 -4.265 -7.012
562 HZ1 LYS 75 HZ1 LYS 75 -0.496 -2.719 -5.092
563 HZ2 LYS 75 HZ2 LYS 75 -0.921 -4.310 -4.688
564 HZ3 LYS 75 HZ3 LYS 75 -2.122 -3.135 -4.831
565 H GLU 76 H GLU 76 -5.453 0.704 -9.048
566 HA GLU 76 HA GLU 76 -4.140 2.887 -10.466
567 HB2 GLU 76 HB2 GLU 76 -6.420 2.646 -11.097
568 HB3 GLU 76 HB3 GLU 76 -6.943 2.455 -9.431
569 HG2 GLU 76 HG2 GLU 76 -6.392 4.796 -8.993
570 HG3 GLU 76 HG3 GLU 76 -5.871 4.986 -10.663
571 H SER 77 H SER 77 -3.725 4.905 -9.406
572 HA SER 77 HA SER 77 -3.897 4.786 -6.483
573 HB2 SER 77 HB2 SER 77 -1.597 5.837 -6.408
574 HB3 SER 77 HB3 SER 77 -1.647 4.158 -6.940
575 HG SER 77 HG SER 77 -1.385 4.809 -9.054
576 H ARG 78 H ARG 78 -4.390 6.647 -5.460
577 HA ARG 78 HA ARG 78 -4.498 9.142 -6.997
578 HB2 ARG 78 HB2 ARG 78 -6.818 9.464 -6.720
579 HB3 ARG 78 HB3 ARG 78 -6.680 7.780 -7.213
580 HG2 ARG 78 HG2 ARG 78 -6.775 7.162 -4.776
581 HG3 ARG 78 HG3 ARG 78 -7.167 8.847 -4.439
582 HD2 ARG 78 HD2 ARG 78 -8.777 6.815 -5.955
583 HD3 ARG 78 HD3 ARG 78 -9.225 7.716 -4.513
584 HE ARG 78 HE ARG 78 -8.829 9.658 -6.383
585 HH11 ARG 78 HH11 ARG 78 -10.828 6.783 -6.232
586 HH12 ARG 78 HH12 ARG 78 -12.074 7.430 -7.255
587 HH21 ARG 78 HH21 ARG 78 -10.468 10.509 -7.737
588 HH22 ARG 78 HH22 ARG 78 -11.871 9.548 -8.104
589 H TRP 79 H TRP 79 -5.053 11.030 -5.538
590 HA TRP 79 HA TRP 79 -4.897 10.273 -2.698
591 HB2 TRP 79 HB2 TRP 79 -3.005 11.688 -3.128
592 HB3 TRP 79 HB3 TRP 79 -3.998 12.853 -3.997
593 HD1 TRP 79 HD1 TRP 79 -3.957 14.977 -2.557
594 HE1 TRP 79 HE1 TRP 79 -4.438 15.541 -0.091
595 HE3 TRP 79 HE3 TRP 79 -4.557 10.225 -0.707
596 HZ2 TRP 79 HZ2 TRP 79 -5.009 14.174 2.297
597 HZ3 TRP 79 HZ3 TRP 79 -5.073 9.954 1.677
598 HH2 TRP 79 HH2 TRP 79 -5.292 11.891 3.150
599 H ALA 80 H ALA 80 -6.818 10.156 -1.961
600 HA ALA 80 HA ALA 80 -8.684 12.040 -1.457
601 HB1 ALA 80 HB1 ALA 80 -10.428 11.727 -3.187
602 HB2 ALA 80 HB2 ALA 80 -9.299 10.752 -4.129
603 HB3 ALA 80 HB3 ALA 80 -8.971 12.463 -3.855
604 H LYS 81 H LYS 81 -10.004 11.012 0.001
605 HA LYS 81 HA LYS 81 -10.249 8.103 -0.320
606 HB2 LYS 81 HB2 LYS 81 -10.030 8.079 2.294
607 HB3 LYS 81 HB3 LYS 81 -8.611 8.050 1.264
608 HG2 LYS 81 HG2 LYS 81 -8.359 9.551 3.185
609 HG3 LYS 81 HG3 LYS 81 -8.228 10.398 1.648
610 HD2 LYS 81 HD2 LYS 81 -10.198 11.533 1.952
611 HD3 LYS 81 HD3 LYS 81 -10.886 10.283 2.991
612 HE2 LYS 81 HE2 LYS 81 -8.557 11.980 3.840
613 HE3 LYS 81 HE3 LYS 81 -10.229 12.483 4.090
614 HZ1 LYS 81 HZ1 LYS 81 -9.046 11.226 5.960
615 HZ2 LYS 81 HZ2 LYS 81 -9.297 9.840 5.015
616 HZ3 LYS 81 HZ3 LYS 81 -10.621 10.752 5.548
617 HA PRO 82 HA PRO 82 -14.390 9.915 0.942
618 HB2 PRO 82 HB2 PRO 82 -15.774 9.142 -1.257
619 HB3 PRO 82 HB3 PRO 82 -15.005 10.729 -1.124
620 HG2 PRO 82 HG2 PRO 82 -14.029 8.262 -2.515
621 HG3 PRO 82 HG3 PRO 82 -14.005 9.946 -3.066
622 HD2 PRO 82 HD2 PRO 82 -11.821 8.732 -2.025
623 HD3 PRO 82 HD3 PRO 82 -12.139 10.466 -1.808
624 H LYS 83 H LYS 83 -15.430 8.518 2.222
625 HA LYS 83 HA LYS 83 -15.091 5.719 2.065
626 HB2 LYS 83 HB2 LYS 83 -16.501 5.532 3.893
627 HB3 LYS 83 HB3 LYS 83 -15.821 7.133 4.089
628 HG2 LYS 83 HG2 LYS 83 -18.553 6.488 3.010
629 HG3 LYS 83 HG3 LYS 83 -18.184 7.095 4.620
630 HD2 LYS 83 HD2 LYS 83 -17.147 9.103 3.429
631 HD3 LYS 83 HD3 LYS 83 -17.962 8.511 1.981
632 HE2 LYS 83 HE2 LYS 83 -19.306 9.144 4.596
633 HE3 LYS 83 HE3 LYS 83 -19.299 10.198 3.184
634 HZ1 LYS 83 HZ1 LYS 83 -20.572 8.627 1.969
635 HZ2 LYS 83 HZ2 LYS 83 -21.332 8.808 3.474
636 HZ3 LYS 83 HZ3 LYS 83 -20.390 7.437 3.162
637 H GLU 84 H GLU 84 -17.011 7.879 0.376
638 HA GLU 84 HA GLU 84 -19.247 6.430 -0.419
639 HB2 GLU 84 HB2 GLU 84 -18.836 8.821 -0.884
640 HB3 GLU 84 HB3 GLU 84 -17.570 8.379 -2.017
641 HG2 GLU 84 HG2 GLU 84 -19.249 7.250 -3.415
642 HG3 GLU 84 HG3 GLU 84 -20.504 7.776 -2.292
643 H LEU 85 H LEU 85 -15.910 6.294 -1.519
644 HA LEU 85 HA LEU 85 -16.273 4.746 -3.830
645 HB2 LEU 85 HB2 LEU 85 -14.162 5.920 -2.534
646 HB3 LEU 85 HB3 LEU 85 -13.836 4.217 -2.276
647 HG LEU 85 HG LEU 85 -12.690 5.134 -4.264
648 HD11 LEU 85 HD11 LEU 85 -14.806 3.095 -4.931
649 HD12 LEU 85 HD12 LEU 85 -13.265 2.753 -4.143
650 HD13 LEU 85 HD13 LEU 85 -13.293 3.359 -5.798
651 HD21 LEU 85 HD21 LEU 85 -13.917 5.829 -6.196
652 HD22 LEU 85 HD22 LEU 85 -14.500 6.759 -4.812
653 HD23 LEU 85 HD23 LEU 85 -15.452 5.411 -5.432
654 H GLU 86 H GLU 86 -15.380 3.745 -0.529
655 HA GLU 86 HA GLU 86 -15.705 0.967 -1.070
656 HB2 GLU 86 HB2 GLU 86 -14.245 1.927 0.736
657 HB3 GLU 86 HB3 GLU 86 -15.705 2.324 1.636
658 HG2 GLU 86 HG2 GLU 86 -14.673 0.255 2.410
659 HG3 GLU 86 HG3 GLU 86 -16.295 -0.010 1.773
660 H ASP 87 H ASP 87 -17.829 3.518 -0.367
661 HA ASP 87 HA ASP 87 -20.073 3.686 -0.166
662 HB2 ASP 87 HB2 ASP 87 -20.060 1.920 -1.971
663 HB3 ASP 87 HB3 ASP 87 -20.208 0.710 -0.703
664 H LEU 88 H LEU 88 -18.244 2.992 2.005
665 HA LEU 88 HA LEU 88 -20.215 2.471 4.035
666 HB2 LEU 88 HB2 LEU 88 -19.171 0.223 3.160
667 HB3 LEU 88 HB3 LEU 88 -17.786 0.710 4.113
668 HG LEU 88 HG LEU 88 -19.214 -0.874 5.317
669 HD11 LEU 88 HD11 LEU 88 -19.328 1.872 6.548
670 HD12 LEU 88 HD12 LEU 88 -17.948 0.778 6.606
671 HD13 LEU 88 HD13 LEU 88 -19.459 0.333 7.401
672 HD21 LEU 88 HD21 LEU 88 -21.335 1.255 5.111
673 HD22 LEU 88 HD22 LEU 88 -21.450 -0.238 6.044
674 HD23 LEU 88 HD23 LEU 88 -21.339 -0.305 4.285
675 H GLU 89 H GLU 89 -16.765 1.901 4.335
676 HA GLU 89 HA GLU 89 -16.185 4.596 5.224
677 HB2 GLU 89 HB2 GLU 89 -16.198 2.247 7.118
678 HB3 GLU 89 HB3 GLU 89 -15.172 3.644 7.395
679 HG2 GLU 89 HG2 GLU 89 -18.165 3.746 7.140
680 HG3 GLU 89 HG3 GLU 89 -17.286 3.674 8.665
681 H GLY 90 H GLY 90 -14.930 1.294 5.553
682 HA2 GLY 90 HA2 GLY 90 -12.742 1.648 3.805
683 HA3 GLY 90 HA3 GLY 90 -12.229 1.936 5.461
684 H LEU 91 H LEU 91 -14.468 -0.394 3.993
685 HA LEU 91 HA LEU 91 -12.688 -2.572 4.199
686 HB2 LEU 91 HB2 LEU 91 -13.630 -3.860 5.949
687 HB3 LEU 91 HB3 LEU 91 -13.294 -2.277 6.598
688 HG LEU 91 HG LEU 91 -15.300 -2.928 7.587
689 HD11 LEU 91 HD11 LEU 91 -17.014 -1.417 6.750
690 HD12 LEU 91 HD12 LEU 91 -16.084 -1.185 5.271
691 HD13 LEU 91 HD13 LEU 91 -15.427 -0.650 6.818
692 HD21 LEU 91 HD21 LEU 91 -17.219 -3.847 6.436
693 HD22 LEU 91 HD22 LEU 91 -15.784 -4.834 6.152
694 HD23 LEU 91 HD23 LEU 91 -16.366 -3.742 4.895
695 H GLU 92 H GLU 92 -13.426 -4.332 3.000
696 HA GLU 92 HA GLU 92 -15.647 -3.627 1.277
697 HB2 GLU 92 HB2 GLU 92 -13.444 -4.488 0.385
698 HB3 GLU 92 HB3 GLU 92 -13.865 -6.057 1.060
699 HG2 GLU 92 HG2 GLU 92 -15.958 -5.979 -0.323
700 HG3 GLU 92 HG3 GLU 92 -15.295 -4.549 -1.112
Start of MODEL 2
1 H1 GLY 1 H1 GLY 1 22.270 -13.672 -4.783
2 H2 GLY 1 H2 GLY 1 21.463 -12.507 -3.856
3 H3 GLY 1 H3 GLY 1 22.922 -13.164 -3.305
4 HA2 GLY 1 HA3 GLY 1 24.150 -12.135 -5.073
5 HA3 GLY 1 HA2 GLY 1 22.651 -11.552 -5.783
6 H SER 2 H SER 2 21.302 -10.179 -4.291
7 HA SER 2 HA SER 2 22.905 -8.688 -2.339
8 HB2 SER 2 HB2 SER 2 22.863 -7.463 -4.546
9 HB3 SER 2 HB3 SER 2 21.111 -7.360 -4.390
10 HG SER 2 HG SER 2 23.128 -6.066 -2.933
11 H ASP 3 H ASP 3 21.531 -10.379 -1.209
12 HA ASP 3 HA ASP 3 18.673 -9.918 -1.203
13 HB2 ASP 3 HB2 ASP 3 20.426 -11.976 0.138
14 HB3 ASP 3 HB3 ASP 3 18.683 -11.898 0.374
15 H VAL 4 H VAL 4 20.807 -8.111 0.089
16 HA VAL 4 HA VAL 4 19.825 -7.923 2.804
17 HB VAL 4 HB VAL 4 21.488 -5.913 1.266
18 HG11 VAL 4 HG11 VAL 4 21.127 -6.328 4.233
19 HG12 VAL 4 HG12 VAL 4 20.442 -5.013 3.280
20 HG13 VAL 4 HG13 VAL 4 22.190 -5.140 3.477
21 HG21 VAL 4 HG21 VAL 4 22.430 -8.168 3.033
22 HG22 VAL 4 HG22 VAL 4 23.453 -6.930 2.303
23 HG23 VAL 4 HG23 VAL 4 22.600 -8.087 1.280
24 H ALA 5 H ALA 5 19.093 -6.755 -0.323
25 HA ALA 5 HA ALA 5 16.850 -5.240 0.722
26 HB1 ALA 5 HB1 ALA 5 18.712 -4.219 -1.422
27 HB2 ALA 5 HB2 ALA 5 18.588 -3.588 0.221
28 HB3 ALA 5 HB3 ALA 5 17.225 -3.433 -0.888
29 H ALA 6 H ALA 6 15.129 -6.262 -0.050
30 HA ALA 6 HA ALA 6 15.370 -7.673 -2.627
31 HB1 ALA 6 HB1 ALA 6 13.466 -8.196 -0.346
32 HB2 ALA 6 HB2 ALA 6 14.933 -9.108 -0.696
33 HB3 ALA 6 HB3 ALA 6 13.588 -9.134 -1.834
34 H GLY 7 H GLY 7 13.945 -4.999 -1.167
35 HA2 GLY 7 HA2 GLY 7 11.547 -5.015 -2.819
36 HA3 GLY 7 HA3 GLY 7 12.026 -3.771 -1.675
37 H THR 8 H THR 8 14.578 -3.220 -2.598
38 HA THR 8 HA THR 8 14.134 -1.359 -4.619
39 HB THR 8 HB THR 8 16.007 -1.251 -3.022
40 HG1 THR 8 HG1 THR 8 17.536 -1.233 -5.265
41 HG21 THR 8 HG21 THR 8 16.650 -3.606 -3.019
42 HG22 THR 8 HG22 THR 8 18.030 -2.576 -3.395
43 HG23 THR 8 HG23 THR 8 17.217 -3.461 -4.684
44 H ALA 9 H ALA 9 14.483 -4.721 -4.902
45 HA ALA 9 HA ALA 9 15.379 -4.669 -7.659
46 HB1 ALA 9 HB1 ALA 9 16.072 -6.495 -6.164
47 HB2 ALA 9 HB2 ALA 9 15.183 -7.085 -7.567
48 HB3 ALA 9 HB3 ALA 9 14.386 -6.984 -5.998
49 H SER 10 H SER 10 12.707 -3.617 -6.413
50 HA SER 10 HA SER 10 10.687 -3.094 -7.261
51 HB2 SER 10 HB2 SER 10 11.551 -4.654 -9.707
52 HB3 SER 10 HB3 SER 10 10.154 -3.582 -9.607
53 HG SER 10 HG SER 10 12.908 -2.908 -9.430
54 H GLY 11 H GLY 11 9.887 -4.398 -5.539
55 HA2 GLY 11 HA2 GLY 11 9.128 -7.136 -6.052
56 HA3 GLY 11 HA3 GLY 11 8.739 -6.189 -4.619
57 H ALA 12 H ALA 12 6.884 -7.877 -5.963
58 HA ALA 12 HA ALA 12 5.170 -5.918 -7.324
59 HB1 ALA 12 HB1 ALA 12 5.083 -8.912 -7.608
60 HB2 ALA 12 HB2 ALA 12 5.993 -7.826 -8.660
61 HB3 ALA 12 HB3 ALA 12 4.232 -7.708 -8.587
62 H LYS 13 H LYS 13 2.857 -7.659 -7.219
63 HA LYS 13 HA LYS 13 0.983 -7.910 -5.962
64 HB2 LYS 13 HB2 LYS 13 2.689 -7.645 -3.489
65 HB3 LYS 13 HB3 LYS 13 1.102 -8.399 -3.624
66 HG2 LYS 13 HG2 LYS 13 1.978 -10.216 -4.877
67 HG3 LYS 13 HG3 LYS 13 3.542 -9.406 -5.068
68 HD2 LYS 13 HD2 LYS 13 2.440 -10.075 -2.354
69 HD3 LYS 13 HD3 LYS 13 3.320 -11.275 -3.300
70 HE2 LYS 13 HE2 LYS 13 4.405 -8.550 -2.569
71 HE3 LYS 13 HE3 LYS 13 4.714 -10.025 -1.654
72 HZ1 LYS 13 HZ1 LYS 13 6.530 -9.644 -3.133
73 HZ2 LYS 13 HZ2 LYS 13 5.501 -9.503 -4.467
74 HZ3 LYS 13 HZ3 LYS 13 5.672 -10.996 -3.692
75 H SER 14 H SER 14 3.195 -5.505 -5.386
76 HA SER 14 HA SER 14 1.513 -3.347 -5.795
77 HB2 SER 14 HB2 SER 14 1.678 -2.254 -3.541
78 HB3 SER 14 HB3 SER 14 0.657 -3.691 -3.526
79 HG SER 14 HG SER 14 3.257 -4.282 -2.990
80 H MET 15 H MET 15 3.043 -2.496 -7.083
81 HA MET 15 HA MET 15 5.689 -3.356 -7.004
82 HB2 MET 15 HB2 MET 15 4.579 -0.887 -8.335
83 HB3 MET 15 HB3 MET 15 6.158 -1.588 -8.662
84 HG2 MET 15 HG2 MET 15 4.943 -3.708 -9.297
85 HG3 MET 15 HG3 MET 15 3.458 -2.760 -9.244
86 HE1 MET 15 HE1 MET 15 7.048 -1.611 -10.436
87 HE2 MET 15 HE2 MET 15 6.950 -1.993 -12.156
88 HE3 MET 15 HE3 MET 15 6.912 -3.290 -10.961
89 H TRP 16 H TRP 16 7.141 -2.990 -5.545
90 HA TRP 16 HA TRP 16 7.379 -0.321 -4.377
91 HB2 TRP 16 HB2 TRP 16 7.412 -1.183 -2.118
92 HB3 TRP 16 HB3 TRP 16 5.927 -1.705 -2.901
93 HD1 TRP 16 HD1 TRP 16 5.880 -4.338 -3.708
94 HE1 TRP 16 HE1 TRP 16 6.983 -6.404 -2.638
95 HE3 TRP 16 HE3 TRP 16 9.358 -1.968 -0.838
96 HZ2 TRP 16 HZ2 TRP 16 9.066 -6.949 -0.802
97 HZ3 TRP 16 HZ3 TRP 16 10.871 -3.327 0.552
98 HH2 TRP 16 HH2 TRP 16 10.726 -5.764 0.568
99 H THR 17 H THR 17 9.327 0.226 -3.565
100 HA THR 17 HA THR 17 11.486 -1.771 -3.629
101 HB THR 17 HB THR 17 13.048 -0.058 -4.483
102 HG1 THR 17 HG1 THR 17 10.750 1.541 -5.021
103 HG21 THR 17 HG21 THR 17 11.232 -1.497 -5.904
104 HG22 THR 17 HG22 THR 17 12.614 -0.648 -6.600
105 HG23 THR 17 HG23 THR 17 11.022 0.119 -6.579
106 H GLU 18 H GLU 18 12.759 -1.637 -1.733
107 HA GLU 18 HA GLU 18 11.758 0.265 0.206
108 HB2 GLU 18 HB2 GLU 18 12.456 -1.128 1.859
109 HB3 GLU 18 HB3 GLU 18 12.177 -2.290 0.588
110 HG2 GLU 18 HG2 GLU 18 14.892 -1.136 1.055
111 HG3 GLU 18 HG3 GLU 18 14.291 -2.478 2.025
112 H HIS 19 H HIS 19 12.948 1.771 1.255
113 HA HIS 19 HA HIS 19 15.706 2.233 0.351
114 HB2 HIS 19 HB2 HIS 19 13.559 4.376 0.452
115 HB3 HIS 19 HB3 HIS 19 15.257 4.642 0.081
116 HD1 HIS 19 HD1 HIS 19 16.008 4.245 -2.322
117 HD2 HIS 19 HD2 HIS 19 12.088 3.055 -1.601
118 HE1 HIS 19 HE1 HIS 19 15.033 3.712 -4.577
119 HE2 HIS 19 HE2 HIS 19 12.751 2.760 -4.079
120 H LYS 20 H LYS 20 17.039 3.024 1.992
121 HA LYS 20 HA LYS 20 15.650 3.416 4.555
122 HB2 LYS 20 HB2 LYS 20 17.196 2.207 5.686
123 HB3 LYS 20 HB3 LYS 20 17.344 1.424 4.123
124 HG2 LYS 20 HG2 LYS 20 19.125 3.703 4.412
125 HG3 LYS 20 HG3 LYS 20 19.388 2.454 5.628
126 HD2 LYS 20 HD2 LYS 20 20.786 1.979 3.761
127 HD3 LYS 20 HD3 LYS 20 19.496 0.780 3.791
128 HE2 LYS 20 HE2 LYS 20 19.800 1.481 1.527
129 HE3 LYS 20 HE3 LYS 20 18.279 2.158 2.107
130 HZ1 LYS 20 HZ1 LYS 20 20.854 3.640 2.046
131 HZ2 LYS 20 HZ2 LYS 20 19.325 4.272 2.414
132 HZ3 LYS 20 HZ3 LYS 20 19.668 3.745 0.839
133 H SER 21 H SER 21 15.963 5.168 5.706
134 HA SER 21 HA SER 21 17.475 7.384 4.750
135 HB2 SER 21 HB2 SER 21 16.356 6.905 7.525
136 HB3 SER 21 HB3 SER 21 16.790 8.460 6.817
137 HG SER 21 HG SER 21 15.141 7.684 5.118
138 HA PRO 22 HA PRO 22 21.572 6.635 5.809
139 HB2 PRO 22 HB2 PRO 22 22.077 8.683 7.713
140 HB3 PRO 22 HB3 PRO 22 22.410 8.710 5.982
141 HG2 PRO 22 HG2 PRO 22 20.120 9.840 7.485
142 HG3 PRO 22 HG3 PRO 22 20.855 10.385 5.967
143 HD2 PRO 22 HD2 PRO 22 18.479 9.154 6.007
144 HD3 PRO 22 HD3 PRO 22 19.643 8.876 4.694
145 H ASP 23 H ASP 23 19.481 7.054 8.611
146 HA ASP 23 HA ASP 23 21.365 6.034 10.510
147 HB2 ASP 23 HB2 ASP 23 18.379 6.431 10.718
148 HB3 ASP 23 HB3 ASP 23 19.429 6.009 12.064
149 H GLY 24 H GLY 24 19.593 4.479 8.152
150 HA2 GLY 24 HA2 GLY 24 19.896 2.106 7.884
151 HA3 GLY 24 HA3 GLY 24 19.811 1.938 9.630
152 H ARG 25 H ARG 25 17.470 3.946 9.458
153 HA ARG 25 HA ARG 25 15.409 2.031 9.602
154 HB2 ARG 25 HB2 ARG 25 15.368 4.233 10.739
155 HB3 ARG 25 HB3 ARG 25 15.165 5.014 9.180
156 HG2 ARG 25 HG2 ARG 25 13.056 4.853 10.361
157 HG3 ARG 25 HG3 ARG 25 13.027 3.890 8.883
158 HD2 ARG 25 HD2 ARG 25 13.226 1.863 10.079
159 HD3 ARG 25 HD3 ARG 25 13.692 2.696 11.563
160 HE ARG 25 HE ARG 25 11.266 3.674 11.241
161 HH11 ARG 25 HH11 ARG 25 12.336 0.380 10.728
162 HH12 ARG 25 HH12 ARG 25 10.841 -0.327 11.267
163 HH21 ARG 25 HH21 ARG 25 9.294 2.757 11.944
164 HH22 ARG 25 HH22 ARG 25 9.112 1.027 11.952
165 H THR 26 H THR 26 14.344 1.020 8.029
166 HA THR 26 HA THR 26 14.605 2.098 5.297
167 HB THR 26 HB THR 26 13.829 -0.735 5.674
168 HG1 THR 26 HG1 THR 26 15.964 0.328 6.971
169 HG21 THR 26 HG21 THR 26 14.330 0.342 3.453
170 HG22 THR 26 HG22 THR 26 15.303 -1.084 3.804
171 HG23 THR 26 HG23 THR 26 16.000 0.524 3.989
172 H TYR 27 H TYR 27 12.805 2.530 4.141
173 HA TYR 27 HA TYR 27 10.242 1.454 5.101
174 HB2 TYR 27 HB2 TYR 27 9.276 3.619 4.024
175 HB3 TYR 27 HB3 TYR 27 9.956 3.706 5.638
176 HD1 TYR 27 HD1 TYR 27 11.078 4.068 2.091
177 HD2 TYR 27 HD2 TYR 27 11.352 5.493 6.084
178 HE1 TYR 27 HE1 TYR 27 12.537 5.893 1.330
179 HE2 TYR 27 HE2 TYR 27 12.821 7.318 5.340
180 HH TYR 27 HH TYR 27 13.169 8.213 2.153
181 H TYR 28 H TYR 28 8.576 1.981 3.143
182 HA TYR 28 HA TYR 28 9.839 0.703 0.808
183 HB2 TYR 28 HB2 TYR 28 7.002 0.462 1.836
184 HB3 TYR 28 HB3 TYR 28 7.582 -0.250 0.340
185 HD1 TYR 28 HD2 TYR 28 10.317 -0.702 2.303
186 HD2 TYR 28 HD1 TYR 28 6.278 -2.021 2.071
187 HE1 TYR 28 HE2 TYR 28 10.921 -2.755 3.515
188 HE2 TYR 28 HE1 TYR 28 6.874 -4.073 3.277
189 HH TYR 28 HH TYR 28 9.871 -4.481 4.860
190 H TYR 29 H TYR 29 9.267 1.436 -1.233
191 HA TYR 29 HA TYR 29 7.483 3.767 -1.302
192 HB2 TYR 29 HB2 TYR 29 9.415 4.817 -1.886
193 HB3 TYR 29 HB3 TYR 29 10.156 3.346 -2.492
194 HD1 TYR 29 HD1 TYR 29 7.315 5.638 -3.461
195 HD2 TYR 29 HD2 TYR 29 10.608 3.262 -4.680
196 HE1 TYR 29 HE1 TYR 29 6.981 6.394 -5.793
197 HE2 TYR 29 HE2 TYR 29 10.300 4.001 -7.005
198 HH TYR 29 HH TYR 29 8.595 6.626 -7.871
199 H ASN 30 H ASN 30 5.712 3.442 -2.370
200 HA ASN 30 HA ASN 30 5.518 1.150 -4.169
201 HB2 ASN 30 HB2 ASN 30 3.626 2.634 -2.447
202 HB3 ASN 30 HB3 ASN 30 2.977 2.152 -4.015
203 HD21 ASN 30 HD21 ASN 30 4.669 -0.216 -4.171
204 HD22 ASN 30 HD22 ASN 30 3.995 -1.364 -3.071
205 H THR 31 H THR 31 5.792 1.494 -6.245
206 HA THR 31 HA THR 31 6.085 4.118 -7.310
207 HB THR 31 HB THR 31 6.576 3.013 -9.412
208 HG1 THR 31 HG1 THR 31 5.766 1.109 -9.880
209 HG21 THR 31 HG21 THR 31 7.632 1.639 -6.956
210 HG22 THR 31 HG22 THR 31 8.389 2.932 -7.892
211 HG23 THR 31 HG23 THR 31 8.263 1.308 -8.572
212 H GLU 32 H GLU 32 3.466 1.992 -6.944
213 HA GLU 32 HA GLU 32 1.838 2.673 -9.121
214 HB2 GLU 32 HB2 GLU 32 0.201 2.172 -6.870
215 HB3 GLU 32 HB3 GLU 32 0.609 1.069 -8.174
216 HG2 GLU 32 HG2 GLU 32 2.784 0.703 -6.799
217 HG3 GLU 32 HG3 GLU 32 1.827 1.345 -5.469
218 H THR 33 H THR 33 1.960 3.899 -5.829
219 HA THR 33 HA THR 33 0.252 6.154 -6.559
220 HB THR 33 HB THR 33 0.135 6.549 -4.109
221 HG1 THR 33 HG1 THR 33 1.077 4.795 -2.788
222 HG21 THR 33 HG21 THR 33 -0.425 3.691 -4.934
223 HG22 THR 33 HG22 THR 33 -1.514 5.068 -5.152
224 HG23 THR 33 HG23 THR 33 -1.113 4.507 -3.527
225 H LYS 34 H LYS 34 3.439 5.324 -6.296
226 HA LYS 34 HA LYS 34 5.412 6.419 -6.307
227 HB2 LYS 34 HB2 LYS 34 3.627 8.760 -6.949
228 HB3 LYS 34 HB3 LYS 34 5.386 8.871 -6.920
229 HG2 LYS 34 HG2 LYS 34 3.956 6.826 -8.560
230 HG3 LYS 34 HG3 LYS 34 4.271 8.457 -9.175
231 HD2 LYS 34 HD2 LYS 34 6.651 8.134 -8.877
232 HD3 LYS 34 HD3 LYS 34 6.376 6.564 -8.122
233 HE2 LYS 34 HE2 LYS 34 5.409 5.745 -10.232
234 HE3 LYS 34 HE3 LYS 34 5.747 7.309 -10.977
235 HZ1 LYS 34 HZ1 LYS 34 8.077 6.969 -10.689
236 HZ2 LYS 34 HZ2 LYS 34 7.450 5.580 -11.433
237 HZ3 LYS 34 HZ3 LYS 34 7.825 5.560 -9.784
238 H GLN 35 H GLN 35 3.892 6.024 -3.901
239 HA GLN 35 HA GLN 35 4.824 8.286 -2.266
240 HB2 GLN 35 HB2 GLN 35 2.555 6.354 -1.814
241 HB3 GLN 35 HB3 GLN 35 3.127 7.489 -0.598
242 HG2 GLN 35 HG2 GLN 35 2.603 9.349 -2.105
243 HG3 GLN 35 HG3 GLN 35 1.994 8.198 -3.293
244 HE21 GLN 35 HE21 GLN 35 0.702 10.407 -1.766
245 HE22 GLN 35 HE22 GLN 35 -0.665 9.669 -1.009
246 H SER 36 H SER 36 5.874 7.871 -0.313
247 HA SER 36 HA SER 36 6.942 5.144 -0.046
248 HB2 SER 36 HB2 SER 36 8.590 7.031 -0.382
249 HB3 SER 36 HB3 SER 36 8.068 7.686 1.171
250 HG SER 36 HG SER 36 8.840 5.001 1.070
251 H THR 37 H THR 37 6.725 4.069 1.886
252 HA THR 37 HA THR 37 5.252 5.248 4.071
253 HB THR 37 HB THR 37 3.710 4.433 2.018
254 HG1 THR 37 HG1 THR 37 2.225 4.866 3.460
255 HG21 THR 37 HG21 THR 37 4.715 2.065 2.396
256 HG22 THR 37 HG22 THR 37 2.978 2.233 2.130
257 HG23 THR 37 HG23 THR 37 3.600 1.998 3.763
258 H TRP 38 H TRP 38 4.875 3.533 5.804
259 HA TRP 38 HA TRP 38 7.293 2.084 6.188
260 HB2 TRP 38 HB2 TRP 38 6.529 1.637 8.351
261 HB3 TRP 38 HB3 TRP 38 5.783 3.179 7.967
262 HD1 TRP 38 HD1 TRP 38 4.928 0.319 9.788
263 HE1 TRP 38 HE1 TRP 38 2.413 -0.210 9.791
264 HE3 TRP 38 HE3 TRP 38 3.478 3.138 5.757
265 HZ2 TRP 38 HZ2 TRP 38 0.132 0.459 8.302
266 HZ3 TRP 38 HZ3 TRP 38 1.100 3.128 5.125
267 HH2 TRP 38 HH2 TRP 38 -0.536 1.814 6.370
268 H GLU 39 H GLU 39 7.050 -0.332 7.041
269 HA GLU 39 HA GLU 39 6.367 -1.906 4.822
270 HB2 GLU 39 HB2 GLU 39 6.659 -3.845 6.369
271 HB3 GLU 39 HB3 GLU 39 8.005 -2.716 6.370
272 HG2 GLU 39 HG2 GLU 39 7.086 -1.699 8.432
273 HG3 GLU 39 HG3 GLU 39 5.850 -2.959 8.451
274 H LYS 40 H LYS 40 4.519 -2.711 4.141
275 HA LYS 40 HA LYS 40 2.144 -1.829 5.499
276 HB2 LYS 40 HB2 LYS 40 2.394 -3.238 2.843
277 HB3 LYS 40 HB3 LYS 40 0.982 -2.384 3.446
278 HG2 LYS 40 HG2 LYS 40 2.313 -0.288 3.424
279 HG3 LYS 40 HG3 LYS 40 3.630 -1.188 2.666
280 HD2 LYS 40 HD2 LYS 40 0.854 -0.761 1.558
281 HD3 LYS 40 HD3 LYS 40 2.352 -0.046 0.960
282 HE2 LYS 40 HE2 LYS 40 3.183 -2.279 0.374
283 HE3 LYS 40 HE3 LYS 40 1.692 -2.989 0.990
284 HZ1 LYS 40 HZ1 LYS 40 1.782 -2.682 -1.467
285 HZ2 LYS 40 HZ2 LYS 40 1.740 -1.004 -1.214
286 HZ3 LYS 40 HZ3 LYS 40 0.436 -1.976 -0.715
287 HA PRO 41 HA PRO 41 0.341 -5.724 6.890
288 HB2 PRO 41 HB2 PRO 41 -2.115 -5.472 5.610
289 HB3 PRO 41 HB3 PRO 41 -1.716 -4.824 7.204
290 HG2 PRO 41 HG2 PRO 41 -1.734 -3.457 4.551
291 HG3 PRO 41 HG3 PRO 41 -2.256 -2.848 6.133
292 HD2 PRO 41 HD2 PRO 41 0.080 -2.102 5.085
293 HD3 PRO 41 HD3 PRO 41 -0.073 -2.421 6.827
294 H ASP 42 H ASP 42 -1.352 -7.356 5.704
295 HA ASP 42 HA ASP 42 0.036 -9.037 4.013
296 HB2 ASP 42 HB2 ASP 42 -2.949 -8.668 4.309
297 HB3 ASP 42 HB3 ASP 42 -2.188 -10.042 3.514
298 H ASP 43 H ASP 43 -0.633 -6.049 2.918
299 HA ASP 43 HA ASP 43 -1.679 -6.330 0.315
300 HB2 ASP 43 HB2 ASP 43 -0.300 -4.348 1.850
301 HB3 ASP 43 HB3 ASP 43 0.543 -4.518 0.325
302 H LEU 44 H LEU 44 1.445 -6.780 1.720
303 HA LEU 44 HA LEU 44 2.715 -7.326 -0.829
304 HB2 LEU 44 HB2 LEU 44 3.980 -7.552 1.885
305 HB3 LEU 44 HB3 LEU 44 4.757 -7.286 0.328
306 HG LEU 44 HG LEU 44 2.807 -5.259 1.245
307 HD11 LEU 44 HD11 LEU 44 5.546 -5.627 2.433
308 HD12 LEU 44 HD12 LEU 44 3.993 -5.531 3.272
309 HD13 LEU 44 HD13 LEU 44 4.657 -4.102 2.478
310 HD21 LEU 44 HD21 LEU 44 4.552 -3.782 0.195
311 HD22 LEU 44 HD22 LEU 44 3.736 -4.913 -0.882
312 HD23 LEU 44 HD23 LEU 44 5.372 -5.262 -0.315
313 H LYS 45 H LYS 45 0.773 -9.059 1.034
314 HA LYS 45 HA LYS 45 2.184 -11.581 0.661
315 HB2 LYS 45 HB2 LYS 45 -0.603 -11.213 1.741
316 HB3 LYS 45 HB3 LYS 45 0.527 -12.530 2.051
317 HG2 LYS 45 HG2 LYS 45 1.148 -9.724 2.891
318 HG3 LYS 45 HG3 LYS 45 0.154 -10.781 3.890
319 HD2 LYS 45 HD2 LYS 45 2.797 -11.721 2.887
320 HD3 LYS 45 HD3 LYS 45 2.704 -10.660 4.300
321 HE2 LYS 45 HE2 LYS 45 1.342 -12.162 5.467
322 HE3 LYS 45 HE3 LYS 45 1.074 -13.150 4.040
323 HZ1 LYS 45 HZ1 LYS 45 3.571 -12.885 5.627
324 HZ2 LYS 45 HZ2 LYS 45 3.525 -13.640 4.110
325 HZ3 LYS 45 HZ3 LYS 45 2.632 -14.280 5.400
326 H THR 46 H THR 46 -1.173 -10.540 0.076
327 HA THR 46 HA THR 46 -1.175 -11.087 -2.717
328 HB THR 46 HB THR 46 -2.878 -13.008 -1.126
329 HG1 THR 46 HG1 THR 46 -0.942 -13.857 -0.636
330 HG21 THR 46 HG21 THR 46 -1.982 -12.919 -3.986
331 HG22 THR 46 HG22 THR 46 -3.620 -12.708 -3.370
332 HG23 THR 46 HG23 THR 46 -2.835 -14.285 -3.269
333 HA PRO 47 HA PRO 47 -4.447 -8.129 -2.325
334 HB2 PRO 47 HB2 PRO 47 -5.933 -9.789 -4.297
335 HB3 PRO 47 HB3 PRO 47 -5.616 -8.048 -4.310
336 HG2 PRO 47 HG2 PRO 47 -4.211 -9.638 -5.895
337 HG3 PRO 47 HG3 PRO 47 -3.400 -8.329 -5.015
338 HD2 PRO 47 HD2 PRO 47 -3.445 -11.260 -4.445
339 HD3 PRO 47 HD3 PRO 47 -2.108 -10.112 -4.282
340 H ALA 48 H ALA 48 -5.686 -11.468 -2.616
341 HA ALA 48 HA ALA 48 -8.030 -10.914 -1.116
342 HB1 ALA 48 HB1 ALA 48 -7.662 -12.791 -2.793
343 HB2 ALA 48 HB2 ALA 48 -8.553 -13.159 -1.324
344 HB3 ALA 48 HB3 ALA 48 -6.866 -13.650 -1.471
345 H GLU 49 H GLU 49 -4.840 -12.149 -0.273
346 HA GLU 49 HA GLU 49 -5.423 -12.910 2.351
347 HB2 GLU 49 HB2 GLU 49 -2.851 -11.886 1.157
348 HB3 GLU 49 HB3 GLU 49 -2.983 -12.479 2.810
349 HG2 GLU 49 HG2 GLU 49 -3.933 -14.609 1.801
350 HG3 GLU 49 HG3 GLU 49 -3.359 -13.998 0.252
351 H GLN 50 H GLN 50 -4.897 -9.774 0.908
352 HA GLN 50 HA GLN 50 -4.460 -8.218 3.166
353 HB2 GLN 50 HB2 GLN 50 -6.158 -7.469 0.784
354 HB3 GLN 50 HB3 GLN 50 -5.344 -6.364 1.882
355 HG2 GLN 50 HG2 GLN 50 -3.195 -7.103 1.099
356 HG3 GLN 50 HG3 GLN 50 -3.961 -8.333 0.085
357 HE21 GLN 50 HE21 GLN 50 -2.989 -7.432 -1.778
358 HE22 GLN 50 HE22 GLN 50 -3.552 -5.953 -2.472
359 H LEU 51 H LEU 51 -7.536 -9.457 1.860
360 HA LEU 51 HA LEU 51 -9.220 -7.590 3.064
361 HB2 LEU 51 HB2 LEU 51 -11.040 -9.024 2.517
362 HB3 LEU 51 HB3 LEU 51 -9.860 -9.091 1.226
363 HG LEU 51 HG LEU 51 -9.096 -11.255 2.622
364 HD11 LEU 51 HD11 LEU 51 -12.082 -11.087 3.006
365 HD12 LEU 51 HD12 LEU 51 -10.868 -11.036 4.286
366 HD13 LEU 51 HD13 LEU 51 -11.073 -12.499 3.320
367 HD21 LEU 51 HD21 LEU 51 -10.406 -12.537 0.962
368 HD22 LEU 51 HD22 LEU 51 -9.510 -11.182 0.261
369 HD23 LEU 51 HD23 LEU 51 -11.256 -11.051 0.528
370 H LEU 52 H LEU 52 -7.962 -10.595 4.382
371 HA LEU 52 HA LEU 52 -9.623 -10.773 6.645
372 HB2 LEU 52 HB2 LEU 52 -6.730 -11.623 6.446
373 HB3 LEU 52 HB3 LEU 52 -7.889 -12.178 7.635
374 HG LEU 52 HG LEU 52 -9.211 -13.101 5.616
375 HD11 LEU 52 HD11 LEU 52 -6.517 -13.138 4.313
376 HD12 LEU 52 HD12 LEU 52 -7.642 -11.806 4.031
377 HD13 LEU 52 HD13 LEU 52 -8.104 -13.463 3.606
378 HD21 LEU 52 HD21 LEU 52 -8.103 -14.491 7.274
379 HD22 LEU 52 HD22 LEU 52 -6.566 -14.297 6.430
380 HD23 LEU 52 HD23 LEU 52 -7.895 -15.164 5.657
381 H SER 53 H SER 53 -6.464 -9.303 6.198
382 HA SER 53 HA SER 53 -6.364 -8.163 8.836
383 HB2 SER 53 HB2 SER 53 -4.656 -7.678 6.381
384 HB3 SER 53 HB3 SER 53 -4.231 -7.213 8.029
385 HG SER 53 HG SER 53 -3.284 -9.232 7.316
386 H LYS 54 H LYS 54 -6.094 -6.687 5.647
387 HA LYS 54 HA LYS 54 -7.869 -4.474 6.403
388 HB2 LYS 54 HB2 LYS 54 -5.074 -4.051 5.304
389 HB3 LYS 54 HB3 LYS 54 -6.255 -2.792 5.622
390 HG2 LYS 54 HG2 LYS 54 -4.903 -4.534 7.672
391 HG3 LYS 54 HG3 LYS 54 -4.566 -2.833 7.348
392 HD2 LYS 54 HD2 LYS 54 -7.151 -3.978 8.402
393 HD3 LYS 54 HD3 LYS 54 -5.957 -3.075 9.332
394 HE2 LYS 54 HE2 LYS 54 -6.380 -1.090 8.018
395 HE3 LYS 54 HE3 LYS 54 -7.484 -1.984 6.971
396 HZ1 LYS 54 HZ1 LYS 54 -8.901 -2.377 8.918
397 HZ2 LYS 54 HZ2 LYS 54 -8.722 -0.722 8.585
398 HZ3 LYS 54 HZ3 LYS 54 -7.860 -1.429 9.867
399 H CYS 55 H CYS 55 -9.158 -3.937 4.697
400 HA CYS 55 HA CYS 55 -9.295 -5.783 2.574
401 HB2 CYS 55 HB2 CYS 55 -11.159 -4.465 1.765
402 HB3 CYS 55 HB3 CYS 55 -11.238 -4.545 3.521
403 HG CYS 55 HG CYS 55 -9.551 -1.865 2.515
404 HA PRO 56 HA PRO 56 -6.786 -4.480 -0.806
405 HB2 PRO 56 HB2 PRO 56 -9.332 -3.903 -2.278
406 HB3 PRO 56 HB3 PRO 56 -7.889 -4.767 -2.826
407 HG2 PRO 56 HG2 PRO 56 -10.031 -6.129 -2.068
408 HG3 PRO 56 HG3 PRO 56 -8.409 -6.679 -1.608
409 HD2 PRO 56 HD2 PRO 56 -10.506 -5.369 0.044
410 HD3 PRO 56 HD3 PRO 56 -9.281 -6.564 0.511
411 H TRP 57 H TRP 57 -9.580 -2.388 -0.191
412 HA TRP 57 HA TRP 57 -8.286 -0.041 -1.239
413 HB2 TRP 57 HB2 TRP 57 -10.762 -0.271 0.488
414 HB3 TRP 57 HB3 TRP 57 -10.246 1.160 -0.399
415 HD1 TRP 57 HD1 TRP 57 -10.196 0.836 -3.181
416 HE1 TRP 57 HE1 TRP 57 -11.885 -0.444 -4.655
417 HE3 TRP 57 HE3 TRP 57 -12.316 -2.155 0.393
418 HZ2 TRP 57 HZ2 TRP 57 -13.849 -2.445 -4.342
419 HZ3 TRP 57 HZ3 TRP 57 -14.093 -3.716 -0.275
420 HH2 TRP 57 HH2 TRP 57 -14.844 -3.858 -2.595
421 H LYS 58 H LYS 58 -6.852 1.186 -0.178
422 HA LYS 58 HA LYS 58 -6.952 1.268 2.756
423 HB2 LYS 58 HB2 LYS 58 -4.927 -0.029 1.243
424 HB3 LYS 58 HB3 LYS 58 -4.237 1.350 2.095
425 HG2 LYS 58 HG2 LYS 58 -4.101 -0.070 3.802
426 HG3 LYS 58 HG3 LYS 58 -5.796 0.296 4.026
427 HD2 LYS 58 HD2 LYS 58 -5.449 -2.106 4.071
428 HD3 LYS 58 HD3 LYS 58 -6.400 -1.643 2.659
429 HE2 LYS 58 HE2 LYS 58 -4.221 -1.645 1.368
430 HE3 LYS 58 HE3 LYS 58 -3.497 -2.417 2.775
431 HZ1 LYS 58 HZ1 LYS 58 -5.802 -3.488 1.247
432 HZ2 LYS 58 HZ2 LYS 58 -5.023 -4.250 2.535
433 HZ3 LYS 58 HZ3 LYS 58 -4.196 -4.005 1.071
434 H GLU 59 H GLU 59 -5.815 2.990 3.710
435 HA GLU 59 HA GLU 59 -5.167 5.248 1.956
436 HB2 GLU 59 HB2 GLU 59 -7.252 5.932 2.739
437 HB3 GLU 59 HB3 GLU 59 -7.043 5.145 4.293
438 HG2 GLU 59 HG2 GLU 59 -5.295 7.459 3.629
439 HG3 GLU 59 HG3 GLU 59 -6.982 7.762 4.038
440 H TYR 60 H TYR 60 -3.122 5.883 2.285
441 HA TYR 60 HA TYR 60 -2.170 6.007 5.041
442 HB2 TYR 60 HB2 TYR 60 0.073 5.128 4.394
443 HB3 TYR 60 HB3 TYR 60 -1.203 3.921 4.326
444 HD1 TYR 60 HD1 TYR 60 0.856 6.184 2.207
445 HD2 TYR 60 HD2 TYR 60 -1.605 2.716 2.361
446 HE1 TYR 60 HE1 TYR 60 1.510 5.616 -0.089
447 HE2 TYR 60 HE2 TYR 60 -0.954 2.149 0.062
448 HH TYR 60 HH TYR 60 -0.076 3.153 -1.899
449 H LYS 61 H LYS 61 -0.453 7.535 5.357
450 HA LYS 61 HA LYS 61 -0.327 9.536 3.227
451 HB2 LYS 61 HB2 LYS 61 0.682 9.724 6.061
452 HB3 LYS 61 HB3 LYS 61 0.650 11.030 4.887
453 HG2 LYS 61 HG2 LYS 61 -1.863 10.686 4.818
454 HG3 LYS 61 HG3 LYS 61 -1.648 9.700 6.259
455 HD2 LYS 61 HD2 LYS 61 -1.056 12.626 5.899
456 HD3 LYS 61 HD3 LYS 61 -2.196 11.877 7.018
457 HE2 LYS 61 HE2 LYS 61 0.804 11.610 7.116
458 HE3 LYS 61 HE3 LYS 61 -0.161 12.667 8.144
459 HZ1 LYS 61 HZ1 LYS 61 -0.324 9.698 8.071
460 HZ2 LYS 61 HZ2 LYS 61 -1.270 10.713 9.048
461 HZ3 LYS 61 HZ3 LYS 61 0.408 10.626 9.285
462 H SER 62 H SER 62 1.568 10.082 2.242
463 HA SER 62 HA SER 62 3.708 8.238 2.227
464 HB2 SER 62 HB2 SER 62 4.118 11.027 1.286
465 HB3 SER 62 HB3 SER 62 4.539 9.508 0.497
466 HG SER 62 HG SER 62 2.026 9.368 0.475
467 H ASP 63 H ASP 63 6.057 9.285 2.412
468 HA ASP 63 HA ASP 63 6.628 10.069 5.035
469 HB2 ASP 63 HB2 ASP 63 8.839 10.634 4.223
470 HB3 ASP 63 HB3 ASP 63 8.296 9.175 3.403
471 H SER 64 H SER 64 5.632 11.854 2.244
472 HA SER 64 HA SER 64 6.143 14.455 3.401
473 HB2 SER 64 HB2 SER 64 4.552 13.773 0.924
474 HB3 SER 64 HB3 SER 64 5.303 15.323 1.327
475 HG SER 64 HG SER 64 7.029 13.161 1.303
476 H GLY 65 H GLY 65 3.777 12.134 3.794
477 HA2 GLY 65 HA2 GLY 65 1.931 12.267 5.191
478 HA3 GLY 65 HA3 GLY 65 2.090 14.011 5.212
479 H LYS 66 H LYS 66 2.046 12.671 2.068
480 HA LYS 66 HA LYS 66 -0.612 13.690 1.568
481 HB2 LYS 66 HB2 LYS 66 1.102 13.951 -0.140
482 HB3 LYS 66 HB3 LYS 66 1.346 12.218 -0.206
483 HG2 LYS 66 HG2 LYS 66 0.050 13.119 -2.104
484 HG3 LYS 66 HG3 LYS 66 -0.808 11.882 -1.188
485 HD2 LYS 66 HD2 LYS 66 -2.243 13.792 -1.828
486 HD3 LYS 66 HD3 LYS 66 -2.138 13.564 -0.082
487 HE2 LYS 66 HE2 LYS 66 -0.607 15.385 0.132
488 HE3 LYS 66 HE3 LYS 66 -0.456 15.535 -1.621
489 HZ1 LYS 66 HZ1 LYS 66 -2.637 16.356 -1.796
490 HZ2 LYS 66 HZ2 LYS 66 -1.964 17.182 -0.473
491 HZ3 LYS 66 HZ3 LYS 66 -3.040 15.895 -0.214
492 H THR 67 H THR 67 -2.395 12.534 2.043
493 HA THR 67 HA THR 67 -2.273 9.663 2.314
494 HB THR 67 HB THR 67 -4.972 10.391 2.304
495 HG1 THR 67 HG1 THR 67 -4.458 12.117 4.154
496 HG21 THR 67 HG21 THR 67 -3.580 8.821 3.758
497 HG22 THR 67 HG22 THR 67 -4.913 9.689 4.535
498 HG23 THR 67 HG23 THR 67 -3.251 10.239 4.761
499 H TYR 68 H TYR 68 -2.819 8.205 0.870
500 HA TYR 68 HA TYR 68 -4.563 9.033 -1.331
501 HB2 TYR 68 HB2 TYR 68 -1.869 7.980 -1.566
502 HB3 TYR 68 HB3 TYR 68 -3.041 6.964 -2.403
503 HD1 TYR 68 HD2 TYR 68 -1.823 10.464 -2.121
504 HD2 TYR 68 HD1 TYR 68 -3.930 7.618 -4.483
505 HE1 TYR 68 HE2 TYR 68 -1.874 12.059 -3.992
506 HE2 TYR 68 HE1 TYR 68 -3.987 9.208 -6.360
507 HH TYR 68 HH TYR 68 -3.865 11.701 -6.664
508 H TYR 69 H TYR 69 -5.975 7.516 -2.076
509 HA TYR 69 HA TYR 69 -6.374 5.175 -0.324
510 HB2 TYR 69 HB2 TYR 69 -8.033 7.175 -0.265
511 HB3 TYR 69 HB3 TYR 69 -8.527 6.633 -1.861
512 HD1 TYR 69 HD1 TYR 69 -8.310 5.651 1.683
513 HD2 TYR 69 HD2 TYR 69 -10.035 4.836 -2.121
514 HE1 TYR 69 HE1 TYR 69 -9.897 4.085 2.741
515 HE2 TYR 69 HE2 TYR 69 -11.618 3.274 -1.088
516 HH TYR 69 HH TYR 69 -11.726 1.869 1.010
517 H TYR 70 H TYR 70 -6.329 3.223 -1.456
518 HA TYR 70 HA TYR 70 -6.537 3.473 -4.374
519 HB2 TYR 70 HB2 TYR 70 -4.491 2.241 -4.739
520 HB3 TYR 70 HB3 TYR 70 -4.144 3.636 -3.720
521 HD1 TYR 70 HD2 TYR 70 -3.723 3.293 -1.279
522 HD2 TYR 70 HD1 TYR 70 -4.180 0.027 -3.960
523 HE1 TYR 70 HE2 TYR 70 -2.749 1.785 0.401
524 HE2 TYR 70 HE1 TYR 70 -3.210 -1.497 -2.286
525 HH TYR 70 HH TYR 70 -1.956 -1.549 -0.340
526 H ASN 71 H ASN 71 -7.181 1.759 -5.494
527 HA ASN 71 HA ASN 71 -8.302 -0.525 -4.058
528 HB2 ASN 71 HB2 ASN 71 -8.325 0.145 -7.023
529 HB3 ASN 71 HB3 ASN 71 -9.261 -1.124 -6.246
530 HD21 ASN 71 HD21 ASN 71 -11.202 -0.339 -6.954
531 HD22 ASN 71 HD22 ASN 71 -11.906 1.123 -6.346
532 H SER 72 H SER 72 -6.740 -2.032 -3.562
533 HA SER 72 HA SER 72 -4.255 -2.032 -4.932
534 HB2 SER 72 HB2 SER 72 -4.574 -2.544 -2.498
535 HB3 SER 72 HB3 SER 72 -5.226 -4.110 -2.963
536 HG SER 72 HG SER 72 -2.829 -3.805 -2.450
537 H GLN 73 H GLN 73 -7.086 -4.147 -5.260
538 HA GLN 73 HA GLN 73 -5.638 -6.229 -6.531
539 HB2 GLN 73 HB2 GLN 73 -7.758 -7.172 -7.167
540 HB3 GLN 73 HB3 GLN 73 -7.810 -6.674 -5.489
541 HG2 GLN 73 HG2 GLN 73 -9.049 -5.243 -7.833
542 HG3 GLN 73 HG3 GLN 73 -9.897 -6.262 -6.678
543 HE21 GLN 73 HE21 GLN 73 -8.771 -3.145 -7.399
544 HE22 GLN 73 HE22 GLN 73 -9.253 -2.389 -5.920
545 H THR 74 H THR 74 -7.160 -3.357 -7.698
546 HA THR 74 HA THR 74 -6.643 -4.189 -10.467
547 HB THR 74 HB THR 74 -8.346 -2.401 -11.024
548 HG1 THR 74 HG1 THR 74 -9.711 -1.835 -9.191
549 HG21 THR 74 HG21 THR 74 -9.082 -4.810 -9.349
550 HG22 THR 74 HG22 THR 74 -9.022 -4.688 -11.115
551 HG23 THR 74 HG23 THR 74 -10.275 -3.832 -10.214
552 H LYS 75 H LYS 75 -5.429 -2.403 -8.056
553 HA LYS 75 HA LYS 75 -3.899 -0.784 -7.832
554 HB2 LYS 75 HB2 LYS 75 -3.282 -1.664 -10.643
555 HB3 LYS 75 HB3 LYS 75 -2.262 -0.565 -9.717
556 HG2 LYS 75 HG2 LYS 75 -3.010 -3.366 -8.892
557 HG3 LYS 75 HG3 LYS 75 -1.459 -2.878 -9.595
558 HD2 LYS 75 HD2 LYS 75 -1.034 -1.436 -7.692
559 HD3 LYS 75 HD3 LYS 75 -2.621 -1.814 -7.021
560 HE2 LYS 75 HE2 LYS 75 -1.886 -4.228 -6.979
561 HE3 LYS 75 HE3 LYS 75 -0.262 -3.649 -7.355
562 HZ1 LYS 75 HZ1 LYS 75 -0.389 -2.250 -5.343
563 HZ2 LYS 75 HZ2 LYS 75 -0.473 -3.915 -5.008
564 HZ3 LYS 75 HZ3 LYS 75 -1.876 -2.976 -4.961
565 H GLU 76 H GLU 76 -6.459 0.103 -8.482
566 HA GLU 76 HA GLU 76 -5.987 2.523 -10.039
567 HB2 GLU 76 HB2 GLU 76 -8.177 1.588 -10.367
568 HB3 GLU 76 HB3 GLU 76 -8.429 1.416 -8.634
569 HG2 GLU 76 HG2 GLU 76 -8.492 3.831 -8.386
570 HG3 GLU 76 HG3 GLU 76 -8.193 4.031 -10.109
571 H SER 77 H SER 77 -5.978 4.589 -9.052
572 HA SER 77 HA SER 77 -5.864 4.525 -6.126
573 HB2 SER 77 HB2 SER 77 -3.975 6.164 -6.216
574 HB3 SER 77 HB3 SER 77 -3.571 4.573 -6.853
575 HG SER 77 HG SER 77 -2.963 5.618 -8.560
576 H ARG 78 H ARG 78 -7.020 5.995 -5.156
577 HA ARG 78 HA ARG 78 -8.004 8.334 -6.661
578 HB2 ARG 78 HB2 ARG 78 -10.200 8.020 -5.572
579 HB3 ARG 78 HB3 ARG 78 -9.782 6.617 -6.538
580 HG2 ARG 78 HG2 ARG 78 -9.001 5.507 -4.480
581 HG3 ARG 78 HG3 ARG 78 -9.640 6.859 -3.563
582 HD2 ARG 78 HD2 ARG 78 -11.138 4.938 -3.690
583 HD3 ARG 78 HD3 ARG 78 -11.823 6.389 -4.352
584 HE ARG 78 HE ARG 78 -10.601 4.502 -6.205
585 HH11 ARG 78 HH11 ARG 78 -13.517 5.929 -4.886
586 HH12 ARG 78 HH12 ARG 78 -14.556 5.225 -6.090
587 HH21 ARG 78 HH21 ARG 78 -11.984 3.571 -7.808
588 HH22 ARG 78 HH22 ARG 78 -13.695 3.898 -7.725
589 H TRP 79 H TRP 79 -8.802 10.082 -5.122
590 HA TRP 79 HA TRP 79 -7.562 9.787 -2.476
591 HB2 TRP 79 HB2 TRP 79 -7.353 12.272 -2.398
592 HB3 TRP 79 HB3 TRP 79 -6.367 11.522 -3.644
593 HD1 TRP 79 HD1 TRP 79 -7.250 11.842 -6.223
594 HE1 TRP 79 HE1 TRP 79 -8.568 13.781 -7.282
595 HE3 TRP 79 HE3 TRP 79 -9.085 13.979 -1.962
596 HZ2 TRP 79 HZ2 TRP 79 -10.172 15.939 -6.410
597 HZ3 TRP 79 HZ3 TRP 79 -10.505 15.978 -2.159
598 HH2 TRP 79 HH2 TRP 79 -11.034 16.938 -4.341
599 H ALA 80 H ALA 80 -9.004 9.384 -1.041
600 HA ALA 80 HA ALA 80 -11.221 10.886 -0.333
601 HB1 ALA 80 HB1 ALA 80 -13.085 9.529 -1.167
602 HB2 ALA 80 HB2 ALA 80 -11.956 8.524 -2.074
603 HB3 ALA 80 HB3 ALA 80 -12.168 10.220 -2.507
604 H LYS 81 H LYS 81 -12.895 9.176 0.853
605 HA LYS 81 HA LYS 81 -11.550 6.781 1.748
606 HB2 LYS 81 HB2 LYS 81 -11.895 7.472 4.203
607 HB3 LYS 81 HB3 LYS 81 -10.506 8.109 3.341
608 HG2 LYS 81 HG2 LYS 81 -11.365 9.918 4.553
609 HG3 LYS 81 HG3 LYS 81 -11.909 10.178 2.897
610 HD2 LYS 81 HD2 LYS 81 -14.097 9.178 3.515
611 HD3 LYS 81 HD3 LYS 81 -13.534 9.066 5.183
612 HE2 LYS 81 HE2 LYS 81 -14.881 11.046 4.934
613 HE3 LYS 81 HE3 LYS 81 -13.202 11.515 5.195
614 HZ1 LYS 81 HZ1 LYS 81 -14.138 12.843 3.451
615 HZ2 LYS 81 HZ2 LYS 81 -14.642 11.467 2.601
616 HZ3 LYS 81 HZ3 LYS 81 -12.989 11.798 2.770
617 HA PRO 82 HA PRO 82 -16.332 7.088 2.130
618 HB2 PRO 82 HB2 PRO 82 -17.203 6.027 -0.187
619 HB3 PRO 82 HB3 PRO 82 -16.855 7.751 -0.013
620 HG2 PRO 82 HG2 PRO 82 -15.178 5.597 -1.234
621 HG3 PRO 82 HG3 PRO 82 -15.469 7.251 -1.804
622 HD2 PRO 82 HD2 PRO 82 -13.221 6.495 -0.453
623 HD3 PRO 82 HD3 PRO 82 -13.879 8.140 -0.419
624 H LYS 83 H LYS 83 -17.106 5.464 3.316
625 HA LYS 83 HA LYS 83 -16.207 2.792 3.194
626 HB2 LYS 83 HB2 LYS 83 -17.726 2.321 4.856
627 HB3 LYS 83 HB3 LYS 83 -17.533 4.048 5.066
628 HG2 LYS 83 HG2 LYS 83 -19.821 2.661 3.683
629 HG3 LYS 83 HG3 LYS 83 -19.856 3.408 5.277
630 HD2 LYS 83 HD2 LYS 83 -19.272 5.587 4.117
631 HD3 LYS 83 HD3 LYS 83 -19.587 4.756 2.598
632 HE2 LYS 83 HE2 LYS 83 -21.860 4.246 3.327
633 HE3 LYS 83 HE3 LYS 83 -21.556 5.051 4.865
634 HZ1 LYS 83 HZ1 LYS 83 -21.271 7.131 3.713
635 HZ2 LYS 83 HZ2 LYS 83 -22.770 6.454 3.295
636 HZ3 LYS 83 HZ3 LYS 83 -21.472 6.377 2.207
637 H GLU 84 H GLU 84 -18.123 4.554 1.156
638 HA GLU 84 HA GLU 84 -20.309 3.054 0.468
639 HB2 GLU 84 HB2 GLU 84 -19.974 5.318 -0.276
640 HB3 GLU 84 HB3 GLU 84 -18.572 4.848 -1.221
641 HG2 GLU 84 HG2 GLU 84 -20.086 3.457 -2.632
642 HG3 GLU 84 HG3 GLU 84 -21.447 4.152 -1.751
643 H LEU 85 H LEU 85 -16.994 2.535 -0.583
644 HA LEU 85 HA LEU 85 -17.603 0.928 -2.840
645 HB2 LEU 85 HB2 LEU 85 -15.136 0.915 -1.095
646 HB3 LEU 85 HB3 LEU 85 -15.257 0.220 -2.698
647 HG LEU 85 HG LEU 85 -15.559 3.158 -2.087
648 HD11 LEU 85 HD11 LEU 85 -13.223 1.740 -3.350
649 HD12 LEU 85 HD12 LEU 85 -13.303 2.189 -1.648
650 HD13 LEU 85 HD13 LEU 85 -13.337 3.442 -2.890
651 HD21 LEU 85 HD21 LEU 85 -15.345 3.421 -4.514
652 HD22 LEU 85 HD22 LEU 85 -16.757 2.452 -4.093
653 HD23 LEU 85 HD23 LEU 85 -15.299 1.667 -4.700
654 H GLU 86 H GLU 86 -16.464 0.011 0.410
655 HA GLU 86 HA GLU 86 -17.112 -2.748 0.046
656 HB2 GLU 86 HB2 GLU 86 -15.329 -1.825 1.580
657 HB3 GLU 86 HB3 GLU 86 -16.618 -1.301 2.652
658 HG2 GLU 86 HG2 GLU 86 -16.660 -4.141 1.865
659 HG3 GLU 86 HG3 GLU 86 -15.325 -3.635 2.900
660 H ASP 87 H ASP 87 -18.674 0.040 1.381
661 HA ASP 87 HA ASP 87 -20.858 0.563 1.599
662 HB2 ASP 87 HB2 ASP 87 -21.305 -1.173 -0.183
663 HB3 ASP 87 HB3 ASP 87 -21.613 -2.318 1.118
664 H LEU 88 H LEU 88 -19.022 -0.778 3.675
665 HA LEU 88 HA LEU 88 -21.109 -0.799 5.706
666 HB2 LEU 88 HB2 LEU 88 -20.188 -3.166 4.948
667 HB3 LEU 88 HB3 LEU 88 -18.879 -2.749 6.035
668 HG LEU 88 HG LEU 88 -20.612 -4.167 7.088
669 HD11 LEU 88 HD11 LEU 88 -20.939 -2.791 9.119
670 HD12 LEU 88 HD12 LEU 88 -20.309 -1.396 8.237
671 HD13 LEU 88 HD13 LEU 88 -19.278 -2.797 8.531
672 HD21 LEU 88 HD21 LEU 88 -22.555 -3.334 5.881
673 HD22 LEU 88 HD22 LEU 88 -22.401 -1.774 6.689
674 HD23 LEU 88 HD23 LEU 88 -22.797 -3.215 7.624
675 H GLU 89 H GLU 89 -17.600 -1.474 5.894
676 HA GLU 89 HA GLU 89 -17.238 1.183 7.105
677 HB2 GLU 89 HB2 GLU 89 -16.333 -1.392 8.398
678 HB3 GLU 89 HB3 GLU 89 -15.846 0.214 8.918
679 HG2 GLU 89 HG2 GLU 89 -18.309 0.693 9.260
680 HG3 GLU 89 HG3 GLU 89 -18.566 -1.035 9.046
681 H GLY 90 H GLY 90 -16.057 -1.463 5.284
682 HA2 GLY 90 HA2 GLY 90 -14.314 -0.978 3.653
683 HA3 GLY 90 HA3 GLY 90 -13.515 -0.013 4.887
684 H LEU 91 H LEU 91 -14.948 -3.250 5.067
685 HA LEU 91 HA LEU 91 -12.326 -4.463 5.042
686 HB2 LEU 91 HB2 LEU 91 -12.483 -5.605 7.138
687 HB3 LEU 91 HB3 LEU 91 -12.637 -3.891 7.419
688 HG LEU 91 HG LEU 91 -14.103 -4.932 8.923
689 HD11 LEU 91 HD11 LEU 91 -16.345 -4.223 8.278
690 HD12 LEU 91 HD12 LEU 91 -15.791 -4.004 6.619
691 HD13 LEU 91 HD13 LEU 91 -15.123 -3.005 7.909
692 HD21 LEU 91 HD21 LEU 91 -15.750 -6.606 8.375
693 HD22 LEU 91 HD22 LEU 91 -14.145 -7.144 7.880
694 HD23 LEU 91 HD23 LEU 91 -15.285 -6.546 6.675
695 H GLU 92 H GLU 92 -12.359 -6.630 4.369
696 HA GLU 92 HA GLU 92 -15.022 -7.471 3.453
697 HB2 GLU 92 HB2 GLU 92 -12.295 -8.127 2.342
698 HB3 GLU 92 HB3 GLU 92 -13.786 -8.879 1.793
699 HG2 GLU 92 HG2 GLU 92 -14.570 -6.444 1.383
700 HG3 GLU 92 HG3 GLU 92 -12.848 -6.068 1.449
Start of MODEL 3
1 H1 GLY 1 H1 GLY 1 25.704 1.002 -7.268
2 H2 GLY 1 H2 GLY 1 26.993 0.171 -6.548
3 H3 GLY 1 H3 GLY 1 27.112 1.837 -6.830
4 HA2 GLY 1 HA3 GLY 1 26.695 1.420 -4.504
5 HA3 GLY 1 HA2 GLY 1 25.347 2.269 -5.247
6 H SER 2 H SER 2 25.804 0.219 -2.956
7 HA SER 2 HA SER 2 24.116 -1.986 -3.747
8 HB2 SER 2 HB2 SER 2 25.193 -1.227 -1.021
9 HB3 SER 2 HB3 SER 2 24.446 -2.767 -1.447
10 HG SER 2 HG SER 2 26.209 -2.783 -3.149
11 H ASP 3 H ASP 3 22.318 -0.609 -4.377
12 HA ASP 3 HA ASP 3 20.421 -0.291 -2.217
13 HB2 ASP 3 HB2 ASP 3 21.613 1.881 -2.229
14 HB3 ASP 3 HB3 ASP 3 21.191 2.088 -3.926
15 H VAL 4 H VAL 4 21.211 0.072 -5.616
16 HA VAL 4 HA VAL 4 19.953 0.092 -7.517
17 HB VAL 4 HB VAL 4 18.755 -2.091 -7.895
18 HG11 VAL 4 HG11 VAL 4 21.082 -1.751 -8.501
19 HG12 VAL 4 HG12 VAL 4 20.831 -3.393 -7.908
20 HG13 VAL 4 HG13 VAL 4 21.586 -2.185 -6.868
21 HG21 VAL 4 HG21 VAL 4 19.789 -2.706 -5.127
22 HG22 VAL 4 HG22 VAL 4 19.119 -3.884 -6.257
23 HG23 VAL 4 HG23 VAL 4 18.095 -2.605 -5.604
24 H ALA 5 H ALA 5 18.742 1.947 -6.768
25 HA ALA 5 HA ALA 5 16.215 1.820 -5.592
26 HB1 ALA 5 HB1 ALA 5 15.906 4.086 -6.424
27 HB2 ALA 5 HB2 ALA 5 17.277 3.883 -7.515
28 HB3 ALA 5 HB3 ALA 5 17.529 3.873 -5.769
29 H ALA 6 H ALA 6 14.135 2.192 -6.515
30 HA ALA 6 HA ALA 6 12.400 1.854 -7.919
31 HB1 ALA 6 HB1 ALA 6 13.678 3.179 -9.543
32 HB2 ALA 6 HB2 ALA 6 12.675 1.948 -10.310
33 HB3 ALA 6 HB3 ALA 6 14.414 1.696 -10.149
34 H GLY 7 H GLY 7 14.899 -0.442 -7.601
35 HA2 GLY 7 HA2 GLY 7 12.981 -2.570 -7.814
36 HA3 GLY 7 HA3 GLY 7 14.136 -2.576 -9.139
37 H THR 8 H THR 8 14.172 -2.225 -5.586
38 HA THR 8 HA THR 8 16.775 -3.394 -5.424
39 HB THR 8 HB THR 8 14.922 -2.879 -3.111
40 HG1 THR 8 HG1 THR 8 16.774 -1.009 -4.211
41 HG21 THR 8 HG21 THR 8 16.966 -4.112 -2.585
42 HG22 THR 8 HG22 THR 8 17.028 -2.488 -1.899
43 HG23 THR 8 HG23 THR 8 17.934 -2.860 -3.365
44 H ALA 9 H ALA 9 14.047 -4.359 -3.404
45 HA ALA 9 HA ALA 9 14.825 -7.134 -3.661
46 HB1 ALA 9 HB1 ALA 9 13.098 -7.557 -1.991
47 HB2 ALA 9 HB2 ALA 9 12.553 -5.884 -2.113
48 HB3 ALA 9 HB3 ALA 9 14.157 -6.246 -1.473
49 H SER 10 H SER 10 13.093 -5.023 -5.421
50 HA SER 10 HA SER 10 11.185 -5.072 -6.747
51 HB2 SER 10 HB2 SER 10 13.162 -5.860 -8.048
52 HB3 SER 10 HB3 SER 10 12.683 -7.520 -7.699
53 HG SER 10 HG SER 10 11.394 -7.385 -9.325
54 H GLY 11 H GLY 11 9.641 -5.623 -5.008
55 HA2 GLY 11 HA2 GLY 11 8.795 -8.439 -5.011
56 HA3 GLY 11 HA3 GLY 11 8.352 -7.236 -3.806
57 H ALA 12 H ALA 12 6.633 -9.041 -5.390
58 HA ALA 12 HA ALA 12 5.133 -7.052 -6.951
59 HB1 ALA 12 HB1 ALA 12 5.167 -10.049 -7.255
60 HB2 ALA 12 HB2 ALA 12 6.001 -8.892 -8.294
61 HB3 ALA 12 HB3 ALA 12 4.236 -8.920 -8.240
62 H LYS 13 H LYS 13 2.773 -8.486 -7.189
63 HA LYS 13 HA LYS 13 0.753 -8.831 -6.205
64 HB2 LYS 13 HB2 LYS 13 2.130 -9.034 -3.529
65 HB3 LYS 13 HB3 LYS 13 0.583 -9.723 -4.005
66 HG2 LYS 13 HG2 LYS 13 1.612 -11.369 -5.345
67 HG3 LYS 13 HG3 LYS 13 3.179 -10.544 -5.274
68 HD2 LYS 13 HD2 LYS 13 1.759 -11.729 -2.883
69 HD3 LYS 13 HD3 LYS 13 3.010 -12.563 -3.804
70 HE2 LYS 13 HE2 LYS 13 3.430 -9.873 -2.502
71 HE3 LYS 13 HE3 LYS 13 3.778 -11.403 -1.697
72 HZ1 LYS 13 HZ1 LYS 13 5.420 -11.921 -3.281
73 HZ2 LYS 13 HZ2 LYS 13 5.709 -10.315 -2.825
74 HZ3 LYS 13 HZ3 LYS 13 4.962 -10.655 -4.303
75 H SER 14 H SER 14 2.839 -6.465 -5.540
76 HA SER 14 HA SER 14 1.267 -4.282 -5.246
77 HB2 SER 14 HB2 SER 14 1.668 -3.855 -2.699
78 HB3 SER 14 HB3 SER 14 0.316 -4.876 -3.179
79 HG SER 14 HG SER 14 1.399 -6.651 -2.534
80 H MET 15 H MET 15 2.958 -3.614 -6.521
81 HA MET 15 HA MET 15 5.559 -4.503 -6.272
82 HB2 MET 15 HB2 MET 15 4.581 -2.028 -7.688
83 HB3 MET 15 HB3 MET 15 6.163 -2.762 -7.912
84 HG2 MET 15 HG2 MET 15 4.875 -4.883 -8.543
85 HG3 MET 15 HG3 MET 15 3.477 -3.820 -8.696
86 HE1 MET 15 HE1 MET 15 7.312 -3.532 -11.234
87 HE2 MET 15 HE2 MET 15 7.002 -4.770 -10.018
88 HE3 MET 15 HE3 MET 15 7.273 -3.098 -9.524
89 H TRP 16 H TRP 16 7.024 -4.146 -4.883
90 HA TRP 16 HA TRP 16 7.341 -1.491 -3.700
91 HB2 TRP 16 HB2 TRP 16 7.504 -2.425 -1.458
92 HB3 TRP 16 HB3 TRP 16 5.956 -2.857 -2.164
93 HD1 TRP 16 HD1 TRP 16 5.602 -5.457 -2.824
94 HE1 TRP 16 HE1 TRP 16 6.759 -7.599 -1.971
95 HE3 TRP 16 HE3 TRP 16 9.696 -3.333 -0.643
96 HZ2 TRP 16 HZ2 TRP 16 9.108 -8.285 -0.551
97 HZ3 TRP 16 HZ3 TRP 16 11.355 -4.795 0.444
98 HH2 TRP 16 HH2 TRP 16 11.064 -7.220 0.488
99 H THR 17 H THR 17 9.390 -1.115 -2.751
100 HA THR 17 HA THR 17 11.478 -3.045 -3.481
101 HB THR 17 HB THR 17 12.953 -1.247 -4.196
102 HG1 THR 17 HG1 THR 17 10.752 0.535 -3.877
103 HG21 THR 17 HG21 THR 17 11.050 -2.261 -5.700
104 HG22 THR 17 HG22 THR 17 12.044 -0.925 -6.284
105 HG23 THR 17 HG23 THR 17 10.427 -0.611 -5.651
106 H GLU 18 H GLU 18 13.170 -3.192 -2.051
107 HA GLU 18 HA GLU 18 12.699 -2.247 0.627
108 HB2 GLU 18 HB2 GLU 18 13.551 -4.511 0.220
109 HB3 GLU 18 HB3 GLU 18 14.969 -3.848 -0.577
110 HG2 GLU 18 HG2 GLU 18 15.512 -2.714 1.623
111 HG3 GLU 18 HG3 GLU 18 14.246 -3.716 2.334
112 H HIS 19 H HIS 19 13.515 -0.428 1.474
113 HA HIS 19 HA HIS 19 16.107 0.536 0.566
114 HB2 HIS 19 HB2 HIS 19 13.541 2.043 0.221
115 HB3 HIS 19 HB3 HIS 19 15.014 2.935 0.595
116 HD1 HIS 19 HD1 HIS 19 13.124 1.919 -2.226
117 HD2 HIS 19 HD2 HIS 19 17.178 2.032 -1.337
118 HE1 HIS 19 HE1 HIS 19 14.303 1.894 -4.449
119 HE2 HIS 19 HE2 HIS 19 16.754 2.131 -3.877
120 H LYS 20 H LYS 20 17.224 1.687 2.133
121 HA LYS 20 HA LYS 20 15.844 1.840 4.719
122 HB2 LYS 20 HB2 LYS 20 17.479 0.684 5.781
123 HB3 LYS 20 HB3 LYS 20 17.652 -0.028 4.191
124 HG2 LYS 20 HG2 LYS 20 19.374 2.138 5.373
125 HG3 LYS 20 HG3 LYS 20 19.803 0.445 5.171
126 HD2 LYS 20 HD2 LYS 20 19.412 2.540 3.060
127 HD3 LYS 20 HD3 LYS 20 20.864 1.609 3.410
128 HE2 LYS 20 HE2 LYS 20 19.643 -0.442 2.681
129 HE3 LYS 20 HE3 LYS 20 18.297 0.579 2.203
130 HZ1 LYS 20 HZ1 LYS 20 21.043 0.875 1.111
131 HZ2 LYS 20 HZ2 LYS 20 19.632 1.633 0.561
132 HZ3 LYS 20 HZ3 LYS 20 19.824 -0.039 0.364
133 H SER 21 H SER 21 16.270 3.559 6.013
134 HA SER 21 HA SER 21 17.569 5.868 4.894
135 HB2 SER 21 HB2 SER 21 15.576 5.728 6.612
136 HB3 SER 21 HB3 SER 21 16.860 5.558 7.809
137 HG SER 21 HG SER 21 16.749 7.669 5.911
138 HA PRO 22 HA PRO 22 21.781 5.102 5.961
139 HB2 PRO 22 HB2 PRO 22 22.353 7.466 7.372
140 HB3 PRO 22 HB3 PRO 22 22.538 7.203 5.637
141 HG2 PRO 22 HG2 PRO 22 20.312 8.501 7.131
142 HG3 PRO 22 HG3 PRO 22 20.982 8.894 5.536
143 HD2 PRO 22 HD2 PRO 22 18.645 7.627 5.765
144 HD3 PRO 22 HD3 PRO 22 19.795 7.194 4.482
145 H ASP 23 H ASP 23 19.491 5.721 8.424
146 HA ASP 23 HA ASP 23 21.210 5.203 10.666
147 HB2 ASP 23 HB2 ASP 23 19.269 6.640 10.931
148 HB3 ASP 23 HB3 ASP 23 18.199 5.350 10.394
149 H GLY 24 H GLY 24 19.885 3.239 8.290
150 HA2 GLY 24 HA2 GLY 24 20.240 0.891 8.233
151 HA3 GLY 24 HA3 GLY 24 20.210 0.862 9.991
152 H ARG 25 H ARG 25 17.795 2.716 9.755
153 HA ARG 25 HA ARG 25 15.789 0.772 10.087
154 HB2 ARG 25 HB2 ARG 25 15.725 3.049 11.073
155 HB3 ARG 25 HB3 ARG 25 15.468 3.717 9.467
156 HG2 ARG 25 HG2 ARG 25 13.386 3.585 10.703
157 HG3 ARG 25 HG3 ARG 25 13.353 2.518 9.298
158 HD2 ARG 25 HD2 ARG 25 13.791 0.599 10.687
159 HD3 ARG 25 HD3 ARG 25 13.998 1.624 12.106
160 HE ARG 25 HE ARG 25 11.430 1.840 10.784
161 HH11 ARG 25 HH11 ARG 25 13.281 0.166 13.235
162 HH12 ARG 25 HH12 ARG 25 11.898 -0.210 14.213
163 HH21 ARG 25 HH21 ARG 25 9.604 1.324 12.042
164 HH22 ARG 25 HH22 ARG 25 9.789 0.416 13.510
165 H THR 26 H THR 26 14.729 -0.368 8.607
166 HA THR 26 HA THR 26 14.959 0.447 5.805
167 HB THR 26 HB THR 26 14.001 -2.201 6.900
168 HG1 THR 26 HG1 THR 26 16.402 -1.215 7.118
169 HG21 THR 26 HG21 THR 26 15.113 -1.492 4.172
170 HG22 THR 26 HG22 THR 26 13.398 -1.683 4.542
171 HG23 THR 26 HG23 THR 26 14.488 -3.059 4.692
172 H TYR 27 H TYR 27 13.265 1.003 4.600
173 HA TYR 27 HA TYR 27 10.561 0.413 5.575
174 HB2 TYR 27 HB2 TYR 27 9.959 2.580 4.231
175 HB3 TYR 27 HB3 TYR 27 10.542 2.715 5.884
176 HD1 TYR 27 HD1 TYR 27 11.879 2.659 2.393
177 HD2 TYR 27 HD2 TYR 27 12.207 4.258 6.320
178 HE1 TYR 27 HE1 TYR 27 13.660 4.168 1.623
179 HE2 TYR 27 HE2 TYR 27 13.996 5.764 5.565
180 HH TYR 27 HH TYR 27 14.709 6.241 2.236
181 H TYR 28 H TYR 28 9.026 0.890 3.550
182 HA TYR 28 HA TYR 28 10.258 -0.531 1.287
183 HB2 TYR 28 HB2 TYR 28 7.414 -0.868 2.247
184 HB3 TYR 28 HB3 TYR 28 8.216 -1.781 0.971
185 HD1 TYR 28 HD2 TYR 28 10.412 -3.050 1.748
186 HD2 TYR 28 HD1 TYR 28 7.290 -1.808 4.357
187 HE1 TYR 28 HE2 TYR 28 11.135 -4.722 3.401
188 HE2 TYR 28 HE1 TYR 28 8.009 -3.471 6.018
189 HH TYR 28 HH TYR 28 10.981 -5.079 5.857
190 H TYR 29 H TYR 29 9.766 0.239 -0.755
191 HA TYR 29 HA TYR 29 7.981 2.578 -0.781
192 HB2 TYR 29 HB2 TYR 29 9.936 3.567 -1.391
193 HB3 TYR 29 HB3 TYR 29 10.608 2.082 -2.040
194 HD1 TYR 29 HD1 TYR 29 7.726 4.358 -2.940
195 HD2 TYR 29 HD2 TYR 29 11.120 2.169 -4.207
196 HE1 TYR 29 HE1 TYR 29 7.369 5.158 -5.247
197 HE2 TYR 29 HE2 TYR 29 10.785 2.947 -6.519
198 HH TYR 29 HH TYR 29 9.015 3.820 -7.934
199 H ASN 30 H ASN 30 6.170 2.319 -1.779
200 HA ASN 30 HA ASN 30 5.818 0.093 -3.616
201 HB2 ASN 30 HB2 ASN 30 3.956 1.920 -2.139
202 HB3 ASN 30 HB3 ASN 30 3.382 1.140 -3.609
203 HD21 ASN 30 HD21 ASN 30 1.914 -0.178 -2.699
204 HD22 ASN 30 HD22 ASN 30 2.306 -1.460 -1.613
205 H THR 31 H THR 31 6.198 0.386 -5.671
206 HA THR 31 HA THR 31 6.773 2.953 -6.756
207 HB THR 31 HB THR 31 7.235 1.768 -8.826
208 HG1 THR 31 HG1 THR 31 6.712 -0.445 -9.017
209 HG21 THR 31 HG21 THR 31 8.064 0.295 -6.336
210 HG22 THR 31 HG22 THR 31 8.949 1.579 -7.168
211 HG23 THR 31 HG23 THR 31 8.770 -0.006 -7.927
212 H GLU 32 H GLU 32 3.954 1.196 -6.335
213 HA GLU 32 HA GLU 32 2.442 2.053 -8.573
214 HB2 GLU 32 HB2 GLU 32 0.664 1.512 -6.533
215 HB3 GLU 32 HB3 GLU 32 1.246 0.363 -7.734
216 HG2 GLU 32 HG2 GLU 32 3.118 -0.182 -6.231
217 HG3 GLU 32 HG3 GLU 32 2.418 0.883 -5.014
218 H THR 33 H THR 33 2.509 3.000 -5.174
219 HA THR 33 HA THR 33 0.826 5.320 -5.686
220 HB THR 33 HB THR 33 0.941 5.605 -3.204
221 HG1 THR 33 HG1 THR 33 1.862 3.599 -2.145
222 HG21 THR 33 HG21 THR 33 0.171 2.825 -4.115
223 HG22 THR 33 HG22 THR 33 -0.851 4.261 -4.228
224 HG23 THR 33 HG23 THR 33 -0.391 3.629 -2.647
225 H LYS 34 H LYS 34 4.029 4.470 -5.618
226 HA LYS 34 HA LYS 34 5.989 5.568 -5.754
227 HB2 LYS 34 HB2 LYS 34 4.219 7.983 -6.092
228 HB3 LYS 34 HB3 LYS 34 5.970 8.006 -6.289
229 HG2 LYS 34 HG2 LYS 34 4.256 6.102 -7.805
230 HG3 LYS 34 HG3 LYS 34 4.533 7.749 -8.386
231 HD2 LYS 34 HD2 LYS 34 6.918 7.334 -8.441
232 HD3 LYS 34 HD3 LYS 34 6.683 5.732 -7.738
233 HE2 LYS 34 HE2 LYS 34 5.397 5.060 -9.701
234 HE3 LYS 34 HE3 LYS 34 5.623 6.661 -10.404
235 HZ1 LYS 34 HZ1 LYS 34 7.782 4.724 -9.769
236 HZ2 LYS 34 HZ2 LYS 34 8.004 6.267 -10.435
237 HZ3 LYS 34 HZ3 LYS 34 7.186 5.075 -11.315
238 H GLN 35 H GLN 35 4.650 5.072 -3.233
239 HA GLN 35 HA GLN 35 5.680 7.285 -1.591
240 HB2 GLN 35 HB2 GLN 35 3.418 5.366 -1.072
241 HB3 GLN 35 HB3 GLN 35 4.057 6.474 0.135
242 HG2 GLN 35 HG2 GLN 35 3.483 8.361 -1.332
243 HG3 GLN 35 HG3 GLN 35 2.779 7.223 -2.482
244 HE21 GLN 35 HE21 GLN 35 1.610 9.427 -0.883
245 HE22 GLN 35 HE22 GLN 35 0.298 8.707 -0.018
246 H SER 36 H SER 36 6.630 6.766 0.437
247 HA SER 36 HA SER 36 7.693 4.031 0.593
248 HB2 SER 36 HB2 SER 36 9.356 5.928 0.446
249 HB3 SER 36 HB3 SER 36 8.755 6.496 2.003
250 HG SER 36 HG SER 36 9.474 3.821 1.871
251 H THR 37 H THR 37 7.156 2.820 2.325
252 HA THR 37 HA THR 37 5.445 3.962 4.397
253 HB THR 37 HB THR 37 3.995 3.356 2.443
254 HG1 THR 37 HG1 THR 37 3.411 1.457 4.432
255 HG21 THR 37 HG21 THR 37 5.051 0.580 3.003
256 HG22 THR 37 HG22 THR 37 5.243 1.515 1.516
257 HG23 THR 37 HG23 THR 37 3.646 0.935 1.991
258 H TRP 38 H TRP 38 4.944 2.370 6.084
259 HA TRP 38 HA TRP 38 7.061 0.506 6.597
260 HB2 TRP 38 HB2 TRP 38 5.355 -0.164 8.509
261 HB3 TRP 38 HB3 TRP 38 6.337 1.287 8.620
262 HD1 TRP 38 HD1 TRP 38 4.933 3.038 9.779
263 HE1 TRP 38 HE1 TRP 38 2.533 3.931 9.592
264 HE3 TRP 38 HE3 TRP 38 3.140 -0.156 6.186
265 HZ2 TRP 38 HZ2 TRP 38 0.195 3.365 8.138
266 HZ3 TRP 38 HZ3 TRP 38 0.799 0.093 5.469
267 HH2 TRP 38 HH2 TRP 38 -0.639 1.819 6.421
268 H GLU 39 H GLU 39 6.142 -1.778 7.475
269 HA GLU 39 HA GLU 39 5.515 -3.301 5.259
270 HB2 GLU 39 HB2 GLU 39 4.890 -5.086 6.839
271 HB3 GLU 39 HB3 GLU 39 6.379 -4.284 7.319
272 HG2 GLU 39 HG2 GLU 39 5.294 -3.103 9.058
273 HG3 GLU 39 HG3 GLU 39 3.700 -3.559 8.461
274 H LYS 40 H LYS 40 3.714 -3.670 4.125
275 HA LYS 40 HA LYS 40 1.281 -2.385 5.020
276 HB2 LYS 40 HB2 LYS 40 0.530 -3.084 2.645
277 HB3 LYS 40 HB3 LYS 40 1.725 -1.804 2.811
278 HG2 LYS 40 HG2 LYS 40 3.505 -3.352 2.309
279 HG3 LYS 40 HG3 LYS 40 2.355 -4.688 2.244
280 HD2 LYS 40 HD2 LYS 40 1.273 -3.721 0.319
281 HD3 LYS 40 HD3 LYS 40 2.291 -2.282 0.431
282 HE2 LYS 40 HE2 LYS 40 3.471 -5.013 0.134
283 HE3 LYS 40 HE3 LYS 40 2.934 -4.091 -1.276
284 HZ1 LYS 40 HZ1 LYS 40 4.444 -2.306 -0.600
285 HZ2 LYS 40 HZ2 LYS 40 5.271 -3.756 -0.875
286 HZ3 LYS 40 HZ3 LYS 40 4.974 -3.243 0.709
287 HA PRO 41 HA PRO 41 -1.146 -5.909 6.142
288 HB2 PRO 41 HB2 PRO 41 -3.310 -5.695 4.426
289 HB3 PRO 41 HB3 PRO 41 -3.125 -4.828 5.955
290 HG2 PRO 41 HG2 PRO 41 -2.545 -3.912 3.171
291 HG3 PRO 41 HG3 PRO 41 -3.311 -3.026 4.505
292 HD2 PRO 41 HD2 PRO 41 -0.769 -2.575 3.867
293 HD3 PRO 41 HD3 PRO 41 -1.278 -2.629 5.568
294 H ASP 42 H ASP 42 -2.675 -7.590 5.033
295 HA ASP 42 HA ASP 42 -1.129 -9.554 3.878
296 HB2 ASP 42 HB2 ASP 42 -4.114 -9.210 3.952
297 HB3 ASP 42 HB3 ASP 42 -3.325 -10.675 3.369
298 H ASP 43 H ASP 43 -1.628 -6.913 2.131
299 HA ASP 43 HA ASP 43 -2.518 -7.769 -0.383
300 HB2 ASP 43 HB2 ASP 43 -0.418 -5.733 0.354
301 HB3 ASP 43 HB3 ASP 43 -1.054 -5.935 -1.268
302 H LEU 44 H LEU 44 0.469 -8.219 1.303
303 HA LEU 44 HA LEU 44 1.943 -9.177 -0.965
304 HB2 LEU 44 HB2 LEU 44 2.570 -9.480 1.970
305 HB3 LEU 44 HB3 LEU 44 3.681 -9.695 0.624
306 HG LEU 44 HG LEU 44 2.361 -7.051 0.833
307 HD11 LEU 44 HD11 LEU 44 4.489 -7.987 2.751
308 HD12 LEU 44 HD12 LEU 44 2.865 -7.414 3.150
309 HD13 LEU 44 HD13 LEU 44 4.055 -6.299 2.477
310 HD21 LEU 44 HD21 LEU 44 4.649 -6.336 0.176
311 HD22 LEU 44 HD22 LEU 44 3.905 -7.458 -0.959
312 HD23 LEU 44 HD23 LEU 44 5.133 -8.032 0.170
313 H LYS 45 H LYS 45 -0.346 -10.562 1.174
314 HA LYS 45 HA LYS 45 0.525 -13.276 0.768
315 HB2 LYS 45 HB2 LYS 45 -2.285 -12.512 1.491
316 HB3 LYS 45 HB3 LYS 45 -1.365 -13.926 1.978
317 HG2 LYS 45 HG2 LYS 45 -0.894 -11.118 2.937
318 HG3 LYS 45 HG3 LYS 45 -1.746 -12.381 3.823
319 HD2 LYS 45 HD2 LYS 45 0.537 -13.663 3.303
320 HD3 LYS 45 HD3 LYS 45 1.131 -12.004 3.345
321 HE2 LYS 45 HE2 LYS 45 0.225 -11.649 5.506
322 HE3 LYS 45 HE3 LYS 45 -0.583 -13.217 5.491
323 HZ1 LYS 45 HZ1 LYS 45 2.361 -12.778 5.465
324 HZ2 LYS 45 HZ2 LYS 45 1.585 -14.285 5.472
325 HZ3 LYS 45 HZ3 LYS 45 1.451 -13.258 6.815
326 H THR 46 H THR 46 -2.632 -11.931 0.018
327 HA THR 46 HA THR 46 -2.642 -12.607 -2.765
328 HB THR 46 HB THR 46 -4.480 -14.258 -1.031
329 HG1 THR 46 HG1 THR 46 -2.696 -15.305 -0.462
330 HG21 THR 46 HG21 THR 46 -5.099 -14.001 -3.379
331 HG22 THR 46 HG22 THR 46 -4.678 -15.671 -3.000
332 HG23 THR 46 HG23 THR 46 -3.528 -14.646 -3.860
333 HA PRO 47 HA PRO 47 -5.648 -9.365 -2.623
334 HB2 PRO 47 HB2 PRO 47 -7.332 -11.102 -4.363
335 HB3 PRO 47 HB3 PRO 47 -6.908 -9.395 -4.558
336 HG2 PRO 47 HG2 PRO 47 -5.654 -11.211 -6.015
337 HG3 PRO 47 HG3 PRO 47 -4.730 -9.892 -5.273
338 HD2 PRO 47 HD2 PRO 47 -4.959 -12.752 -4.444
339 HD3 PRO 47 HD3 PRO 47 -3.546 -11.688 -4.406
340 H ALA 48 H ALA 48 -7.151 -12.598 -2.460
341 HA ALA 48 HA ALA 48 -9.423 -11.644 -1.037
342 HB1 ALA 48 HB1 ALA 48 -9.233 -13.735 -2.494
343 HB2 ALA 48 HB2 ALA 48 -10.187 -13.812 -1.019
344 HB3 ALA 48 HB3 ALA 48 -8.567 -14.507 -1.052
345 H GLU 49 H GLU 49 -6.312 -12.922 -0.059
346 HA GLU 49 HA GLU 49 -6.977 -13.354 2.652
347 HB2 GLU 49 HB2 GLU 49 -4.337 -12.770 1.315
348 HB3 GLU 49 HB3 GLU 49 -4.479 -13.090 3.045
349 HG2 GLU 49 HG2 GLU 49 -5.603 -15.254 2.435
350 HG3 GLU 49 HG3 GLU 49 -5.142 -14.935 0.763
351 H GLN 50 H GLN 50 -6.125 -10.521 0.808
352 HA GLN 50 HA GLN 50 -5.481 -8.743 2.850
353 HB2 GLN 50 HB2 GLN 50 -7.072 -8.091 0.373
354 HB3 GLN 50 HB3 GLN 50 -6.070 -6.991 1.309
355 HG2 GLN 50 HG2 GLN 50 -4.081 -8.217 0.645
356 HG3 GLN 50 HG3 GLN 50 -5.088 -9.362 -0.253
357 HE21 GLN 50 HE21 GLN 50 -4.040 -8.850 -2.203
358 HE22 GLN 50 HE22 GLN 50 -4.306 -7.352 -3.023
359 H LEU 51 H LEU 51 -8.661 -9.767 1.644
360 HA LEU 51 HA LEU 51 -10.111 -7.557 2.519
361 HB2 LEU 51 HB2 LEU 51 -12.074 -8.779 2.031
362 HB3 LEU 51 HB3 LEU 51 -10.853 -9.251 0.867
363 HG LEU 51 HG LEU 51 -10.504 -11.224 2.630
364 HD11 LEU 51 HD11 LEU 51 -12.289 -10.352 4.118
365 HD12 LEU 51 HD12 LEU 51 -12.582 -11.990 3.542
366 HD13 LEU 51 HD13 LEU 51 -13.452 -10.634 2.821
367 HD21 LEU 51 HD21 LEU 51 -11.948 -12.564 1.157
368 HD22 LEU 51 HD22 LEU 51 -10.876 -11.470 0.270
369 HD23 LEU 51 HD23 LEU 51 -12.590 -11.071 0.463
370 H LEU 52 H LEU 52 -9.223 -10.452 4.281
371 HA LEU 52 HA LEU 52 -11.010 -10.136 6.446
372 HB2 LEU 52 HB2 LEU 52 -8.267 -11.407 6.466
373 HB3 LEU 52 HB3 LEU 52 -9.498 -11.613 7.694
374 HG LEU 52 HG LEU 52 -10.939 -12.586 5.769
375 HD11 LEU 52 HD11 LEU 52 -8.249 -13.203 4.602
376 HD12 LEU 52 HD12 LEU 52 -9.188 -11.805 4.071
377 HD13 LEU 52 HD13 LEU 52 -9.849 -13.436 3.890
378 HD21 LEU 52 HD21 LEU 52 -10.091 -13.875 7.656
379 HD22 LEU 52 HD22 LEU 52 -8.543 -14.072 6.835
380 HD23 LEU 52 HD23 LEU 52 -9.998 -14.804 6.160
381 H SER 53 H SER 53 -7.689 -9.095 5.922
382 HA SER 53 HA SER 53 -7.512 -7.637 8.394
383 HB2 SER 53 HB2 SER 53 -5.768 -7.512 5.926
384 HB3 SER 53 HB3 SER 53 -5.313 -6.988 7.548
385 HG SER 53 HG SER 53 -4.557 -9.143 6.925
386 H LYS 54 H LYS 54 -7.243 -6.674 5.017
387 HA LYS 54 HA LYS 54 -8.828 -4.255 5.459
388 HB2 LYS 54 HB2 LYS 54 -5.967 -4.204 4.469
389 HB3 LYS 54 HB3 LYS 54 -7.065 -2.836 4.434
390 HG2 LYS 54 HG2 LYS 54 -6.169 -4.233 6.943
391 HG3 LYS 54 HG3 LYS 54 -5.429 -2.770 6.289
392 HD2 LYS 54 HD2 LYS 54 -7.721 -1.714 6.408
393 HD3 LYS 54 HD3 LYS 54 -8.231 -3.123 7.334
394 HE2 LYS 54 HE2 LYS 54 -6.004 -1.230 8.087
395 HE3 LYS 54 HE3 LYS 54 -7.623 -1.240 8.782
396 HZ1 LYS 54 HZ1 LYS 54 -7.219 -3.454 9.642
397 HZ2 LYS 54 HZ2 LYS 54 -6.025 -2.380 10.191
398 HZ3 LYS 54 HZ3 LYS 54 -5.670 -3.476 8.948
399 H CYS 55 H CYS 55 -10.137 -4.013 3.747
400 HA CYS 55 HA CYS 55 -10.146 -5.930 1.674
401 HB2 CYS 55 HB2 CYS 55 -12.120 -4.841 0.894
402 HB3 CYS 55 HB3 CYS 55 -12.143 -4.704 2.644
403 HG CYS 55 HG CYS 55 -13.139 -2.365 1.390
404 HA PRO 56 HA PRO 56 -7.725 -4.633 -1.738
405 HB2 PRO 56 HB2 PRO 56 -10.242 -3.795 -3.140
406 HB3 PRO 56 HB3 PRO 56 -8.853 -4.693 -3.770
407 HG2 PRO 56 HG2 PRO 56 -11.034 -6.004 -3.070
408 HG3 PRO 56 HG3 PRO 56 -9.437 -6.646 -2.637
409 HD2 PRO 56 HD2 PRO 56 -11.477 -5.321 -0.927
410 HD3 PRO 56 HD3 PRO 56 -10.315 -6.596 -0.515
411 H TRP 57 H TRP 57 -10.274 -2.280 -0.933
412 HA TRP 57 HA TRP 57 -8.635 -0.103 -1.940
413 HB2 TRP 57 HB2 TRP 57 -11.382 -0.167 -0.698
414 HB3 TRP 57 HB3 TRP 57 -10.557 1.324 -1.145
415 HD1 TRP 57 HD1 TRP 57 -9.782 1.400 -3.864
416 HE1 TRP 57 HE1 TRP 57 -11.184 0.664 -5.897
417 HE3 TRP 57 HE3 TRP 57 -13.126 -1.665 -1.491
418 HZ2 TRP 57 HZ2 TRP 57 -13.409 -1.003 -6.423
419 HZ3 TRP 57 HZ3 TRP 57 -14.854 -2.791 -2.832
420 HH2 TRP 57 HH2 TRP 57 -14.992 -2.466 -5.246
421 H LYS 58 H LYS 58 -7.203 0.911 -0.760
422 HA LYS 58 HA LYS 58 -7.473 1.016 2.146
423 HB2 LYS 58 HB2 LYS 58 -5.532 -0.586 0.616
424 HB3 LYS 58 HB3 LYS 58 -4.843 0.355 1.928
425 HG2 LYS 58 HG2 LYS 58 -6.045 -0.786 3.541
426 HG3 LYS 58 HG3 LYS 58 -7.248 -1.354 2.384
427 HD2 LYS 58 HD2 LYS 58 -4.371 -2.243 2.524
428 HD3 LYS 58 HD3 LYS 58 -5.769 -3.166 3.080
429 HE2 LYS 58 HE2 LYS 58 -6.609 -2.800 0.634
430 HE3 LYS 58 HE3 LYS 58 -4.905 -2.511 0.299
431 HZ1 LYS 58 HZ1 LYS 58 -6.009 -4.955 1.562
432 HZ2 LYS 58 HZ2 LYS 58 -4.372 -4.669 1.208
433 HZ3 LYS 58 HZ3 LYS 58 -5.498 -4.825 -0.048
434 H GLU 59 H GLU 59 -6.232 2.648 3.145
435 HA GLU 59 HA GLU 59 -4.608 4.282 1.333
436 HB2 GLU 59 HB2 GLU 59 -5.452 6.310 2.082
437 HB3 GLU 59 HB3 GLU 59 -6.895 5.318 1.988
438 HG2 GLU 59 HG2 GLU 59 -5.357 5.885 4.511
439 HG3 GLU 59 HG3 GLU 59 -6.800 6.749 3.988
440 H TYR 60 H TYR 60 -2.665 4.917 2.112
441 HA TYR 60 HA TYR 60 -2.202 4.755 4.979
442 HB2 TYR 60 HB2 TYR 60 0.045 3.689 4.611
443 HB3 TYR 60 HB3 TYR 60 -1.325 2.627 4.315
444 HD1 TYR 60 HD1 TYR 60 1.252 4.704 2.615
445 HD2 TYR 60 HD2 TYR 60 -1.593 1.554 2.258
446 HE1 TYR 60 HE1 TYR 60 2.165 4.127 0.408
447 HE2 TYR 60 HE2 TYR 60 -0.685 0.976 0.053
448 HH TYR 60 HH TYR 60 0.573 1.920 -1.714
449 H LYS 61 H LYS 61 -0.395 6.015 5.662
450 HA LYS 61 HA LYS 61 0.234 8.150 3.754
451 HB2 LYS 61 HB2 LYS 61 0.714 8.092 6.733
452 HB3 LYS 61 HB3 LYS 61 0.896 9.477 5.669
453 HG2 LYS 61 HG2 LYS 61 -1.530 9.378 5.207
454 HG3 LYS 61 HG3 LYS 61 -1.663 8.082 6.394
455 HD2 LYS 61 HD2 LYS 61 -0.882 10.951 6.845
456 HD3 LYS 61 HD3 LYS 61 -2.264 10.077 7.513
457 HE2 LYS 61 HE2 LYS 61 0.646 9.650 8.145
458 HE3 LYS 61 HE3 LYS 61 -0.575 10.342 9.214
459 HZ1 LYS 61 HZ1 LYS 61 -0.378 7.532 8.272
460 HZ2 LYS 61 HZ2 LYS 61 -1.750 8.146 9.049
461 HZ3 LYS 61 HZ3 LYS 61 -0.267 8.099 9.864
462 H SER 62 H SER 62 2.278 8.525 3.139
463 HA SER 62 HA SER 62 4.251 6.528 3.426
464 HB2 SER 62 HB2 SER 62 5.077 9.273 2.695
465 HB3 SER 62 HB3 SER 62 5.388 7.745 1.858
466 HG SER 62 HG SER 62 2.975 7.882 1.442
467 H ASP 63 H ASP 63 6.625 7.466 4.098
468 HA ASP 63 HA ASP 63 6.598 7.978 6.857
469 HB2 ASP 63 HB2 ASP 63 8.924 8.200 6.736
470 HB3 ASP 63 HB3 ASP 63 8.550 7.142 5.381
471 H SER 64 H SER 64 6.440 10.077 4.100
472 HA SER 64 HA SER 64 6.800 12.518 5.570
473 HB2 SER 64 HB2 SER 64 5.568 12.198 2.831
474 HB3 SER 64 HB3 SER 64 6.410 13.605 3.484
475 HG SER 64 HG SER 64 8.027 11.468 3.619
476 H GLY 65 H GLY 65 4.288 10.316 5.185
477 HA2 GLY 65 HA2 GLY 65 2.249 10.346 6.289
478 HA3 GLY 65 HA3 GLY 65 2.461 12.050 6.629
479 H LYS 66 H LYS 66 2.899 11.166 3.353
480 HA LYS 66 HA LYS 66 0.490 12.492 2.516
481 HB2 LYS 66 HB2 LYS 66 2.475 12.639 1.131
482 HB3 LYS 66 HB3 LYS 66 2.564 10.894 0.997
483 HG2 LYS 66 HG2 LYS 66 1.722 11.964 -1.042
484 HG3 LYS 66 HG3 LYS 66 0.554 10.852 -0.335
485 HD2 LYS 66 HD2 LYS 66 -0.455 12.967 -1.143
486 HD3 LYS 66 HD3 LYS 66 -0.716 12.681 0.580
487 HE2 LYS 66 HE2 LYS 66 1.062 14.211 1.139
488 HE3 LYS 66 HE3 LYS 66 1.447 14.442 -0.569
489 HZ1 LYS 66 HZ1 LYS 66 0.097 16.255 0.360
490 HZ2 LYS 66 HZ2 LYS 66 -1.147 15.154 0.696
491 HZ3 LYS 66 HZ3 LYS 66 -0.697 15.457 -0.911
492 H THR 67 H THR 67 -1.487 11.515 2.557
493 HA THR 67 HA THR 67 -1.666 8.626 2.656
494 HB THR 67 HB THR 67 -4.242 9.727 2.276
495 HG1 THR 67 HG1 THR 67 -4.211 11.578 3.295
496 HG21 THR 67 HG21 THR 67 -3.322 7.772 3.696
497 HG22 THR 67 HG22 THR 67 -4.694 8.699 4.318
498 HG23 THR 67 HG23 THR 67 -3.071 9.001 4.939
499 H TYR 68 H TYR 68 -2.020 7.326 0.999
500 HA TYR 68 HA TYR 68 -3.388 8.428 -1.359
501 HB2 TYR 68 HB2 TYR 68 -0.803 7.134 -1.237
502 HB3 TYR 68 HB3 TYR 68 -1.913 6.224 -2.259
503 HD1 TYR 68 HD2 TYR 68 -0.404 9.560 -1.727
504 HD2 TYR 68 HD1 TYR 68 -2.469 6.994 -4.422
505 HE1 TYR 68 HE2 TYR 68 -0.009 11.163 -3.556
506 HE2 TYR 68 HE1 TYR 68 -2.083 8.590 -6.251
507 HH TYR 68 HH TYR 68 0.142 11.039 -6.109
508 H TYR 69 H TYR 69 -4.853 7.082 -2.352
509 HA TYR 69 HA TYR 69 -5.714 4.785 -0.716
510 HB2 TYR 69 HB2 TYR 69 -7.152 6.930 -0.856
511 HB3 TYR 69 HB3 TYR 69 -7.482 6.446 -2.511
512 HD1 TYR 69 HD1 TYR 69 -7.902 5.498 1.025
513 HD2 TYR 69 HD2 TYR 69 -9.084 4.750 -2.993
514 HE1 TYR 69 HE1 TYR 69 -9.785 4.144 1.838
515 HE2 TYR 69 HE2 TYR 69 -10.969 3.389 -2.189
516 HH TYR 69 HH TYR 69 -11.942 3.372 1.096
517 H TYR 70 H TYR 70 -5.716 2.849 -1.792
518 HA TYR 70 HA TYR 70 -5.422 3.041 -4.706
519 HB2 TYR 70 HB2 TYR 70 -3.623 1.438 -4.710
520 HB3 TYR 70 HB3 TYR 70 -3.205 2.742 -3.604
521 HD1 TYR 70 HD2 TYR 70 -3.263 2.346 -1.150
522 HD2 TYR 70 HD1 TYR 70 -3.919 -0.802 -3.935
523 HE1 TYR 70 HE2 TYR 70 -2.871 0.691 0.631
524 HE2 TYR 70 HE1 TYR 70 -3.526 -2.462 -2.166
525 HH TYR 70 HH TYR 70 -2.656 -2.749 -0.077
526 H ASN 71 H ASN 71 -6.147 1.465 -5.939
527 HA ASN 71 HA ASN 71 -8.021 -0.446 -4.758
528 HB2 ASN 71 HB2 ASN 71 -7.424 -0.159 -7.697
529 HB3 ASN 71 HB3 ASN 71 -8.924 -0.651 -6.927
530 HD21 ASN 71 HD21 ASN 71 -6.977 2.000 -7.974
531 HD22 ASN 71 HD22 ASN 71 -8.177 3.221 -7.772
532 H SER 72 H SER 72 -6.947 -2.260 -4.030
533 HA SER 72 HA SER 72 -4.332 -2.878 -4.984
534 HB2 SER 72 HB2 SER 72 -5.057 -3.171 -2.625
535 HB3 SER 72 HB3 SER 72 -6.038 -4.539 -3.131
536 HG SER 72 HG SER 72 -3.676 -4.781 -2.334
537 H GLN 73 H GLN 73 -7.477 -4.182 -5.868
538 HA GLN 73 HA GLN 73 -6.573 -6.711 -6.731
539 HB2 GLN 73 HB2 GLN 73 -8.645 -6.905 -7.944
540 HB3 GLN 73 HB3 GLN 73 -8.973 -6.168 -6.383
541 HG2 GLN 73 HG2 GLN 73 -8.756 -4.738 -9.018
542 HG3 GLN 73 HG3 GLN 73 -10.254 -5.168 -8.202
543 HE21 GLN 73 HE21 GLN 73 -8.700 -2.634 -8.974
544 HE22 GLN 73 HE22 GLN 73 -8.892 -1.651 -7.568
545 H THR 74 H THR 74 -6.931 -3.643 -8.432
546 HA THR 74 HA THR 74 -5.639 -4.801 -10.795
547 HB THR 74 HB THR 74 -6.453 -2.741 -11.946
548 HG1 THR 74 HG1 THR 74 -7.479 -1.209 -10.854
549 HG21 THR 74 HG21 THR 74 -8.409 -4.535 -10.511
550 HG22 THR 74 HG22 THR 74 -7.829 -4.650 -12.181
551 HG23 THR 74 HG23 THR 74 -8.925 -3.347 -11.716
552 H LYS 75 H LYS 75 -5.112 -2.961 -8.089
553 HA LYS 75 HA LYS 75 -3.205 -2.135 -7.188
554 HB2 LYS 75 HB2 LYS 75 -1.901 -3.025 -9.766
555 HB3 LYS 75 HB3 LYS 75 -1.041 -2.471 -8.337
556 HG2 LYS 75 HG2 LYS 75 -2.946 -4.714 -7.999
557 HG3 LYS 75 HG3 LYS 75 -1.448 -5.039 -8.862
558 HD2 LYS 75 HD2 LYS 75 -1.218 -5.564 -6.498
559 HD3 LYS 75 HD3 LYS 75 -0.157 -4.232 -6.945
560 HE2 LYS 75 HE2 LYS 75 -2.861 -3.682 -5.792
561 HE3 LYS 75 HE3 LYS 75 -1.532 -4.150 -4.733
562 HZ1 LYS 75 HZ1 LYS 75 -1.621 -1.787 -4.840
563 HZ2 LYS 75 HZ2 LYS 75 -1.630 -1.794 -6.528
564 HZ3 LYS 75 HZ3 LYS 75 -0.241 -2.281 -5.692
565 H GLU 76 H GLU 76 -5.028 -0.548 -8.823
566 HA GLU 76 HA GLU 76 -3.341 1.546 -9.911
567 HB2 GLU 76 HB2 GLU 76 -5.376 1.227 -11.107
568 HB3 GLU 76 HB3 GLU 76 -6.333 1.227 -9.631
569 HG2 GLU 76 HG2 GLU 76 -5.781 3.603 -9.301
570 HG3 GLU 76 HG3 GLU 76 -4.871 3.586 -10.806
571 H SER 77 H SER 77 -3.164 3.625 -8.999
572 HA SER 77 HA SER 77 -4.014 3.779 -6.178
573 HB2 SER 77 HB2 SER 77 -2.025 5.217 -5.786
574 HB3 SER 77 HB3 SER 77 -1.584 3.595 -6.315
575 HG SER 77 HG SER 77 -1.900 5.175 -8.458
576 H ARG 78 H ARG 78 -5.172 5.543 -5.578
577 HA ARG 78 HA ARG 78 -5.400 7.735 -7.536
578 HB2 ARG 78 HB2 ARG 78 -7.747 7.741 -7.433
579 HB3 ARG 78 HB3 ARG 78 -7.331 6.040 -7.569
580 HG2 ARG 78 HG2 ARG 78 -7.554 5.894 -5.065
581 HG3 ARG 78 HG3 ARG 78 -8.210 7.528 -5.107
582 HD2 ARG 78 HD2 ARG 78 -9.426 4.969 -5.921
583 HD3 ARG 78 HD3 ARG 78 -10.161 6.417 -5.247
584 HE ARG 78 HE ARG 78 -9.278 6.374 -8.053
585 HH11 ARG 78 HH11 ARG 78 -11.827 6.689 -5.681
586 HH12 ARG 78 HH12 ARG 78 -12.998 7.272 -6.825
587 HH21 ARG 78 HH21 ARG 78 -10.787 7.120 -9.556
588 HH22 ARG 78 HH22 ARG 78 -12.401 7.519 -9.045
589 H TRP 79 H TRP 79 -6.106 9.787 -6.587
590 HA TRP 79 HA TRP 79 -5.564 9.898 -3.709
591 HB2 TRP 79 HB2 TRP 79 -5.239 12.344 -4.045
592 HB3 TRP 79 HB3 TRP 79 -4.114 11.372 -4.982
593 HD1 TRP 79 HD1 TRP 79 -4.766 11.136 -7.698
594 HE1 TRP 79 HE1 TRP 79 -5.792 12.910 -9.262
595 HE3 TRP 79 HE3 TRP 79 -6.719 14.269 -4.165
596 HZ2 TRP 79 HZ2 TRP 79 -7.242 15.326 -9.010
597 HZ3 TRP 79 HZ3 TRP 79 -7.916 16.284 -4.903
598 HH2 TRP 79 HH2 TRP 79 -8.169 16.804 -7.280
599 H ALA 80 H ALA 80 -7.292 9.670 -2.601
600 HA ALA 80 HA ALA 80 -9.394 11.257 -2.124
601 HB1 ALA 80 HB1 ALA 80 -11.301 10.334 -3.398
602 HB2 ALA 80 HB2 ALA 80 -10.180 9.364 -4.354
603 HB3 ALA 80 HB3 ALA 80 -10.137 11.123 -4.463
604 H LYS 81 H LYS 81 -10.083 10.364 -0.228
605 HA LYS 81 HA LYS 81 -9.880 7.431 -0.047
606 HB2 LYS 81 HB2 LYS 81 -9.228 7.879 2.407
607 HB3 LYS 81 HB3 LYS 81 -8.025 8.114 1.150
608 HG2 LYS 81 HG2 LYS 81 -7.678 10.015 2.336
609 HG3 LYS 81 HG3 LYS 81 -8.938 10.600 1.251
610 HD2 LYS 81 HD2 LYS 81 -10.620 10.132 2.979
611 HD3 LYS 81 HD3 LYS 81 -9.344 9.582 4.065
612 HE2 LYS 81 HE2 LYS 81 -8.305 11.856 3.836
613 HE3 LYS 81 HE3 LYS 81 -9.756 12.357 2.968
614 HZ1 LYS 81 HZ1 LYS 81 -11.051 11.680 4.961
615 HZ2 LYS 81 HZ2 LYS 81 -9.996 12.975 5.238
616 HZ3 LYS 81 HZ3 LYS 81 -9.587 11.422 5.781
617 HA PRO 82 HA PRO 82 -14.092 8.904 1.567
618 HB2 PRO 82 HB2 PRO 82 -15.658 7.768 -0.327
619 HB3 PRO 82 HB3 PRO 82 -15.037 9.417 -0.472
620 HG2 PRO 82 HG2 PRO 82 -14.004 6.888 -1.712
621 HG3 PRO 82 HG3 PRO 82 -14.227 8.488 -2.440
622 HD2 PRO 82 HD2 PRO 82 -11.822 7.604 -1.588
623 HD3 PRO 82 HD3 PRO 82 -12.285 9.316 -1.527
624 H LYS 83 H LYS 83 -14.796 7.563 3.131
625 HA LYS 83 HA LYS 83 -14.340 4.764 3.104
626 HB2 LYS 83 HB2 LYS 83 -15.439 4.634 5.147
627 HB3 LYS 83 HB3 LYS 83 -14.758 6.246 5.158
628 HG2 LYS 83 HG2 LYS 83 -17.622 5.559 4.542
629 HG3 LYS 83 HG3 LYS 83 -17.020 6.173 6.082
630 HD2 LYS 83 HD2 LYS 83 -16.120 8.138 4.625
631 HD3 LYS 83 HD3 LYS 83 -17.301 7.567 3.453
632 HE2 LYS 83 HE2 LYS 83 -19.075 7.775 5.121
633 HE3 LYS 83 HE3 LYS 83 -17.901 8.361 6.299
634 HZ1 LYS 83 HZ1 LYS 83 -18.540 9.700 3.725
635 HZ2 LYS 83 HZ2 LYS 83 -17.500 10.288 4.929
636 HZ3 LYS 83 HZ3 LYS 83 -19.163 10.157 5.237
637 H GLU 84 H GLU 84 -16.618 6.760 1.613
638 HA GLU 84 HA GLU 84 -18.881 5.120 1.446
639 HB2 GLU 84 HB2 GLU 84 -17.806 7.210 -0.439
640 HB3 GLU 84 HB3 GLU 84 -19.347 6.403 -0.690
641 HG2 GLU 84 HG2 GLU 84 -20.026 8.296 0.372
642 HG3 GLU 84 HG3 GLU 84 -19.827 7.215 1.744
643 H LEU 85 H LEU 85 -15.805 4.726 -0.045
644 HA LEU 85 HA LEU 85 -16.637 3.319 -2.364
645 HB2 LEU 85 HB2 LEU 85 -14.212 4.168 -1.240
646 HB3 LEU 85 HB3 LEU 85 -14.087 2.422 -1.338
647 HG LEU 85 HG LEU 85 -13.151 3.386 -3.331
648 HD11 LEU 85 HD11 LEU 85 -15.861 2.255 -3.997
649 HD12 LEU 85 HD12 LEU 85 -14.464 1.293 -3.518
650 HD13 LEU 85 HD13 LEU 85 -14.418 2.233 -5.013
651 HD21 LEU 85 HD21 LEU 85 -14.233 5.533 -3.339
652 HD22 LEU 85 HD22 LEU 85 -15.805 4.785 -3.613
653 HD23 LEU 85 HD23 LEU 85 -14.570 4.723 -4.870
654 H GLU 86 H GLU 86 -15.243 2.110 0.685
655 HA GLU 86 HA GLU 86 -16.184 -0.554 0.305
656 HB2 GLU 86 HB2 GLU 86 -14.236 -0.122 1.691
657 HB3 GLU 86 HB3 GLU 86 -15.187 0.874 2.782
658 HG2 GLU 86 HG2 GLU 86 -14.719 -1.333 3.714
659 HG3 GLU 86 HG3 GLU 86 -16.446 -1.059 3.502
660 H ASP 87 H ASP 87 -17.597 2.335 1.353
661 HA ASP 87 HA ASP 87 -19.555 2.961 2.285
662 HB2 ASP 87 HB2 ASP 87 -20.493 1.338 0.577
663 HB3 ASP 87 HB3 ASP 87 -20.538 0.132 1.859
664 H LEU 88 H LEU 88 -17.391 1.954 3.800
665 HA LEU 88 HA LEU 88 -18.666 1.648 6.341
666 HB2 LEU 88 HB2 LEU 88 -18.447 -0.709 5.227
667 HB3 LEU 88 HB3 LEU 88 -16.749 -0.548 5.615
668 HG LEU 88 HG LEU 88 -18.054 -1.880 7.266
669 HD11 LEU 88 HD11 LEU 88 -17.137 -0.812 9.268
670 HD12 LEU 88 HD12 LEU 88 -16.819 0.650 8.335
671 HD13 LEU 88 HD13 LEU 88 -15.968 -0.845 7.947
672 HD21 LEU 88 HD21 LEU 88 -19.526 -0.695 8.826
673 HD22 LEU 88 HD22 LEU 88 -20.143 -0.655 7.175
674 HD23 LEU 88 HD23 LEU 88 -19.359 0.769 7.856
675 H GLU 89 H GLU 89 -15.449 0.488 5.389
676 HA GLU 89 HA GLU 89 -14.220 3.034 6.042
677 HB2 GLU 89 HB2 GLU 89 -13.919 0.585 7.746
678 HB3 GLU 89 HB3 GLU 89 -12.551 1.668 7.553
679 HG2 GLU 89 HG2 GLU 89 -15.261 2.529 8.533
680 HG3 GLU 89 HG3 GLU 89 -13.920 2.073 9.583
681 H GLY 90 H GLY 90 -12.995 -0.273 6.008
682 HA2 GLY 90 HA2 GLY 90 -12.053 -0.277 3.352
683 HA3 GLY 90 HA3 GLY 90 -10.755 0.230 4.430
684 H LEU 91 H LEU 91 -13.357 -2.072 5.034
685 HA LEU 91 HA LEU 91 -11.472 -4.272 4.979
686 HB2 LEU 91 HB2 LEU 91 -12.166 -5.026 7.231
687 HB3 LEU 91 HB3 LEU 91 -11.242 -3.538 7.227
688 HG LEU 91 HG LEU 91 -13.755 -2.535 7.196
689 HD11 LEU 91 HD11 LEU 91 -13.903 -5.069 8.824
690 HD12 LEU 91 HD12 LEU 91 -14.805 -4.728 7.347
691 HD13 LEU 91 HD13 LEU 91 -15.106 -3.779 8.802
692 HD21 LEU 91 HD21 LEU 91 -13.414 -2.048 9.529
693 HD22 LEU 91 HD22 LEU 91 -11.873 -1.955 8.671
694 HD23 LEU 91 HD23 LEU 91 -12.244 -3.362 9.667
695 H GLU 92 H GLU 92 -12.445 -6.299 4.710
696 HA GLU 92 HA GLU 92 -15.228 -6.155 3.820
697 HB2 GLU 92 HB2 GLU 92 -12.863 -7.581 2.958
698 HB3 GLU 92 HB3 GLU 92 -14.205 -8.685 3.224
699 HG2 GLU 92 HG2 GLU 92 -14.773 -6.228 1.683
700 HG3 GLU 92 HG3 GLU 92 -13.772 -7.452 0.908
Start of MODEL 4
1 H1 GLY 1 H1 GLY 1 11.481 -16.780 -5.883
2 H2 GLY 1 H2 GLY 1 11.919 -16.604 -7.509
3 H3 GLY 1 H3 GLY 1 12.214 -18.068 -6.706
4 HA2 GLY 1 HA3 GLY 1 10.296 -18.247 -8.177
5 HA3 GLY 1 HA2 GLY 1 9.858 -18.480 -6.489
6 H SER 2 H SER 2 9.654 -16.394 -9.263
7 HA SER 2 HA SER 2 8.393 -14.577 -9.783
8 HB2 SER 2 HB2 SER 2 6.615 -15.502 -7.510
9 HB3 SER 2 HB3 SER 2 6.154 -14.435 -8.835
10 HG SER 2 HG SER 2 6.001 -16.094 -10.158
11 H ASP 3 H ASP 3 10.542 -13.894 -8.416
12 HA ASP 3 HA ASP 3 9.736 -12.292 -6.094
13 HB2 ASP 3 HB2 ASP 3 11.619 -13.946 -5.877
14 HB3 ASP 3 HB3 ASP 3 12.534 -12.970 -7.023
15 H VAL 4 H VAL 4 10.542 -10.112 -5.895
16 HA VAL 4 HA VAL 4 10.784 -8.810 -8.524
17 HB VAL 4 HB VAL 4 9.888 -6.769 -7.430
18 HG11 VAL 4 HG11 VAL 4 7.567 -7.548 -7.263
19 HG12 VAL 4 HG12 VAL 4 8.141 -9.214 -7.210
20 HG13 VAL 4 HG13 VAL 4 8.395 -8.240 -8.658
21 HG21 VAL 4 HG21 VAL 4 9.397 -8.598 -5.082
22 HG22 VAL 4 HG22 VAL 4 8.815 -6.941 -5.240
23 HG23 VAL 4 HG23 VAL 4 10.546 -7.262 -5.126
24 H ALA 5 H ALA 5 12.180 -7.039 -8.746
25 HA ALA 5 HA ALA 5 14.214 -6.715 -6.668
26 HB1 ALA 5 HB1 ALA 5 14.722 -7.022 -9.628
27 HB2 ALA 5 HB2 ALA 5 15.118 -8.202 -8.378
28 HB3 ALA 5 HB3 ALA 5 15.946 -6.645 -8.417
29 H ALA 6 H ALA 6 15.600 -4.973 -8.748
30 HA ALA 6 HA ALA 6 15.764 -2.780 -9.280
31 HB1 ALA 6 HB1 ALA 6 13.756 -1.562 -9.952
32 HB2 ALA 6 HB2 ALA 6 12.744 -2.833 -9.266
33 HB3 ALA 6 HB3 ALA 6 13.781 -3.180 -10.650
34 H GLY 7 H GLY 7 15.797 -3.624 -6.548
35 HA2 GLY 7 HA2 GLY 7 15.470 -1.057 -5.278
36 HA3 GLY 7 HA3 GLY 7 14.349 -2.278 -4.687
37 H THR 8 H THR 8 15.026 -3.670 -3.171
38 HA THR 8 HA THR 8 17.777 -4.364 -2.815
39 HB THR 8 HB THR 8 16.591 -2.818 -0.506
40 HG1 THR 8 HG1 THR 8 18.014 -1.896 -2.747
41 HG21 THR 8 HG21 THR 8 18.917 -2.766 0.268
42 HG22 THR 8 HG22 THR 8 19.417 -3.668 -1.163
43 HG23 THR 8 HG23 THR 8 18.360 -4.422 0.031
44 H ALA 9 H ALA 9 15.666 -4.018 -0.059
45 HA ALA 9 HA ALA 9 15.396 -6.897 0.131
46 HB1 ALA 9 HB1 ALA 9 14.354 -4.717 1.944
47 HB2 ALA 9 HB2 ALA 9 15.868 -5.598 2.149
48 HB3 ALA 9 HB3 ALA 9 14.329 -6.447 2.286
49 H SER 10 H SER 10 14.205 -5.778 -2.110
50 HA SER 10 HA SER 10 11.563 -5.061 -2.061
51 HB2 SER 10 HB2 SER 10 12.822 -6.900 -4.097
52 HB3 SER 10 HB3 SER 10 11.492 -5.768 -4.351
53 HG SER 10 HG SER 10 13.196 -4.649 -5.048
54 H GLY 11 H GLY 11 9.604 -6.092 -2.054
55 HA2 GLY 11 HA2 GLY 11 9.550 -9.016 -1.769
56 HA3 GLY 11 HA3 GLY 11 8.857 -8.043 -0.479
57 H ALA 12 H ALA 12 7.280 -9.869 -1.784
58 HA ALA 12 HA ALA 12 5.695 -8.251 -3.655
59 HB1 ALA 12 HB1 ALA 12 5.841 -11.239 -3.299
60 HB2 ALA 12 HB2 ALA 12 6.438 -10.289 -4.660
61 HB3 ALA 12 HB3 ALA 12 4.705 -10.417 -4.369
62 H LYS 13 H LYS 13 3.382 -10.006 -3.366
63 HA LYS 13 HA LYS 13 1.400 -10.021 -2.269
64 HB2 LYS 13 HB2 LYS 13 2.833 -9.181 0.244
65 HB3 LYS 13 HB3 LYS 13 1.302 -10.039 0.114
66 HG2 LYS 13 HG2 LYS 13 2.360 -12.032 -0.573
67 HG3 LYS 13 HG3 LYS 13 3.895 -11.198 -0.868
68 HD2 LYS 13 HD2 LYS 13 2.582 -11.523 1.839
69 HD3 LYS 13 HD3 LYS 13 3.892 -12.534 1.227
70 HE2 LYS 13 HE2 LYS 13 4.099 -9.537 1.501
71 HE3 LYS 13 HE3 LYS 13 4.582 -10.662 2.769
72 HZ1 LYS 13 HZ1 LYS 13 6.245 -11.581 1.371
73 HZ2 LYS 13 HZ2 LYS 13 6.416 -9.894 1.296
74 HZ3 LYS 13 HZ3 LYS 13 5.686 -10.732 0.017
75 H SER 14 H SER 14 3.520 -7.451 -1.871
76 HA SER 14 HA SER 14 1.679 -5.482 -2.738
77 HB2 SER 14 HB2 SER 14 2.187 -4.020 -0.630
78 HB3 SER 14 HB3 SER 14 0.902 -5.224 -0.540
79 HG SER 14 HG SER 14 2.331 -6.606 0.528
80 H MET 15 H MET 15 3.172 -5.166 -4.333
81 HA MET 15 HA MET 15 5.848 -5.818 -4.110
82 HB2 MET 15 HB2 MET 15 4.538 -3.952 -6.091
83 HB3 MET 15 HB3 MET 15 6.132 -4.668 -6.280
84 HG2 MET 15 HG2 MET 15 5.172 -6.877 -6.380
85 HG3 MET 15 HG3 MET 15 3.566 -6.223 -6.063
86 HE1 MET 15 HE1 MET 15 3.520 -3.573 -7.832
87 HE2 MET 15 HE2 MET 15 2.201 -4.741 -7.748
88 HE3 MET 15 HE3 MET 15 2.808 -4.209 -9.316
89 H TRP 16 H TRP 16 7.299 -4.928 -2.868
90 HA TRP 16 HA TRP 16 7.530 -2.012 -2.767
91 HB2 TRP 16 HB2 TRP 16 7.664 -2.005 -0.348
92 HB3 TRP 16 HB3 TRP 16 6.164 -2.780 -0.823
93 HD1 TRP 16 HD1 TRP 16 5.952 -5.417 -0.354
94 HE1 TRP 16 HE1 TRP 16 7.202 -6.972 1.283
95 HE3 TRP 16 HE3 TRP 16 9.940 -2.414 0.705
96 HZ2 TRP 16 HZ2 TRP 16 9.567 -6.913 2.816
97 HZ3 TRP 16 HZ3 TRP 16 11.653 -3.235 2.272
98 HH2 TRP 16 HH2 TRP 16 11.469 -5.436 3.302
99 H THR 17 H THR 17 9.562 -1.232 -2.144
100 HA THR 17 HA THR 17 11.709 -3.247 -1.967
101 HB THR 17 HB THR 17 13.159 -1.884 -3.333
102 HG1 THR 17 HG1 THR 17 12.097 0.029 -4.388
103 HG21 THR 17 HG21 THR 17 11.270 -3.358 -4.366
104 HG22 THR 17 HG22 THR 17 12.235 -2.309 -5.407
105 HG23 THR 17 HG23 THR 17 10.618 -1.810 -4.905
106 H GLU 18 H GLU 18 13.538 -2.546 -0.730
107 HA GLU 18 HA GLU 18 12.789 -0.825 1.469
108 HB2 GLU 18 HB2 GLU 18 13.979 -2.904 1.940
109 HB3 GLU 18 HB3 GLU 18 15.333 -2.377 0.946
110 HG2 GLU 18 HG2 GLU 18 15.405 -0.354 2.571
111 HG3 GLU 18 HG3 GLU 18 14.471 -1.405 3.635
112 H HIS 19 H HIS 19 13.293 1.255 1.665
113 HA HIS 19 HA HIS 19 15.787 2.235 0.460
114 HB2 HIS 19 HB2 HIS 19 13.058 3.502 0.208
115 HB3 HIS 19 HB3 HIS 19 14.536 4.437 0.031
116 HD1 HIS 19 HD1 HIS 19 15.705 4.341 -2.192
117 HD2 HIS 19 HD2 HIS 19 12.648 1.543 -1.856
118 HE1 HIS 19 HE1 HIS 19 15.388 3.403 -4.502
119 HE2 HIS 19 HE2 HIS 19 13.615 1.629 -4.256
120 H LYS 20 H LYS 20 16.967 3.435 1.872
121 HA LYS 20 HA LYS 20 15.524 4.587 4.150
122 HB2 LYS 20 HB2 LYS 20 16.858 3.632 5.702
123 HB3 LYS 20 HB3 LYS 20 17.060 2.420 4.449
124 HG2 LYS 20 HG2 LYS 20 18.991 4.566 4.209
125 HG3 LYS 20 HG3 LYS 20 19.068 3.760 5.776
126 HD2 LYS 20 HD2 LYS 20 20.542 2.609 4.336
127 HD3 LYS 20 HD3 LYS 20 19.126 1.576 4.531
128 HE2 LYS 20 HE2 LYS 20 19.518 1.480 2.244
129 HE3 LYS 20 HE3 LYS 20 18.291 2.733 2.375
130 HZ1 LYS 20 HZ1 LYS 20 19.940 3.547 0.924
131 HZ2 LYS 20 HZ2 LYS 20 21.202 3.088 1.956
132 HZ3 LYS 20 HZ3 LYS 20 20.177 4.364 2.388
133 H SER 21 H SER 21 16.062 6.584 4.719
134 HA SER 21 HA SER 21 17.597 8.252 3.032
135 HB2 SER 21 HB2 SER 21 15.727 9.046 4.470
136 HB3 SER 21 HB3 SER 21 16.687 8.679 5.900
137 HG SER 21 HG SER 21 17.562 10.560 5.699
138 HA PRO 22 HA PRO 22 21.757 7.484 4.176
139 HB2 PRO 22 HB2 PRO 22 22.672 10.097 4.489
140 HB3 PRO 22 HB3 PRO 22 22.589 9.203 2.969
141 HG2 PRO 22 HG2 PRO 22 20.673 11.192 4.108
142 HG3 PRO 22 HG3 PRO 22 21.192 10.966 2.426
143 HD2 PRO 22 HD2 PRO 22 18.812 10.100 3.249
144 HD3 PRO 22 HD3 PRO 22 19.784 9.139 2.113
145 H ASP 23 H ASP 23 19.754 9.297 6.344
146 HA ASP 23 HA ASP 23 21.687 9.340 8.469
147 HB2 ASP 23 HB2 ASP 23 19.722 10.152 9.801
148 HB3 ASP 23 HB3 ASP 23 20.153 11.154 8.428
149 H GLY 24 H GLY 24 19.789 6.936 7.147
150 HA2 GLY 24 HA2 GLY 24 20.084 4.715 8.038
151 HA3 GLY 24 HA3 GLY 24 20.001 5.398 9.653
152 H ARG 25 H ARG 25 17.626 7.076 8.486
153 HA ARG 25 HA ARG 25 15.633 5.356 9.570
154 HB2 ARG 25 HB2 ARG 25 15.579 7.846 9.694
155 HB3 ARG 25 HB3 ARG 25 15.232 7.886 7.971
156 HG2 ARG 25 HG2 ARG 25 13.220 8.159 9.342
157 HG3 ARG 25 HG3 ARG 25 13.150 6.717 8.324
158 HD2 ARG 25 HD2 ARG 25 13.831 5.344 10.234
159 HD3 ARG 25 HD3 ARG 25 13.881 6.785 11.248
160 HE ARG 25 HE ARG 25 11.353 6.813 10.279
161 HH11 ARG 25 HH11 ARG 25 13.283 4.331 11.850
162 HH12 ARG 25 HH12 ARG 25 11.913 3.586 12.627
163 HH21 ARG 25 HH21 ARG 25 9.555 5.830 11.313
164 HH22 ARG 25 HH22 ARG 25 9.806 4.428 12.318
165 H THR 26 H THR 26 14.532 3.788 8.596
166 HA THR 26 HA THR 26 14.696 3.579 5.673
167 HB THR 26 HB THR 26 13.937 1.428 7.659
168 HG1 THR 26 HG1 THR 26 16.228 2.452 7.586
169 HG21 THR 26 HG21 THR 26 14.776 1.280 4.757
170 HG22 THR 26 HG22 THR 26 13.155 0.989 5.387
171 HG23 THR 26 HG23 THR 26 14.473 -0.104 5.810
172 H TYR 27 H TYR 27 12.927 3.467 4.389
173 HA TYR 27 HA TYR 27 10.308 2.992 5.607
174 HB2 TYR 27 HB2 TYR 27 9.411 4.622 3.784
175 HB3 TYR 27 HB3 TYR 27 10.030 5.282 5.285
176 HD1 TYR 27 HD1 TYR 27 11.334 4.332 1.907
177 HD2 TYR 27 HD2 TYR 27 11.376 7.141 5.099
178 HE1 TYR 27 HE1 TYR 27 12.836 5.777 0.607
179 HE2 TYR 27 HE2 TYR 27 12.884 8.591 3.810
180 HH TYR 27 HH TYR 27 13.488 8.120 0.489
181 H TYR 28 H TYR 28 8.699 2.790 3.527
182 HA TYR 28 HA TYR 28 10.035 0.796 1.819
183 HB2 TYR 28 HB2 TYR 28 7.153 0.877 2.724
184 HB3 TYR 28 HB3 TYR 28 7.849 -0.332 1.652
185 HD1 TYR 28 HD2 TYR 28 10.339 -1.062 2.908
186 HD2 TYR 28 HD1 TYR 28 6.602 -0.140 4.715
187 HE1 TYR 28 HE2 TYR 28 10.946 -2.439 4.849
188 HE2 TYR 28 HE1 TYR 28 7.200 -1.518 6.662
189 HH TYR 28 HH TYR 28 10.379 -2.702 7.176
190 H TYR 29 H TYR 29 9.534 0.746 -0.380
191 HA TYR 29 HA TYR 29 7.797 2.920 -1.329
192 HB2 TYR 29 HB2 TYR 29 9.779 3.607 -2.227
193 HB3 TYR 29 HB3 TYR 29 10.439 1.983 -2.281
194 HD1 TYR 29 HD1 TYR 29 7.575 3.791 -3.957
195 HD2 TYR 29 HD2 TYR 29 10.943 1.255 -4.327
196 HE1 TYR 29 HE1 TYR 29 7.207 3.675 -6.395
197 HE2 TYR 29 HE2 TYR 29 10.600 1.120 -6.759
198 HH TYR 29 HH TYR 29 8.847 1.416 -8.392
199 H ASN 30 H ASN 30 6.007 2.273 -2.228
200 HA ASN 30 HA ASN 30 5.751 -0.510 -3.064
201 HB2 ASN 30 HB2 ASN 30 3.786 1.661 -2.410
202 HB3 ASN 30 HB3 ASN 30 3.283 0.315 -3.426
203 HD21 ASN 30 HD21 ASN 30 1.870 -0.574 -2.020
204 HD22 ASN 30 HD22 ASN 30 2.332 -1.293 -0.522
205 H THR 31 H THR 31 6.159 -0.978 -5.058
206 HA THR 31 HA THR 31 6.545 0.968 -7.093
207 HB THR 31 HB THR 31 7.011 -0.933 -8.543
208 HG1 THR 31 HG1 THR 31 6.035 -2.536 -6.386
209 HG21 THR 31 HG21 THR 31 8.003 -1.205 -5.715
210 HG22 THR 31 HG22 THR 31 8.797 -0.379 -7.062
211 HG23 THR 31 HG23 THR 31 8.661 -2.140 -7.060
212 H GLU 32 H GLU 32 3.845 -0.662 -5.917
213 HA GLU 32 HA GLU 32 2.234 -0.882 -8.218
214 HB2 GLU 32 HB2 GLU 32 0.588 -0.425 -5.983
215 HB3 GLU 32 HB3 GLU 32 1.004 -1.973 -6.704
216 HG2 GLU 32 HG2 GLU 32 3.104 -1.883 -5.292
217 HG3 GLU 32 HG3 GLU 32 2.339 -0.555 -4.432
218 H THR 33 H THR 33 2.399 1.524 -5.651
219 HA THR 33 HA THR 33 0.681 3.341 -7.166
220 HB THR 33 HB THR 33 0.641 4.663 -5.056
221 HG1 THR 33 HG1 THR 33 1.578 3.394 -3.188
222 HG21 THR 33 HG21 THR 33 0.019 1.715 -4.720
223 HG22 THR 33 HG22 THR 33 -1.057 2.932 -5.421
224 HG23 THR 33 HG23 THR 33 -0.618 3.020 -3.714
225 H LYS 34 H LYS 34 3.878 2.658 -6.652
226 HA LYS 34 HA LYS 34 5.846 3.649 -7.132
227 HB2 LYS 34 HB2 LYS 34 4.096 5.710 -8.466
228 HB3 LYS 34 HB3 LYS 34 5.854 5.691 -8.568
229 HG2 LYS 34 HG2 LYS 34 4.278 3.282 -9.309
230 HG3 LYS 34 HG3 LYS 34 4.458 4.614 -10.461
231 HD2 LYS 34 HD2 LYS 34 6.908 4.407 -10.242
232 HD3 LYS 34 HD3 LYS 34 6.677 3.040 -9.148
233 HE2 LYS 34 HE2 LYS 34 5.544 1.805 -10.916
234 HE3 LYS 34 HE3 LYS 34 5.734 3.175 -12.010
235 HZ1 LYS 34 HZ1 LYS 34 7.902 1.514 -10.845
236 HZ2 LYS 34 HZ2 LYS 34 8.164 2.922 -11.749
237 HZ3 LYS 34 HZ3 LYS 34 7.425 1.580 -12.474
238 H GLN 35 H GLN 35 4.330 4.190 -4.698
239 HA GLN 35 HA GLN 35 5.395 6.844 -3.982
240 HB2 GLN 35 HB2 GLN 35 3.045 5.338 -2.841
241 HB3 GLN 35 HB3 GLN 35 3.697 6.815 -2.145
242 HG2 GLN 35 HG2 GLN 35 3.246 7.944 -4.325
243 HG3 GLN 35 HG3 GLN 35 2.415 6.477 -4.840
244 HE21 GLN 35 HE21 GLN 35 1.399 9.194 -4.451
245 HE22 GLN 35 HE22 GLN 35 0.115 9.054 -3.292
246 H SER 36 H SER 36 6.227 7.110 -1.838
247 HA SER 36 HA SER 36 7.248 4.622 -0.657
248 HB2 SER 36 HB2 SER 36 8.918 6.370 -1.368
249 HB3 SER 36 HB3 SER 36 8.216 7.457 -0.170
250 HG SER 36 HG SER 36 8.982 4.918 0.693
251 H THR 37 H THR 37 6.868 4.243 1.568
252 HA THR 37 HA THR 37 4.849 5.868 2.853
253 HB THR 37 HB THR 37 3.597 4.582 1.130
254 HG1 THR 37 HG1 THR 37 2.038 4.570 2.540
255 HG21 THR 37 HG21 THR 37 4.729 2.222 2.630
256 HG22 THR 37 HG22 THR 37 4.841 2.576 0.903
257 HG23 THR 37 HG23 THR 37 3.293 2.109 1.609
258 H TRP 38 H TRP 38 4.108 4.883 4.876
259 HA TRP 38 HA TRP 38 6.245 3.842 6.418
260 HB2 TRP 38 HB2 TRP 38 4.348 3.583 8.176
261 HB3 TRP 38 HB3 TRP 38 4.879 5.184 7.691
262 HD1 TRP 38 HD1 TRP 38 2.831 6.650 7.850
263 HE1 TRP 38 HE1 TRP 38 0.400 6.575 7.012
264 HE3 TRP 38 HE3 TRP 38 2.797 1.956 5.791
265 HZ2 TRP 38 HZ2 TRP 38 -1.294 4.789 5.669
266 HZ3 TRP 38 HZ3 TRP 38 0.718 1.149 4.756
267 HH2 TRP 38 HH2 TRP 38 -1.284 2.538 4.694
268 H GLU 39 H GLU 39 5.622 1.984 8.037
269 HA GLU 39 HA GLU 39 5.651 -0.464 6.752
270 HB2 GLU 39 HB2 GLU 39 5.020 -1.411 8.977
271 HB3 GLU 39 HB3 GLU 39 6.349 -0.260 9.044
272 HG2 GLU 39 HG2 GLU 39 4.724 1.488 9.728
273 HG3 GLU 39 HG3 GLU 39 3.482 0.240 9.801
274 H LYS 40 H LYS 40 4.179 -1.500 5.625
275 HA LYS 40 HA LYS 40 1.529 -0.512 5.392
276 HB2 LYS 40 HB2 LYS 40 2.879 -2.926 4.201
277 HB3 LYS 40 HB3 LYS 40 1.250 -2.407 3.788
278 HG2 LYS 40 HG2 LYS 40 2.235 -0.212 3.101
279 HG3 LYS 40 HG3 LYS 40 3.826 -0.943 3.303
280 HD2 LYS 40 HD2 LYS 40 1.702 -2.162 1.559
281 HD3 LYS 40 HD3 LYS 40 2.850 -0.967 0.954
282 HE2 LYS 40 HE2 LYS 40 3.644 -3.544 2.298
283 HE3 LYS 40 HE3 LYS 40 3.510 -3.342 0.550
284 HZ1 LYS 40 HZ1 LYS 40 5.781 -3.061 1.301
285 HZ2 LYS 40 HZ2 LYS 40 5.318 -1.807 2.332
286 HZ3 LYS 40 HZ3 LYS 40 5.189 -1.612 0.653
287 HA PRO 41 HA PRO 41 -0.893 -3.103 8.083
288 HB2 PRO 41 HB2 PRO 41 -3.008 -3.505 6.357
289 HB3 PRO 41 HB3 PRO 41 -2.803 -2.082 7.383
290 HG2 PRO 41 HG2 PRO 41 -2.112 -2.457 4.503
291 HG3 PRO 41 HG3 PRO 41 -2.876 -1.065 5.296
292 HD2 PRO 41 HD2 PRO 41 -0.290 -1.011 4.647
293 HD3 PRO 41 HD3 PRO 41 -0.852 -0.309 6.178
294 H ASP 42 H ASP 42 -2.433 -5.100 7.639
295 HA ASP 42 HA ASP 42 -0.870 -7.350 7.224
296 HB2 ASP 42 HB2 ASP 42 -3.861 -7.034 7.159
297 HB3 ASP 42 HB3 ASP 42 -3.032 -8.589 7.203
298 H ASP 43 H ASP 43 -1.433 -5.424 4.701
299 HA ASP 43 HA ASP 43 -2.212 -7.123 2.610
300 HB2 ASP 43 HB2 ASP 43 -0.296 -4.802 2.702
301 HB3 ASP 43 HB3 ASP 43 -0.684 -5.635 1.204
302 H LEU 44 H LEU 44 0.733 -6.807 4.393
303 HA LEU 44 HA LEU 44 2.350 -8.366 2.628
304 HB2 LEU 44 HB2 LEU 44 2.804 -7.761 5.547
305 HB3 LEU 44 HB3 LEU 44 4.001 -8.302 4.379
306 HG LEU 44 HG LEU 44 2.582 -5.778 3.757
307 HD11 LEU 44 HD11 LEU 44 4.663 -6.013 5.926
308 HD12 LEU 44 HD12 LEU 44 2.994 -5.465 6.109
309 HD13 LEU 44 HD13 LEU 44 4.144 -4.501 5.181
310 HD21 LEU 44 HD21 LEU 44 4.933 -5.185 3.074
311 HD22 LEU 44 HD22 LEU 44 4.197 -6.520 2.191
312 HD23 LEU 44 HD23 LEU 44 5.379 -6.848 3.459
313 H LYS 45 H LYS 45 -0.061 -9.143 4.934
314 HA LYS 45 HA LYS 45 0.876 -11.847 5.340
315 HB2 LYS 45 HB2 LYS 45 -1.969 -11.013 5.756
316 HB3 LYS 45 HB3 LYS 45 -1.015 -12.181 6.654
317 HG2 LYS 45 HG2 LYS 45 -0.683 -9.196 6.766
318 HG3 LYS 45 HG3 LYS 45 -1.522 -10.183 7.962
319 HD2 LYS 45 HD2 LYS 45 0.839 -11.451 7.878
320 HD3 LYS 45 HD3 LYS 45 1.353 -9.809 7.491
321 HE2 LYS 45 HE2 LYS 45 0.382 -8.936 9.448
322 HE3 LYS 45 HE3 LYS 45 -0.439 -10.454 9.807
323 HZ1 LYS 45 HZ1 LYS 45 1.710 -11.484 10.191
324 HZ2 LYS 45 HZ2 LYS 45 1.527 -10.132 11.193
325 HZ3 LYS 45 HZ3 LYS 45 2.508 -10.037 9.817
326 H THR 46 H THR 46 -2.336 -10.968 4.257
327 HA THR 46 HA THR 46 -2.210 -12.362 1.746
328 HB THR 46 HB THR 46 -4.080 -13.601 3.755
329 HG1 THR 46 HG1 THR 46 -2.267 -14.074 4.859
330 HG21 THR 46 HG21 THR 46 -4.344 -14.191 1.423
331 HG22 THR 46 HG22 THR 46 -3.779 -15.586 2.340
332 HG23 THR 46 HG23 THR 46 -2.654 -14.680 1.328
333 HA PRO 47 HA PRO 47 -5.313 -9.391 0.832
334 HB2 PRO 47 HB2 PRO 47 -6.963 -11.617 -0.254
335 HB3 PRO 47 HB3 PRO 47 -6.560 -10.060 -0.989
336 HG2 PRO 47 HG2 PRO 47 -5.277 -12.228 -1.777
337 HG3 PRO 47 HG3 PRO 47 -4.380 -10.723 -1.501
338 HD2 PRO 47 HD2 PRO 47 -4.549 -13.171 0.196
339 HD3 PRO 47 HD3 PRO 47 -3.166 -12.108 -0.110
340 H ALA 48 H ALA 48 -6.823 -12.403 2.061
341 HA ALA 48 HA ALA 48 -9.131 -11.000 2.987
342 HB1 ALA 48 HB1 ALA 48 -8.941 -13.470 2.333
343 HB2 ALA 48 HB2 ALA 48 -9.952 -13.027 3.702
344 HB3 ALA 48 HB3 ALA 48 -8.350 -13.710 3.980
345 H GLU 49 H GLU 49 -6.062 -11.825 4.400
346 HA GLU 49 HA GLU 49 -6.810 -11.369 7.090
347 HB2 GLU 49 HB2 GLU 49 -4.107 -11.226 5.753
348 HB3 GLU 49 HB3 GLU 49 -4.347 -11.085 7.495
349 HG2 GLU 49 HG2 GLU 49 -5.524 -13.317 7.379
350 HG3 GLU 49 HG3 GLU 49 -4.916 -13.452 5.732
351 H GLN 50 H GLN 50 -5.885 -9.281 4.453
352 HA GLN 50 HA GLN 50 -5.302 -6.924 5.812
353 HB2 GLN 50 HB2 GLN 50 -6.845 -7.139 3.232
354 HB3 GLN 50 HB3 GLN 50 -5.881 -5.774 3.773
355 HG2 GLN 50 HG2 GLN 50 -3.861 -7.096 3.565
356 HG3 GLN 50 HG3 GLN 50 -4.826 -8.502 3.092
357 HE21 GLN 50 HE21 GLN 50 -3.779 -8.645 1.075
358 HE22 GLN 50 HE22 GLN 50 -4.061 -7.502 -0.190
359 H LEU 51 H LEU 51 -8.451 -8.335 4.975
360 HA LEU 51 HA LEU 51 -9.920 -5.976 4.955
361 HB2 LEU 51 HB2 LEU 51 -11.883 -7.307 4.923
362 HB3 LEU 51 HB3 LEU 51 -10.646 -8.120 3.992
363 HG LEU 51 HG LEU 51 -10.307 -9.385 6.321
364 HD11 LEU 51 HD11 LEU 51 -13.231 -8.657 6.249
365 HD12 LEU 51 HD12 LEU 51 -12.067 -8.204 7.495
366 HD13 LEU 51 HD13 LEU 51 -12.512 -9.898 7.275
367 HD21 LEU 51 HD21 LEU 51 -11.703 -11.165 5.348
368 HD22 LEU 51 HD22 LEU 51 -10.617 -10.414 4.170
369 HD23 LEU 51 HD23 LEU 51 -12.339 -10.000 4.183
370 H LEU 52 H LEU 52 -9.076 -7.991 7.671
371 HA LEU 52 HA LEU 52 -10.890 -6.937 9.564
372 HB2 LEU 52 HB2 LEU 52 -8.104 -8.003 10.060
373 HB3 LEU 52 HB3 LEU 52 -9.345 -7.781 11.273
374 HG LEU 52 HG LEU 52 -10.718 -9.483 9.920
375 HD11 LEU 52 HD11 LEU 52 -8.013 -10.315 8.920
376 HD12 LEU 52 HD12 LEU 52 -9.092 -9.303 7.958
377 HD13 LEU 52 HD13 LEU 52 -9.601 -10.926 8.446
378 HD21 LEU 52 HD21 LEU 52 -9.584 -11.352 11.037
379 HD22 LEU 52 HD22 LEU 52 -9.746 -9.953 12.098
380 HD23 LEU 52 HD23 LEU 52 -8.193 -10.313 11.345
381 H SER 53 H SER 53 -7.578 -6.102 8.749
382 HA SER 53 HA SER 53 -7.452 -3.847 10.523
383 HB2 SER 53 HB2 SER 53 -5.645 -4.604 8.225
384 HB3 SER 53 HB3 SER 53 -5.214 -3.598 9.609
385 HG SER 53 HG SER 53 -4.510 -5.845 9.759
386 H LYS 54 H LYS 54 -7.120 -4.192 7.022
387 HA LYS 54 HA LYS 54 -8.644 -1.738 6.570
388 HB2 LYS 54 HB2 LYS 54 -5.777 -2.133 5.688
389 HB3 LYS 54 HB3 LYS 54 -6.834 -0.888 5.041
390 HG2 LYS 54 HG2 LYS 54 -6.092 -1.149 7.944
391 HG3 LYS 54 HG3 LYS 54 -5.289 -0.074 6.793
392 HD2 LYS 54 HD2 LYS 54 -7.401 1.077 6.389
393 HD3 LYS 54 HD3 LYS 54 -8.220 -0.003 7.513
394 HE2 LYS 54 HE2 LYS 54 -5.944 1.828 8.254
395 HE3 LYS 54 HE3 LYS 54 -7.649 2.221 8.469
396 HZ1 LYS 54 HZ1 LYS 54 -6.730 1.393 10.513
397 HZ2 LYS 54 HZ2 LYS 54 -6.182 -0.022 9.755
398 HZ3 LYS 54 HZ3 LYS 54 -7.847 0.265 9.917
399 H CYS 55 H CYS 55 -9.938 -1.981 4.868
400 HA CYS 55 HA CYS 55 -10.152 -4.463 3.562
401 HB2 CYS 55 HB2 CYS 55 -11.880 -3.335 2.173
402 HB3 CYS 55 HB3 CYS 55 -12.092 -3.034 3.891
403 HG CYS 55 HG CYS 55 -12.626 -0.797 2.055
404 HA PRO 56 HA PRO 56 -7.551 -4.659 0.031
405 HB2 PRO 56 HB2 PRO 56 -10.025 -4.345 -1.635
406 HB3 PRO 56 HB3 PRO 56 -8.671 -5.466 -1.836
407 HG2 PRO 56 HG2 PRO 56 -10.921 -6.314 -0.731
408 HG3 PRO 56 HG3 PRO 56 -9.356 -6.817 -0.068
409 HD2 PRO 56 HD2 PRO 56 -11.327 -4.872 1.003
410 HD3 PRO 56 HD3 PRO 56 -10.198 -5.927 1.870
411 H TRP 57 H TRP 57 -10.113 -2.220 -0.352
412 HA TRP 57 HA TRP 57 -8.439 -0.505 -1.952
413 HB2 TRP 57 HB2 TRP 57 -11.157 -0.142 -0.689
414 HB3 TRP 57 HB3 TRP 57 -10.347 1.129 -1.594
415 HD1 TRP 57 HD1 TRP 57 -9.935 0.622 -4.265
416 HE1 TRP 57 HE1 TRP 57 -11.371 -0.741 -5.914
417 HE3 TRP 57 HE3 TRP 57 -12.645 -2.115 -0.899
418 HZ2 TRP 57 HZ2 TRP 57 -13.383 -2.716 -5.792
419 HZ3 TRP 57 HZ3 TRP 57 -14.307 -3.717 -1.748
420 HH2 TRP 57 HH2 TRP 57 -14.669 -4.010 -4.146
421 H LYS 58 H LYS 58 -6.950 0.825 -1.135
422 HA LYS 58 HA LYS 58 -7.310 1.847 1.588
423 HB2 LYS 58 HB2 LYS 58 -5.254 -0.005 0.640
424 HB3 LYS 58 HB3 LYS 58 -4.619 1.365 1.543
425 HG2 LYS 58 HG2 LYS 58 -6.034 0.811 3.427
426 HG3 LYS 58 HG3 LYS 58 -6.801 -0.487 2.507
427 HD2 LYS 58 HD2 LYS 58 -3.867 -0.359 3.180
428 HD3 LYS 58 HD3 LYS 58 -5.065 -1.281 4.091
429 HE2 LYS 58 HE2 LYS 58 -4.749 -1.665 1.147
430 HE3 LYS 58 HE3 LYS 58 -3.662 -2.472 2.275
431 HZ1 LYS 58 HZ1 LYS 58 -5.440 -3.934 1.759
432 HZ2 LYS 58 HZ2 LYS 58 -6.612 -2.758 2.111
433 HZ3 LYS 58 HZ3 LYS 58 -5.665 -3.414 3.351
434 H GLU 59 H GLU 59 -6.554 3.845 1.975
435 HA GLU 59 HA GLU 59 -5.119 5.225 -0.205
436 HB2 GLU 59 HB2 GLU 59 -7.402 6.043 -0.048
437 HB3 GLU 59 HB3 GLU 59 -7.226 6.297 1.682
438 HG2 GLU 59 HG2 GLU 59 -5.394 7.940 1.116
439 HG3 GLU 59 HG3 GLU 59 -5.933 7.811 -0.559
440 H TYR 60 H TYR 60 -3.182 6.011 0.355
441 HA TYR 60 HA TYR 60 -2.783 6.971 3.082
442 HB2 TYR 60 HB2 TYR 60 -0.539 5.889 3.194
443 HB3 TYR 60 HB3 TYR 60 -1.872 4.745 3.223
444 HD1 TYR 60 HD1 TYR 60 0.737 6.212 1.004
445 HD2 TYR 60 HD2 TYR 60 -2.001 3.015 1.654
446 HE1 TYR 60 HE1 TYR 60 1.760 4.960 -0.843
447 HE2 TYR 60 HE2 TYR 60 -0.981 1.761 -0.193
448 HH TYR 60 HH TYR 60 0.341 2.073 -2.118
449 H LYS 61 H LYS 61 -0.776 8.303 3.242
450 HA LYS 61 HA LYS 61 -0.381 9.772 0.743
451 HB2 LYS 61 HB2 LYS 61 0.447 10.522 3.537
452 HB3 LYS 61 HB3 LYS 61 0.626 11.526 2.109
453 HG2 LYS 61 HG2 LYS 61 -1.904 11.377 1.897
454 HG3 LYS 61 HG3 LYS 61 -1.876 10.749 3.542
455 HD2 LYS 61 HD2 LYS 61 -1.069 13.459 2.538
456 HD3 LYS 61 HD3 LYS 61 -2.198 13.052 3.834
457 HE2 LYS 61 HE2 LYS 61 0.782 12.617 3.910
458 HE3 LYS 61 HE3 LYS 61 -0.052 13.984 4.647
459 HZ1 LYS 61 HZ1 LYS 61 0.526 12.069 6.162
460 HZ2 LYS 61 HZ2 LYS 61 -0.681 11.174 5.375
461 HZ3 LYS 61 HZ3 LYS 61 -1.085 12.592 6.214
462 H SER 62 H SER 62 1.580 10.001 -0.174
463 HA SER 62 HA SER 62 3.650 8.153 0.453
464 HB2 SER 62 HB2 SER 62 4.721 9.944 -1.314
465 HB3 SER 62 HB3 SER 62 3.800 8.506 -1.775
466 HG SER 62 HG SER 62 2.082 9.729 -2.199
467 H ASP 63 H ASP 63 6.012 9.166 0.337
468 HA ASP 63 HA ASP 63 6.558 10.850 2.499
469 HB2 ASP 63 HB2 ASP 63 8.329 9.547 1.581
470 HB3 ASP 63 HB3 ASP 63 8.111 10.243 -0.018
471 H SER 64 H SER 64 5.849 11.546 -0.870
472 HA SER 64 HA SER 64 6.204 14.374 -0.650
473 HB2 SER 64 HB2 SER 64 4.463 12.998 -2.691
474 HB3 SER 64 HB3 SER 64 5.428 14.463 -2.880
475 HG SER 64 HG SER 64 7.297 12.985 -2.492
476 H GLY 65 H GLY 65 3.864 12.165 0.363
477 HA2 GLY 65 HA2 GLY 65 2.053 12.597 1.757
478 HA3 GLY 65 HA3 GLY 65 2.200 14.309 1.410
479 H LYS 66 H LYS 66 2.185 12.455 -1.401
480 HA LYS 66 HA LYS 66 -0.431 13.351 -2.161
481 HB2 LYS 66 HB2 LYS 66 1.473 13.067 -3.772
482 HB3 LYS 66 HB3 LYS 66 1.361 11.335 -3.535
483 HG2 LYS 66 HG2 LYS 66 0.265 12.142 -5.603
484 HG3 LYS 66 HG3 LYS 66 -0.811 11.261 -4.518
485 HD2 LYS 66 HD2 LYS 66 -1.840 13.300 -5.496
486 HD3 LYS 66 HD3 LYS 66 -1.786 13.316 -3.732
487 HE2 LYS 66 HE2 LYS 66 0.198 14.736 -3.802
488 HE3 LYS 66 HE3 LYS 66 0.160 14.721 -5.567
489 HZ1 LYS 66 HZ1 LYS 66 -1.958 15.819 -3.791
490 HZ2 LYS 66 HZ2 LYS 66 -1.993 15.816 -5.490
491 HZ3 LYS 66 HZ3 LYS 66 -0.829 16.733 -4.668
492 H THR 67 H THR 67 -2.292 12.327 -1.662
493 HA THR 67 HA THR 67 -2.196 9.658 -0.585
494 HB THR 67 HB THR 67 -4.876 10.277 -0.978
495 HG1 THR 67 HG1 THR 67 -4.525 12.505 0.252
496 HG21 THR 67 HG21 THR 67 -3.563 9.273 0.960
497 HG22 THR 67 HG22 THR 67 -4.941 10.308 1.368
498 HG23 THR 67 HG23 THR 67 -3.297 10.940 1.494
499 H TYR 68 H TYR 68 -2.543 7.848 -1.603
500 HA TYR 68 HA TYR 68 -3.897 7.937 -4.205
501 HB2 TYR 68 HB2 TYR 68 -1.208 6.964 -3.623
502 HB3 TYR 68 HB3 TYR 68 -2.214 5.750 -4.410
503 HD1 TYR 68 HD2 TYR 68 -1.414 9.392 -4.739
504 HD2 TYR 68 HD1 TYR 68 -2.209 5.712 -6.717
505 HE1 TYR 68 HE2 TYR 68 -1.031 10.483 -6.908
506 HE2 TYR 68 HE1 TYR 68 -1.824 6.794 -8.892
507 HH TYR 68 HH TYR 68 -0.432 9.921 -9.169
508 H TYR 69 H TYR 69 -5.130 6.141 -4.729
509 HA TYR 69 HA TYR 69 -5.902 4.512 -2.395
510 HB2 TYR 69 HB2 TYR 69 -7.461 6.392 -3.303
511 HB3 TYR 69 HB3 TYR 69 -7.744 5.295 -4.647
512 HD1 TYR 69 HD1 TYR 69 -7.785 5.327 -0.928
513 HD2 TYR 69 HD2 TYR 69 -9.540 3.841 -4.509
514 HE1 TYR 69 HE1 TYR 69 -9.557 4.251 0.395
515 HE2 TYR 69 HE2 TYR 69 -11.313 2.760 -3.193
516 HH TYR 69 HH TYR 69 -11.764 3.414 0.158
517 H TYR 70 H TYR 70 -5.710 2.338 -2.733
518 HA TYR 70 HA TYR 70 -5.589 1.455 -5.533
519 HB2 TYR 70 HB2 TYR 70 -3.609 0.171 -5.187
520 HB3 TYR 70 HB3 TYR 70 -3.277 1.784 -4.568
521 HD1 TYR 70 HD2 TYR 70 -3.356 2.144 -2.054
522 HD2 TYR 70 HD1 TYR 70 -3.425 -1.727 -3.816
523 HE1 TYR 70 HE2 TYR 70 -2.717 1.155 0.107
524 HE2 TYR 70 HE1 TYR 70 -2.784 -2.731 -1.666
525 HH TYR 70 HH TYR 70 -2.066 -2.320 0.415
526 H ASN 71 H ASN 71 -6.215 -0.628 -5.957
527 HA ASN 71 HA ASN 71 -7.701 -1.993 -3.816
528 HB2 ASN 71 HB2 ASN 71 -8.744 -1.326 -6.088
529 HB3 ASN 71 HB3 ASN 71 -7.791 -2.643 -6.764
530 HD21 ASN 71 HD21 ASN 71 -9.693 -3.714 -7.372
531 HD22 ASN 71 HD22 ASN 71 -10.664 -4.540 -6.200
532 H SER 72 H SER 72 -6.478 -3.494 -2.787
533 HA SER 72 HA SER 72 -3.876 -4.011 -3.788
534 HB2 SER 72 HB2 SER 72 -4.436 -3.589 -1.409
535 HB3 SER 72 HB3 SER 72 -5.158 -5.187 -1.328
536 HG SER 72 HG SER 72 -2.865 -4.901 -0.638
537 H GLN 73 H GLN 73 -6.686 -6.273 -3.523
538 HA GLN 73 HA GLN 73 -5.083 -8.574 -3.833
539 HB2 GLN 73 HB2 GLN 73 -7.085 -9.790 -4.455
540 HB3 GLN 73 HB3 GLN 73 -7.391 -8.791 -3.048
541 HG2 GLN 73 HG2 GLN 73 -8.121 -7.900 -5.810
542 HG3 GLN 73 HG3 GLN 73 -9.165 -8.979 -4.889
543 HE21 GLN 73 HE21 GLN 73 -7.846 -5.809 -5.151
544 HE22 GLN 73 HE22 GLN 73 -8.928 -5.046 -4.033
545 H THR 74 H THR 74 -6.454 -6.381 -6.134
546 HA THR 74 HA THR 74 -5.614 -8.100 -8.343
547 HB THR 74 HB THR 74 -7.109 -6.508 -9.665
548 HG1 THR 74 HG1 THR 74 -8.240 -5.030 -8.566
549 HG21 THR 74 HG21 THR 74 -8.143 -8.303 -7.459
550 HG22 THR 74 HG22 THR 74 -7.943 -8.681 -9.179
551 HG23 THR 74 HG23 THR 74 -9.209 -7.567 -8.666
552 H LYS 75 H LYS 75 -4.603 -5.570 -6.544
553 HA LYS 75 HA LYS 75 -2.971 -4.044 -6.658
554 HB2 LYS 75 HB2 LYS 75 -2.079 -5.901 -8.848
555 HB3 LYS 75 HB3 LYS 75 -1.110 -4.532 -8.309
556 HG2 LYS 75 HG2 LYS 75 -2.061 -6.809 -6.580
557 HG3 LYS 75 HG3 LYS 75 -0.416 -6.588 -7.197
558 HD2 LYS 75 HD2 LYS 75 -0.170 -4.557 -5.926
559 HD3 LYS 75 HD3 LYS 75 -1.861 -4.616 -5.429
560 HE2 LYS 75 HE2 LYS 75 -1.376 -6.771 -4.280
561 HE3 LYS 75 HE3 LYS 75 0.329 -6.542 -4.666
562 HZ1 LYS 75 HZ1 LYS 75 -0.111 -5.776 -2.452
563 HZ2 LYS 75 HZ2 LYS 75 -1.352 -4.762 -2.987
564 HZ3 LYS 75 HZ3 LYS 75 0.255 -4.435 -3.429
565 H GLU 76 H GLU 76 -5.332 -3.324 -7.912
566 HA GLU 76 HA GLU 76 -4.519 -1.666 -10.154
567 HB2 GLU 76 HB2 GLU 76 -6.749 -2.515 -10.325
568 HB3 GLU 76 HB3 GLU 76 -7.127 -2.040 -8.674
569 HG2 GLU 76 HG2 GLU 76 -6.947 0.319 -9.332
570 HG3 GLU 76 HG3 GLU 76 -6.626 -0.176 -10.992
571 H SER 77 H SER 77 -4.417 0.608 -10.013
572 HA SER 77 HA SER 77 -4.647 1.730 -7.324
573 HB2 SER 77 HB2 SER 77 -2.559 3.092 -7.777
574 HB3 SER 77 HB3 SER 77 -2.295 1.370 -7.517
575 HG SER 77 HG SER 77 -1.965 1.071 -9.676
576 H ARG 78 H ARG 78 -5.747 3.553 -7.254
577 HA ARG 78 HA ARG 78 -6.232 5.030 -9.771
578 HB2 ARG 78 HB2 ARG 78 -8.566 5.156 -9.296
579 HB3 ARG 78 HB3 ARG 78 -8.126 3.471 -9.055
580 HG2 ARG 78 HG2 ARG 78 -7.912 3.995 -6.599
581 HG3 ARG 78 HG3 ARG 78 -8.644 5.558 -6.952
582 HD2 ARG 78 HD2 ARG 78 -9.878 2.832 -7.325
583 HD3 ARG 78 HD3 ARG 78 -10.347 4.069 -6.171
584 HE ARG 78 HE ARG 78 -10.904 5.418 -8.276
585 HH11 ARG 78 HH11 ARG 78 -11.156 1.930 -8.056
586 HH12 ARG 78 HH12 ARG 78 -12.497 1.829 -9.153
587 HH21 ARG 78 HH21 ARG 78 -12.678 5.285 -9.729
588 HH22 ARG 78 HH22 ARG 78 -13.356 3.721 -10.107
589 H TRP 79 H TRP 79 -6.991 7.288 -9.376
590 HA TRP 79 HA TRP 79 -6.506 8.172 -6.616
591 HB2 TRP 79 HB2 TRP 79 -6.050 10.449 -7.542
592 HB3 TRP 79 HB3 TRP 79 -4.860 9.245 -8.006
593 HD1 TRP 79 HD1 TRP 79 -4.819 8.504 -10.605
594 HE1 TRP 79 HE1 TRP 79 -5.629 9.718 -12.724
595 HE3 TRP 79 HE3 TRP 79 -7.833 12.010 -8.422
596 HZ2 TRP 79 HZ2 TRP 79 -7.318 11.887 -13.378
597 HZ3 TRP 79 HZ3 TRP 79 -9.009 13.616 -9.859
598 HH2 TRP 79 HH2 TRP 79 -8.755 13.558 -12.292
599 H ALA 80 H ALA 80 -8.312 8.324 -5.659
600 HA ALA 80 HA ALA 80 -10.384 9.914 -5.645
601 HB1 ALA 80 HB1 ALA 80 -12.211 8.835 -7.000
602 HB2 ALA 80 HB2 ALA 80 -10.960 7.891 -7.812
603 HB3 ALA 80 HB3 ALA 80 -10.980 9.646 -7.969
604 H LYS 81 H LYS 81 -11.583 9.235 -3.874
605 HA LYS 81 HA LYS 81 -11.854 6.341 -3.564
606 HB2 LYS 81 HB2 LYS 81 -11.180 6.331 -1.256
607 HB3 LYS 81 HB3 LYS 81 -9.883 6.975 -2.248
608 HG2 LYS 81 HG2 LYS 81 -9.923 8.960 -1.226
609 HG3 LYS 81 HG3 LYS 81 -11.686 8.991 -1.128
610 HD2 LYS 81 HD2 LYS 81 -11.467 7.213 0.674
611 HD3 LYS 81 HD3 LYS 81 -9.744 7.597 0.695
612 HE2 LYS 81 HE2 LYS 81 -10.203 9.874 1.301
613 HE3 LYS 81 HE3 LYS 81 -11.937 9.617 1.106
614 HZ1 LYS 81 HZ1 LYS 81 -11.500 9.510 3.402
615 HZ2 LYS 81 HZ2 LYS 81 -10.156 8.498 3.193
616 HZ3 LYS 81 HZ3 LYS 81 -11.717 7.896 2.912
617 HA PRO 82 HA PRO 82 -15.977 7.793 -2.372
618 HB2 PRO 82 HB2 PRO 82 -17.092 5.389 -3.057
619 HB3 PRO 82 HB3 PRO 82 -16.942 6.745 -4.180
620 HG2 PRO 82 HG2 PRO 82 -15.227 4.309 -3.908
621 HG3 PRO 82 HG3 PRO 82 -15.774 5.145 -5.369
622 HD2 PRO 82 HD2 PRO 82 -13.279 5.440 -4.357
623 HD3 PRO 82 HD3 PRO 82 -14.120 6.741 -5.227
624 H LYS 83 H LYS 83 -16.524 7.506 -0.275
625 HA LYS 83 HA LYS 83 -15.245 5.600 1.368
626 HB2 LYS 83 HB2 LYS 83 -16.637 6.252 3.161
627 HB3 LYS 83 HB3 LYS 83 -16.176 7.685 2.288
628 HG2 LYS 83 HG2 LYS 83 -18.848 6.320 2.308
629 HG3 LYS 83 HG3 LYS 83 -18.445 7.908 2.942
630 HD2 LYS 83 HD2 LYS 83 -17.796 8.392 0.453
631 HD3 LYS 83 HD3 LYS 83 -18.847 7.017 0.132
632 HE2 LYS 83 HE2 LYS 83 -19.648 9.412 1.752
633 HE3 LYS 83 HE3 LYS 83 -20.019 9.207 0.040
634 HZ1 LYS 83 HZ1 LYS 83 -20.954 7.533 2.308
635 HZ2 LYS 83 HZ2 LYS 83 -21.171 7.115 0.677
636 HZ3 LYS 83 HZ3 LYS 83 -21.897 8.519 1.296
637 H GLU 84 H GLU 84 -17.827 5.275 -0.787
638 HA GLU 84 HA GLU 84 -19.259 3.152 0.307
639 HB2 GLU 84 HB2 GLU 84 -18.500 3.823 -2.511
640 HB3 GLU 84 HB3 GLU 84 -19.386 2.350 -2.147
641 HG2 GLU 84 HG2 GLU 84 -20.912 4.070 -2.788
642 HG3 GLU 84 HG3 GLU 84 -21.143 3.690 -1.090
643 H LEU 85 H LEU 85 -16.087 3.184 -1.234
644 HA LEU 85 HA LEU 85 -15.780 0.329 -1.221
645 HB2 LEU 85 HB2 LEU 85 -13.688 2.480 -1.507
646 HB3 LEU 85 HB3 LEU 85 -13.488 0.783 -1.893
647 HG LEU 85 HG LEU 85 -15.390 2.648 -3.308
648 HD11 LEU 85 HD11 LEU 85 -12.784 1.523 -4.295
649 HD12 LEU 85 HD12 LEU 85 -12.961 3.130 -3.589
650 HD13 LEU 85 HD13 LEU 85 -13.816 2.722 -5.082
651 HD21 LEU 85 HD21 LEU 85 -15.575 0.830 -4.934
652 HD22 LEU 85 HD22 LEU 85 -16.118 0.319 -3.335
653 HD23 LEU 85 HD23 LEU 85 -14.533 -0.177 -3.928
654 H GLU 86 H GLU 86 -14.323 2.992 0.635
655 HA GLU 86 HA GLU 86 -13.004 1.442 2.557
656 HB2 GLU 86 HB2 GLU 86 -14.295 4.153 2.930
657 HB3 GLU 86 HB3 GLU 86 -13.121 3.428 4.019
658 HG2 GLU 86 HG2 GLU 86 -11.533 3.366 2.055
659 HG3 GLU 86 HG3 GLU 86 -12.697 4.376 1.201
660 H ASP 87 H ASP 87 -16.306 2.520 2.338
661 HA ASP 87 HA ASP 87 -18.221 1.513 2.976
662 HB2 ASP 87 HB2 ASP 87 -17.098 -0.660 2.759
663 HB3 ASP 87 HB3 ASP 87 -16.482 -0.512 4.401
664 H LEU 88 H LEU 88 -16.045 2.977 4.981
665 HA LEU 88 HA LEU 88 -17.608 3.775 7.062
666 HB2 LEU 88 HB2 LEU 88 -18.110 1.435 7.555
667 HB3 LEU 88 HB3 LEU 88 -16.403 1.063 7.654
668 HG LEU 88 HG LEU 88 -16.209 2.440 9.673
669 HD11 LEU 88 HD11 LEU 88 -19.135 2.919 9.208
670 HD12 LEU 88 HD12 LEU 88 -17.839 4.103 9.405
671 HD13 LEU 88 HD13 LEU 88 -18.366 3.135 10.780
672 HD21 LEU 88 HD21 LEU 88 -17.479 0.979 11.167
673 HD22 LEU 88 HD22 LEU 88 -16.679 0.067 9.887
674 HD23 LEU 88 HD23 LEU 88 -18.410 0.388 9.791
675 H GLU 89 H GLU 89 -14.755 1.843 7.730
676 HA GLU 89 HA GLU 89 -13.265 4.331 8.255
677 HB2 GLU 89 HB2 GLU 89 -13.018 1.703 9.733
678 HB3 GLU 89 HB3 GLU 89 -12.198 3.208 10.126
679 HG2 GLU 89 HG2 GLU 89 -15.182 2.820 10.210
680 HG3 GLU 89 HG3 GLU 89 -14.115 2.681 11.605
681 H GLY 90 H GLY 90 -13.486 1.994 6.107
682 HA2 GLY 90 HA2 GLY 90 -11.892 1.437 4.465
683 HA3 GLY 90 HA3 GLY 90 -10.614 1.897 5.585
684 H LEU 91 H LEU 91 -13.350 -0.341 5.944
685 HA LEU 91 HA LEU 91 -11.550 -2.585 6.120
686 HB2 LEU 91 HB2 LEU 91 -12.487 -3.267 8.324
687 HB3 LEU 91 HB3 LEU 91 -11.435 -1.868 8.353
688 HG LEU 91 HG LEU 91 -13.694 -0.536 8.237
689 HD11 LEU 91 HD11 LEU 91 -14.564 -3.139 9.482
690 HD12 LEU 91 HD12 LEU 91 -15.142 -2.475 7.955
691 HD13 LEU 91 HD13 LEU 91 -15.489 -1.638 9.469
692 HD21 LEU 91 HD21 LEU 91 -13.618 -0.328 10.612
693 HD22 LEU 91 HD22 LEU 91 -11.971 -0.554 10.014
694 HD23 LEU 91 HD23 LEU 91 -12.825 -1.898 10.773
695 H GLU 92 H GLU 92 -12.674 -4.643 6.173
696 HA GLU 92 HA GLU 92 -15.214 -4.529 4.757
697 HB2 GLU 92 HB2 GLU 92 -13.395 -5.958 3.908
698 HB3 GLU 92 HB3 GLU 92 -13.388 -6.850 5.419
699 HG2 GLU 92 HG2 GLU 92 -14.537 -8.160 3.814
700 HG3 GLU 92 HG3 GLU 92 -15.728 -7.543 4.954
Start of MODEL 5
1 H1 GLY 1 H1 GLY 1 19.997 2.869 -11.907
2 H2 GLY 1 H2 GLY 1 19.286 1.546 -11.120
3 H3 GLY 1 H3 GLY 1 20.709 1.333 -12.022
4 HA2 GLY 1 HA3 GLY 1 21.916 2.770 -10.487
5 HA3 GLY 1 HA2 GLY 1 20.449 2.920 -9.528
6 H SER 2 H SER 2 23.054 1.851 -8.766
7 HA SER 2 HA SER 2 22.424 -0.989 -8.350
8 HB2 SER 2 HB2 SER 2 24.664 -0.327 -9.313
9 HB3 SER 2 HB3 SER 2 25.031 0.442 -7.770
10 HG SER 2 HG SER 2 24.946 -1.553 -6.768
11 H ASP 3 H ASP 3 22.946 2.060 -6.697
12 HA ASP 3 HA ASP 3 22.714 0.780 -4.089
13 HB2 ASP 3 HB2 ASP 3 23.123 2.986 -3.137
14 HB3 ASP 3 HB3 ASP 3 24.344 2.611 -4.345
15 H VAL 4 H VAL 4 21.137 1.358 -2.576
16 HA VAL 4 HA VAL 4 18.979 1.366 -1.917
17 HB VAL 4 HB VAL 4 17.795 3.456 -2.104
18 HG11 VAL 4 HG11 VAL 4 19.651 3.326 -0.545
19 HG12 VAL 4 HG12 VAL 4 19.499 4.957 -1.198
20 HG13 VAL 4 HG13 VAL 4 20.763 3.881 -1.797
21 HG21 VAL 4 HG21 VAL 4 19.850 4.315 -4.144
22 HG22 VAL 4 HG22 VAL 4 18.561 5.315 -3.471
23 HG23 VAL 4 HG23 VAL 4 18.163 3.930 -4.488
24 H ALA 5 H ALA 5 19.365 -0.019 -4.465
25 HA ALA 5 HA ALA 5 16.875 0.482 -5.851
26 HB1 ALA 5 HB1 ALA 5 19.044 -1.522 -6.454
27 HB2 ALA 5 HB2 ALA 5 18.885 0.073 -7.187
28 HB3 ALA 5 HB3 ALA 5 17.657 -1.157 -7.480
29 H ALA 6 H ALA 6 18.485 -2.510 -4.829
30 HA ALA 6 HA ALA 6 17.715 -4.454 -3.958
31 HB1 ALA 6 HB1 ALA 6 16.291 -4.287 -2.008
32 HB2 ALA 6 HB2 ALA 6 15.835 -2.643 -2.452
33 HB3 ALA 6 HB3 ALA 6 17.498 -3.002 -1.992
34 H GLY 7 H GLY 7 16.901 -4.659 -6.258
35 HA2 GLY 7 HA2 GLY 7 15.299 -5.946 -7.373
36 HA3 GLY 7 HA3 GLY 7 14.152 -5.593 -6.092
37 H THR 8 H THR 8 13.838 -2.997 -5.977
38 HA THR 8 HA THR 8 12.916 -1.157 -6.935
39 HB THR 8 HB THR 8 13.958 -2.177 -9.589
40 HG1 THR 8 HG1 THR 8 15.750 -0.893 -9.150
41 HG21 THR 8 HG21 THR 8 13.770 0.164 -10.297
42 HG22 THR 8 HG22 THR 8 13.086 0.587 -8.727
43 HG23 THR 8 HG23 THR 8 12.200 -0.480 -9.816
44 H ALA 9 H ALA 9 12.440 -4.120 -8.797
45 HA ALA 9 HA ALA 9 9.537 -3.672 -8.528
46 HB1 ALA 9 HB1 ALA 9 9.245 -5.131 -10.494
47 HB2 ALA 9 HB2 ALA 9 10.996 -5.232 -10.670
48 HB3 ALA 9 HB3 ALA 9 10.176 -3.685 -10.884
49 H SER 10 H SER 10 11.289 -4.648 -6.568
50 HA SER 10 HA SER 10 11.781 -7.388 -6.585
51 HB2 SER 10 HB2 SER 10 12.828 -5.690 -5.055
52 HB3 SER 10 HB3 SER 10 11.334 -5.698 -4.119
53 HG SER 10 HG SER 10 12.413 -7.234 -3.110
54 H GLY 11 H GLY 11 9.109 -5.635 -4.955
55 HA2 GLY 11 HA2 GLY 11 7.777 -8.262 -4.707
56 HA3 GLY 11 HA3 GLY 11 7.513 -6.908 -3.621
57 H ALA 12 H ALA 12 5.741 -8.591 -5.456
58 HA ALA 12 HA ALA 12 4.440 -6.312 -6.790
59 HB1 ALA 12 HB1 ALA 12 4.413 -9.230 -7.532
60 HB2 ALA 12 HB2 ALA 12 5.086 -7.886 -8.452
61 HB3 ALA 12 HB3 ALA 12 3.344 -8.023 -8.246
62 H LYS 13 H LYS 13 1.970 -7.680 -7.221
63 HA LYS 13 HA LYS 13 -0.062 -7.919 -6.236
64 HB2 LYS 13 HB2 LYS 13 1.368 -8.455 -3.637
65 HB3 LYS 13 HB3 LYS 13 -0.269 -8.932 -4.074
66 HG2 LYS 13 HG2 LYS 13 0.534 -10.529 -5.650
67 HG3 LYS 13 HG3 LYS 13 2.193 -9.924 -5.492
68 HD2 LYS 13 HD2 LYS 13 0.667 -11.056 -3.155
69 HD3 LYS 13 HD3 LYS 13 1.591 -12.086 -4.250
70 HE2 LYS 13 HE2 LYS 13 2.764 -9.720 -2.777
71 HE3 LYS 13 HE3 LYS 13 2.813 -11.378 -2.178
72 HZ1 LYS 13 HZ1 LYS 13 4.837 -10.646 -3.413
73 HZ2 LYS 13 HZ2 LYS 13 3.899 -10.598 -4.823
74 HZ3 LYS 13 HZ3 LYS 13 4.118 -12.061 -4.003
75 H SER 14 H SER 14 2.316 -6.077 -4.741
76 HA SER 14 HA SER 14 0.758 -3.711 -4.609
77 HB2 SER 14 HB2 SER 14 1.279 -3.422 -2.079
78 HB3 SER 14 HB3 SER 14 -0.095 -4.430 -2.532
79 HG SER 14 HG SER 14 1.026 -6.220 -2.026
80 H MET 15 H MET 15 2.356 -3.021 -5.950
81 HA MET 15 HA MET 15 4.904 -4.059 -6.033
82 HB2 MET 15 HB2 MET 15 3.962 -1.400 -7.113
83 HB3 MET 15 HB3 MET 15 5.417 -2.252 -7.617
84 HG2 MET 15 HG2 MET 15 4.134 -4.045 -8.527
85 HG3 MET 15 HG3 MET 15 2.645 -3.381 -7.859
86 HE1 MET 15 HE1 MET 15 1.392 -3.508 -10.161
87 HE2 MET 15 HE2 MET 15 2.826 -4.281 -10.832
88 HE3 MET 15 HE3 MET 15 2.078 -2.927 -11.678
89 H TRP 16 H TRP 16 6.440 -3.930 -4.614
90 HA TRP 16 HA TRP 16 6.996 -1.349 -3.366
91 HB2 TRP 16 HB2 TRP 16 6.894 -2.141 -1.182
92 HB3 TRP 16 HB3 TRP 16 5.562 -2.997 -1.935
93 HD1 TRP 16 HD1 TRP 16 9.051 -3.569 -0.476
94 HE1 TRP 16 HE1 TRP 16 9.360 -6.085 -0.012
95 HE3 TRP 16 HE3 TRP 16 4.795 -5.343 -2.700
96 HZ2 TRP 16 HZ2 TRP 16 7.997 -8.483 -0.528
97 HZ3 TRP 16 HZ3 TRP 16 4.383 -7.768 -2.667
98 HH2 TRP 16 HH2 TRP 16 5.952 -9.305 -1.603
99 H THR 17 H THR 17 9.044 -0.900 -2.972
100 HA THR 17 HA THR 17 11.077 -2.930 -3.616
101 HB THR 17 HB THR 17 12.628 -1.121 -3.922
102 HG1 THR 17 HG1 THR 17 11.159 0.138 -2.162
103 HG21 THR 17 HG21 THR 17 10.664 -1.548 -5.585
104 HG22 THR 17 HG22 THR 17 11.755 -0.182 -5.830
105 HG23 THR 17 HG23 THR 17 10.167 0.075 -5.101
106 H GLU 18 H GLU 18 12.662 -3.387 -2.064
107 HA GLU 18 HA GLU 18 11.811 -2.724 0.653
108 HB2 GLU 18 HB2 GLU 18 12.204 -5.101 -0.030
109 HB3 GLU 18 HB3 GLU 18 13.905 -4.713 -0.240
110 HG2 GLU 18 HG2 GLU 18 14.137 -4.235 2.104
111 HG3 GLU 18 HG3 GLU 18 12.402 -4.437 2.353
112 H HIS 19 H HIS 19 12.822 -1.248 1.828
113 HA HIS 19 HA HIS 19 15.607 -0.551 1.171
114 HB2 HIS 19 HB2 HIS 19 13.311 1.380 1.555
115 HB3 HIS 19 HB3 HIS 19 14.998 1.862 1.657
116 HD1 HIS 19 HD1 HIS 19 12.774 2.802 -0.461
117 HD2 HIS 19 HD2 HIS 19 15.938 0.182 -1.099
118 HE1 HIS 19 HE1 HIS 19 13.239 2.887 -2.934
119 HE2 HIS 19 HE2 HIS 19 15.321 1.499 -3.233
120 H LYS 20 H LYS 20 16.879 -0.188 2.962
121 HA LYS 20 HA LYS 20 15.427 -0.082 5.514
122 HB2 LYS 20 HB2 LYS 20 16.793 -1.603 6.478
123 HB3 LYS 20 HB3 LYS 20 17.026 -2.119 4.818
124 HG2 LYS 20 HG2 LYS 20 18.875 -0.029 5.650
125 HG3 LYS 20 HG3 LYS 20 19.004 -1.506 6.601
126 HD2 LYS 20 HD2 LYS 20 20.518 -1.656 4.763
127 HD3 LYS 20 HD3 LYS 20 19.193 -2.781 4.474
128 HE2 LYS 20 HE2 LYS 20 19.649 -1.677 2.414
129 HE3 LYS 20 HE3 LYS 20 18.132 -1.028 3.037
130 HZ1 LYS 20 HZ1 LYS 20 19.152 0.969 3.630
131 HZ2 LYS 20 HZ2 LYS 20 19.852 0.604 2.127
132 HZ3 LYS 20 HZ3 LYS 20 20.716 0.321 3.559
133 H SER 21 H SER 21 15.917 1.436 6.940
134 HA SER 21 HA SER 21 17.615 3.635 6.297
135 HB2 SER 21 HB2 SER 21 15.585 3.714 7.814
136 HB3 SER 21 HB3 SER 21 16.509 2.801 9.003
137 HG SER 21 HG SER 21 16.728 5.460 8.229
138 HA PRO 22 HA PRO 22 21.616 2.119 7.255
139 HB2 PRO 22 HB2 PRO 22 21.937 4.507 9.012
140 HB3 PRO 22 HB3 PRO 22 22.976 3.919 7.708
141 HG2 PRO 22 HG2 PRO 22 21.389 6.002 7.309
142 HG3 PRO 22 HG3 PRO 22 21.592 4.772 6.047
143 HD2 PRO 22 HD2 PRO 22 19.299 5.219 7.909
144 HD3 PRO 22 HD3 PRO 22 19.293 4.701 6.211
145 H ASP 23 H ASP 23 19.420 2.710 9.843
146 HA ASP 23 HA ASP 23 21.161 1.557 11.859
147 HB2 ASP 23 HB2 ASP 23 18.363 2.665 11.924
148 HB3 ASP 23 HB3 ASP 23 19.064 1.827 13.305
149 H GLY 24 H GLY 24 19.292 0.273 9.444
150 HA2 GLY 24 HA2 GLY 24 19.218 -2.090 9.156
151 HA3 GLY 24 HA3 GLY 24 19.170 -2.277 10.903
152 H ARG 25 H ARG 25 17.042 0.149 10.101
153 HA ARG 25 HA ARG 25 14.790 -1.653 10.458
154 HB2 ARG 25 HB2 ARG 25 15.329 1.104 11.039
155 HB3 ARG 25 HB3 ARG 25 13.860 0.984 10.081
156 HG2 ARG 25 HG2 ARG 25 13.567 0.926 12.581
157 HG3 ARG 25 HG3 ARG 25 12.807 -0.389 11.683
158 HD2 ARG 25 HD2 ARG 25 14.566 -1.896 12.270
159 HD3 ARG 25 HD3 ARG 25 15.518 -0.593 12.974
160 HE ARG 25 HE ARG 25 13.544 -0.417 14.595
161 HH11 ARG 25 HH11 ARG 25 14.603 -3.423 13.122
162 HH12 ARG 25 HH12 ARG 25 14.107 -4.403 14.471
163 HH21 ARG 25 HH21 ARG 25 12.905 -1.702 16.360
164 HH22 ARG 25 HH22 ARG 25 13.121 -3.425 16.308
165 H THR 26 H THR 26 13.645 -2.443 8.832
166 HA THR 26 HA THR 26 14.116 -1.323 6.165
167 HB THR 26 HB THR 26 12.686 -3.805 6.075
168 HG1 THR 26 HG1 THR 26 13.522 -4.675 7.842
169 HG21 THR 26 HG21 THR 26 14.172 -2.824 4.329
170 HG22 THR 26 HG22 THR 26 14.553 -4.501 4.721
171 HG23 THR 26 HG23 THR 26 15.552 -3.197 5.361
172 H TYR 27 H TYR 27 12.583 -0.338 5.083
173 HA TYR 27 HA TYR 27 9.769 -0.859 5.752
174 HB2 TYR 27 HB2 TYR 27 9.525 1.601 4.784
175 HB3 TYR 27 HB3 TYR 27 9.849 1.322 6.488
176 HD1 TYR 27 HD1 TYR 27 11.618 1.939 3.265
177 HD2 TYR 27 HD2 TYR 27 11.646 2.402 7.490
178 HE1 TYR 27 HE1 TYR 27 13.628 3.344 3.091
179 HE2 TYR 27 HE2 TYR 27 13.662 3.802 7.331
180 HH TYR 27 HH TYR 27 14.746 5.145 4.468
181 H TYR 28 H TYR 28 8.459 0.233 3.761
182 HA TYR 28 HA TYR 28 9.666 -0.995 1.377
183 HB2 TYR 28 HB2 TYR 28 6.756 -1.128 2.172
184 HB3 TYR 28 HB3 TYR 28 7.506 -1.915 0.783
185 HD1 TYR 28 HD2 TYR 28 9.589 -3.456 1.446
186 HD2 TYR 28 HD1 TYR 28 6.386 -2.429 4.046
187 HE1 TYR 28 HE2 TYR 28 10.093 -5.420 2.831
188 HE2 TYR 28 HE1 TYR 28 6.888 -4.388 5.443
189 HH TYR 28 HH TYR 28 9.766 -6.236 5.059
190 H TYR 29 H TYR 29 9.200 -0.045 -0.613
191 HA TYR 29 HA TYR 29 7.716 2.487 -0.454
192 HB2 TYR 29 HB2 TYR 29 9.795 3.270 -0.998
193 HB3 TYR 29 HB3 TYR 29 10.253 1.788 -1.818
194 HD1 TYR 29 HD1 TYR 29 7.631 4.449 -2.368
195 HD2 TYR 29 HD2 TYR 29 10.731 2.065 -3.980
196 HE1 TYR 29 HE1 TYR 29 7.291 5.519 -4.564
197 HE2 TYR 29 HE2 TYR 29 10.416 3.115 -6.185
198 HH TYR 29 HH TYR 29 8.775 5.926 -6.659
199 H ASN 30 H ASN 30 5.893 2.499 -1.473
200 HA ASN 30 HA ASN 30 5.313 0.412 -3.432
201 HB2 ASN 30 HB2 ASN 30 3.574 2.343 -1.895
202 HB3 ASN 30 HB3 ASN 30 2.953 1.440 -3.270
203 HD21 ASN 30 HD21 ASN 30 1.491 0.249 -2.165
204 HD22 ASN 30 HD22 ASN 30 1.912 -0.932 -0.979
205 H THR 31 H THR 31 5.709 0.868 -5.473
206 HA THR 31 HA THR 31 6.236 3.502 -6.409
207 HB THR 31 HB THR 31 6.548 2.488 -8.576
208 HG1 THR 31 HG1 THR 31 5.811 0.429 -9.041
209 HG21 THR 31 HG21 THR 31 7.454 0.801 -6.260
210 HG22 THR 31 HG22 THR 31 8.362 2.052 -7.116
211 HG23 THR 31 HG23 THR 31 8.010 0.516 -7.913
212 H GLU 32 H GLU 32 3.450 1.688 -5.965
213 HA GLU 32 HA GLU 32 1.728 2.640 -7.962
214 HB2 GLU 32 HB2 GLU 32 0.265 2.207 -5.578
215 HB3 GLU 32 HB3 GLU 32 0.424 1.129 -6.956
216 HG2 GLU 32 HG2 GLU 32 2.530 0.276 -5.936
217 HG3 GLU 32 HG3 GLU 32 2.159 1.234 -4.510
218 H THR 33 H THR 33 2.298 3.656 -4.648
219 HA THR 33 HA THR 33 0.753 6.109 -5.071
220 HB THR 33 HB THR 33 0.794 6.309 -2.607
221 HG1 THR 33 HG1 THR 33 1.646 4.295 -1.523
222 HG21 THR 33 HG21 THR 33 -0.015 3.560 -3.585
223 HG22 THR 33 HG22 THR 33 -1.011 5.019 -3.651
224 HG23 THR 33 HG23 THR 33 -0.570 4.324 -2.090
225 H LYS 34 H LYS 34 3.863 4.965 -5.085
226 HA LYS 34 HA LYS 34 5.910 5.911 -5.233
227 HB2 LYS 34 HB2 LYS 34 4.310 8.463 -5.367
228 HB3 LYS 34 HB3 LYS 34 6.060 8.401 -5.557
229 HG2 LYS 34 HG2 LYS 34 4.346 6.657 -7.237
230 HG3 LYS 34 HG3 LYS 34 4.497 8.372 -7.645
231 HD2 LYS 34 HD2 LYS 34 6.952 8.101 -7.688
232 HD3 LYS 34 HD3 LYS 34 6.747 6.381 -7.350
233 HE2 LYS 34 HE2 LYS 34 5.560 6.071 -9.422
234 HE3 LYS 34 HE3 LYS 34 5.590 7.804 -9.741
235 HZ1 LYS 34 HZ1 LYS 34 8.013 7.690 -9.878
236 HZ2 LYS 34 HZ2 LYS 34 7.280 6.676 -11.020
237 HZ3 LYS 34 HZ3 LYS 34 7.963 6.014 -9.616
238 H GLN 35 H GLN 35 4.533 5.403 -2.692
239 HA GLN 35 HA GLN 35 5.861 7.391 -0.960
240 HB2 GLN 35 HB2 GLN 35 3.434 5.684 -0.431
241 HB3 GLN 35 HB3 GLN 35 4.222 6.691 0.776
242 HG2 GLN 35 HG2 GLN 35 3.774 8.661 -0.654
243 HG3 GLN 35 HG3 GLN 35 2.862 7.610 -1.740
244 HE21 GLN 35 HE21 GLN 35 2.054 9.903 -0.060
245 HE22 GLN 35 HE22 GLN 35 0.756 9.315 0.920
246 H SER 36 H SER 36 6.745 6.636 1.047
247 HA SER 36 HA SER 36 7.486 3.796 1.008
248 HB2 SER 36 HB2 SER 36 9.347 5.529 1.023
249 HB3 SER 36 HB3 SER 36 8.809 5.976 2.643
250 HG SER 36 HG SER 36 9.159 3.275 2.312
251 H THR 37 H THR 37 6.882 2.524 2.698
252 HA THR 37 HA THR 37 5.233 3.667 4.809
253 HB THR 37 HB THR 37 3.784 3.285 2.774
254 HG1 THR 37 HG1 THR 37 2.595 3.228 4.586
255 HG21 THR 37 HG21 THR 37 4.592 0.420 3.301
256 HG22 THR 37 HG22 THR 37 4.778 1.346 1.807
257 HG23 THR 37 HG23 THR 37 3.171 0.873 2.353
258 H TRP 38 H TRP 38 4.495 1.951 6.306
259 HA TRP 38 HA TRP 38 6.642 0.139 6.909
260 HB2 TRP 38 HB2 TRP 38 4.789 -0.574 8.698
261 HB3 TRP 38 HB3 TRP 38 5.801 0.848 8.898
262 HD1 TRP 38 HD1 TRP 38 4.412 2.752 9.835
263 HE1 TRP 38 HE1 TRP 38 2.039 3.683 9.490
264 HE3 TRP 38 HE3 TRP 38 2.684 -0.642 6.403
265 HZ2 TRP 38 HZ2 TRP 38 -0.250 3.065 7.985
266 HZ3 TRP 38 HZ3 TRP 38 0.379 -0.395 5.576
267 HH2 TRP 38 HH2 TRP 38 -1.053 1.423 6.348
268 H GLU 39 H GLU 39 5.888 -2.175 7.672
269 HA GLU 39 HA GLU 39 5.116 -3.687 5.469
270 HB2 GLU 39 HB2 GLU 39 4.650 -5.504 7.163
271 HB3 GLU 39 HB3 GLU 39 6.252 -4.785 7.245
272 HG2 GLU 39 HG2 GLU 39 5.577 -3.424 9.129
273 HG3 GLU 39 HG3 GLU 39 3.939 -4.065 9.028
274 H LYS 40 H LYS 40 3.220 -4.059 4.525
275 HA LYS 40 HA LYS 40 0.888 -2.837 5.760
276 HB2 LYS 40 HB2 LYS 40 -0.054 -2.751 3.492
277 HB3 LYS 40 HB3 LYS 40 1.492 -1.924 3.600
278 HG2 LYS 40 HG2 LYS 40 2.002 -4.602 2.847
279 HG3 LYS 40 HG3 LYS 40 0.693 -3.990 1.833
280 HD2 LYS 40 HD2 LYS 40 2.109 -1.969 1.384
281 HD3 LYS 40 HD3 LYS 40 3.433 -2.791 2.213
282 HE2 LYS 40 HE2 LYS 40 3.264 -4.642 0.606
283 HE3 LYS 40 HE3 LYS 40 1.979 -3.781 -0.236
284 HZ1 LYS 40 HZ1 LYS 40 3.636 -1.943 -0.567
285 HZ2 LYS 40 HZ2 LYS 40 3.963 -3.372 -1.414
286 HZ3 LYS 40 HZ3 LYS 40 4.829 -3.003 -0.006
287 HA PRO 41 HA PRO 41 -1.568 -6.394 6.441
288 HB2 PRO 41 HB2 PRO 41 -3.822 -5.917 4.896
289 HB3 PRO 41 HB3 PRO 41 -3.526 -5.268 6.513
290 HG2 PRO 41 HG2 PRO 41 -3.075 -3.999 3.847
291 HG3 PRO 41 HG3 PRO 41 -3.746 -3.289 5.328
292 HD2 PRO 41 HD2 PRO 41 -1.234 -2.793 4.621
293 HD3 PRO 41 HD3 PRO 41 -1.643 -3.085 6.326
294 H ASP 42 H ASP 42 -3.229 -7.861 5.249
295 HA ASP 42 HA ASP 42 -1.825 -9.806 3.926
296 HB2 ASP 42 HB2 ASP 42 -4.789 -9.308 4.068
297 HB3 ASP 42 HB3 ASP 42 -4.067 -10.804 3.475
298 H ASP 43 H ASP 43 -2.355 -7.000 2.341
299 HA ASP 43 HA ASP 43 -3.324 -7.752 -0.175
300 HB2 ASP 43 HB2 ASP 43 -1.192 -5.739 0.532
301 HB3 ASP 43 HB3 ASP 43 -1.977 -5.846 -1.035
302 H LEU 44 H LEU 44 -0.195 -8.113 1.320
303 HA LEU 44 HA LEU 44 1.206 -8.972 -1.005
304 HB2 LEU 44 HB2 LEU 44 1.923 -9.745 1.805
305 HB3 LEU 44 HB3 LEU 44 2.980 -9.505 0.418
306 HG LEU 44 HG LEU 44 1.437 -7.141 1.255
307 HD11 LEU 44 HD11 LEU 44 3.663 -8.269 2.951
308 HD12 LEU 44 HD12 LEU 44 1.984 -8.031 3.438
309 HD13 LEU 44 HD13 LEU 44 3.009 -6.638 3.093
310 HD21 LEU 44 HD21 LEU 44 3.581 -6.046 0.813
311 HD22 LEU 44 HD22 LEU 44 3.055 -7.042 -0.546
312 HD23 LEU 44 HD23 LEU 44 4.322 -7.623 0.538
313 H LYS 45 H LYS 45 -0.965 -10.431 1.199
314 HA LYS 45 HA LYS 45 -0.188 -13.154 0.745
315 HB2 LYS 45 HB2 LYS 45 -2.860 -12.284 1.804
316 HB3 LYS 45 HB3 LYS 45 -1.907 -13.698 2.236
317 HG2 LYS 45 HG2 LYS 45 -0.784 -11.012 2.849
318 HG3 LYS 45 HG3 LYS 45 -2.116 -11.612 3.829
319 HD2 LYS 45 HD2 LYS 45 0.193 -13.401 3.309
320 HD3 LYS 45 HD3 LYS 45 0.355 -12.112 4.507
321 HE2 LYS 45 HE2 LYS 45 -1.417 -12.913 5.786
322 HE3 LYS 45 HE3 LYS 45 -1.984 -13.971 4.503
323 HZ1 LYS 45 HZ1 LYS 45 0.515 -14.294 6.082
324 HZ2 LYS 45 HZ2 LYS 45 0.032 -15.309 4.811
325 HZ3 LYS 45 HZ3 LYS 45 -0.894 -15.229 6.228
326 H THR 46 H THR 46 -3.474 -11.938 0.359
327 HA THR 46 HA THR 46 -3.693 -12.580 -2.434
328 HB THR 46 HB THR 46 -5.349 -14.323 -0.623
329 HG1 THR 46 HG1 THR 46 -3.417 -15.132 -0.066
330 HG21 THR 46 HG21 THR 46 -6.035 -14.129 -2.949
331 HG22 THR 46 HG22 THR 46 -5.490 -15.768 -2.591
332 HG23 THR 46 HG23 THR 46 -4.440 -14.661 -3.477
333 HA PRO 47 HA PRO 47 -6.832 -9.496 -2.045
334 HB2 PRO 47 HB2 PRO 47 -8.533 -11.312 -3.689
335 HB3 PRO 47 HB3 PRO 47 -8.220 -9.584 -3.895
336 HG2 PRO 47 HG2 PRO 47 -6.967 -11.309 -5.451
337 HG3 PRO 47 HG3 PRO 47 -6.065 -9.952 -4.746
338 HD2 PRO 47 HD2 PRO 47 -6.100 -12.832 -3.950
339 HD3 PRO 47 HD3 PRO 47 -4.742 -11.698 -3.992
340 H ALA 48 H ALA 48 -8.190 -12.795 -1.817
341 HA ALA 48 HA ALA 48 -10.410 -11.945 -0.263
342 HB1 ALA 48 HB1 ALA 48 -10.161 -14.052 -1.716
343 HB2 ALA 48 HB2 ALA 48 -11.099 -14.127 -0.231
344 HB3 ALA 48 HB3 ALA 48 -9.457 -14.771 -0.264
345 H GLU 49 H GLU 49 -7.185 -12.965 0.568
346 HA GLU 49 HA GLU 49 -7.720 -13.354 3.332
347 HB2 GLU 49 HB2 GLU 49 -5.136 -12.717 1.896
348 HB3 GLU 49 HB3 GLU 49 -5.243 -13.081 3.615
349 HG2 GLU 49 HG2 GLU 49 -6.255 -15.276 3.018
350 HG3 GLU 49 HG3 GLU 49 -5.940 -14.905 1.325
351 H GLN 50 H GLN 50 -7.009 -10.596 1.322
352 HA GLN 50 HA GLN 50 -6.335 -8.719 3.296
353 HB2 GLN 50 HB2 GLN 50 -7.859 -8.130 0.770
354 HB3 GLN 50 HB3 GLN 50 -6.787 -7.052 1.651
355 HG2 GLN 50 HG2 GLN 50 -4.884 -8.426 1.045
356 HG3 GLN 50 HG3 GLN 50 -5.960 -9.544 0.197
357 HE21 GLN 50 HE21 GLN 50 -4.978 -9.208 -1.799
358 HE22 GLN 50 HE22 GLN 50 -5.126 -7.726 -2.673
359 H LEU 51 H LEU 51 -9.490 -9.802 2.107
360 HA LEU 51 HA LEU 51 -10.964 -7.523 2.653
361 HB2 LEU 51 HB2 LEU 51 -12.917 -8.834 2.372
362 HB3 LEU 51 HB3 LEU 51 -11.693 -9.417 1.267
363 HG LEU 51 HG LEU 51 -11.280 -11.155 3.236
364 HD11 LEU 51 HD11 LEU 51 -14.211 -10.493 3.455
365 HD12 LEU 51 HD12 LEU 51 -12.992 -10.210 4.697
366 HD13 LEU 51 HD13 LEU 51 -13.392 -11.859 4.214
367 HD21 LEU 51 HD21 LEU 51 -12.701 -12.685 1.977
368 HD22 LEU 51 HD22 LEU 51 -11.735 -11.652 0.921
369 HD23 LEU 51 HD23 LEU 51 -13.454 -11.313 1.158
370 H LEU 52 H LEU 52 -10.067 -10.084 4.852
371 HA LEU 52 HA LEU 52 -11.874 -9.348 6.940
372 HB2 LEU 52 HB2 LEU 52 -9.258 -10.823 7.249
373 HB3 LEU 52 HB3 LEU 52 -10.615 -10.837 8.357
374 HG LEU 52 HG LEU 52 -11.907 -11.898 6.358
375 HD11 LEU 52 HD11 LEU 52 -9.126 -12.776 5.629
376 HD12 LEU 52 HD12 LEU 52 -9.951 -11.454 4.801
377 HD13 LEU 52 HD13 LEU 52 -10.636 -13.083 4.767
378 HD21 LEU 52 HD21 LEU 52 -9.806 -13.410 7.904
379 HD22 LEU 52 HD22 LEU 52 -11.210 -14.122 7.105
380 HD23 LEU 52 HD23 LEU 52 -11.431 -13.019 8.463
381 H SER 53 H SER 53 -8.567 -8.594 6.112
382 HA SER 53 HA SER 53 -8.030 -7.151 8.548
383 HB2 SER 53 HB2 SER 53 -6.398 -7.143 6.016
384 HB3 SER 53 HB3 SER 53 -5.822 -6.937 7.672
385 HG SER 53 HG SER 53 -5.419 -9.065 6.820
386 H LYS 54 H LYS 54 -7.852 -6.321 5.132
387 HA LYS 54 HA LYS 54 -9.116 -3.728 5.559
388 HB2 LYS 54 HB2 LYS 54 -6.268 -4.046 4.594
389 HB3 LYS 54 HB3 LYS 54 -7.212 -2.586 4.352
390 HG2 LYS 54 HG2 LYS 54 -6.445 -3.776 7.003
391 HG3 LYS 54 HG3 LYS 54 -5.703 -2.366 6.242
392 HD2 LYS 54 HD2 LYS 54 -8.094 -1.401 6.223
393 HD3 LYS 54 HD3 LYS 54 -8.453 -2.655 7.405
394 HE2 LYS 54 HE2 LYS 54 -7.907 -0.676 8.612
395 HE3 LYS 54 HE3 LYS 54 -6.542 -1.783 8.774
396 HZ1 LYS 54 HZ1 LYS 54 -5.434 -0.552 6.974
397 HZ2 LYS 54 HZ2 LYS 54 -5.748 0.427 8.314
398 HZ3 LYS 54 HZ3 LYS 54 -6.722 0.547 6.932
399 H CYS 55 H CYS 55 -10.170 -3.055 3.777
400 HA CYS 55 HA CYS 55 -10.678 -4.835 1.677
401 HB2 CYS 55 HB2 CYS 55 -11.722 -2.720 0.631
402 HB3 CYS 55 HB3 CYS 55 -12.349 -3.243 2.193
403 HG CYS 55 HG CYS 55 -11.623 -0.289 1.548
404 HA PRO 56 HA PRO 56 -7.610 -4.184 -1.452
405 HB2 PRO 56 HB2 PRO 56 -9.761 -3.505 -3.375
406 HB3 PRO 56 HB3 PRO 56 -8.534 -4.774 -3.455
407 HG2 PRO 56 HG2 PRO 56 -11.053 -5.382 -2.908
408 HG3 PRO 56 HG3 PRO 56 -9.721 -6.192 -2.060
409 HD2 PRO 56 HD2 PRO 56 -11.508 -3.981 -1.112
410 HD3 PRO 56 HD3 PRO 56 -10.937 -5.419 -0.239
411 H TRP 57 H TRP 57 -9.697 -1.687 -0.577
412 HA TRP 57 HA TRP 57 -7.992 0.302 -1.919
413 HB2 TRP 57 HB2 TRP 57 -10.746 0.624 -0.693
414 HB3 TRP 57 HB3 TRP 57 -9.795 1.927 -1.405
415 HD1 TRP 57 HD1 TRP 57 -9.438 1.843 -4.093
416 HE1 TRP 57 HE1 TRP 57 -10.907 0.799 -5.938
417 HE3 TRP 57 HE3 TRP 57 -12.266 -1.291 -1.208
418 HZ2 TRP 57 HZ2 TRP 57 -12.984 -1.110 -6.138
419 HZ3 TRP 57 HZ3 TRP 57 -13.967 -2.692 -2.299
420 HH2 TRP 57 HH2 TRP 57 -14.318 -2.603 -4.714
421 H LYS 58 H LYS 58 -6.695 1.555 -0.642
422 HA LYS 58 HA LYS 58 -7.202 1.536 2.223
423 HB2 LYS 58 HB2 LYS 58 -5.094 0.033 0.908
424 HB3 LYS 58 HB3 LYS 58 -4.503 1.065 2.203
425 HG2 LYS 58 HG2 LYS 58 -6.086 0.044 3.751
426 HG3 LYS 58 HG3 LYS 58 -6.727 -0.960 2.450
427 HD2 LYS 58 HD2 LYS 58 -3.898 -1.008 3.486
428 HD3 LYS 58 HD3 LYS 58 -5.151 -2.200 3.846
429 HE2 LYS 58 HE2 LYS 58 -4.275 -1.546 1.054
430 HE3 LYS 58 HE3 LYS 58 -3.498 -2.797 2.020
431 HZ1 LYS 58 HZ1 LYS 58 -5.640 -3.920 2.187
432 HZ2 LYS 58 HZ2 LYS 58 -5.156 -3.742 0.579
433 HZ3 LYS 58 HZ3 LYS 58 -6.366 -2.733 1.220
434 H GLU 59 H GLU 59 -6.360 3.161 3.371
435 HA GLU 59 HA GLU 59 -4.807 5.205 1.941
436 HB2 GLU 59 HB2 GLU 59 -7.019 6.063 2.336
437 HB3 GLU 59 HB3 GLU 59 -6.990 5.521 4.008
438 HG2 GLU 59 HG2 GLU 59 -5.125 7.119 4.407
439 HG3 GLU 59 HG3 GLU 59 -5.373 7.729 2.773
440 H TYR 60 H TYR 60 -2.839 5.489 2.769
441 HA TYR 60 HA TYR 60 -2.458 5.251 5.656
442 HB2 TYR 60 HB2 TYR 60 -0.288 4.034 5.290
443 HB3 TYR 60 HB3 TYR 60 -1.716 3.084 4.894
444 HD1 TYR 60 HD1 TYR 60 1.091 5.022 3.427
445 HD2 TYR 60 HD2 TYR 60 -2.041 2.220 2.723
446 HE1 TYR 60 HE1 TYR 60 2.019 4.537 1.207
447 HE2 TYR 60 HE2 TYR 60 -1.117 1.736 0.500
448 HH TYR 60 HH TYR 60 0.298 2.673 -1.146
449 H LYS 61 H LYS 61 -0.539 6.377 6.388
450 HA LYS 61 HA LYS 61 0.232 8.513 4.546
451 HB2 LYS 61 HB2 LYS 61 0.700 8.245 7.512
452 HB3 LYS 61 HB3 LYS 61 1.181 9.619 6.531
453 HG2 LYS 61 HG2 LYS 61 -1.271 9.862 5.943
454 HG3 LYS 61 HG3 LYS 61 -1.582 8.723 7.250
455 HD2 LYS 61 HD2 LYS 61 -0.288 11.435 7.437
456 HD3 LYS 61 HD3 LYS 61 -1.830 10.930 8.130
457 HE2 LYS 61 HE2 LYS 61 0.884 9.871 8.896
458 HE3 LYS 61 HE3 LYS 61 -0.051 11.050 9.817
459 HZ1 LYS 61 HZ1 LYS 61 -1.815 9.353 10.027
460 HZ2 LYS 61 HZ2 LYS 61 -0.368 8.908 10.783
461 HZ3 LYS 61 HZ3 LYS 61 -0.791 8.218 9.292
462 H SER 62 H SER 62 2.299 8.797 3.914
463 HA SER 62 HA SER 62 4.123 6.645 4.018
464 HB2 SER 62 HB2 SER 62 5.438 9.103 3.427
465 HB3 SER 62 HB3 SER 62 4.990 7.814 2.306
466 HG SER 62 HG SER 62 2.934 8.802 2.115
467 H ASP 63 H ASP 63 6.549 7.312 4.680
468 HA ASP 63 HA ASP 63 6.671 7.766 7.447
469 HB2 ASP 63 HB2 ASP 63 8.468 6.698 6.118
470 HB3 ASP 63 HB3 ASP 63 8.852 8.262 5.410
471 H SER 64 H SER 64 6.662 9.936 4.720
472 HA SER 64 HA SER 64 7.261 12.306 6.225
473 HB2 SER 64 HB2 SER 64 5.862 12.187 3.553
474 HB3 SER 64 HB3 SER 64 6.897 13.469 4.190
475 HG SER 64 HG SER 64 8.665 12.042 4.029
476 H GLY 65 H GLY 65 4.551 10.322 5.857
477 HA2 GLY 65 HA2 GLY 65 2.566 10.477 7.063
478 HA3 GLY 65 HA3 GLY 65 2.951 12.135 7.474
479 H LYS 66 H LYS 66 3.122 11.304 4.143
480 HA LYS 66 HA LYS 66 0.761 12.872 3.532
481 HB2 LYS 66 HB2 LYS 66 2.671 13.098 2.069
482 HB3 LYS 66 HB3 LYS 66 2.739 11.366 1.808
483 HG2 LYS 66 HG2 LYS 66 1.834 12.543 -0.124
484 HG3 LYS 66 HG3 LYS 66 0.653 11.441 0.579
485 HD2 LYS 66 HD2 LYS 66 -0.286 13.644 -0.091
486 HD3 LYS 66 HD3 LYS 66 -0.518 13.254 1.615
487 HE2 LYS 66 HE2 LYS 66 1.189 14.730 2.287
488 HE3 LYS 66 HE3 LYS 66 1.784 14.923 0.635
489 HZ1 LYS 66 HZ1 LYS 66 -0.861 15.858 1.624
490 HZ2 LYS 66 HZ2 LYS 66 -0.245 16.078 0.059
491 HZ3 LYS 66 HZ3 LYS 66 0.500 16.843 1.379
492 H THR 67 H THR 67 -1.269 11.976 3.456
493 HA THR 67 HA THR 67 -1.538 9.101 3.381
494 HB THR 67 HB THR 67 -4.083 10.108 2.978
495 HG1 THR 67 HG1 THR 67 -3.555 11.657 5.099
496 HG21 THR 67 HG21 THR 67 -3.214 8.309 4.484
497 HG22 THR 67 HG22 THR 67 -4.469 9.339 5.190
498 HG23 THR 67 HG23 THR 67 -2.779 9.574 5.642
499 H TYR 68 H TYR 68 -1.928 7.884 1.710
500 HA TYR 68 HA TYR 68 -3.107 9.112 -0.687
501 HB2 TYR 68 HB2 TYR 68 -0.610 7.653 -0.476
502 HB3 TYR 68 HB3 TYR 68 -1.723 6.854 -1.581
503 HD1 TYR 68 HD2 TYR 68 -0.065 10.104 -0.876
504 HD2 TYR 68 HD1 TYR 68 -2.046 7.673 -3.752
505 HE1 TYR 68 HE2 TYR 68 0.557 11.699 -2.649
506 HE2 TYR 68 HE1 TYR 68 -1.430 9.255 -5.529
507 HH TYR 68 HH TYR 68 0.893 11.657 -5.141
508 H TYR 69 H TYR 69 -4.611 7.890 -1.742
509 HA TYR 69 HA TYR 69 -5.550 5.493 -0.301
510 HB2 TYR 69 HB2 TYR 69 -6.967 7.604 -0.169
511 HB3 TYR 69 HB3 TYR 69 -7.206 7.455 -1.903
512 HD1 TYR 69 HD2 TYR 69 -8.588 5.640 -2.818
513 HD2 TYR 69 HD1 TYR 69 -8.070 6.179 1.381
514 HE1 TYR 69 HE2 TYR 69 -10.550 4.220 -2.404
515 HE2 TYR 69 HE1 TYR 69 -10.050 4.757 1.800
516 HH TYR 69 HH TYR 69 -11.274 2.796 0.377
517 H TYR 70 H TYR 70 -5.539 3.661 -1.597
518 HA TYR 70 HA TYR 70 -5.358 4.204 -4.478
519 HB2 TYR 70 HB2 TYR 70 -3.511 2.703 -4.760
520 HB3 TYR 70 HB3 TYR 70 -3.083 3.834 -3.481
521 HD1 TYR 70 HD2 TYR 70 -3.350 3.036 -1.061
522 HD2 TYR 70 HD1 TYR 70 -3.446 0.393 -4.393
523 HE1 TYR 70 HE2 TYR 70 -2.896 1.139 0.440
524 HE2 TYR 70 HE1 TYR 70 -2.994 -1.511 -2.907
525 HH TYR 70 HH TYR 70 -2.133 -2.017 -0.793
526 H ASN 71 H ASN 71 -6.152 2.781 -5.850
527 HA ASN 71 HA ASN 71 -7.839 0.645 -4.790
528 HB2 ASN 71 HB2 ASN 71 -7.435 1.217 -7.721
529 HB3 ASN 71 HB3 ASN 71 -8.859 0.580 -6.912
530 HD21 ASN 71 HD21 ASN 71 -7.135 3.414 -7.864
531 HD22 ASN 71 HD22 ASN 71 -8.372 4.552 -7.468
532 H SER 72 H SER 72 -6.626 -1.155 -4.289
533 HA SER 72 HA SER 72 -4.075 -1.564 -5.473
534 HB2 SER 72 HB2 SER 72 -4.655 -2.186 -3.126
535 HB3 SER 72 HB3 SER 72 -5.619 -3.511 -3.760
536 HG SER 72 HG SER 72 -3.549 -4.239 -3.216
537 H GLN 73 H GLN 73 -7.245 -3.044 -6.036
538 HA GLN 73 HA GLN 73 -6.307 -5.238 -7.518
539 HB2 GLN 73 HB2 GLN 73 -8.594 -5.392 -8.436
540 HB3 GLN 73 HB3 GLN 73 -8.564 -5.273 -6.686
541 HG2 GLN 73 HG2 GLN 73 -9.000 -2.857 -8.399
542 HG3 GLN 73 HG3 GLN 73 -10.326 -3.955 -8.028
543 HE21 GLN 73 HE21 GLN 73 -8.210 -1.509 -6.830
544 HE22 GLN 73 HE22 GLN 73 -8.971 -1.319 -5.283
545 H THR 74 H THR 74 -6.954 -1.937 -8.454
546 HA THR 74 HA THR 74 -6.449 -2.661 -11.252
547 HB THR 74 HB THR 74 -7.504 -0.409 -11.728
548 HG1 THR 74 HG1 THR 74 -8.957 -0.184 -9.525
549 HG21 THR 74 HG21 THR 74 -9.072 -2.584 -10.333
550 HG22 THR 74 HG22 THR 74 -8.793 -2.398 -12.069
551 HG23 THR 74 HG23 THR 74 -9.822 -1.248 -11.213
552 H LYS 75 H LYS 75 -5.063 -1.318 -8.578
553 HA LYS 75 HA LYS 75 -3.115 -0.305 -8.127
554 HB2 LYS 75 HB2 LYS 75 -2.533 -1.194 -10.942
555 HB3 LYS 75 HB3 LYS 75 -1.326 -0.426 -9.914
556 HG2 LYS 75 HG2 LYS 75 -2.815 -2.972 -9.304
557 HG3 LYS 75 HG3 LYS 75 -1.123 -2.846 -9.819
558 HD2 LYS 75 HD2 LYS 75 -0.578 -1.613 -7.801
559 HD3 LYS 75 HD3 LYS 75 -2.272 -1.627 -7.307
560 HE2 LYS 75 HE2 LYS 75 -2.128 -4.146 -7.328
561 HE3 LYS 75 HE3 LYS 75 -0.383 -3.956 -7.512
562 HZ1 LYS 75 HZ1 LYS 75 -0.399 -2.621 -5.448
563 HZ2 LYS 75 HZ2 LYS 75 -0.903 -4.230 -5.208
564 HZ3 LYS 75 HZ3 LYS 75 -2.047 -2.987 -5.256
565 H GLU 76 H GLU 76 -5.212 1.368 -8.833
566 HA GLU 76 HA GLU 76 -3.747 3.624 -10.025
567 HB2 GLU 76 HB2 GLU 76 -5.890 3.336 -11.077
568 HB3 GLU 76 HB3 GLU 76 -6.701 3.208 -9.520
569 HG2 GLU 76 HG2 GLU 76 -6.159 5.530 -9.035
570 HG3 GLU 76 HG3 GLU 76 -5.321 5.669 -10.578
571 H SER 77 H SER 77 -3.490 5.537 -8.820
572 HA SER 77 HA SER 77 -4.140 5.220 -5.970
573 HB2 SER 77 HB2 SER 77 -2.022 6.537 -5.501
574 HB3 SER 77 HB3 SER 77 -1.792 4.898 -6.104
575 HG SER 77 HG SER 77 -0.547 5.872 -7.493
576 H ARG 78 H ARG 78 -5.123 6.816 -4.992
577 HA ARG 78 HA ARG 78 -5.556 9.361 -6.414
578 HB2 ARG 78 HB2 ARG 78 -7.918 9.191 -6.137
579 HB3 ARG 78 HB3 ARG 78 -7.405 7.641 -6.789
580 HG2 ARG 78 HG2 ARG 78 -7.298 6.928 -4.287
581 HG3 ARG 78 HG3 ARG 78 -8.358 8.314 -4.042
582 HD2 ARG 78 HD2 ARG 78 -8.867 5.934 -5.816
583 HD3 ARG 78 HD3 ARG 78 -9.676 6.316 -4.303
584 HE ARG 78 HE ARG 78 -10.107 8.492 -5.943
585 HH11 ARG 78 HH11 ARG 78 -10.778 5.045 -6.112
586 HH12 ARG 78 HH12 ARG 78 -12.259 5.252 -6.997
587 HH21 ARG 78 HH21 ARG 78 -12.080 8.746 -7.104
588 HH22 ARG 78 HH22 ARG 78 -12.992 7.333 -7.548
589 H TRP 79 H TRP 79 -6.636 10.985 -4.899
590 HA TRP 79 HA TRP 79 -6.055 10.356 -2.087
591 HB2 TRP 79 HB2 TRP 79 -5.897 12.860 -1.746
592 HB3 TRP 79 HB3 TRP 79 -4.588 12.138 -2.671
593 HD1 TRP 79 HD1 TRP 79 -4.636 12.603 -5.380
594 HE1 TRP 79 HE1 TRP 79 -5.529 14.631 -6.693
595 HE3 TRP 79 HE3 TRP 79 -7.637 14.648 -1.774
596 HZ2 TRP 79 HZ2 TRP 79 -7.278 16.795 -6.258
597 HZ3 TRP 79 HZ3 TRP 79 -8.881 16.700 -2.306
598 HH2 TRP 79 HH2 TRP 79 -8.702 17.754 -4.504
599 H ALA 80 H ALA 80 -7.866 9.871 -1.098
600 HA ALA 80 HA ALA 80 -10.096 11.507 -0.795
601 HB1 ALA 80 HB1 ALA 80 -11.787 10.392 -2.153
602 HB2 ALA 80 HB2 ALA 80 -10.563 9.322 -2.833
603 HB3 ALA 80 HB3 ALA 80 -10.517 11.048 -3.187
604 H LYS 81 H LYS 81 -12.093 9.959 -0.106
605 HA LYS 81 HA LYS 81 -11.336 7.350 0.816
606 HB2 LYS 81 HB2 LYS 81 -11.755 7.824 3.225
607 HB3 LYS 81 HB3 LYS 81 -10.308 8.603 2.598
608 HG2 LYS 81 HG2 LYS 81 -11.548 10.713 2.398
609 HG3 LYS 81 HG3 LYS 81 -12.978 9.923 3.067
610 HD2 LYS 81 HD2 LYS 81 -11.922 11.106 4.847
611 HD3 LYS 81 HD3 LYS 81 -11.612 9.388 5.101
612 HE2 LYS 81 HE2 LYS 81 -9.591 10.641 5.517
613 HE3 LYS 81 HE3 LYS 81 -9.395 9.660 4.065
614 HZ1 LYS 81 HZ1 LYS 81 -10.086 12.550 4.073
615 HZ2 LYS 81 HZ2 LYS 81 -9.776 11.594 2.712
616 HZ3 LYS 81 HZ3 LYS 81 -8.532 11.928 3.812
617 HA PRO 82 HA PRO 82 -15.899 8.361 0.092
618 HB2 PRO 82 HB2 PRO 82 -16.324 6.638 -1.956
619 HB3 PRO 82 HB3 PRO 82 -15.776 8.301 -2.204
620 HG2 PRO 82 HG2 PRO 82 -14.183 5.765 -2.168
621 HG3 PRO 82 HG3 PRO 82 -14.084 7.138 -3.283
622 HD2 PRO 82 HD2 PRO 82 -12.346 6.810 -1.235
623 HD3 PRO 82 HD3 PRO 82 -12.847 8.413 -1.811
624 H LYS 83 H LYS 83 -17.294 7.282 1.327
625 HA LYS 83 HA LYS 83 -16.684 4.764 2.457
626 HB2 LYS 83 HB2 LYS 83 -18.686 4.888 3.645
627 HB3 LYS 83 HB3 LYS 83 -18.167 6.552 3.488
628 HG2 LYS 83 HG2 LYS 83 -20.311 5.190 1.877
629 HG3 LYS 83 HG3 LYS 83 -20.559 6.353 3.179
630 HD2 LYS 83 HD2 LYS 83 -19.068 7.890 1.677
631 HD3 LYS 83 HD3 LYS 83 -19.555 6.781 0.402
632 HE2 LYS 83 HE2 LYS 83 -21.903 7.207 0.913
633 HE3 LYS 83 HE3 LYS 83 -21.425 8.323 2.192
634 HZ1 LYS 83 HZ1 LYS 83 -21.846 9.708 0.419
635 HZ2 LYS 83 HZ2 LYS 83 -21.202 8.645 -0.729
636 HZ3 LYS 83 HZ3 LYS 83 -20.167 9.510 0.301
637 H GLU 84 H GLU 84 -18.039 5.647 -0.539
638 HA GLU 84 HA GLU 84 -19.723 3.496 -1.088
639 HB2 GLU 84 HB2 GLU 84 -17.817 4.891 -2.979
640 HB3 GLU 84 HB3 GLU 84 -19.113 3.813 -3.474
641 HG2 GLU 84 HG2 GLU 84 -20.203 5.758 -3.741
642 HG3 GLU 84 HG3 GLU 84 -20.540 5.533 -2.027
643 H LEU 85 H LEU 85 -16.207 3.735 -1.451
644 HA LEU 85 HA LEU 85 -15.920 1.009 -2.312
645 HB2 LEU 85 HB2 LEU 85 -13.821 2.901 -1.264
646 HB3 LEU 85 HB3 LEU 85 -13.539 1.440 -2.187
647 HG LEU 85 HG LEU 85 -14.956 3.886 -3.242
648 HD11 LEU 85 HD11 LEU 85 -12.184 2.909 -3.868
649 HD12 LEU 85 HD12 LEU 85 -12.539 4.172 -2.690
650 HD13 LEU 85 HD13 LEU 85 -12.946 4.414 -4.392
651 HD21 LEU 85 HD21 LEU 85 -14.644 2.801 -5.423
652 HD22 LEU 85 HD22 LEU 85 -15.664 1.842 -4.352
653 HD23 LEU 85 HD23 LEU 85 -13.982 1.381 -4.613
654 H GLU 86 H GLU 86 -15.062 2.808 0.619
655 HA GLU 86 HA GLU 86 -14.010 0.664 2.079
656 HB2 GLU 86 HB2 GLU 86 -15.266 3.238 3.022
657 HB3 GLU 86 HB3 GLU 86 -14.373 2.140 4.060
658 HG2 GLU 86 HG2 GLU 86 -13.279 3.587 1.661
659 HG3 GLU 86 HG3 GLU 86 -13.010 4.026 3.347
660 H ASP 87 H ASP 87 -17.277 1.773 1.713
661 HA ASP 87 HA ASP 87 -19.257 0.704 1.993
662 HB2 ASP 87 HB2 ASP 87 -18.194 -1.465 1.629
663 HB3 ASP 87 HB3 ASP 87 -17.671 -1.511 3.310
664 H LEU 88 H LEU 88 -17.111 1.501 4.451
665 HA LEU 88 HA LEU 88 -18.931 2.678 6.152
666 HB2 LEU 88 HB2 LEU 88 -19.458 0.088 6.401
667 HB3 LEU 88 HB3 LEU 88 -18.080 0.137 7.480
668 HG LEU 88 HG LEU 88 -20.294 0.326 8.623
669 HD11 LEU 88 HD11 LEU 88 -19.676 2.224 10.072
670 HD12 LEU 88 HD12 LEU 88 -18.415 2.662 8.917
671 HD13 LEU 88 HD13 LEU 88 -18.336 1.120 9.768
672 HD21 LEU 88 HD21 LEU 88 -21.441 1.640 6.922
673 HD22 LEU 88 HD22 LEU 88 -20.382 3.009 7.259
674 HD23 LEU 88 HD23 LEU 88 -21.503 2.437 8.494
675 H GLU 89 H GLU 89 -16.180 0.452 6.693
676 HA GLU 89 HA GLU 89 -14.690 2.734 7.820
677 HB2 GLU 89 HB2 GLU 89 -14.789 -0.091 8.882
678 HB3 GLU 89 HB3 GLU 89 -13.694 1.156 9.457
679 HG2 GLU 89 HG2 GLU 89 -15.636 2.498 10.155
680 HG3 GLU 89 HG3 GLU 89 -16.693 1.178 9.650
681 H GLY 90 H GLY 90 -14.759 0.281 5.543
682 HA2 GLY 90 HA2 GLY 90 -12.935 0.143 3.953
683 HA3 GLY 90 HA3 GLY 90 -11.826 0.361 5.302
684 H LEU 91 H LEU 91 -14.607 -1.771 4.812
685 HA LEU 91 HA LEU 91 -12.808 -4.058 4.854
686 HB2 LEU 91 HB2 LEU 91 -14.066 -5.288 6.459
687 HB3 LEU 91 HB3 LEU 91 -13.653 -3.749 7.167
688 HG LEU 91 HG LEU 91 -15.823 -4.226 7.911
689 HD11 LEU 91 HD11 LEU 91 -17.242 -2.502 7.019
690 HD12 LEU 91 HD12 LEU 91 -16.248 -2.391 5.567
691 HD13 LEU 91 HD13 LEU 91 -15.583 -1.915 7.129
692 HD21 LEU 91 HD21 LEU 91 -17.672 -4.923 6.514
693 HD22 LEU 91 HD22 LEU 91 -16.314 -6.039 6.355
694 HD23 LEU 91 HD23 LEU 91 -16.641 -4.860 5.085
695 H GLU 92 H GLU 92 -13.743 -5.979 3.873
696 HA GLU 92 HA GLU 92 -15.993 -5.304 2.104
697 HB2 GLU 92 HB2 GLU 92 -13.413 -5.475 1.266
698 HB3 GLU 92 HB3 GLU 92 -13.935 -7.139 1.042
699 HG2 GLU 92 HG2 GLU 92 -15.315 -4.725 -0.116
700 HG3 GLU 92 HG3 GLU 92 -14.189 -5.767 -0.982
Start of MODEL 6
1 H1 GLY 1 H1 GLY 1 20.334 -12.354 -10.472
2 H2 GLY 1 H2 GLY 1 20.806 -12.489 -12.092
3 H3 GLY 1 H3 GLY 1 19.363 -11.694 -11.693
4 HA2 GLY 1 HA3 GLY 1 22.101 -10.786 -11.000
5 HA3 GLY 1 HA2 GLY 1 21.077 -10.094 -12.249
6 H SER 2 H SER 2 20.286 -11.149 -8.948
7 HA SER 2 HA SER 2 19.741 -8.363 -8.208
8 HB2 SER 2 HB2 SER 2 17.791 -10.649 -7.790
9 HB3 SER 2 HB3 SER 2 17.568 -8.982 -7.261
10 HG SER 2 HG SER 2 17.739 -9.924 -9.943
11 H ASP 3 H ASP 3 19.741 -8.007 -5.913
12 HA ASP 3 HA ASP 3 20.972 -10.196 -4.387
13 HB2 ASP 3 HB2 ASP 3 21.823 -8.538 -2.845
14 HB3 ASP 3 HB3 ASP 3 22.265 -8.072 -4.482
15 H VAL 4 H VAL 4 20.307 -9.054 -1.802
16 HA VAL 4 HA VAL 4 17.715 -10.323 -1.657
17 HB VAL 4 HB VAL 4 17.989 -10.142 0.804
18 HG11 VAL 4 HG11 VAL 4 18.745 -12.119 -0.393
19 HG12 VAL 4 HG12 VAL 4 19.825 -11.762 0.954
20 HG13 VAL 4 HG13 VAL 4 20.307 -11.360 -0.694
21 HG21 VAL 4 HG21 VAL 4 20.679 -8.962 0.107
22 HG22 VAL 4 HG22 VAL 4 20.134 -9.425 1.720
23 HG23 VAL 4 HG23 VAL 4 19.338 -8.102 0.868
24 H ALA 5 H ALA 5 18.844 -7.055 -1.724
25 HA ALA 5 HA ALA 5 16.170 -6.105 -1.357
26 HB1 ALA 5 HB1 ALA 5 18.218 -5.301 0.697
27 HB2 ALA 5 HB2 ALA 5 16.850 -6.380 0.979
28 HB3 ALA 5 HB3 ALA 5 16.569 -4.687 0.569
29 H ALA 6 H ALA 6 19.132 -4.369 -0.571
30 HA ALA 6 HA ALA 6 20.112 -2.515 -1.410
31 HB1 ALA 6 HB1 ALA 6 20.141 -2.114 -3.806
32 HB2 ALA 6 HB2 ALA 6 18.838 -3.279 -4.034
33 HB3 ALA 6 HB3 ALA 6 20.414 -3.822 -3.461
34 H GLY 7 H GLY 7 16.944 -2.711 -3.021
35 HA2 GLY 7 HA2 GLY 7 15.418 -1.007 -1.641
36 HA3 GLY 7 HA3 GLY 7 16.466 0.112 -2.507
37 H THR 8 H THR 8 14.927 -2.951 -3.443
38 HA THR 8 HA THR 8 13.059 -2.013 -5.231
39 HB THR 8 HB THR 8 14.941 -0.911 -6.405
40 HG1 THR 8 HG1 THR 8 14.151 -1.443 -8.343
41 HG21 THR 8 HG21 THR 8 16.731 -2.479 -5.879
42 HG22 THR 8 HG22 THR 8 16.589 -2.264 -7.624
43 HG23 THR 8 HG23 THR 8 15.950 -3.719 -6.858
44 H ALA 9 H ALA 9 11.939 -3.705 -6.075
45 HA ALA 9 HA ALA 9 11.175 -5.838 -6.224
46 HB1 ALA 9 HB1 ALA 9 12.658 -7.486 -7.202
47 HB2 ALA 9 HB2 ALA 9 14.061 -6.498 -6.795
48 HB3 ALA 9 HB3 ALA 9 12.892 -5.922 -7.982
49 H SER 10 H SER 10 12.357 -4.815 -3.626
50 HA SER 10 HA SER 10 13.478 -7.079 -2.307
51 HB2 SER 10 HB2 SER 10 13.037 -5.615 -0.239
52 HB3 SER 10 HB3 SER 10 14.148 -4.982 -1.455
53 HG SER 10 HG SER 10 11.416 -4.296 -1.073
54 H GLY 11 H GLY 11 10.267 -5.748 -2.710
55 HA2 GLY 11 HA2 GLY 11 9.253 -8.242 -1.520
56 HA3 GLY 11 HA3 GLY 11 8.580 -6.706 -0.995
57 H ALA 12 H ALA 12 7.828 -9.248 -2.753
58 HA ALA 12 HA ALA 12 6.462 -7.733 -4.861
59 HB1 ALA 12 HB1 ALA 12 6.877 -10.704 -4.530
60 HB2 ALA 12 HB2 ALA 12 7.700 -9.641 -5.674
61 HB3 ALA 12 HB3 ALA 12 5.974 -9.949 -5.843
62 H LYS 13 H LYS 13 4.346 -9.655 -5.182
63 HA LYS 13 HA LYS 13 2.237 -10.098 -4.474
64 HB2 LYS 13 HB2 LYS 13 3.119 -9.428 -1.667
65 HB3 LYS 13 HB3 LYS 13 1.757 -10.432 -2.150
66 HG2 LYS 13 HG2 LYS 13 3.184 -12.172 -2.899
67 HG3 LYS 13 HG3 LYS 13 4.611 -11.130 -2.791
68 HD2 LYS 13 HD2 LYS 13 2.918 -11.953 -0.426
69 HD3 LYS 13 HD3 LYS 13 4.385 -12.793 -0.929
70 HE2 LYS 13 HE2 LYS 13 4.309 -9.853 -0.231
71 HE3 LYS 13 HE3 LYS 13 4.676 -11.122 0.939
72 HZ1 LYS 13 HZ1 LYS 13 6.696 -10.168 0.031
73 HZ2 LYS 13 HZ2 LYS 13 6.212 -10.564 -1.541
74 HZ3 LYS 13 HZ3 LYS 13 6.558 -11.793 -0.432
75 H SER 14 H SER 14 3.823 -7.284 -3.855
76 HA SER 14 HA SER 14 1.881 -5.498 -4.656
77 HB2 SER 14 HB2 SER 14 1.479 -4.318 -2.439
78 HB3 SER 14 HB3 SER 14 0.653 -5.863 -2.617
79 HG SER 14 HG SER 14 2.632 -6.719 -1.507
80 H MET 15 H MET 15 3.518 -4.554 -5.744
81 HA MET 15 HA MET 15 6.176 -4.929 -5.102
82 HB2 MET 15 HB2 MET 15 4.965 -2.826 -6.897
83 HB3 MET 15 HB3 MET 15 6.669 -3.253 -6.864
84 HG2 MET 15 HG2 MET 15 6.140 -5.509 -7.578
85 HG3 MET 15 HG3 MET 15 4.421 -5.122 -7.563
86 HE1 MET 15 HE1 MET 15 7.889 -4.428 -9.299
87 HE2 MET 15 HE2 MET 15 7.389 -2.838 -8.726
88 HE3 MET 15 HE3 MET 15 7.447 -3.174 -10.456
89 H TRP 16 H TRP 16 7.169 -4.221 -3.357
90 HA TRP 16 HA TRP 16 7.204 -1.328 -2.931
91 HB2 TRP 16 HB2 TRP 16 6.926 -1.452 -0.624
92 HB3 TRP 16 HB3 TRP 16 5.805 -2.681 -1.184
93 HD1 TRP 16 HD1 TRP 16 9.196 -2.311 0.589
94 HE1 TRP 16 HE1 TRP 16 9.711 -4.497 1.853
95 HE3 TRP 16 HE3 TRP 16 5.325 -5.172 -1.135
96 HZ2 TRP 16 HZ2 TRP 16 8.610 -7.075 2.095
97 HZ3 TRP 16 HZ3 TRP 16 5.131 -7.490 -0.331
98 HH2 TRP 16 HH2 TRP 16 6.739 -8.421 1.248
99 H THR 17 H THR 17 9.121 -0.499 -2.128
100 HA THR 17 HA THR 17 11.435 -2.328 -2.342
101 HB THR 17 HB THR 17 12.715 -0.463 -3.269
102 HG1 THR 17 HG1 THR 17 10.286 1.022 -3.323
103 HG21 THR 17 HG21 THR 17 11.086 -1.963 -4.650
104 HG22 THR 17 HG22 THR 17 11.853 -0.571 -5.420
105 HG23 THR 17 HG23 THR 17 10.182 -0.464 -4.863
106 H GLU 18 H GLU 18 12.705 -2.378 -0.615
107 HA GLU 18 HA GLU 18 12.044 -0.837 1.721
108 HB2 GLU 18 HB2 GLU 18 12.849 -3.239 1.691
109 HB3 GLU 18 HB3 GLU 18 14.446 -2.619 1.298
110 HG2 GLU 18 HG2 GLU 18 14.369 -1.292 3.407
111 HG3 GLU 18 HG3 GLU 18 12.862 -2.120 3.803
112 H HIS 19 H HIS 19 12.843 1.074 2.269
113 HA HIS 19 HA HIS 19 15.547 1.801 1.393
114 HB2 HIS 19 HB2 HIS 19 13.073 3.504 1.041
115 HB3 HIS 19 HB3 HIS 19 14.695 4.173 1.028
116 HD1 HIS 19 HD1 HIS 19 12.263 3.561 -1.266
117 HD2 HIS 19 HD2 HIS 19 16.222 2.318 -1.057
118 HE1 HIS 19 HE1 HIS 19 12.925 3.018 -3.629
119 HE2 HIS 19 HE2 HIS 19 15.386 2.503 -3.503
120 H LYS 20 H LYS 20 16.705 2.667 3.020
121 HA LYS 20 HA LYS 20 15.180 3.780 5.267
122 HB2 LYS 20 HB2 LYS 20 16.576 2.842 6.794
123 HB3 LYS 20 HB3 LYS 20 16.803 1.670 5.508
124 HG2 LYS 20 HG2 LYS 20 18.651 3.899 5.312
125 HG3 LYS 20 HG3 LYS 20 18.778 3.037 6.845
126 HD2 LYS 20 HD2 LYS 20 20.290 2.072 5.253
127 HD3 LYS 20 HD3 LYS 20 19.001 0.919 5.593
128 HE2 LYS 20 HE2 LYS 20 19.367 0.886 3.243
129 HE3 LYS 20 HE3 LYS 20 17.854 1.738 3.525
130 HZ1 LYS 20 HZ1 LYS 20 19.161 2.893 1.895
131 HZ2 LYS 20 HZ2 LYS 20 20.488 2.978 2.944
132 HZ3 LYS 20 HZ3 LYS 20 19.073 3.843 3.299
133 H SER 21 H SER 21 15.585 5.765 5.903
134 HA SER 21 HA SER 21 17.033 7.630 4.394
135 HB2 SER 21 HB2 SER 21 16.759 9.078 6.445
136 HB3 SER 21 HB3 SER 21 15.255 8.357 5.867
137 HG SER 21 HG SER 21 15.370 6.843 7.497
138 HA PRO 22 HA PRO 22 21.281 7.108 5.479
139 HB2 PRO 22 HB2 PRO 22 21.924 9.745 6.123
140 HB3 PRO 22 HB3 PRO 22 21.962 9.035 4.507
141 HG2 PRO 22 HG2 PRO 22 19.838 10.685 5.804
142 HG3 PRO 22 HG3 PRO 22 20.404 10.699 4.123
143 HD2 PRO 22 HD2 PRO 22 18.105 9.517 4.783
144 HD3 PRO 22 HD3 PRO 22 19.185 8.801 3.567
145 H ASP 23 H ASP 23 19.026 8.415 7.721
146 HA ASP 23 HA ASP 23 20.902 8.409 9.941
147 HB2 ASP 23 HB2 ASP 23 17.943 9.009 9.826
148 HB3 ASP 23 HB3 ASP 23 18.928 9.125 11.282
149 H GLY 24 H GLY 24 19.073 6.106 8.356
150 HA2 GLY 24 HA2 GLY 24 19.311 3.816 9.069
151 HA3 GLY 24 HA3 GLY 24 19.184 4.360 10.730
152 H ARG 25 H ARG 25 16.851 6.150 9.686
153 HA ARG 25 HA ARG 25 14.816 4.346 10.534
154 HB2 ARG 25 HB2 ARG 25 14.777 6.818 10.904
155 HB3 ARG 25 HB3 ARG 25 14.474 7.030 9.186
156 HG2 ARG 25 HG2 ARG 25 12.429 7.203 10.491
157 HG3 ARG 25 HG3 ARG 25 12.375 5.828 9.387
158 HD2 ARG 25 HD2 ARG 25 12.878 4.306 11.188
159 HD3 ARG 25 HD3 ARG 25 13.107 5.649 12.307
160 HE ARG 25 HE ARG 25 10.666 6.133 11.842
161 HH11 ARG 25 HH11 ARG 25 12.017 2.901 11.684
162 HH12 ARG 25 HH12 ARG 25 10.524 2.125 12.125
163 HH21 ARG 25 HH21 ARG 25 8.710 5.126 12.392
164 HH22 ARG 25 HH22 ARG 25 8.624 3.386 12.498
165 H THR 26 H THR 26 13.733 2.900 9.381
166 HA THR 26 HA THR 26 14.080 2.940 6.460
167 HB THR 26 HB THR 26 13.346 0.623 8.261
168 HG1 THR 26 HG1 THR 26 15.521 1.572 8.500
169 HG21 THR 26 HG21 THR 26 14.151 0.711 5.340
170 HG22 THR 26 HG22 THR 26 12.581 0.241 5.993
171 HG23 THR 26 HG23 THR 26 13.999 -0.760 6.301
172 H TYR 27 H TYR 27 12.400 2.899 5.080
173 HA TYR 27 HA TYR 27 9.769 2.114 6.043
174 HB2 TYR 27 HB2 TYR 27 8.758 3.993 4.633
175 HB3 TYR 27 HB3 TYR 27 9.435 4.442 6.187
176 HD1 TYR 27 HD1 TYR 27 10.799 4.025 2.716
177 HD2 TYR 27 HD2 TYR 27 10.435 6.499 6.154
178 HE1 TYR 27 HE1 TYR 27 12.118 5.769 1.591
179 HE2 TYR 27 HE2 TYR 27 11.764 8.245 5.047
180 HH TYR 27 HH TYR 27 13.338 8.519 3.265
181 H TYR 28 H TYR 28 8.270 2.213 3.896
182 HA TYR 28 HA TYR 28 9.816 0.762 1.854
183 HB2 TYR 28 HB2 TYR 28 7.010 0.112 2.782
184 HB3 TYR 28 HB3 TYR 28 7.959 -0.786 1.598
185 HD1 TYR 28 HD2 TYR 28 10.274 -1.692 2.493
186 HD2 TYR 28 HD1 TYR 28 6.987 -0.627 4.974
187 HE1 TYR 28 HE2 TYR 28 11.190 -3.088 4.295
188 HE2 TYR 28 HE1 TYR 28 7.899 -2.017 6.787
189 HH TYR 28 HH TYR 28 9.413 -3.943 7.059
190 H TYR 29 H TYR 29 9.352 1.266 -0.270
191 HA TYR 29 HA TYR 29 7.231 3.272 -0.615
192 HB2 TYR 29 HB2 TYR 29 8.926 4.562 -1.340
193 HB3 TYR 29 HB3 TYR 29 9.991 3.189 -1.596
194 HD1 TYR 29 HD1 TYR 29 6.976 4.789 -3.208
195 HD2 TYR 29 HD2 TYR 29 10.631 2.727 -3.681
196 HE1 TYR 29 HE1 TYR 29 6.776 5.020 -5.658
197 HE2 TYR 29 HE2 TYR 29 10.465 2.934 -6.125
198 HH TYR 29 HH TYR 29 8.545 5.025 -7.674
199 H ASN 30 H ASN 30 5.611 2.781 -1.747
200 HA ASN 30 HA ASN 30 5.508 0.227 -3.130
201 HB2 ASN 30 HB2 ASN 30 3.371 2.263 -2.434
202 HB3 ASN 30 HB3 ASN 30 3.057 0.731 -3.247
203 HD21 ASN 30 HD21 ASN 30 2.100 1.782 -0.708
204 HD22 ASN 30 HD22 ASN 30 2.568 0.630 0.496
205 H THR 31 H THR 31 6.017 0.194 -5.208
206 HA THR 31 HA THR 31 6.199 2.544 -6.804
207 HB THR 31 HB THR 31 6.770 1.030 -8.631
208 HG1 THR 31 HG1 THR 31 5.446 -0.704 -8.449
209 HG21 THR 31 HG21 THR 31 7.904 0.322 -5.935
210 HG22 THR 31 HG22 THR 31 8.570 1.437 -7.134
211 HG23 THR 31 HG23 THR 31 8.577 -0.302 -7.443
212 H GLU 32 H GLU 32 3.714 0.464 -5.929
213 HA GLU 32 HA GLU 32 2.016 0.472 -8.160
214 HB2 GLU 32 HB2 GLU 32 0.449 0.458 -5.810
215 HB3 GLU 32 HB3 GLU 32 0.934 -0.921 -6.787
216 HG2 GLU 32 HG2 GLU 32 3.126 -0.803 -5.448
217 HG3 GLU 32 HG3 GLU 32 2.208 0.191 -4.325
218 H THR 33 H THR 33 2.122 2.492 -5.291
219 HA THR 33 HA THR 33 0.233 4.380 -6.500
220 HB THR 33 HB THR 33 0.061 5.282 -4.169
221 HG1 THR 33 HG1 THR 33 1.032 3.818 -2.543
222 HG21 THR 33 HG21 THR 33 -0.366 2.288 -4.382
223 HG22 THR 33 HG22 THR 33 -1.484 3.517 -4.988
224 HG23 THR 33 HG23 THR 33 -1.177 3.383 -3.255
225 H LYS 34 H LYS 34 3.461 3.867 -5.986
226 HA LYS 34 HA LYS 34 5.342 5.058 -6.265
227 HB2 LYS 34 HB2 LYS 34 3.430 7.119 -7.332
228 HB3 LYS 34 HB3 LYS 34 5.180 7.337 -7.326
229 HG2 LYS 34 HG2 LYS 34 3.852 4.960 -8.552
230 HG3 LYS 34 HG3 LYS 34 4.176 6.442 -9.463
231 HD2 LYS 34 HD2 LYS 34 6.544 6.209 -9.035
232 HD3 LYS 34 HD3 LYS 34 6.250 4.814 -7.996
233 HE2 LYS 34 HE2 LYS 34 5.393 3.560 -9.898
234 HE3 LYS 34 HE3 LYS 34 5.631 4.961 -10.943
235 HZ1 LYS 34 HZ1 LYS 34 7.422 3.334 -11.141
236 HZ2 LYS 34 HZ2 LYS 34 7.796 3.532 -9.499
237 HZ3 LYS 34 HZ3 LYS 34 7.991 4.825 -10.574
238 H GLN 35 H GLN 35 3.842 5.051 -3.795
239 HA GLN 35 HA GLN 35 4.696 7.629 -2.635
240 HB2 GLN 35 HB2 GLN 35 2.700 5.701 -1.456
241 HB3 GLN 35 HB3 GLN 35 3.042 7.343 -0.926
242 HG2 GLN 35 HG2 GLN 35 2.088 8.242 -2.939
243 HG3 GLN 35 HG3 GLN 35 1.856 6.619 -3.586
244 HE21 GLN 35 HE21 GLN 35 0.617 9.065 -1.538
245 HE22 GLN 35 HE22 GLN 35 -0.805 8.232 -1.030
246 H SER 36 H SER 36 5.719 7.566 -0.557
247 HA SER 36 HA SER 36 6.875 4.959 0.104
248 HB2 SER 36 HB2 SER 36 8.632 6.264 1.272
249 HB3 SER 36 HB3 SER 36 8.539 6.659 -0.434
250 HG SER 36 HG SER 36 8.593 8.422 1.337
251 H THR 37 H THR 37 6.597 4.141 2.174
252 HA THR 37 HA THR 37 4.602 5.417 3.861
253 HB THR 37 HB THR 37 3.390 4.430 1.871
254 HG1 THR 37 HG1 THR 37 1.976 4.523 3.462
255 HG21 THR 37 HG21 THR 37 4.490 1.875 3.053
256 HG22 THR 37 HG22 THR 37 4.658 2.480 1.400
257 HG23 THR 37 HG23 THR 37 3.088 1.923 1.975
258 H TRP 38 H TRP 38 3.941 3.949 5.664
259 HA TRP 38 HA TRP 38 6.169 2.508 6.743
260 HB2 TRP 38 HB2 TRP 38 4.239 1.816 8.437
261 HB3 TRP 38 HB3 TRP 38 4.998 3.400 8.490
262 HD1 TRP 38 HD1 TRP 38 3.281 5.187 8.918
263 HE1 TRP 38 HE1 TRP 38 0.849 5.657 8.238
264 HE3 TRP 38 HE3 TRP 38 2.408 1.025 6.069
265 HZ2 TRP 38 HZ2 TRP 38 -1.181 4.427 6.711
266 HZ3 TRP 38 HZ3 TRP 38 0.191 0.748 5.043
267 HH2 TRP 38 HH2 TRP 38 -1.564 2.414 5.353
268 H GLU 39 H GLU 39 5.564 0.211 7.746
269 HA GLU 39 HA GLU 39 5.317 -1.590 5.633
270 HB2 GLU 39 HB2 GLU 39 4.975 -3.316 7.376
271 HB3 GLU 39 HB3 GLU 39 6.335 -2.256 7.719
272 HG2 GLU 39 HG2 GLU 39 4.995 -1.019 9.319
273 HG3 GLU 39 HG3 GLU 39 3.596 -2.027 8.944
274 H LYS 40 H LYS 40 3.648 -2.397 4.551
275 HA LYS 40 HA LYS 40 1.065 -1.281 4.965
276 HB2 LYS 40 HB2 LYS 40 1.969 -3.445 3.051
277 HB3 LYS 40 HB3 LYS 40 0.405 -2.642 3.004
278 HG2 LYS 40 HG2 LYS 40 1.612 -0.483 2.682
279 HG3 LYS 40 HG3 LYS 40 3.103 -1.407 2.528
280 HD2 LYS 40 HD2 LYS 40 0.671 -1.737 0.771
281 HD3 LYS 40 HD3 LYS 40 2.101 -0.798 0.346
282 HE2 LYS 40 HE2 LYS 40 3.262 -3.149 0.963
283 HE3 LYS 40 HE3 LYS 40 1.686 -3.720 0.414
284 HZ1 LYS 40 HZ1 LYS 40 3.241 -3.626 -1.422
285 HZ2 LYS 40 HZ2 LYS 40 3.535 -1.983 -1.138
286 HZ3 LYS 40 HZ3 LYS 40 2.005 -2.489 -1.665
287 HA PRO 41 HA PRO 41 -1.074 -4.379 7.364
288 HB2 PRO 41 HB2 PRO 41 -3.354 -4.634 5.814
289 HB3 PRO 41 HB3 PRO 41 -3.095 -3.385 7.036
290 HG2 PRO 41 HG2 PRO 41 -2.707 -3.253 4.076
291 HG3 PRO 41 HG3 PRO 41 -3.428 -2.050 5.163
292 HD2 PRO 41 HD2 PRO 41 -0.939 -1.746 4.272
293 HD3 PRO 41 HD3 PRO 41 -1.345 -1.346 5.955
294 H ASP 42 H ASP 42 -2.584 -6.378 6.771
295 HA ASP 42 HA ASP 42 -0.998 -8.460 5.892
296 HB2 ASP 42 HB2 ASP 42 -3.994 -8.263 6.101
297 HB3 ASP 42 HB3 ASP 42 -3.136 -9.770 5.790
298 H ASP 43 H ASP 43 -1.848 -6.191 3.782
299 HA ASP 43 HA ASP 43 -2.776 -7.503 1.476
300 HB2 ASP 43 HB2 ASP 43 -1.546 -5.003 2.167
301 HB3 ASP 43 HB3 ASP 43 -0.742 -5.654 0.750
302 H LEU 44 H LEU 44 0.324 -7.178 2.954
303 HA LEU 44 HA LEU 44 1.890 -8.218 0.863
304 HB2 LEU 44 HB2 LEU 44 2.614 -8.389 3.765
305 HB3 LEU 44 HB3 LEU 44 3.673 -8.188 2.373
306 HG LEU 44 HG LEU 44 1.660 -6.072 2.918
307 HD11 LEU 44 HD11 LEU 44 4.228 -6.459 4.461
308 HD12 LEU 44 HD12 LEU 44 2.585 -6.406 5.109
309 HD13 LEU 44 HD13 LEU 44 3.309 -4.954 4.415
310 HD21 LEU 44 HD21 LEU 44 3.468 -4.653 2.051
311 HD22 LEU 44 HD22 LEU 44 3.014 -5.932 0.926
312 HD23 LEU 44 HD23 LEU 44 4.487 -6.082 1.882
313 H LYS 45 H LYS 45 0.024 -9.680 3.397
314 HA LYS 45 HA LYS 45 1.197 -12.269 3.228
315 HB2 LYS 45 HB2 LYS 45 -1.632 -11.862 4.085
316 HB3 LYS 45 HB3 LYS 45 -0.411 -12.934 4.750
317 HG2 LYS 45 HG2 LYS 45 -0.385 -9.947 5.059
318 HG3 LYS 45 HG3 LYS 45 -1.068 -11.061 6.239
319 HD2 LYS 45 HD2 LYS 45 1.323 -12.159 6.021
320 HD3 LYS 45 HD3 LYS 45 1.751 -10.516 5.550
321 HE2 LYS 45 HE2 LYS 45 0.876 -9.618 7.545
322 HE3 LYS 45 HE3 LYS 45 0.167 -11.160 8.011
323 HZ1 LYS 45 HZ1 LYS 45 2.451 -12.055 8.157
324 HZ2 LYS 45 HZ2 LYS 45 2.148 -10.810 9.266
325 HZ3 LYS 45 HZ3 LYS 45 3.064 -10.498 7.874
326 H THR 46 H THR 46 -2.196 -11.530 2.571
327 HA THR 46 HA THR 46 -2.245 -12.756 -0.023
328 HB THR 46 HB THR 46 -3.784 -14.261 2.075
329 HG1 THR 46 HG1 THR 46 -1.862 -14.769 2.904
330 HG21 THR 46 HG21 THR 46 -4.323 -14.673 -0.251
331 HG22 THR 46 HG22 THR 46 -3.596 -16.105 0.475
332 HG23 THR 46 HG23 THR 46 -2.640 -15.075 -0.591
333 HA PRO 47 HA PRO 47 -5.783 -10.086 -0.295
334 HB2 PRO 47 HB2 PRO 47 -7.183 -12.416 -1.516
335 HB3 PRO 47 HB3 PRO 47 -7.094 -10.742 -2.080
336 HG2 PRO 47 HG2 PRO 47 -5.589 -12.581 -3.239
337 HG3 PRO 47 HG3 PRO 47 -4.895 -10.994 -2.853
338 HD2 PRO 47 HD2 PRO 47 -4.548 -13.611 -1.456
339 HD3 PRO 47 HD3 PRO 47 -3.361 -12.330 -1.748
340 H ALA 48 H ALA 48 -6.633 -13.425 0.648
341 HA ALA 48 HA ALA 48 -8.999 -12.589 2.003
342 HB1 ALA 48 HB1 ALA 48 -8.469 -14.889 0.992
343 HB2 ALA 48 HB2 ALA 48 -9.392 -14.788 2.486
344 HB3 ALA 48 HB3 ALA 48 -7.679 -15.210 2.540
345 H GLU 49 H GLU 49 -5.680 -12.995 2.979
346 HA GLU 49 HA GLU 49 -6.200 -12.849 5.768
347 HB2 GLU 49 HB2 GLU 49 -3.712 -12.268 4.164
348 HB3 GLU 49 HB3 GLU 49 -3.768 -12.138 5.921
349 HG2 GLU 49 HG2 GLU 49 -4.520 -14.513 5.999
350 HG3 GLU 49 HG3 GLU 49 -4.244 -14.605 4.262
351 H GLN 50 H GLN 50 -5.847 -10.484 3.206
352 HA GLN 50 HA GLN 50 -5.464 -8.163 4.700
353 HB2 GLN 50 HB2 GLN 50 -7.173 -8.408 2.227
354 HB3 GLN 50 HB3 GLN 50 -6.360 -6.965 2.810
355 HG2 GLN 50 HG2 GLN 50 -4.209 -7.962 2.343
356 HG3 GLN 50 HG3 GLN 50 -5.005 -9.458 1.835
357 HE21 GLN 50 HE21 GLN 50 -4.119 -9.317 -0.245
358 HE22 GLN 50 HE22 GLN 50 -4.650 -8.148 -1.401
359 H LEU 51 H LEU 51 -8.446 -9.935 3.972
360 HA LEU 51 HA LEU 51 -10.218 -7.826 4.184
361 HB2 LEU 51 HB2 LEU 51 -11.978 -9.432 4.252
362 HB3 LEU 51 HB3 LEU 51 -10.718 -10.009 3.179
363 HG LEU 51 HG LEU 51 -9.968 -11.309 5.367
364 HD11 LEU 51 HD11 LEU 51 -12.179 -12.215 6.347
365 HD12 LEU 51 HD12 LEU 51 -12.861 -10.684 5.794
366 HD13 LEU 51 HD13 LEU 51 -11.534 -10.691 6.949
367 HD21 LEU 51 HD21 LEU 51 -11.226 -13.222 4.458
368 HD22 LEU 51 HD22 LEU 51 -10.397 -12.271 3.222
369 HD23 LEU 51 HD23 LEU 51 -12.142 -12.102 3.441
370 H LEU 52 H LEU 52 -9.032 -9.905 6.771
371 HA LEU 52 HA LEU 52 -10.961 -9.093 8.684
372 HB2 LEU 52 HB2 LEU 52 -8.171 -10.043 9.328
373 HB3 LEU 52 HB3 LEU 52 -9.594 -10.142 10.343
374 HG LEU 52 HG LEU 52 -10.511 -11.674 8.424
375 HD11 LEU 52 HD11 LEU 52 -7.541 -12.064 8.097
376 HD12 LEU 52 HD12 LEU 52 -8.561 -11.193 6.950
377 HD13 LEU 52 HD13 LEU 52 -8.835 -12.914 7.249
378 HD21 LEU 52 HD21 LEU 52 -9.593 -13.616 9.589
379 HD22 LEU 52 HD22 LEU 52 -10.120 -12.373 10.723
380 HD23 LEU 52 HD23 LEU 52 -8.404 -12.582 10.380
381 H SER 53 H SER 53 -7.808 -7.961 7.747
382 HA SER 53 HA SER 53 -7.563 -6.021 9.867
383 HB2 SER 53 HB2 SER 53 -5.953 -6.186 7.318
384 HB3 SER 53 HB3 SER 53 -5.440 -5.535 8.875
385 HG SER 53 HG SER 53 -4.558 -7.581 8.664
386 H LYS 54 H LYS 54 -7.517 -5.781 6.350
387 HA LYS 54 HA LYS 54 -9.212 -3.407 6.377
388 HB2 LYS 54 HB2 LYS 54 -6.341 -3.383 5.422
389 HB3 LYS 54 HB3 LYS 54 -7.512 -2.135 5.027
390 HG2 LYS 54 HG2 LYS 54 -6.663 -2.859 7.822
391 HG3 LYS 54 HG3 LYS 54 -6.004 -1.519 6.881
392 HD2 LYS 54 HD2 LYS 54 -8.159 -0.463 6.792
393 HD3 LYS 54 HD3 LYS 54 -8.921 -1.848 7.567
394 HE2 LYS 54 HE2 LYS 54 -8.593 -0.014 9.147
395 HE3 LYS 54 HE3 LYS 54 -7.649 -1.431 9.597
396 HZ1 LYS 54 HZ1 LYS 54 -5.681 -0.388 8.670
397 HZ2 LYS 54 HZ2 LYS 54 -6.382 0.616 9.841
398 HZ3 LYS 54 HZ3 LYS 54 -6.585 0.969 8.194
399 H CYS 55 H CYS 55 -10.313 -3.151 4.478
400 HA CYS 55 HA CYS 55 -10.690 -5.450 2.918
401 HB2 CYS 55 HB2 CYS 55 -12.166 -3.972 1.552
402 HB3 CYS 55 HB3 CYS 55 -12.468 -3.847 3.282
403 HG CYS 55 HG CYS 55 -10.347 -1.588 1.897
404 HA PRO 56 HA PRO 56 -7.896 -5.498 -0.456
405 HB2 PRO 56 HB2 PRO 56 -10.174 -5.303 -2.361
406 HB3 PRO 56 HB3 PRO 56 -8.895 -6.519 -2.249
407 HG2 PRO 56 HG2 PRO 56 -11.339 -7.087 -1.402
408 HG3 PRO 56 HG3 PRO 56 -9.920 -7.626 -0.482
409 HD2 PRO 56 HD2 PRO 56 -11.779 -5.347 0.064
410 HD3 PRO 56 HD3 PRO 56 -11.050 -6.503 1.197
411 H TRP 57 H TRP 57 -10.068 -2.880 -0.242
412 HA TRP 57 HA TRP 57 -8.369 -1.275 -2.029
413 HB2 TRP 57 HB2 TRP 57 -11.156 -0.795 -0.961
414 HB3 TRP 57 HB3 TRP 57 -10.227 0.413 -1.843
415 HD1 TRP 57 HD1 TRP 57 -9.851 0.007 -4.461
416 HE1 TRP 57 HE1 TRP 57 -11.139 -1.424 -6.169
417 HE3 TRP 57 HE3 TRP 57 -12.433 -2.995 -1.221
418 HZ2 TRP 57 HZ2 TRP 57 -13.003 -3.550 -6.144
419 HZ3 TRP 57 HZ3 TRP 57 -13.944 -4.702 -2.144
420 HH2 TRP 57 HH2 TRP 57 -14.222 -4.973 -4.554
421 H LYS 58 H LYS 58 -7.132 0.350 -1.144
422 HA LYS 58 HA LYS 58 -7.548 0.909 1.711
423 HB2 LYS 58 HB2 LYS 58 -5.439 -0.635 0.691
424 HB3 LYS 58 HB3 LYS 58 -4.769 0.891 1.266
425 HG2 LYS 58 HG2 LYS 58 -4.781 -0.227 3.216
426 HG3 LYS 58 HG3 LYS 58 -6.405 0.405 3.285
427 HD2 LYS 58 HD2 LYS 58 -6.408 -1.947 3.868
428 HD3 LYS 58 HD3 LYS 58 -7.264 -1.684 2.348
429 HE2 LYS 58 HE2 LYS 58 -5.205 -2.345 1.135
430 HE3 LYS 58 HE3 LYS 58 -4.452 -2.714 2.684
431 HZ1 LYS 58 HZ1 LYS 58 -5.354 -4.678 1.565
432 HZ2 LYS 58 HZ2 LYS 58 -6.916 -4.007 1.648
433 HZ3 LYS 58 HZ3 LYS 58 -6.093 -4.409 3.068
434 H GLU 59 H GLU 59 -6.623 2.744 2.532
435 HA GLU 59 HA GLU 59 -5.743 4.789 0.611
436 HB2 GLU 59 HB2 GLU 59 -8.005 5.363 1.021
437 HB3 GLU 59 HB3 GLU 59 -7.886 4.961 2.728
438 HG2 GLU 59 HG2 GLU 59 -6.212 6.914 2.838
439 HG3 GLU 59 HG3 GLU 59 -6.896 7.380 1.280
440 H TYR 60 H TYR 60 -3.752 5.471 1.207
441 HA TYR 60 HA TYR 60 -3.313 6.014 4.044
442 HB2 TYR 60 HB2 TYR 60 -0.996 5.051 3.951
443 HB3 TYR 60 HB3 TYR 60 -2.288 3.855 3.872
444 HD1 TYR 60 HD1 TYR 60 0.182 5.710 1.799
445 HD2 TYR 60 HD2 TYR 60 -2.415 2.346 2.092
446 HE1 TYR 60 HE1 TYR 60 1.187 4.754 -0.224
447 HE2 TYR 60 HE2 TYR 60 -1.412 1.390 0.066
448 HH TYR 60 HH TYR 60 -0.186 2.078 -1.872
449 H LYS 61 H LYS 61 -1.587 7.512 4.453
450 HA LYS 61 HA LYS 61 -1.071 9.221 2.141
451 HB2 LYS 61 HB2 LYS 61 -0.674 9.798 5.069
452 HB3 LYS 61 HB3 LYS 61 -0.378 10.929 3.758
453 HG2 LYS 61 HG2 LYS 61 -2.831 10.542 3.140
454 HG3 LYS 61 HG3 LYS 61 -2.976 9.852 4.753
455 HD2 LYS 61 HD2 LYS 61 -2.181 12.659 4.003
456 HD3 LYS 61 HD3 LYS 61 -3.605 12.145 4.907
457 HE2 LYS 61 HE2 LYS 61 -0.744 11.918 5.817
458 HE3 LYS 61 HE3 LYS 61 -1.909 13.122 6.370
459 HZ1 LYS 61 HZ1 LYS 61 -1.891 11.452 7.997
460 HZ2 LYS 61 HZ2 LYS 61 -1.936 10.200 6.861
461 HZ3 LYS 61 HZ3 LYS 61 -3.308 11.174 7.107
462 H SER 62 H SER 62 0.904 9.566 1.363
463 HA SER 62 HA SER 62 3.057 7.867 2.013
464 HB2 SER 62 HB2 SER 62 4.034 10.120 0.645
465 HB3 SER 62 HB3 SER 62 3.606 8.555 -0.054
466 HG SER 62 HG SER 62 2.474 10.342 -1.004
467 H ASP 63 H ASP 63 5.336 9.017 2.289
468 HA ASP 63 HA ASP 63 5.558 10.385 4.708
469 HB2 ASP 63 HB2 ASP 63 7.484 9.336 3.747
470 HB3 ASP 63 HB3 ASP 63 7.369 10.309 2.289
471 H SER 64 H SER 64 5.075 11.540 1.433
472 HA SER 64 HA SER 64 5.244 14.321 2.043
473 HB2 SER 64 HB2 SER 64 3.621 13.419 -0.270
474 HB3 SER 64 HB3 SER 64 4.929 14.602 -0.207
475 HG SER 64 HG SER 64 6.272 13.097 -0.796
476 H GLY 65 H GLY 65 2.952 11.918 2.627
477 HA2 GLY 65 HA2 GLY 65 0.994 12.091 3.854
478 HA3 GLY 65 HA3 GLY 65 1.126 13.838 3.787
479 H LYS 66 H LYS 66 1.294 12.105 0.821
480 HA LYS 66 HA LYS 66 -1.247 13.173 -0.058
481 HB2 LYS 66 HB2 LYS 66 0.755 13.036 -1.563
482 HB3 LYS 66 HB3 LYS 66 0.654 11.291 -1.479
483 HG2 LYS 66 HG2 LYS 66 -0.311 12.289 -3.543
484 HG3 LYS 66 HG3 LYS 66 -1.418 11.261 -2.633
485 HD2 LYS 66 HD2 LYS 66 -2.481 13.335 -3.464
486 HD3 LYS 66 HD3 LYS 66 -2.523 13.196 -1.706
487 HE2 LYS 66 HE2 LYS 66 -0.572 14.682 -1.561
488 HE3 LYS 66 HE3 LYS 66 -0.584 14.855 -3.318
489 HZ1 LYS 66 HZ1 LYS 66 -1.681 16.705 -2.171
490 HZ2 LYS 66 HZ2 LYS 66 -2.817 15.628 -1.518
491 HZ3 LYS 66 HZ3 LYS 66 -2.748 15.873 -3.195
492 H THR 67 H THR 67 -3.172 12.045 0.039
493 HA THR 67 HA THR 67 -3.047 9.244 0.803
494 HB THR 67 HB THR 67 -5.724 9.822 0.315
495 HG1 THR 67 HG1 THR 67 -5.435 11.829 1.982
496 HG21 THR 67 HG21 THR 67 -4.493 8.558 2.151
497 HG22 THR 67 HG22 THR 67 -5.953 9.445 2.614
498 HG23 THR 67 HG23 THR 67 -4.362 10.118 2.976
499 H TYR 68 H TYR 68 -3.230 7.628 -0.518
500 HA TYR 68 HA TYR 68 -4.543 8.077 -3.102
501 HB2 TYR 68 HB2 TYR 68 -1.898 6.935 -2.575
502 HB3 TYR 68 HB3 TYR 68 -2.903 5.953 -3.625
503 HD1 TYR 68 HD2 TYR 68 -1.302 9.260 -3.234
504 HD2 TYR 68 HD1 TYR 68 -3.340 6.607 -5.861
505 HE1 TYR 68 HE2 TYR 68 -0.686 10.684 -5.141
506 HE2 TYR 68 HE1 TYR 68 -2.728 8.021 -7.775
507 HH TYR 68 HH TYR 68 -2.067 10.271 -8.262
508 H TYR 69 H TYR 69 -5.773 6.391 -3.861
509 HA TYR 69 HA TYR 69 -6.437 4.333 -1.861
510 HB2 TYR 69 HB2 TYR 69 -8.113 6.224 -2.346
511 HB3 TYR 69 HB3 TYR 69 -8.300 5.492 -3.934
512 HD1 TYR 69 HD1 TYR 69 -8.707 4.913 -0.314
513 HD2 TYR 69 HD2 TYR 69 -9.682 3.622 -4.249
514 HE1 TYR 69 HE1 TYR 69 -10.434 3.411 0.605
515 HE2 TYR 69 HE2 TYR 69 -11.404 2.123 -3.347
516 HH TYR 69 HH TYR 69 -12.444 2.284 -0.088
517 H TYR 70 H TYR 70 -6.108 2.273 -2.607
518 HA TYR 70 HA TYR 70 -5.832 2.032 -5.523
519 HB2 TYR 70 HB2 TYR 70 -3.896 0.637 -5.309
520 HB3 TYR 70 HB3 TYR 70 -3.613 2.098 -4.370
521 HD1 TYR 70 HD1 TYR 70 -4.256 -1.518 -4.199
522 HD2 TYR 70 HD2 TYR 70 -3.390 1.990 -1.960
523 HE1 TYR 70 HE1 TYR 70 -3.730 -2.911 -2.244
524 HE2 TYR 70 HE2 TYR 70 -2.865 0.610 0.007
525 HH TYR 70 HH TYR 70 -2.661 -2.879 -0.195
526 H ASN 71 H ASN 71 -6.458 0.227 -6.498
527 HA ASN 71 HA ASN 71 -8.139 -1.646 -5.017
528 HB2 ASN 71 HB2 ASN 71 -7.500 -1.835 -7.958
529 HB3 ASN 71 HB3 ASN 71 -8.950 -2.361 -7.116
530 HD21 ASN 71 HD21 ASN 71 -7.307 0.282 -8.627
531 HD22 ASN 71 HD22 ASN 71 -8.642 1.379 -8.626
532 H SER 72 H SER 72 -6.924 -3.213 -3.981
533 HA SER 72 HA SER 72 -4.288 -3.830 -4.838
534 HB2 SER 72 HB2 SER 72 -5.015 -3.918 -2.471
535 HB3 SER 72 HB3 SER 72 -5.978 -5.343 -2.841
536 HG SER 72 HG SER 72 -3.589 -5.436 -2.028
537 H GLN 73 H GLN 73 -7.391 -5.442 -5.375
538 HA GLN 73 HA GLN 73 -6.345 -7.902 -6.223
539 HB2 GLN 73 HB2 GLN 73 -8.489 -8.183 -7.466
540 HB3 GLN 73 HB3 GLN 73 -8.669 -7.841 -5.756
541 HG2 GLN 73 HG2 GLN 73 -8.855 -5.664 -7.801
542 HG3 GLN 73 HG3 GLN 73 -10.233 -6.711 -7.457
543 HE21 GLN 73 HE21 GLN 73 -8.246 -4.130 -6.335
544 HE22 GLN 73 HE22 GLN 73 -9.185 -3.751 -4.922
545 H THR 74 H THR 74 -7.018 -4.942 -8.035
546 HA THR 74 HA THR 74 -6.014 -6.220 -10.460
547 HB THR 74 HB THR 74 -6.847 -4.128 -11.570
548 HG1 THR 74 HG1 THR 74 -8.041 -2.677 -10.336
549 HG21 THR 74 HG21 THR 74 -8.730 -5.799 -9.905
550 HG22 THR 74 HG22 THR 74 -8.285 -6.028 -11.602
551 HG23 THR 74 HG23 THR 74 -9.285 -4.653 -11.129
552 H LYS 75 H LYS 75 -4.948 -4.399 -7.913
553 HA LYS 75 HA LYS 75 -3.070 -3.256 -7.400
554 HB2 LYS 75 HB2 LYS 75 -2.057 -4.605 -9.899
555 HB3 LYS 75 HB3 LYS 75 -1.036 -3.695 -8.792
556 HG2 LYS 75 HG2 LYS 75 -2.660 -6.124 -8.073
557 HG3 LYS 75 HG3 LYS 75 -0.921 -6.110 -8.390
558 HD2 LYS 75 HD2 LYS 75 -0.590 -4.602 -6.494
559 HD3 LYS 75 HD3 LYS 75 -2.329 -4.590 -6.192
560 HE2 LYS 75 HE2 LYS 75 -2.156 -7.109 -5.942
561 HE3 LYS 75 HE3 LYS 75 -0.407 -6.886 -5.911
562 HZ1 LYS 75 HZ1 LYS 75 -2.386 -5.781 -3.995
563 HZ2 LYS 75 HZ2 LYS 75 -0.753 -5.345 -4.016
564 HZ3 LYS 75 HZ3 LYS 75 -1.195 -6.942 -3.676
565 H GLU 76 H GLU 76 -5.091 -1.930 -8.902
566 HA GLU 76 HA GLU 76 -3.511 0.041 -10.405
567 HB2 GLU 76 HB2 GLU 76 -5.382 -0.692 -11.697
568 HB3 GLU 76 HB3 GLU 76 -6.473 -0.537 -10.326
569 HG2 GLU 76 HG2 GLU 76 -6.236 1.873 -10.378
570 HG3 GLU 76 HG3 GLU 76 -5.088 1.751 -11.708
571 H SER 77 H SER 77 -3.535 2.213 -9.798
572 HA SER 77 HA SER 77 -4.610 2.688 -7.100
573 HB2 SER 77 HB2 SER 77 -2.845 4.440 -6.893
574 HB3 SER 77 HB3 SER 77 -2.178 2.825 -7.128
575 HG SER 77 HG SER 77 -1.293 3.482 -8.912
576 H ARG 78 H ARG 78 -5.972 4.380 -6.787
577 HA ARG 78 HA ARG 78 -6.458 6.196 -9.056
578 HB2 ARG 78 HB2 ARG 78 -8.725 5.735 -9.145
579 HB3 ARG 78 HB3 ARG 78 -8.095 4.145 -8.748
580 HG2 ARG 78 HG2 ARG 78 -8.506 4.925 -6.283
581 HG3 ARG 78 HG3 ARG 78 -9.612 6.067 -7.044
582 HD2 ARG 78 HD2 ARG 78 -9.757 3.091 -6.881
583 HD3 ARG 78 HD3 ARG 78 -11.007 4.294 -6.597
584 HE ARG 78 HE ARG 78 -10.216 4.263 -9.330
585 HH11 ARG 78 HH11 ARG 78 -12.162 2.569 -6.956
586 HH12 ARG 78 HH12 ARG 78 -13.196 1.825 -8.134
587 HH21 ARG 78 HH21 ARG 78 -11.556 3.269 -10.887
588 HH22 ARG 78 HH22 ARG 78 -12.854 2.224 -10.371
589 H TRP 79 H TRP 79 -7.564 8.213 -8.389
590 HA TRP 79 HA TRP 79 -7.288 8.703 -5.504
591 HB2 TRP 79 HB2 TRP 79 -7.254 11.107 -6.041
592 HB3 TRP 79 HB3 TRP 79 -5.972 10.252 -6.886
593 HD1 TRP 79 HD1 TRP 79 -6.395 9.860 -9.598
594 HE1 TRP 79 HE1 TRP 79 -7.652 11.345 -11.288
595 HE3 TRP 79 HE3 TRP 79 -9.130 12.689 -6.325
596 HZ2 TRP 79 HZ2 TRP 79 -9.541 13.433 -11.236
597 HZ3 TRP 79 HZ3 TRP 79 -10.633 14.414 -7.231
598 HH2 TRP 79 HH2 TRP 79 -10.832 14.778 -9.637
599 H ALA 80 H ALA 80 -9.120 8.278 -4.546
600 HA ALA 80 HA ALA 80 -11.437 9.598 -4.417
601 HB1 ALA 80 HB1 ALA 80 -13.069 8.293 -5.793
602 HB2 ALA 80 HB2 ALA 80 -11.702 7.543 -6.618
603 HB3 ALA 80 HB3 ALA 80 -11.969 9.281 -6.756
604 H LYS 81 H LYS 81 -12.578 8.686 -2.730
605 HA LYS 81 HA LYS 81 -12.347 5.792 -2.432
606 HB2 LYS 81 HB2 LYS 81 -12.259 6.365 0.166
607 HB3 LYS 81 HB3 LYS 81 -10.824 6.155 -0.819
608 HG2 LYS 81 HG2 LYS 81 -10.333 8.053 0.371
609 HG3 LYS 81 HG3 LYS 81 -10.954 8.717 -1.136
610 HD2 LYS 81 HD2 LYS 81 -11.795 9.862 0.902
611 HD3 LYS 81 HD3 LYS 81 -13.071 9.203 -0.120
612 HE2 LYS 81 HE2 LYS 81 -13.328 8.861 2.377
613 HE3 LYS 81 HE3 LYS 81 -13.489 7.429 1.367
614 HZ1 LYS 81 HZ1 LYS 81 -11.666 6.498 2.251
615 HZ2 LYS 81 HZ2 LYS 81 -11.965 7.551 3.545
616 HZ3 LYS 81 HZ3 LYS 81 -10.813 7.961 2.367
617 HA PRO 82 HA PRO 82 -16.802 6.615 -1.903
618 HB2 PRO 82 HB2 PRO 82 -17.452 4.215 -3.027
619 HB3 PRO 82 HB3 PRO 82 -17.272 5.707 -3.956
620 HG2 PRO 82 HG2 PRO 82 -15.331 3.464 -3.576
621 HG3 PRO 82 HG3 PRO 82 -15.724 4.374 -5.042
622 HD2 PRO 82 HD2 PRO 82 -13.506 4.867 -3.590
623 HD3 PRO 82 HD3 PRO 82 -14.379 6.155 -4.447
624 H LYS 83 H LYS 83 -17.779 5.969 -0.082
625 HA LYS 83 HA LYS 83 -16.505 4.256 1.756
626 HB2 LYS 83 HB2 LYS 83 -18.190 4.758 3.243
627 HB3 LYS 83 HB3 LYS 83 -18.276 6.135 2.158
628 HG2 LYS 83 HG2 LYS 83 -20.067 3.714 2.060
629 HG3 LYS 83 HG3 LYS 83 -20.487 5.280 2.760
630 HD2 LYS 83 HD2 LYS 83 -20.031 6.268 0.472
631 HD3 LYS 83 HD3 LYS 83 -19.946 4.617 -0.124
632 HE2 LYS 83 HE2 LYS 83 -22.317 5.681 1.383
633 HE3 LYS 83 HE3 LYS 83 -22.180 5.762 -0.373
634 HZ1 LYS 83 HZ1 LYS 83 -23.437 3.816 0.432
635 HZ2 LYS 83 HZ2 LYS 83 -22.035 3.241 1.198
636 HZ3 LYS 83 HZ3 LYS 83 -22.081 3.395 -0.490
637 H GLU 84 H GLU 84 -18.500 3.599 -0.906
638 HA GLU 84 HA GLU 84 -19.795 1.250 -0.057
639 HB2 GLU 84 HB2 GLU 84 -20.246 2.584 -2.146
640 HB3 GLU 84 HB3 GLU 84 -18.823 1.831 -2.851
641 HG2 GLU 84 HG2 GLU 84 -19.834 -0.343 -2.686
642 HG3 GLU 84 HG3 GLU 84 -21.220 0.331 -1.828
643 H LEU 85 H LEU 85 -16.602 1.761 -1.491
644 HA LEU 85 HA LEU 85 -15.977 -1.032 -1.676
645 HB2 LEU 85 HB2 LEU 85 -14.130 1.355 -1.710
646 HB3 LEU 85 HB3 LEU 85 -13.717 -0.273 -2.206
647 HG LEU 85 HG LEU 85 -15.759 1.473 -3.571
648 HD11 LEU 85 HD11 LEU 85 -12.996 0.719 -4.494
649 HD12 LEU 85 HD12 LEU 85 -13.389 2.244 -3.701
650 HD13 LEU 85 HD13 LEU 85 -14.122 1.846 -5.258
651 HD21 LEU 85 HD21 LEU 85 -15.660 -0.223 -5.328
652 HD22 LEU 85 HD22 LEU 85 -16.209 -0.913 -3.802
653 HD23 LEU 85 HD23 LEU 85 -14.554 -1.181 -4.347
654 H GLU 86 H GLU 86 -14.846 1.623 0.386
655 HA GLU 86 HA GLU 86 -13.308 0.102 2.164
656 HB2 GLU 86 HB2 GLU 86 -14.728 2.742 2.481
657 HB3 GLU 86 HB3 GLU 86 -13.721 2.057 3.747
658 HG2 GLU 86 HG2 GLU 86 -11.780 2.180 2.381
659 HG3 GLU 86 HG3 GLU 86 -12.738 2.570 0.955
660 H ASP 87 H ASP 87 -16.692 0.643 1.964
661 HA ASP 87 HA ASP 87 -18.495 -0.162 3.051
662 HB2 ASP 87 HB2 ASP 87 -17.112 -2.337 2.884
663 HB3 ASP 87 HB3 ASP 87 -16.740 -2.070 4.585
664 H LEU 88 H LEU 88 -17.236 2.070 3.962
665 HA LEU 88 HA LEU 88 -17.617 3.606 5.581
666 HB2 LEU 88 HB2 LEU 88 -19.631 2.074 6.072
667 HB3 LEU 88 HB3 LEU 88 -18.681 1.474 7.413
668 HG LEU 88 HG LEU 88 -20.384 3.246 7.971
669 HD11 LEU 88 HD11 LEU 88 -17.510 3.856 8.634
670 HD12 LEU 88 HD12 LEU 88 -18.568 2.736 9.494
671 HD13 LEU 88 HD13 LEU 88 -18.921 4.464 9.500
672 HD21 LEU 88 HD21 LEU 88 -18.431 5.017 6.508
673 HD22 LEU 88 HD22 LEU 88 -19.777 5.575 7.502
674 HD23 LEU 88 HD23 LEU 88 -20.090 4.662 6.025
675 H GLU 89 H GLU 89 -16.337 0.524 6.878
676 HA GLU 89 HA GLU 89 -14.786 2.058 8.831
677 HB2 GLU 89 HB2 GLU 89 -15.393 -0.880 8.547
678 HB3 GLU 89 HB3 GLU 89 -14.243 -0.258 9.722
679 HG2 GLU 89 HG2 GLU 89 -17.116 0.612 9.588
680 HG3 GLU 89 HG3 GLU 89 -16.534 -0.708 10.602
681 H GLY 90 H GLY 90 -14.387 0.395 5.862
682 HA2 GLY 90 HA2 GLY 90 -12.427 0.302 4.572
683 HA3 GLY 90 HA3 GLY 90 -11.491 0.726 6.004
684 H LEU 91 H LEU 91 -13.792 -1.619 6.661
685 HA LEU 91 HA LEU 91 -11.756 -3.712 6.562
686 HB2 LEU 91 HB2 LEU 91 -13.897 -3.043 8.499
687 HB3 LEU 91 HB3 LEU 91 -13.434 -4.712 8.319
688 HG LEU 91 HG LEU 91 -11.071 -4.025 8.858
689 HD11 LEU 91 HD11 LEU 91 -12.406 -1.439 9.639
690 HD12 LEU 91 HD12 LEU 91 -11.282 -1.655 8.295
691 HD13 LEU 91 HD13 LEU 91 -10.728 -1.886 9.955
692 HD21 LEU 91 HD21 LEU 91 -11.489 -3.817 11.262
693 HD22 LEU 91 HD22 LEU 91 -12.500 -5.058 10.520
694 HD23 LEU 91 HD23 LEU 91 -13.190 -3.486 10.929
695 H GLU 92 H GLU 92 -12.257 -5.690 5.716
696 HA GLU 92 HA GLU 92 -14.593 -5.757 3.988
697 HB2 GLU 92 HB2 GLU 92 -12.363 -6.301 3.092
698 HB3 GLU 92 HB3 GLU 92 -12.234 -7.630 4.230
699 HG2 GLU 92 HG2 GLU 92 -12.801 -8.427 2.016
700 HG3 GLU 92 HG3 GLU 92 -14.100 -8.757 3.160
Start of MODEL 7
1 H1 GLY 1 H1 GLY 1 -0.003 -8.484 -15.141
2 H2 GLY 1 H2 GLY 1 -0.411 -9.098 -13.616
3 H3 GLY 1 H3 GLY 1 1.069 -9.517 -14.331
4 HA2 GLY 1 HA3 GLY 1 1.752 -7.167 -14.237
5 HA3 GLY 1 HA2 GLY 1 0.259 -6.828 -13.371
6 H SER 2 H SER 2 2.638 -6.192 -12.231
7 HA SER 2 HA SER 2 3.899 -6.387 -10.370
8 HB2 SER 2 HB2 SER 2 1.708 -8.300 -9.531
9 HB3 SER 2 HB3 SER 2 2.936 -7.635 -8.454
10 HG SER 2 HG SER 2 1.204 -6.309 -8.248
11 H ASP 3 H ASP 3 4.773 -8.301 -8.750
12 HA ASP 3 HA ASP 3 6.082 -10.128 -8.466
13 HB2 ASP 3 HB2 ASP 3 4.117 -11.362 -9.344
14 HB3 ASP 3 HB3 ASP 3 4.757 -11.187 -10.972
15 H VAL 4 H VAL 4 6.611 -7.882 -10.597
16 HA VAL 4 HA VAL 4 8.652 -9.168 -12.218
17 HB VAL 4 HB VAL 4 7.124 -7.417 -13.154
18 HG11 VAL 4 HG11 VAL 4 8.748 -5.535 -11.453
19 HG12 VAL 4 HG12 VAL 4 7.040 -5.921 -11.244
20 HG13 VAL 4 HG13 VAL 4 7.580 -5.066 -12.689
21 HG21 VAL 4 HG21 VAL 4 8.862 -6.236 -14.422
22 HG22 VAL 4 HG22 VAL 4 9.192 -7.963 -14.287
23 HG23 VAL 4 HG23 VAL 4 10.076 -6.814 -13.280
24 H ALA 5 H ALA 5 8.436 -7.685 -9.189
25 HA ALA 5 HA ALA 5 9.951 -6.927 -7.655
26 HB1 ALA 5 HB1 ALA 5 11.914 -8.336 -7.401
27 HB2 ALA 5 HB2 ALA 5 11.684 -8.978 -9.028
28 HB3 ALA 5 HB3 ALA 5 10.492 -9.310 -7.771
29 H ALA 6 H ALA 6 9.960 -4.861 -8.924
30 HA ALA 6 HA ALA 6 12.339 -4.288 -10.454
31 HB1 ALA 6 HB1 ALA 6 10.188 -3.249 -11.031
32 HB2 ALA 6 HB2 ALA 6 11.426 -2.046 -10.667
33 HB3 ALA 6 HB3 ALA 6 10.180 -2.419 -9.475
34 H GLY 7 H GLY 7 13.870 -4.838 -8.820
35 HA2 GLY 7 HA2 GLY 7 15.460 -3.307 -7.588
36 HA3 GLY 7 HA3 GLY 7 14.063 -2.907 -6.594
37 H THR 8 H THR 8 13.150 -4.539 -5.253
38 HA THR 8 HA THR 8 14.808 -6.928 -4.862
39 HB THR 8 HB THR 8 14.612 -6.742 -2.440
40 HG1 THR 8 HG1 THR 8 13.170 -5.467 -1.611
41 HG21 THR 8 HG21 THR 8 16.577 -5.714 -3.446
42 HG22 THR 8 HG22 THR 8 16.052 -4.788 -2.040
43 HG23 THR 8 HG23 THR 8 15.695 -4.202 -3.665
44 H ALA 9 H ALA 9 13.668 -8.765 -4.250
45 HA ALA 9 HA ALA 9 10.782 -8.591 -4.643
46 HB1 ALA 9 HB1 ALA 9 10.838 -11.031 -4.769
47 HB2 ALA 9 HB2 ALA 9 12.555 -11.021 -4.364
48 HB3 ALA 9 HB3 ALA 9 12.003 -10.313 -5.882
49 H SER 10 H SER 10 11.846 -7.435 -2.322
50 HA SER 10 HA SER 10 11.667 -9.092 -0.040
51 HB2 SER 10 HB2 SER 10 11.006 -6.150 -0.088
52 HB3 SER 10 HB3 SER 10 11.743 -7.083 1.215
53 HG SER 10 HG SER 10 13.554 -7.402 -0.274
54 H GLY 11 H GLY 11 9.327 -6.852 -1.521
55 HA2 GLY 11 HA2 GLY 11 7.213 -8.194 0.025
56 HA3 GLY 11 HA3 GLY 11 7.112 -6.556 -0.604
57 H ALA 12 H ALA 12 6.213 -9.726 -1.093
58 HA ALA 12 HA ALA 12 5.552 -9.177 -3.907
59 HB1 ALA 12 HB1 ALA 12 5.762 -11.800 -2.423
60 HB2 ALA 12 HB2 ALA 12 6.827 -11.209 -3.697
61 HB3 ALA 12 HB3 ALA 12 5.159 -11.631 -4.071
62 H LYS 13 H LYS 13 3.350 -10.507 -4.375
63 HA LYS 13 HA LYS 13 1.081 -10.588 -4.055
64 HB2 LYS 13 HB2 LYS 13 1.506 -10.139 -1.100
65 HB3 LYS 13 HB3 LYS 13 0.234 -11.058 -1.896
66 HG2 LYS 13 HG2 LYS 13 1.689 -12.854 -2.374
67 HG3 LYS 13 HG3 LYS 13 3.124 -11.878 -2.007
68 HD2 LYS 13 HD2 LYS 13 1.084 -12.376 0.124
69 HD3 LYS 13 HD3 LYS 13 2.256 -13.633 -0.278
70 HE2 LYS 13 HE2 LYS 13 2.937 -10.795 0.523
71 HE3 LYS 13 HE3 LYS 13 3.024 -12.206 1.573
72 HZ1 LYS 13 HZ1 LYS 13 5.169 -11.456 0.472
73 HZ2 LYS 13 HZ2 LYS 13 4.536 -12.095 -0.964
74 HZ3 LYS 13 HZ3 LYS 13 4.787 -13.105 0.369
75 H SER 14 H SER 14 2.994 -8.112 -3.611
76 HA SER 14 HA SER 14 1.395 -5.914 -3.939
77 HB2 SER 14 HB2 SER 14 1.512 -4.960 -1.563
78 HB3 SER 14 HB3 SER 14 0.338 -6.252 -1.801
79 HG SER 14 HG SER 14 2.645 -7.379 -1.139
80 H MET 15 H MET 15 3.017 -4.809 -4.968
81 HA MET 15 HA MET 15 5.678 -5.748 -4.479
82 HB2 MET 15 HB2 MET 15 4.560 -3.760 -6.437
83 HB3 MET 15 HB3 MET 15 6.278 -4.119 -6.327
84 HG2 MET 15 HG2 MET 15 5.668 -6.542 -6.674
85 HG3 MET 15 HG3 MET 15 4.047 -5.981 -7.073
86 HE1 MET 15 HE1 MET 15 7.787 -4.708 -9.446
87 HE2 MET 15 HE2 MET 15 7.848 -5.692 -7.984
88 HE3 MET 15 HE3 MET 15 7.325 -4.009 -7.893
89 H TRP 16 H TRP 16 6.723 -5.132 -2.812
90 HA TRP 16 HA TRP 16 7.244 -2.274 -2.447
91 HB2 TRP 16 HB2 TRP 16 6.373 -4.285 -0.445
92 HB3 TRP 16 HB3 TRP 16 7.658 -3.201 0.051
93 HD1 TRP 16 HD1 TRP 16 7.003 -0.484 -0.278
94 HE1 TRP 16 HE1 TRP 16 4.778 0.673 0.301
95 HE3 TRP 16 HE3 TRP 16 3.953 -4.573 -0.258
96 HZ2 TRP 16 HZ2 TRP 16 2.093 -0.052 0.710
97 HZ3 TRP 16 HZ3 TRP 16 1.566 -4.256 0.241
98 HH2 TRP 16 HH2 TRP 16 0.655 -2.042 0.716
99 H THR 17 H THR 17 9.339 -1.763 -2.289
100 HA THR 17 HA THR 17 11.256 -4.001 -2.276
101 HB THR 17 HB THR 17 12.736 -2.578 -3.640
102 HG1 THR 17 HG1 THR 17 10.506 -0.804 -3.805
103 HG21 THR 17 HG21 THR 17 10.599 -3.993 -4.486
104 HG22 THR 17 HG22 THR 17 11.755 -3.224 -5.571
105 HG23 THR 17 HG23 THR 17 10.234 -2.418 -5.187
106 H GLU 18 H GLU 18 13.124 -3.786 -1.050
107 HA GLU 18 HA GLU 18 12.806 -2.048 1.258
108 HB2 GLU 18 HB2 GLU 18 13.349 -4.495 1.443
109 HB3 GLU 18 HB3 GLU 18 14.918 -4.146 0.730
110 HG2 GLU 18 HG2 GLU 18 15.394 -2.629 2.623
111 HG3 GLU 18 HG3 GLU 18 13.857 -3.105 3.346
112 H HIS 19 H HIS 19 13.867 -0.210 1.544
113 HA HIS 19 HA HIS 19 16.528 0.133 0.372
114 HB2 HIS 19 HB2 HIS 19 14.343 2.215 0.094
115 HB3 HIS 19 HB3 HIS 19 16.013 2.398 -0.421
116 HD1 HIS 19 HD1 HIS 19 16.742 0.911 -2.532
117 HD2 HIS 19 HD2 HIS 19 12.672 1.028 -1.688
118 HE1 HIS 19 HE1 HIS 19 15.594 0.086 -4.613
119 HE2 HIS 19 HE2 HIS 19 13.152 -0.047 -3.984
120 H LYS 20 H LYS 20 17.897 1.130 1.798
121 HA LYS 20 HA LYS 20 16.596 2.499 4.050
122 HB2 LYS 20 HB2 LYS 20 17.709 1.268 5.543
123 HB3 LYS 20 HB3 LYS 20 18.057 0.182 4.214
124 HG2 LYS 20 HG2 LYS 20 19.865 2.407 5.129
125 HG3 LYS 20 HG3 LYS 20 20.010 0.724 5.625
126 HD2 LYS 20 HD2 LYS 20 20.537 1.973 2.959
127 HD3 LYS 20 HD3 LYS 20 21.566 0.910 3.915
128 HE2 LYS 20 HE2 LYS 20 19.876 -0.911 3.478
129 HE3 LYS 20 HE3 LYS 20 19.119 0.177 2.328
130 HZ1 LYS 20 HZ1 LYS 20 21.256 0.299 1.144
131 HZ2 LYS 20 HZ2 LYS 20 20.627 -1.275 1.176
132 HZ3 LYS 20 HZ3 LYS 20 21.905 -0.851 2.207
133 H SER 21 H SER 21 17.406 4.394 4.747
134 HA SER 21 HA SER 21 19.220 5.846 3.048
135 HB2 SER 21 HB2 SER 21 17.994 6.542 5.737
136 HB3 SER 21 HB3 SER 21 18.895 7.660 4.716
137 HG SER 21 HG SER 21 17.057 6.649 3.163
138 HA PRO 22 HA PRO 22 23.127 4.799 4.762
139 HB2 PRO 22 HB2 PRO 22 23.541 7.746 5.018
140 HB3 PRO 22 HB3 PRO 22 24.575 6.520 4.273
141 HG2 PRO 22 HG2 PRO 22 23.117 8.113 2.745
142 HG3 PRO 22 HG3 PRO 22 23.259 6.388 2.355
143 HD2 PRO 22 HD2 PRO 22 20.985 7.870 3.603
144 HD3 PRO 22 HD3 PRO 22 20.955 6.531 2.439
145 H ASP 23 H ASP 23 20.951 6.759 6.573
146 HA ASP 23 HA ASP 23 22.565 6.908 8.957
147 HB2 ASP 23 HB2 ASP 23 20.866 8.621 8.338
148 HB3 ASP 23 HB3 ASP 23 19.605 7.424 8.596
149 H GLY 24 H GLY 24 20.814 4.455 7.492
150 HA2 GLY 24 HA2 GLY 24 20.679 2.260 8.402
151 HA3 GLY 24 HA3 GLY 24 20.686 2.955 10.017
152 H ARG 25 H ARG 25 18.645 4.681 8.020
153 HA ARG 25 HA ARG 25 16.301 3.586 9.344
154 HB2 ARG 25 HB2 ARG 25 16.484 5.871 7.386
155 HB3 ARG 25 HB3 ARG 25 15.129 5.505 8.440
156 HG2 ARG 25 HG2 ARG 25 17.838 6.570 9.167
157 HG3 ARG 25 HG3 ARG 25 16.253 7.304 9.439
158 HD2 ARG 25 HD2 ARG 25 15.701 5.460 10.971
159 HD3 ARG 25 HD3 ARG 25 17.314 4.807 10.726
160 HE ARG 25 HE ARG 25 18.081 7.070 11.637
161 HH11 ARG 25 HH11 ARG 25 15.160 5.411 12.644
162 HH12 ARG 25 HH12 ARG 25 15.116 6.163 14.211
163 HH21 ARG 25 HH21 ARG 25 18.047 8.036 13.705
164 HH22 ARG 25 HH22 ARG 25 16.762 7.652 14.815
165 H THR 26 H THR 26 15.099 2.008 8.394
166 HA THR 26 HA THR 26 15.463 1.611 5.502
167 HB THR 26 HB THR 26 14.449 -0.392 7.527
168 HG1 THR 26 HG1 THR 26 16.476 -0.971 7.831
169 HG21 THR 26 HG21 THR 26 15.325 -0.698 4.643
170 HG22 THR 26 HG22 THR 26 13.691 -0.903 5.281
171 HG23 THR 26 HG23 THR 26 14.964 -2.033 5.740
172 H TYR 27 H TYR 27 13.847 1.984 4.180
173 HA TYR 27 HA TYR 27 11.096 1.761 5.170
174 HB2 TYR 27 HB2 TYR 27 10.596 3.659 3.480
175 HB3 TYR 27 HB3 TYR 27 11.289 4.092 5.038
176 HD1 TYR 27 HD1 TYR 27 12.504 3.112 1.639
177 HD2 TYR 27 HD2 TYR 27 12.961 5.668 4.998
178 HE1 TYR 27 HE1 TYR 27 14.326 4.285 0.482
179 HE2 TYR 27 HE2 TYR 27 14.792 6.848 3.861
180 HH TYR 27 HH TYR 27 15.492 6.407 0.537
181 H TYR 28 H TYR 28 9.664 1.969 2.960
182 HA TYR 28 HA TYR 28 10.862 0.004 1.129
183 HB2 TYR 28 HB2 TYR 28 7.978 0.018 2.016
184 HB3 TYR 28 HB3 TYR 28 8.778 -1.197 1.023
185 HD1 TYR 28 HD2 TYR 28 10.665 -2.559 2.107
186 HD2 TYR 28 HD1 TYR 28 7.921 -0.193 4.336
187 HE1 TYR 28 HE2 TYR 28 11.223 -3.831 4.137
188 HE2 TYR 28 HE1 TYR 28 8.474 -1.453 6.369
189 HH TYR 28 HH TYR 28 11.122 -3.619 6.540
190 H TYR 29 H TYR 29 10.234 0.151 -1.041
191 HA TYR 29 HA TYR 29 8.661 2.553 -1.669
192 HB2 TYR 29 HB2 TYR 29 10.606 3.132 -2.681
193 HB3 TYR 29 HB3 TYR 29 11.129 1.465 -2.866
194 HD1 TYR 29 HD1 TYR 29 8.324 3.592 -4.263
195 HD2 TYR 29 HD2 TYR 29 11.453 0.833 -4.965
196 HE1 TYR 29 HE1 TYR 29 7.809 3.646 -6.679
197 HE2 TYR 29 HE2 TYR 29 10.964 0.857 -7.378
198 HH TYR 29 HH TYR 29 9.081 1.353 -8.855
199 H ASN 30 H ASN 30 6.826 2.268 -2.492
200 HA ASN 30 HA ASN 30 5.939 -0.363 -3.352
201 HB2 ASN 30 HB2 ASN 30 4.609 0.994 -1.741
202 HB3 ASN 30 HB3 ASN 30 4.441 2.242 -2.961
203 HD21 ASN 30 HD21 ASN 30 3.520 -1.014 -2.067
204 HD22 ASN 30 HD22 ASN 30 2.162 -1.112 -3.136
205 H THR 31 H THR 31 6.206 -0.849 -5.449
206 HA THR 31 HA THR 31 6.933 1.153 -7.354
207 HB THR 31 HB THR 31 7.003 -0.683 -8.976
208 HG1 THR 31 HG1 THR 31 5.282 -1.969 -8.433
209 HG21 THR 31 HG21 THR 31 8.123 -1.317 -6.251
210 HG22 THR 31 HG22 THR 31 8.929 -0.457 -7.566
211 HG23 THR 31 HG23 THR 31 8.577 -2.179 -7.723
212 H GLU 32 H GLU 32 3.987 -0.204 -6.344
213 HA GLU 32 HA GLU 32 2.504 0.057 -8.750
214 HB2 GLU 32 HB2 GLU 32 0.866 0.120 -6.389
215 HB3 GLU 32 HB3 GLU 32 1.045 -1.162 -7.573
216 HG2 GLU 32 HG2 GLU 32 3.173 -1.788 -6.335
217 HG3 GLU 32 HG3 GLU 32 2.613 -0.711 -5.069
218 H THR 33 H THR 33 2.649 1.911 -5.735
219 HA THR 33 HA THR 33 1.108 4.070 -6.944
220 HB THR 33 HB THR 33 0.971 5.000 -4.707
221 HG1 THR 33 HG1 THR 33 2.123 3.342 -3.099
222 HG21 THR 33 HG21 THR 33 0.654 1.984 -4.703
223 HG22 THR 33 HG22 THR 33 -0.573 3.177 -5.164
224 HG23 THR 33 HG23 THR 33 -0.030 3.077 -3.488
225 H LYS 34 H LYS 34 4.267 3.142 -6.556
226 HA LYS 34 HA LYS 34 6.261 4.091 -7.033
227 HB2 LYS 34 HB2 LYS 34 4.463 6.257 -8.086
228 HB3 LYS 34 HB3 LYS 34 6.217 6.389 -8.149
229 HG2 LYS 34 HG2 LYS 34 4.728 4.049 -9.261
230 HG3 LYS 34 HG3 LYS 34 5.093 5.497 -10.217
231 HD2 LYS 34 HD2 LYS 34 7.483 5.187 -9.709
232 HD3 LYS 34 HD3 LYS 34 7.090 3.708 -8.833
233 HE2 LYS 34 HE2 LYS 34 6.210 2.720 -10.876
234 HE3 LYS 34 HE3 LYS 34 6.558 4.209 -11.757
235 HZ1 LYS 34 HZ1 LYS 34 8.910 3.904 -11.256
236 HZ2 LYS 34 HZ2 LYS 34 8.294 2.579 -12.111
237 HZ3 LYS 34 HZ3 LYS 34 8.562 2.458 -10.445
238 H GLN 35 H GLN 35 5.111 4.339 -4.416
239 HA GLN 35 HA GLN 35 6.256 6.923 -3.573
240 HB2 GLN 35 HB2 GLN 35 4.159 5.232 -2.233
241 HB3 GLN 35 HB3 GLN 35 4.885 6.663 -1.514
242 HG2 GLN 35 HG2 GLN 35 4.079 7.935 -3.531
243 HG3 GLN 35 HG3 GLN 35 3.150 6.497 -3.949
244 HE21 GLN 35 HE21 GLN 35 2.270 9.186 -3.213
245 HE22 GLN 35 HE22 GLN 35 1.225 8.985 -1.850
246 H SER 36 H SER 36 7.505 7.011 -1.671
247 HA SER 36 HA SER 36 8.567 4.419 -0.762
248 HB2 SER 36 HB2 SER 36 10.270 5.992 -1.586
249 HB3 SER 36 HB3 SER 36 9.698 7.224 -0.460
250 HG SER 36 HG SER 36 10.639 6.205 1.160
251 H THR 37 H THR 37 8.159 3.806 1.316
252 HA THR 37 HA THR 37 6.614 5.580 3.030
253 HB THR 37 HB THR 37 5.054 4.617 1.313
254 HG1 THR 37 HG1 THR 37 3.871 5.074 3.024
255 HG21 THR 37 HG21 THR 37 5.911 2.041 2.621
256 HG22 THR 37 HG22 THR 37 5.953 2.462 0.907
257 HG23 THR 37 HG23 THR 37 4.406 2.199 1.711
258 H TRP 38 H TRP 38 5.947 4.455 5.055
259 HA TRP 38 HA TRP 38 8.175 2.889 6.034
260 HB2 TRP 38 HB2 TRP 38 7.560 3.480 8.182
261 HB3 TRP 38 HB3 TRP 38 7.050 4.877 7.253
262 HD1 TRP 38 HD1 TRP 38 5.945 3.270 10.101
263 HE1 TRP 38 HE1 TRP 38 3.388 3.245 10.397
264 HE3 TRP 38 HE3 TRP 38 4.550 4.282 5.280
265 HZ2 TRP 38 HZ2 TRP 38 1.097 3.598 8.805
266 HZ3 TRP 38 HZ3 TRP 38 2.152 4.418 4.760
267 HH2 TRP 38 HH2 TRP 38 0.462 4.080 6.486
268 H GLU 39 H GLU 39 7.304 1.189 7.868
269 HA GLU 39 HA GLU 39 6.683 -1.071 6.422
270 HB2 GLU 39 HB2 GLU 39 6.078 -2.073 8.668
271 HB3 GLU 39 HB3 GLU 39 7.667 -1.331 8.549
272 HG2 GLU 39 HG2 GLU 39 6.648 0.737 9.562
273 HG3 GLU 39 HG3 GLU 39 5.217 -0.240 9.893
274 H LYS 40 H LYS 40 4.851 -2.257 5.982
275 HA LYS 40 HA LYS 40 2.480 -0.558 5.888
276 HB2 LYS 40 HB2 LYS 40 2.250 -2.036 3.649
277 HB3 LYS 40 HB3 LYS 40 3.070 -0.482 3.716
278 HG2 LYS 40 HG2 LYS 40 4.543 -1.895 2.574
279 HG3 LYS 40 HG3 LYS 40 5.193 -1.794 4.205
280 HD2 LYS 40 HD2 LYS 40 4.003 -3.933 4.712
281 HD3 LYS 40 HD3 LYS 40 3.609 -4.048 2.996
282 HE2 LYS 40 HE2 LYS 40 5.548 -5.370 3.369
283 HE3 LYS 40 HE3 LYS 40 6.065 -3.918 2.514
284 HZ1 LYS 40 HZ1 LYS 40 6.939 -3.020 4.512
285 HZ2 LYS 40 HZ2 LYS 40 7.506 -4.617 4.420
286 HZ3 LYS 40 HZ3 LYS 40 6.225 -4.226 5.465
287 HA PRO 41 HA PRO 41 -0.298 -3.438 7.588
288 HB2 PRO 41 HB2 PRO 41 -2.379 -3.290 5.793
289 HB3 PRO 41 HB3 PRO 41 -2.042 -2.109 7.062
290 HG2 PRO 41 HG2 PRO 41 -1.296 -2.044 4.168
291 HG3 PRO 41 HG3 PRO 41 -1.953 -0.745 5.183
292 HD2 PRO 41 HD2 PRO 41 0.641 -0.829 4.619
293 HD3 PRO 41 HD3 PRO 41 0.088 -0.382 6.248
294 H ASP 42 H ASP 42 -2.062 -5.034 6.903
295 HA ASP 42 HA ASP 42 -0.962 -7.482 6.328
296 HB2 ASP 42 HB2 ASP 42 -3.761 -6.457 6.400
297 HB3 ASP 42 HB3 ASP 42 -3.445 -8.127 5.939
298 H ASP 43 H ASP 43 -0.962 -5.417 3.837
299 HA ASP 43 HA ASP 43 -2.222 -6.826 1.749
300 HB2 ASP 43 HB2 ASP 43 0.204 -5.049 1.781
301 HB3 ASP 43 HB3 ASP 43 -0.390 -5.780 0.295
302 H LEU 44 H LEU 44 0.741 -7.311 3.447
303 HA LEU 44 HA LEU 44 1.898 -9.193 1.666
304 HB2 LEU 44 HB2 LEU 44 2.397 -8.917 4.619
305 HB3 LEU 44 HB3 LEU 44 3.447 -9.664 3.424
306 HG LEU 44 HG LEU 44 2.731 -6.813 3.031
307 HD11 LEU 44 HD11 LEU 44 4.614 -7.844 5.143
308 HD12 LEU 44 HD12 LEU 44 3.231 -6.762 5.352
309 HD13 LEU 44 HD13 LEU 44 4.671 -6.201 4.501
310 HD21 LEU 44 HD21 LEU 44 5.068 -6.753 2.226
311 HD22 LEU 44 HD22 LEU 44 4.080 -7.940 1.374
312 HD23 LEU 44 HD23 LEU 44 5.219 -8.468 2.614
313 H LYS 45 H LYS 45 -0.631 -9.444 4.017
314 HA LYS 45 HA LYS 45 -0.397 -12.286 4.325
315 HB2 LYS 45 HB2 LYS 45 -2.995 -10.824 4.626
316 HB3 LYS 45 HB3 LYS 45 -2.397 -12.210 5.522
317 HG2 LYS 45 HG2 LYS 45 -1.414 -9.382 5.777
318 HG3 LYS 45 HG3 LYS 45 -2.477 -10.220 6.904
319 HD2 LYS 45 HD2 LYS 45 -0.492 -11.952 6.928
320 HD3 LYS 45 HD3 LYS 45 0.428 -10.530 6.441
321 HE2 LYS 45 HE2 LYS 45 -0.371 -9.298 8.322
322 HE3 LYS 45 HE3 LYS 45 -1.400 -10.642 8.819
323 HZ1 LYS 45 HZ1 LYS 45 0.531 -11.944 9.310
324 HZ2 LYS 45 HZ2 LYS 45 0.728 -10.441 10.072
325 HZ3 LYS 45 HZ3 LYS 45 1.569 -10.780 8.639
326 H THR 46 H THR 46 -3.228 -10.652 3.069
327 HA THR 46 HA THR 46 -3.202 -11.747 0.446
328 HB THR 46 HB THR 46 -5.358 -12.930 2.189
329 HG1 THR 46 HG1 THR 46 -2.707 -13.746 2.045
330 HG21 THR 46 HG21 THR 46 -5.713 -13.007 -0.197
331 HG22 THR 46 HG22 THR 46 -5.452 -14.635 0.426
332 HG23 THR 46 HG23 THR 46 -4.156 -13.798 -0.430
333 HA PRO 47 HA PRO 47 -5.905 -8.244 -0.036
334 HB2 PRO 47 HB2 PRO 47 -7.657 -10.104 -1.575
335 HB3 PRO 47 HB3 PRO 47 -7.117 -8.471 -1.996
336 HG2 PRO 47 HG2 PRO 47 -5.932 -10.546 -3.127
337 HG3 PRO 47 HG3 PRO 47 -4.951 -9.192 -2.533
338 HD2 PRO 47 HD2 PRO 47 -5.388 -11.893 -1.338
339 HD3 PRO 47 HD3 PRO 47 -3.919 -10.908 -1.368
340 H ALA 48 H ALA 48 -7.675 -11.294 0.525
341 HA ALA 48 HA ALA 48 -9.907 -10.018 1.699
342 HB1 ALA 48 HB1 ALA 48 -9.723 -12.367 0.665
343 HB2 ALA 48 HB2 ALA 48 -10.767 -12.114 2.055
344 HB3 ALA 48 HB3 ALA 48 -9.184 -12.859 2.273
345 H GLU 49 H GLU 49 -6.980 -11.481 3.074
346 HA GLU 49 HA GLU 49 -7.726 -11.265 5.760
347 HB2 GLU 49 HB2 GLU 49 -5.007 -11.229 4.460
348 HB3 GLU 49 HB3 GLU 49 -5.214 -11.170 6.214
349 HG2 GLU 49 HG2 GLU 49 -6.654 -13.272 5.907
350 HG3 GLU 49 HG3 GLU 49 -5.934 -13.371 4.304
351 H GLN 50 H GLN 50 -6.553 -8.893 3.493
352 HA GLN 50 HA GLN 50 -5.852 -6.833 5.224
353 HB2 GLN 50 HB2 GLN 50 -7.266 -6.530 2.579
354 HB3 GLN 50 HB3 GLN 50 -6.243 -5.342 3.374
355 HG2 GLN 50 HG2 GLN 50 -4.323 -6.839 3.113
356 HG3 GLN 50 HG3 GLN 50 -5.365 -8.002 2.281
357 HE21 GLN 50 HE21 GLN 50 -4.187 -7.882 0.352
358 HE22 GLN 50 HE22 GLN 50 -4.204 -6.481 -0.665
359 H LEU 51 H LEU 51 -9.080 -7.820 4.087
360 HA LEU 51 HA LEU 51 -10.431 -5.448 4.620
361 HB2 LEU 51 HB2 LEU 51 -12.456 -6.634 4.413
362 HB3 LEU 51 HB3 LEU 51 -11.305 -7.349 3.306
363 HG LEU 51 HG LEU 51 -10.991 -9.009 5.391
364 HD11 LEU 51 HD11 LEU 51 -13.888 -8.177 5.475
365 HD12 LEU 51 HD12 LEU 51 -12.697 -7.904 6.748
366 HD13 LEU 51 HD13 LEU 51 -13.175 -9.549 6.324
367 HD21 LEU 51 HD21 LEU 51 -12.502 -10.520 4.159
368 HD22 LEU 51 HD22 LEU 51 -11.373 -9.652 3.108
369 HD23 LEU 51 HD23 LEU 51 -13.066 -9.140 3.208
370 H LEU 52 H LEU 52 -9.538 -7.993 6.835
371 HA LEU 52 HA LEU 52 -11.147 -7.007 9.004
372 HB2 LEU 52 HB2 LEU 52 -8.745 -8.817 9.219
373 HB3 LEU 52 HB3 LEU 52 -10.047 -8.638 10.378
374 HG LEU 52 HG LEU 52 -11.531 -9.513 8.388
375 HD11 LEU 52 HD11 LEU 52 -8.958 -10.896 7.720
376 HD12 LEU 52 HD12 LEU 52 -9.461 -9.427 6.881
377 HD13 LEU 52 HD13 LEU 52 -10.475 -10.877 6.816
378 HD21 LEU 52 HD21 LEU 52 -11.206 -11.794 9.197
379 HD22 LEU 52 HD22 LEU 52 -11.247 -10.639 10.529
380 HD23 LEU 52 HD23 LEU 52 -9.707 -11.304 9.985
381 H SER 53 H SER 53 -7.698 -6.919 8.216
382 HA SER 53 HA SER 53 -7.023 -5.283 10.485
383 HB2 SER 53 HB2 SER 53 -5.415 -6.017 8.034
384 HB3 SER 53 HB3 SER 53 -4.753 -5.330 9.514
385 HG SER 53 HG SER 53 -4.785 -7.785 9.134
386 H LYS 54 H LYS 54 -6.384 -4.775 7.062
387 HA LYS 54 HA LYS 54 -7.260 -1.988 7.247
388 HB2 LYS 54 HB2 LYS 54 -4.543 -2.836 6.209
389 HB3 LYS 54 HB3 LYS 54 -5.209 -1.214 6.103
390 HG2 LYS 54 HG2 LYS 54 -4.617 -2.676 8.667
391 HG3 LYS 54 HG3 LYS 54 -3.565 -1.472 7.914
392 HD2 LYS 54 HD2 LYS 54 -6.367 -1.011 8.950
393 HD3 LYS 54 HD3 LYS 54 -4.870 -0.451 9.697
394 HE2 LYS 54 HE2 LYS 54 -4.408 0.899 7.683
395 HE3 LYS 54 HE3 LYS 54 -5.948 0.379 7.002
396 HZ1 LYS 54 HZ1 LYS 54 -5.478 2.109 9.357
397 HZ2 LYS 54 HZ2 LYS 54 -6.972 1.356 9.091
398 HZ3 LYS 54 HZ3 LYS 54 -6.362 2.454 7.955
399 H CYS 55 H CYS 55 -8.485 -1.536 5.539
400 HA CYS 55 HA CYS 55 -9.410 -3.705 4.050
401 HB2 CYS 55 HB2 CYS 55 -10.706 -1.825 2.849
402 HB3 CYS 55 HB3 CYS 55 -10.965 -2.065 4.575
403 HG CYS 55 HG CYS 55 -9.203 0.427 3.043
404 HA PRO 56 HA PRO 56 -7.380 -4.051 0.137
405 HB2 PRO 56 HB2 PRO 56 -9.978 -3.222 -1.096
406 HB3 PRO 56 HB3 PRO 56 -8.924 -4.582 -1.504
407 HG2 PRO 56 HG2 PRO 56 -11.138 -4.989 -0.102
408 HG3 PRO 56 HG3 PRO 56 -9.643 -5.852 0.304
409 HD2 PRO 56 HD2 PRO 56 -10.953 -3.570 1.699
410 HD3 PRO 56 HD3 PRO 56 -10.016 -4.920 2.369
411 H TRP 57 H TRP 57 -9.636 -1.300 0.250
412 HA TRP 57 HA TRP 57 -7.876 0.368 -1.324
413 HB2 TRP 57 HB2 TRP 57 -10.381 1.026 0.253
414 HB3 TRP 57 HB3 TRP 57 -9.525 2.154 -0.787
415 HD1 TRP 57 HD1 TRP 57 -9.653 1.704 -3.451
416 HE1 TRP 57 HE1 TRP 57 -11.465 0.513 -4.847
417 HE3 TRP 57 HE3 TRP 57 -12.021 -0.887 0.282
418 HZ2 TRP 57 HZ2 TRP 57 -13.596 -1.279 -4.431
419 HZ3 TRP 57 HZ3 TRP 57 -13.931 -2.320 -0.309
420 HH2 TRP 57 HH2 TRP 57 -14.702 -2.511 -2.616
421 H LYS 58 H LYS 58 -6.148 1.378 -0.439
422 HA LYS 58 HA LYS 58 -6.303 2.012 2.440
423 HB2 LYS 58 HB2 LYS 58 -4.530 0.249 1.237
424 HB3 LYS 58 HB3 LYS 58 -3.600 1.705 1.586
425 HG2 LYS 58 HG2 LYS 58 -3.413 0.865 3.633
426 HG3 LYS 58 HG3 LYS 58 -5.054 1.427 3.864
427 HD2 LYS 58 HD2 LYS 58 -4.873 -0.880 4.574
428 HD3 LYS 58 HD3 LYS 58 -5.894 -0.764 3.137
429 HE2 LYS 58 HE2 LYS 58 -3.816 -1.292 1.795
430 HE3 LYS 58 HE3 LYS 58 -3.045 -1.695 3.325
431 HZ1 LYS 58 HZ1 LYS 58 -5.413 -3.001 2.121
432 HZ2 LYS 58 HZ2 LYS 58 -4.854 -3.321 3.682
433 HZ3 LYS 58 HZ3 LYS 58 -3.870 -3.669 2.344
434 H GLU 59 H GLU 59 -5.269 3.786 3.196
435 HA GLU 59 HA GLU 59 -4.207 5.676 1.214
436 HB2 GLU 59 HB2 GLU 59 -6.204 6.712 1.780
437 HB3 GLU 59 HB3 GLU 59 -6.211 6.058 3.408
438 HG2 GLU 59 HG2 GLU 59 -4.100 8.022 2.767
439 HG3 GLU 59 HG3 GLU 59 -5.755 8.622 2.839
440 H TYR 60 H TYR 60 -2.091 5.974 1.562
441 HA TYR 60 HA TYR 60 -1.258 6.482 4.311
442 HB2 TYR 60 HB2 TYR 60 0.866 5.224 3.979
443 HB3 TYR 60 HB3 TYR 60 -0.556 4.192 4.018
444 HD1 TYR 60 HD1 TYR 60 1.948 5.745 1.741
445 HD2 TYR 60 HD2 TYR 60 -1.053 2.757 2.224
446 HE1 TYR 60 HE1 TYR 60 2.647 4.691 -0.366
447 HE2 TYR 60 HE2 TYR 60 -0.356 1.714 0.114
448 HH TYR 60 HH TYR 60 0.804 2.173 -1.869
449 H LYS 61 H LYS 61 0.616 7.812 4.463
450 HA LYS 61 HA LYS 61 1.129 9.308 1.993
451 HB2 LYS 61 HB2 LYS 61 1.673 10.031 4.868
452 HB3 LYS 61 HB3 LYS 61 2.133 11.020 3.492
453 HG2 LYS 61 HG2 LYS 61 -0.311 11.085 2.880
454 HG3 LYS 61 HG3 LYS 61 -0.632 10.357 4.455
455 HD2 LYS 61 HD2 LYS 61 0.659 13.021 3.887
456 HD3 LYS 61 HD3 LYS 61 -0.896 12.724 4.666
457 HE2 LYS 61 HE2 LYS 61 1.814 11.968 5.738
458 HE3 LYS 61 HE3 LYS 61 0.812 13.307 6.300
459 HZ1 LYS 61 HZ1 LYS 61 -0.043 10.461 6.401
460 HZ2 LYS 61 HZ2 LYS 61 -0.840 11.791 7.084
461 HZ3 LYS 61 HZ3 LYS 61 0.653 11.288 7.707
462 H SER 62 H SER 62 3.113 9.459 1.158
463 HA SER 62 HA SER 62 5.082 7.536 1.787
464 HB2 SER 62 HB2 SER 62 6.033 9.855 0.316
465 HB3 SER 62 HB3 SER 62 5.902 8.175 -0.219
466 HG SER 62 HG SER 62 3.654 8.581 -0.567
467 H ASP 63 H ASP 63 7.504 8.517 1.949
468 HA ASP 63 HA ASP 63 7.853 9.760 4.431
469 HB2 ASP 63 HB2 ASP 63 10.158 10.113 3.789
470 HB3 ASP 63 HB3 ASP 63 9.641 8.543 3.186
471 H SER 64 H SER 64 7.354 11.059 1.245
472 HA SER 64 HA SER 64 7.873 13.784 1.991
473 HB2 SER 64 HB2 SER 64 6.494 12.724 -0.482
474 HB3 SER 64 HB3 SER 64 7.281 14.294 -0.287
475 HG SER 64 HG SER 64 9.023 12.363 0.356
476 H GLY 65 H GLY 65 5.308 11.646 2.369
477 HA2 GLY 65 HA2 GLY 65 3.359 12.023 3.562
478 HA3 GLY 65 HA3 GLY 65 3.638 13.750 3.466
479 H LYS 66 H LYS 66 3.798 12.022 0.509
480 HA LYS 66 HA LYS 66 1.361 13.158 -0.494
481 HB2 LYS 66 HB2 LYS 66 3.279 12.731 -1.969
482 HB3 LYS 66 HB3 LYS 66 3.173 11.013 -1.629
483 HG2 LYS 66 HG2 LYS 66 2.238 11.552 -3.810
484 HG3 LYS 66 HG3 LYS 66 1.008 10.904 -2.724
485 HD2 LYS 66 HD2 LYS 66 0.269 12.860 -4.095
486 HD3 LYS 66 HD3 LYS 66 0.092 13.076 -2.352
487 HE2 LYS 66 HE2 LYS 66 2.081 14.406 -2.258
488 HE3 LYS 66 HE3 LYS 66 2.429 14.086 -3.961
489 HZ1 LYS 66 HZ1 LYS 66 0.085 15.582 -2.919
490 HZ2 LYS 66 HZ2 LYS 66 0.408 15.274 -4.551
491 HZ3 LYS 66 HZ3 LYS 66 1.449 16.268 -3.655
492 H THR 67 H THR 67 -0.624 12.351 0.051
493 HA THR 67 HA THR 67 -0.856 9.633 1.021
494 HB THR 67 HB THR 67 -3.429 10.751 0.486
495 HG1 THR 67 HG1 THR 67 -2.913 12.570 2.138
496 HG21 THR 67 HG21 THR 67 -2.489 9.156 2.302
497 HG22 THR 67 HG22 THR 67 -3.799 10.266 2.719
498 HG23 THR 67 HG23 THR 67 -2.139 10.646 3.183
499 H TYR 68 H TYR 68 -1.385 7.918 -0.144
500 HA TYR 68 HA TYR 68 -2.673 8.370 -2.750
501 HB2 TYR 68 HB2 TYR 68 -0.224 6.940 -2.140
502 HB3 TYR 68 HB3 TYR 68 -1.401 5.894 -2.929
503 HD1 TYR 68 HD2 TYR 68 -0.538 9.507 -3.359
504 HD2 TYR 68 HD1 TYR 68 -0.852 5.666 -5.154
505 HE1 TYR 68 HE2 TYR 68 0.053 10.481 -5.534
506 HE2 TYR 68 HE1 TYR 68 -0.258 6.630 -7.336
507 HH TYR 68 HH TYR 68 -0.317 8.787 -8.465
508 H TYR 69 H TYR 69 -4.234 6.941 -3.375
509 HA TYR 69 HA TYR 69 -5.202 5.084 -1.302
510 HB2 TYR 69 HB2 TYR 69 -6.496 7.317 -1.812
511 HB3 TYR 69 HB3 TYR 69 -7.020 6.465 -3.259
512 HD1 TYR 69 HD1 TYR 69 -6.951 6.224 0.440
513 HD2 TYR 69 HD2 TYR 69 -8.853 5.007 -3.166
514 HE1 TYR 69 HE1 TYR 69 -8.758 5.189 1.748
515 HE2 TYR 69 HE2 TYR 69 -10.664 3.972 -1.870
516 HH TYR 69 HH TYR 69 -11.149 4.581 1.410
517 H TYR 70 H TYR 70 -5.371 3.003 -2.055
518 HA TYR 70 HA TYR 70 -5.318 2.680 -4.966
519 HB2 TYR 70 HB2 TYR 70 -3.455 1.166 -4.922
520 HB3 TYR 70 HB3 TYR 70 -2.974 2.642 -4.095
521 HD1 TYR 70 HD1 TYR 70 -3.787 -0.915 -3.683
522 HD2 TYR 70 HD2 TYR 70 -2.499 2.632 -1.725
523 HE1 TYR 70 HE1 TYR 70 -3.124 -2.252 -1.731
524 HE2 TYR 70 HE2 TYR 70 -1.831 1.307 0.234
525 HH TYR 70 HH TYR 70 -1.855 -2.195 0.191
526 H ASN 71 H ASN 71 -6.079 0.836 -5.794
527 HA ASN 71 HA ASN 71 -7.748 -0.883 -4.141
528 HB2 ASN 71 HB2 ASN 71 -7.179 -0.684 -7.109
529 HB3 ASN 71 HB3 ASN 71 -8.128 -1.996 -6.430
530 HD21 ASN 71 HD21 ASN 71 -8.009 1.426 -7.061
531 HD22 ASN 71 HD22 ASN 71 -9.702 1.705 -6.879
532 H SER 72 H SER 72 -6.566 -2.401 -3.001
533 HA SER 72 HA SER 72 -4.008 -3.246 -3.899
534 HB2 SER 72 HB2 SER 72 -4.635 -3.079 -1.500
535 HB3 SER 72 HB3 SER 72 -5.671 -4.488 -1.704
536 HG SER 72 HG SER 72 -3.141 -4.503 -1.089
537 H GLN 73 H GLN 73 -7.210 -4.791 -4.087
538 HA GLN 73 HA GLN 73 -6.185 -7.363 -4.656
539 HB2 GLN 73 HB2 GLN 73 -8.420 -7.990 -5.303
540 HB3 GLN 73 HB3 GLN 73 -8.462 -7.083 -3.806
541 HG2 GLN 73 HG2 GLN 73 -9.198 -6.070 -6.546
542 HG3 GLN 73 HG3 GLN 73 -10.327 -6.568 -5.294
543 HE21 GLN 73 HE21 GLN 73 -8.489 -4.039 -6.589
544 HE22 GLN 73 HE22 GLN 73 -8.872 -2.849 -5.392
545 H THR 74 H THR 74 -6.916 -4.663 -6.673
546 HA THR 74 HA THR 74 -6.426 -6.303 -9.059
547 HB THR 74 HB THR 74 -7.604 -4.392 -10.244
548 HG1 THR 74 HG1 THR 74 -8.390 -2.779 -9.062
549 HG21 THR 74 HG21 THR 74 -9.018 -6.052 -8.138
550 HG22 THR 74 HG22 THR 74 -8.816 -6.422 -9.858
551 HG23 THR 74 HG23 THR 74 -9.875 -5.101 -9.363
552 H LYS 75 H LYS 75 -5.010 -4.222 -7.013
553 HA LYS 75 HA LYS 75 -3.188 -2.943 -6.962
554 HB2 LYS 75 HB2 LYS 75 -2.551 -4.760 -9.257
555 HB3 LYS 75 HB3 LYS 75 -1.401 -3.553 -8.688
556 HG2 LYS 75 HG2 LYS 75 -2.626 -5.769 -7.052
557 HG3 LYS 75 HG3 LYS 75 -0.946 -5.667 -7.613
558 HD2 LYS 75 HD2 LYS 75 -0.600 -3.665 -6.282
559 HD3 LYS 75 HD3 LYS 75 -2.290 -3.675 -5.784
560 HE2 LYS 75 HE2 LYS 75 -1.909 -5.849 -4.673
561 HE3 LYS 75 HE3 LYS 75 -0.200 -5.742 -5.109
562 HZ1 LYS 75 HZ1 LYS 75 -0.488 -4.962 -2.879
563 HZ2 LYS 75 HZ2 LYS 75 -1.704 -3.890 -3.344
564 HZ3 LYS 75 HZ3 LYS 75 -0.108 -3.624 -3.856
565 H GLU 76 H GLU 76 -5.362 -1.735 -8.121
566 HA GLU 76 HA GLU 76 -4.212 0.091 -10.078
567 HB2 GLU 76 HB2 GLU 76 -6.530 -0.386 -10.460
568 HB3 GLU 76 HB3 GLU 76 -6.934 -0.106 -8.772
569 HG2 GLU 76 HG2 GLU 76 -6.273 2.286 -9.110
570 HG3 GLU 76 HG3 GLU 76 -6.133 1.937 -10.830
571 H SER 77 H SER 77 -3.930 2.323 -9.573
572 HA SER 77 HA SER 77 -3.954 2.970 -6.708
573 HB2 SER 77 HB2 SER 77 -1.749 4.140 -7.010
574 HB3 SER 77 HB3 SER 77 -1.653 2.388 -7.170
575 HG SER 77 HG SER 77 -1.988 2.930 -9.547
576 H ARG 78 H ARG 78 -4.697 4.992 -6.247
577 HA ARG 78 HA ARG 78 -4.912 6.935 -8.435
578 HB2 ARG 78 HB2 ARG 78 -7.221 7.071 -8.415
579 HB3 ARG 78 HB3 ARG 78 -7.001 5.357 -8.116
580 HG2 ARG 78 HG2 ARG 78 -7.012 6.408 -5.585
581 HG3 ARG 78 HG3 ARG 78 -8.176 7.423 -6.437
582 HD2 ARG 78 HD2 ARG 78 -8.264 4.509 -5.844
583 HD3 ARG 78 HD3 ARG 78 -9.524 5.723 -5.692
584 HE ARG 78 HE ARG 78 -8.694 4.415 -8.200
585 HH11 ARG 78 HH11 ARG 78 -11.000 6.321 -6.385
586 HH12 ARG 78 HH12 ARG 78 -12.276 6.125 -7.548
587 HH21 ARG 78 HH21 ARG 78 -10.343 4.165 -9.731
588 HH22 ARG 78 HH22 ARG 78 -11.889 4.917 -9.470
589 H TRP 79 H TRP 79 -5.629 9.107 -7.604
590 HA TRP 79 HA TRP 79 -5.196 9.374 -4.706
591 HB2 TRP 79 HB2 TRP 79 -3.438 10.597 -5.726
592 HB3 TRP 79 HB3 TRP 79 -4.505 11.259 -6.958
593 HD1 TRP 79 HD1 TRP 79 -4.533 13.771 -6.574
594 HE1 TRP 79 HE1 TRP 79 -4.929 15.342 -4.575
595 HE3 TRP 79 HE3 TRP 79 -4.793 10.278 -2.848
596 HZ2 TRP 79 HZ2 TRP 79 -5.295 15.120 -1.778
597 HZ3 TRP 79 HZ3 TRP 79 -5.170 11.042 -0.541
598 HH2 TRP 79 HH2 TRP 79 -5.416 13.411 -0.019
599 H ALA 80 H ALA 80 -7.065 9.416 -3.828
600 HA ALA 80 HA ALA 80 -8.949 11.252 -3.582
601 HB1 ALA 80 HB1 ALA 80 -10.807 10.642 -5.125
602 HB2 ALA 80 HB2 ALA 80 -9.686 9.600 -6.004
603 HB3 ALA 80 HB3 ALA 80 -9.425 11.343 -5.968
604 H LYS 81 H LYS 81 -10.222 10.468 -1.940
605 HA LYS 81 HA LYS 81 -10.740 7.570 -1.973
606 HB2 LYS 81 HB2 LYS 81 -10.652 7.586 0.515
607 HB3 LYS 81 HB3 LYS 81 -9.113 7.895 -0.269
608 HG2 LYS 81 HG2 LYS 81 -9.294 10.255 0.221
609 HG3 LYS 81 HG3 LYS 81 -10.899 10.007 0.919
610 HD2 LYS 81 HD2 LYS 81 -9.882 8.481 2.588
611 HD3 LYS 81 HD3 LYS 81 -8.293 8.872 1.931
612 HE2 LYS 81 HE2 LYS 81 -8.824 10.158 3.961
613 HE3 LYS 81 HE3 LYS 81 -8.566 11.190 2.555
614 HZ1 LYS 81 HZ1 LYS 81 -10.546 11.687 4.060
615 HZ2 LYS 81 HZ2 LYS 81 -11.284 10.337 3.340
616 HZ3 LYS 81 HZ3 LYS 81 -10.817 11.658 2.386
617 HA PRO 82 HA PRO 82 -14.842 9.728 -1.805
618 HB2 PRO 82 HB2 PRO 82 -15.950 8.119 -3.707
619 HB3 PRO 82 HB3 PRO 82 -15.110 9.627 -4.083
620 HG2 PRO 82 HG2 PRO 82 -14.099 6.810 -4.214
621 HG3 PRO 82 HG3 PRO 82 -13.877 8.137 -5.369
622 HD2 PRO 82 HD2 PRO 82 -11.968 7.435 -3.608
623 HD3 PRO 82 HD3 PRO 82 -12.210 9.117 -4.119
624 H LYS 83 H LYS 83 -16.426 8.998 -0.502
625 HA LYS 83 HA LYS 83 -16.175 6.543 0.851
626 HB2 LYS 83 HB2 LYS 83 -18.045 7.101 2.104
627 HB3 LYS 83 HB3 LYS 83 -17.343 8.648 1.701
628 HG2 LYS 83 HG2 LYS 83 -19.774 7.372 0.465
629 HG3 LYS 83 HG3 LYS 83 -19.730 8.776 1.528
630 HD2 LYS 83 HD2 LYS 83 -18.349 9.917 -0.259
631 HD3 LYS 83 HD3 LYS 83 -18.749 8.561 -1.306
632 HE2 LYS 83 HE2 LYS 83 -21.134 9.022 -0.996
633 HE3 LYS 83 HE3 LYS 83 -20.732 10.395 0.033
634 HZ1 LYS 83 HZ1 LYS 83 -19.970 10.122 -2.828
635 HZ2 LYS 83 HZ2 LYS 83 -19.654 11.460 -1.830
636 HZ3 LYS 83 HZ3 LYS 83 -21.255 11.064 -2.241
637 H GLU 84 H GLU 84 -17.570 7.298 -2.172
638 HA GLU 84 HA GLU 84 -19.396 5.230 -2.502
639 HB2 GLU 84 HB2 GLU 84 -17.392 6.414 -4.413
640 HB3 GLU 84 HB3 GLU 84 -18.543 5.182 -4.907
641 HG2 GLU 84 HG2 GLU 84 -19.591 7.128 -5.521
642 HG3 GLU 84 HG3 GLU 84 -20.328 6.774 -3.967
643 H LEU 85 H LEU 85 -15.859 5.146 -2.742
644 HA LEU 85 HA LEU 85 -15.734 2.315 -3.218
645 HB2 LEU 85 HB2 LEU 85 -13.590 4.176 -2.189
646 HB3 LEU 85 HB3 LEU 85 -13.338 2.569 -2.833
647 HG LEU 85 HG LEU 85 -14.358 4.921 -4.420
648 HD11 LEU 85 HD11 LEU 85 -11.650 3.608 -4.463
649 HD12 LEU 85 HD12 LEU 85 -12.023 5.097 -3.597
650 HD13 LEU 85 HD13 LEU 85 -12.164 5.041 -5.356
651 HD21 LEU 85 HD21 LEU 85 -13.950 3.482 -6.354
652 HD22 LEU 85 HD22 LEU 85 -15.141 2.763 -5.270
653 HD23 LEU 85 HD23 LEU 85 -13.483 2.163 -5.281
654 H GLU 86 H GLU 86 -15.031 4.438 -0.489
655 HA GLU 86 HA GLU 86 -14.264 2.491 1.352
656 HB2 GLU 86 HB2 GLU 86 -15.616 5.118 1.964
657 HB3 GLU 86 HB3 GLU 86 -14.605 4.184 3.054
658 HG2 GLU 86 HG2 GLU 86 -12.726 4.509 1.422
659 HG3 GLU 86 HG3 GLU 86 -13.771 5.642 0.566
660 H ASP 87 H ASP 87 -17.412 3.829 0.656
661 HA ASP 87 HA ASP 87 -19.516 3.031 0.937
662 HB2 ASP 87 HB2 ASP 87 -18.437 0.737 0.712
663 HB3 ASP 87 HB3 ASP 87 -18.408 0.679 2.471
664 H LEU 88 H LEU 88 -17.296 3.597 3.389
665 HA LEU 88 HA LEU 88 -18.794 4.920 5.218
666 HB2 LEU 88 HB2 LEU 88 -19.988 2.597 5.300
667 HB3 LEU 88 HB3 LEU 88 -18.598 2.099 6.243
668 HG LEU 88 HG LEU 88 -20.648 2.784 7.554
669 HD11 LEU 88 HD11 LEU 88 -18.098 4.296 8.084
670 HD12 LEU 88 HD12 LEU 88 -18.473 2.657 8.617
671 HD13 LEU 88 HD13 LEU 88 -19.393 4.022 9.249
672 HD21 LEU 88 HD21 LEU 88 -21.317 4.681 6.199
673 HD22 LEU 88 HD22 LEU 88 -19.823 5.524 6.610
674 HD23 LEU 88 HD23 LEU 88 -21.019 5.187 7.862
675 H GLU 89 H GLU 89 -16.604 2.096 5.454
676 HA GLU 89 HA GLU 89 -14.695 3.815 6.913
677 HB2 GLU 89 HB2 GLU 89 -15.336 0.886 7.252
678 HB3 GLU 89 HB3 GLU 89 -13.911 1.640 7.950
679 HG2 GLU 89 HG2 GLU 89 -16.708 2.577 8.508
680 HG3 GLU 89 HG3 GLU 89 -15.876 1.365 9.482
681 H GLY 90 H GLY 90 -15.221 1.865 4.189
682 HA2 GLY 90 HA2 GLY 90 -13.658 1.757 2.392
683 HA3 GLY 90 HA3 GLY 90 -12.351 1.894 3.563
684 H LEU 91 H LEU 91 -14.120 -0.090 5.178
685 HA LEU 91 HA LEU 91 -12.682 -2.380 4.100
686 HB2 LEU 91 HB2 LEU 91 -13.303 -3.360 6.409
687 HB3 LEU 91 HB3 LEU 91 -12.006 -2.193 6.264
688 HG LEU 91 HG LEU 91 -13.760 -0.433 6.901
689 HD11 LEU 91 HD11 LEU 91 -15.193 -2.916 7.830
690 HD12 LEU 91 HD12 LEU 91 -15.753 -1.781 6.602
691 HD13 LEU 91 HD13 LEU 91 -15.606 -1.261 8.280
692 HD21 LEU 91 HD21 LEU 91 -13.318 -0.783 9.230
693 HD22 LEU 91 HD22 LEU 91 -11.899 -1.247 8.287
694 HD23 LEU 91 HD23 LEU 91 -12.964 -2.489 8.945
695 H GLU 92 H GLU 92 -13.764 -4.555 4.670
696 HA GLU 92 HA GLU 92 -16.520 -4.411 3.665
697 HB2 GLU 92 HB2 GLU 92 -14.380 -6.502 3.293
698 HB3 GLU 92 HB3 GLU 92 -16.067 -6.767 2.861
699 HG2 GLU 92 HG2 GLU 92 -15.890 -4.736 1.387
700 HG3 GLU 92 HG3 GLU 92 -14.153 -4.771 1.686
Start of MODEL 8
1 H1 GLY 1 H1 GLY 1 28.112 -8.481 -0.438
2 H2 GLY 1 H2 GLY 1 26.584 -8.234 -1.135
3 H3 GLY 1 H3 GLY 1 26.752 -9.276 0.191
4 HA2 GLY 1 HA3 GLY 1 27.314 -7.470 1.637
5 HA3 GLY 1 HA2 GLY 1 27.297 -6.364 0.269
6 H SER 2 H SER 2 25.697 -5.074 1.281
7 HA SER 2 HA SER 2 23.049 -6.301 1.515
8 HB2 SER 2 HB2 SER 2 22.494 -3.953 2.442
9 HB3 SER 2 HB3 SER 2 23.500 -5.016 3.427
10 HG SER 2 HG SER 2 24.800 -3.358 3.418
11 H ASP 3 H ASP 3 24.972 -4.455 -0.553
12 HA ASP 3 HA ASP 3 24.670 -3.673 -2.654
13 HB2 ASP 3 HB2 ASP 3 22.994 -5.719 -2.649
14 HB3 ASP 3 HB3 ASP 3 21.779 -4.446 -2.699
15 H VAL 4 H VAL 4 22.692 -2.293 -3.898
16 HA VAL 4 HA VAL 4 22.166 -0.114 -1.987
17 HB VAL 4 HB VAL 4 22.268 1.435 -3.955
18 HG11 VAL 4 HG11 VAL 4 24.136 1.235 -2.406
19 HG12 VAL 4 HG12 VAL 4 24.715 1.495 -4.051
20 HG13 VAL 4 HG13 VAL 4 24.780 -0.117 -3.335
21 HG21 VAL 4 HG21 VAL 4 23.409 -0.992 -5.336
22 HG22 VAL 4 HG22 VAL 4 23.484 0.656 -5.958
23 HG23 VAL 4 HG23 VAL 4 21.923 -0.143 -5.757
24 H ALA 5 H ALA 5 20.157 0.514 -1.721
25 HA ALA 5 HA ALA 5 18.041 -0.918 -2.953
26 HB1 ALA 5 HB1 ALA 5 17.917 -0.187 -0.625
27 HB2 ALA 5 HB2 ALA 5 16.570 0.448 -1.570
28 HB3 ALA 5 HB3 ALA 5 17.924 1.496 -1.152
29 H ALA 6 H ALA 6 18.022 -0.515 -5.113
30 HA ALA 6 HA ALA 6 16.934 2.099 -5.872
31 HB1 ALA 6 HB1 ALA 6 18.267 2.087 -7.940
32 HB2 ALA 6 HB2 ALA 6 19.099 0.633 -7.387
33 HB3 ALA 6 HB3 ALA 6 19.291 2.147 -6.504
34 H GLY 7 H GLY 7 15.564 -0.240 -5.273
35 HA2 GLY 7 HA2 GLY 7 13.608 -1.027 -6.495
36 HA3 GLY 7 HA3 GLY 7 14.625 -1.109 -7.931
37 H THR 8 H THR 8 14.398 -2.412 -4.640
38 HA THR 8 HA THR 8 15.591 -4.909 -5.635
39 HB THR 8 HB THR 8 15.973 -5.254 -3.064
40 HG1 THR 8 HG1 THR 8 16.085 -3.376 -1.889
41 HG21 THR 8 HG21 THR 8 18.159 -4.136 -3.225
42 HG22 THR 8 HG22 THR 8 17.608 -3.278 -4.665
43 HG23 THR 8 HG23 THR 8 17.779 -5.033 -4.695
44 H ALA 9 H ALA 9 14.825 -6.867 -4.430
45 HA ALA 9 HA ALA 9 13.218 -8.299 -3.743
46 HB1 ALA 9 HB1 ALA 9 11.577 -5.897 -2.966
47 HB2 ALA 9 HB2 ALA 9 12.764 -6.692 -1.935
48 HB3 ALA 9 HB3 ALA 9 11.324 -7.566 -2.454
49 H SER 10 H SER 10 11.920 -5.531 -5.561
50 HA SER 10 HA SER 10 10.507 -5.413 -7.344
51 HB2 SER 10 HB2 SER 10 11.514 -8.209 -7.925
52 HB3 SER 10 HB3 SER 10 10.808 -7.082 -9.083
53 HG SER 10 HG SER 10 12.588 -5.834 -9.000
54 H GLY 11 H GLY 11 8.939 -5.662 -5.393
55 HA2 GLY 11 HA2 GLY 11 7.534 -8.210 -5.342
56 HA3 GLY 11 HA3 GLY 11 7.273 -6.851 -4.258
57 H ALA 12 H ALA 12 5.561 -8.600 -6.135
58 HA ALA 12 HA ALA 12 4.178 -6.354 -7.425
59 HB1 ALA 12 HB1 ALA 12 3.930 -9.291 -8.065
60 HB2 ALA 12 HB2 ALA 12 4.924 -8.138 -8.957
61 HB3 ALA 12 HB3 ALA 12 3.169 -7.954 -8.930
62 H LYS 13 H LYS 13 1.689 -7.757 -7.714
63 HA LYS 13 HA LYS 13 -0.295 -7.980 -6.619
64 HB2 LYS 13 HB2 LYS 13 1.258 -8.540 -4.095
65 HB3 LYS 13 HB3 LYS 13 -0.376 -9.060 -4.490
66 HG2 LYS 13 HG2 LYS 13 0.409 -10.635 -6.080
67 HG3 LYS 13 HG3 LYS 13 2.045 -9.955 -6.040
68 HD2 LYS 13 HD2 LYS 13 0.698 -11.233 -3.662
69 HD3 LYS 13 HD3 LYS 13 1.751 -12.108 -4.776
70 HE2 LYS 13 HE2 LYS 13 2.603 -9.628 -3.272
71 HE3 LYS 13 HE3 LYS 13 2.857 -11.266 -2.674
72 HZ1 LYS 13 HZ1 LYS 13 4.797 -10.322 -3.841
73 HZ2 LYS 13 HZ2 LYS 13 3.893 -10.275 -5.271
74 HZ3 LYS 13 HZ3 LYS 13 4.236 -11.760 -4.541
75 H SER 14 H SER 14 2.017 -5.854 -5.880
76 HA SER 14 HA SER 14 0.549 -3.611 -5.371
77 HB2 SER 14 HB2 SER 14 1.154 -3.247 -2.919
78 HB3 SER 14 HB3 SER 14 -0.132 -4.409 -3.220
79 HG SER 14 HG SER 14 1.620 -6.031 -3.116
80 H MET 15 H MET 15 2.107 -3.007 -6.861
81 HA MET 15 HA MET 15 4.687 -4.021 -6.937
82 HB2 MET 15 HB2 MET 15 3.633 -1.468 -8.161
83 HB3 MET 15 HB3 MET 15 5.162 -2.227 -8.586
84 HG2 MET 15 HG2 MET 15 3.971 -4.209 -9.350
85 HG3 MET 15 HG3 MET 15 2.438 -3.463 -8.908
86 HE1 MET 15 HE1 MET 15 2.344 -3.461 -12.819
87 HE2 MET 15 HE2 MET 15 1.546 -3.990 -11.338
88 HE3 MET 15 HE3 MET 15 3.099 -4.686 -11.799
89 H TRP 16 H TRP 16 6.232 -3.781 -5.530
90 HA TRP 16 HA TRP 16 6.768 -1.129 -4.437
91 HB2 TRP 16 HB2 TRP 16 6.856 -1.935 -2.163
92 HB3 TRP 16 HB3 TRP 16 5.297 -2.368 -2.843
93 HD1 TRP 16 HD1 TRP 16 4.862 -4.985 -3.319
94 HE1 TRP 16 HE1 TRP 16 5.938 -7.096 -2.303
95 HE3 TRP 16 HE3 TRP 16 9.021 -2.845 -1.293
96 HZ2 TRP 16 HZ2 TRP 16 8.259 -7.753 -0.831
97 HZ3 TRP 16 HZ3 TRP 16 10.628 -4.277 -0.092
98 HH2 TRP 16 HH2 TRP 16 10.250 -6.684 0.132
99 H THR 17 H THR 17 8.830 -0.763 -3.726
100 HA THR 17 HA THR 17 10.821 -2.871 -4.237
101 HB THR 17 HB THR 17 12.349 -1.194 -5.169
102 HG1 THR 17 HG1 THR 17 10.120 0.582 -4.993
103 HG21 THR 17 HG21 THR 17 10.326 -2.382 -6.475
104 HG22 THR 17 HG22 THR 17 11.510 -1.343 -7.269
105 HG23 THR 17 HG23 THR 17 9.938 -0.693 -6.799
106 H GLU 18 H GLU 18 12.604 -2.832 -2.865
107 HA GLU 18 HA GLU 18 12.075 -1.662 -0.286
108 HB2 GLU 18 HB2 GLU 18 12.850 -3.937 -0.377
109 HB3 GLU 18 HB3 GLU 18 14.255 -3.480 -1.321
110 HG2 GLU 18 HG2 GLU 18 13.950 -2.258 1.361
111 HG3 GLU 18 HG3 GLU 18 14.373 -3.967 1.280
112 H HIS 19 H HIS 19 12.925 0.120 0.547
113 HA HIS 19 HA HIS 19 15.541 1.064 -0.393
114 HB2 HIS 19 HB2 HIS 19 13.115 2.843 -0.012
115 HB3 HIS 19 HB3 HIS 19 14.755 3.428 -0.224
116 HD1 HIS 19 HD1 HIS 19 11.902 3.426 -2.055
117 HD2 HIS 19 HD2 HIS 19 15.698 1.953 -2.893
118 HE1 HIS 19 HE1 HIS 19 12.051 3.324 -4.562
119 HE2 HIS 19 HE2 HIS 19 14.453 2.728 -5.029
120 H LYS 20 H LYS 20 16.849 1.537 1.309
121 HA LYS 20 HA LYS 20 15.547 2.313 3.811
122 HB2 LYS 20 HB2 LYS 20 16.483 0.679 5.041
123 HB3 LYS 20 HB3 LYS 20 16.574 -0.151 3.497
124 HG2 LYS 20 HG2 LYS 20 18.892 1.528 4.075
125 HG3 LYS 20 HG3 LYS 20 18.641 0.214 5.225
126 HD2 LYS 20 HD2 LYS 20 20.029 -0.647 3.530
127 HD3 LYS 20 HD3 LYS 20 18.426 -1.323 3.231
128 HE2 LYS 20 HE2 LYS 20 19.192 -0.653 1.119
129 HE3 LYS 20 HE3 LYS 20 18.095 0.628 1.625
130 HZ1 LYS 20 HZ1 LYS 20 20.115 1.545 0.685
131 HZ2 LYS 20 HZ2 LYS 20 21.058 0.703 1.819
132 HZ3 LYS 20 HZ3 LYS 20 20.012 1.932 2.331
133 H SER 21 H SER 21 16.621 3.771 5.073
134 HA SER 21 HA SER 21 18.630 5.383 3.801
135 HB2 SER 21 HB2 SER 21 18.543 6.631 6.006
136 HB3 SER 21 HB3 SER 21 17.001 6.522 5.159
137 HG SER 21 HG SER 21 16.519 5.951 7.202
138 HA PRO 22 HA PRO 22 22.389 3.492 5.128
139 HB2 PRO 22 HB2 PRO 22 23.085 6.176 6.232
140 HB3 PRO 22 HB3 PRO 22 24.013 5.122 5.159
141 HG2 PRO 22 HG2 PRO 22 22.763 7.251 4.193
142 HG3 PRO 22 HG3 PRO 22 22.784 5.727 3.286
143 HD2 PRO 22 HD2 PRO 22 20.575 6.968 4.858
144 HD3 PRO 22 HD3 PRO 22 20.501 6.011 3.366
145 H ASP 23 H ASP 23 20.345 5.082 7.373
146 HA ASP 23 HA ASP 23 21.813 4.435 9.755
147 HB2 ASP 23 HB2 ASP 23 20.368 6.364 9.754
148 HB3 ASP 23 HB3 ASP 23 18.990 5.393 9.255
149 H GLY 24 H GLY 24 19.953 2.618 7.607
150 HA2 GLY 24 HA2 GLY 24 19.743 0.273 7.806
151 HA3 GLY 24 HA3 GLY 24 19.854 0.431 9.553
152 H ARG 25 H ARG 25 17.742 2.758 8.579
153 HA ARG 25 HA ARG 25 15.471 1.111 9.312
154 HB2 ARG 25 HB2 ARG 25 16.042 3.997 9.263
155 HB3 ARG 25 HB3 ARG 25 14.385 3.558 8.864
156 HG2 ARG 25 HG2 ARG 25 14.967 4.031 11.322
157 HG3 ARG 25 HG3 ARG 25 14.000 2.599 10.955
158 HD2 ARG 25 HD2 ARG 25 15.974 1.204 11.083
159 HD3 ARG 25 HD3 ARG 25 16.985 2.613 11.352
160 HE ARG 25 HE ARG 25 14.959 1.610 13.263
161 HH11 ARG 25 HH11 ARG 25 17.926 3.337 12.570
162 HH12 ARG 25 HH12 ARG 25 18.438 3.380 14.229
163 HH21 ARG 25 HH21 ARG 25 15.644 1.663 15.462
164 HH22 ARG 25 HH22 ARG 25 17.147 2.445 15.864
165 H THR 26 H THR 26 14.141 0.204 7.894
166 HA THR 26 HA THR 26 14.446 0.947 5.072
167 HB THR 26 HB THR 26 13.408 -1.649 6.228
168 HG1 THR 26 HG1 THR 26 15.909 -1.388 4.964
169 HG21 THR 26 HG21 THR 26 14.294 -0.931 3.428
170 HG22 THR 26 HG22 THR 26 12.630 -1.194 3.949
171 HG23 THR 26 HG23 THR 26 13.781 -2.529 3.973
172 H TYR 27 H TYR 27 12.726 1.412 3.798
173 HA TYR 27 HA TYR 27 10.041 0.815 4.779
174 HB2 TYR 27 HB2 TYR 27 9.287 3.000 3.651
175 HB3 TYR 27 HB3 TYR 27 10.031 3.115 5.236
176 HD1 TYR 27 HD1 TYR 27 11.266 3.030 1.697
177 HD2 TYR 27 HD2 TYR 27 11.360 4.966 5.482
178 HE1 TYR 27 HE1 TYR 27 12.819 4.706 0.793
179 HE2 TYR 27 HE2 TYR 27 12.919 6.646 4.589
180 HH TYR 27 HH TYR 27 13.494 7.018 1.260
181 H TYR 28 H TYR 28 8.490 1.397 2.732
182 HA TYR 28 HA TYR 28 9.753 -0.010 0.471
183 HB2 TYR 28 HB2 TYR 28 6.929 -0.497 1.409
184 HB3 TYR 28 HB3 TYR 28 7.850 -1.430 0.233
185 HD1 TYR 28 HD2 TYR 28 9.881 -2.737 1.065
186 HD2 TYR 28 HD1 TYR 28 6.991 -1.052 3.695
187 HE1 TYR 28 HE2 TYR 28 10.666 -4.216 2.866
188 HE2 TYR 28 HE1 TYR 28 7.771 -2.526 5.502
189 HH TYR 28 HH TYR 28 8.949 -4.605 5.822
190 H TYR 29 H TYR 29 9.125 0.633 -1.584
191 HA TYR 29 HA TYR 29 7.345 2.979 -1.622
192 HB2 TYR 29 HB2 TYR 29 9.295 3.920 -2.340
193 HB3 TYR 29 HB3 TYR 29 9.906 2.410 -2.994
194 HD1 TYR 29 HD1 TYR 29 7.087 4.808 -3.744
195 HD2 TYR 29 HD2 TYR 29 10.203 2.342 -5.223
196 HE1 TYR 29 HE1 TYR 29 6.583 5.567 -6.039
197 HE2 TYR 29 HE2 TYR 29 9.721 3.083 -7.517
198 HH TYR 29 HH TYR 29 7.903 4.044 -8.810
199 H ASN 30 H ASN 30 5.523 2.769 -2.601
200 HA ASN 30 HA ASN 30 5.102 0.474 -4.365
201 HB2 ASN 30 HB2 ASN 30 3.325 2.128 -2.625
202 HB3 ASN 30 HB3 ASN 30 2.620 1.387 -4.060
203 HD21 ASN 30 HD21 ASN 30 2.411 -0.821 -4.169
204 HD22 ASN 30 HD22 ASN 30 2.637 -1.855 -2.808
205 H THR 31 H THR 31 5.189 0.804 -6.450
206 HA THR 31 HA THR 31 5.517 3.402 -7.554
207 HB THR 31 HB THR 31 5.778 2.258 -9.672
208 HG1 THR 31 HG1 THR 31 5.146 0.164 -9.964
209 HG21 THR 31 HG21 THR 31 6.946 0.842 -7.293
210 HG22 THR 31 HG22 THR 31 7.706 2.070 -8.313
211 HG23 THR 31 HG23 THR 31 7.415 0.448 -8.949
212 H GLU 32 H GLU 32 2.816 1.473 -6.890
213 HA GLU 32 HA GLU 32 1.036 2.208 -8.920
214 HB2 GLU 32 HB2 GLU 32 -0.405 1.877 -6.510
215 HB3 GLU 32 HB3 GLU 32 -0.214 0.730 -7.823
216 HG2 GLU 32 HG2 GLU 32 2.075 0.261 -6.637
217 HG3 GLU 32 HG3 GLU 32 1.229 0.919 -5.239
218 H THR 33 H THR 33 1.565 3.531 -5.700
219 HA THR 33 HA THR 33 -0.044 5.871 -6.413
220 HB THR 33 HB THR 33 -0.099 6.329 -3.979
221 HG1 THR 33 HG1 THR 33 0.711 4.385 -2.703
222 HG21 THR 33 HG21 THR 33 -0.835 3.472 -4.672
223 HG22 THR 33 HG22 THR 33 -1.838 4.896 -4.980
224 HG23 THR 33 HG23 THR 33 -1.481 4.414 -3.321
225 H LYS 34 H LYS 34 3.063 4.859 -6.369
226 HA LYS 34 HA LYS 34 5.084 5.875 -6.563
227 HB2 LYS 34 HB2 LYS 34 3.311 8.273 -6.954
228 HB3 LYS 34 HB3 LYS 34 5.067 8.389 -7.006
229 HG2 LYS 34 HG2 LYS 34 3.572 6.432 -8.691
230 HG3 LYS 34 HG3 LYS 34 3.827 8.108 -9.213
231 HD2 LYS 34 HD2 LYS 34 6.260 7.782 -8.896
232 HD3 LYS 34 HD3 LYS 34 5.958 6.091 -8.492
233 HE2 LYS 34 HE2 LYS 34 4.998 5.726 -10.694
234 HE3 LYS 34 HE3 LYS 34 5.255 7.421 -11.103
235 HZ1 LYS 34 HZ1 LYS 34 7.390 5.457 -10.464
236 HZ2 LYS 34 HZ2 LYS 34 7.634 7.087 -10.866
237 HZ3 LYS 34 HZ3 LYS 34 6.996 6.016 -12.014
238 H GLN 35 H GLN 35 3.832 5.476 -3.973
239 HA GLN 35 HA GLN 35 4.997 7.706 -2.449
240 HB2 GLN 35 HB2 GLN 35 2.701 5.869 -1.793
241 HB3 GLN 35 HB3 GLN 35 3.441 6.948 -0.616
242 HG2 GLN 35 HG2 GLN 35 2.880 8.859 -2.057
243 HG3 GLN 35 HG3 GLN 35 2.079 7.755 -3.173
244 HE21 GLN 35 HE21 GLN 35 1.097 10.011 -1.512
245 HE22 GLN 35 HE22 GLN 35 -0.225 9.356 -0.612
246 H SER 36 H SER 36 6.095 7.251 -0.528
247 HA SER 36 HA SER 36 7.161 4.523 -0.332
248 HB2 SER 36 HB2 SER 36 8.813 6.370 -0.708
249 HB3 SER 36 HB3 SER 36 8.296 7.096 0.813
250 HG SER 36 HG SER 36 9.292 5.563 1.912
251 H THR 37 H THR 37 6.798 3.400 1.536
252 HA THR 37 HA THR 37 5.198 4.652 3.621
253 HB THR 37 HB THR 37 3.653 4.004 1.746
254 HG1 THR 37 HG1 THR 37 2.297 3.802 3.342
255 HG21 THR 37 HG21 THR 37 4.674 1.254 2.445
256 HG22 THR 37 HG22 THR 37 4.664 2.047 0.865
257 HG23 THR 37 HG23 THR 37 3.147 1.530 1.601
258 H TRP 38 H TRP 38 4.658 3.106 5.332
259 HA TRP 38 HA TRP 38 6.887 1.441 5.999
260 HB2 TRP 38 HB2 TRP 38 5.204 0.856 7.963
261 HB3 TRP 38 HB3 TRP 38 6.099 2.368 7.927
262 HD1 TRP 38 HD1 TRP 38 4.590 4.201 8.808
263 HE1 TRP 38 HE1 TRP 38 2.136 4.911 8.507
264 HE3 TRP 38 HE3 TRP 38 3.014 0.433 5.715
265 HZ2 TRP 38 HZ2 TRP 38 -0.155 4.006 7.144
266 HZ3 TRP 38 HZ3 TRP 38 0.671 0.434 4.965
267 HH2 TRP 38 HH2 TRP 38 -0.878 2.186 5.663
268 H GLU 39 H GLU 39 6.263 -0.784 7.049
269 HA GLU 39 HA GLU 39 5.553 -2.591 5.086
270 HB2 GLU 39 HB2 GLU 39 5.143 -4.159 7.048
271 HB3 GLU 39 HB3 GLU 39 6.728 -3.406 6.950
272 HG2 GLU 39 HG2 GLU 39 5.900 -1.681 8.571
273 HG3 GLU 39 HG3 GLU 39 4.460 -2.678 8.781
274 H LYS 40 H LYS 40 3.699 -3.264 4.225
275 HA LYS 40 HA LYS 40 1.241 -2.115 5.288
276 HB2 LYS 40 HB2 LYS 40 0.393 -2.691 2.933
277 HB3 LYS 40 HB3 LYS 40 1.542 -1.370 3.098
278 HG2 LYS 40 HG2 LYS 40 3.348 -2.785 2.388
279 HG3 LYS 40 HG3 LYS 40 2.277 -4.185 2.343
280 HD2 LYS 40 HD2 LYS 40 1.026 -3.242 0.531
281 HD3 LYS 40 HD3 LYS 40 1.914 -1.719 0.652
282 HE2 LYS 40 HE2 LYS 40 3.322 -4.311 0.169
283 HE3 LYS 40 HE3 LYS 40 2.613 -3.402 -1.172
284 HZ1 LYS 40 HZ1 LYS 40 4.002 -1.522 -0.593
285 HZ2 LYS 40 HZ2 LYS 40 4.970 -2.892 -0.830
286 HZ3 LYS 40 HZ3 LYS 40 4.639 -2.353 0.740
287 HA PRO 41 HA PRO 41 -0.755 -5.853 6.437
288 HB2 PRO 41 HB2 PRO 41 -3.164 -5.587 5.112
289 HB3 PRO 41 HB3 PRO 41 -2.759 -4.837 6.659
290 HG2 PRO 41 HG2 PRO 41 -2.645 -3.682 3.904
291 HG3 PRO 41 HG3 PRO 41 -3.240 -2.943 5.405
292 HD2 PRO 41 HD2 PRO 41 -0.839 -2.312 4.460
293 HD3 PRO 41 HD3 PRO 41 -1.083 -2.547 6.205
294 H ASP 42 H ASP 42 -2.385 -7.476 5.452
295 HA ASP 42 HA ASP 42 -1.054 -9.324 3.937
296 HB2 ASP 42 HB2 ASP 42 -3.996 -9.015 4.479
297 HB3 ASP 42 HB3 ASP 42 -3.287 -10.445 3.731
298 H ASP 43 H ASP 43 -1.848 -6.571 2.457
299 HA ASP 43 HA ASP 43 -3.190 -7.284 0.104
300 HB2 ASP 43 HB2 ASP 43 -0.995 -5.264 0.557
301 HB3 ASP 43 HB3 ASP 43 -1.896 -5.396 -0.943
302 H LEU 44 H LEU 44 0.070 -7.788 1.154
303 HA LEU 44 HA LEU 44 1.125 -8.566 -1.381
304 HB2 LEU 44 HB2 LEU 44 2.181 -9.227 1.366
305 HB3 LEU 44 HB3 LEU 44 3.065 -9.285 -0.155
306 HG LEU 44 HG LEU 44 1.874 -6.673 0.577
307 HD11 LEU 44 HD11 LEU 44 4.236 -7.867 2.021
308 HD12 LEU 44 HD12 LEU 44 2.713 -7.319 2.730
309 HD13 LEU 44 HD13 LEU 44 3.827 -6.151 2.018
310 HD21 LEU 44 HD21 LEU 44 4.081 -5.919 -0.313
311 HD22 LEU 44 HD22 LEU 44 3.112 -6.842 -1.458
312 HD23 LEU 44 HD23 LEU 44 4.469 -7.610 -0.633
313 H LYS 45 H LYS 45 -0.635 -10.187 1.147
314 HA LYS 45 HA LYS 45 0.028 -12.846 0.408
315 HB2 LYS 45 HB2 LYS 45 -2.601 -12.023 1.610
316 HB3 LYS 45 HB3 LYS 45 -1.708 -13.516 1.849
317 HG2 LYS 45 HG2 LYS 45 -0.777 -10.834 2.831
318 HG3 LYS 45 HG3 LYS 45 -1.718 -11.971 3.795
319 HD2 LYS 45 HD2 LYS 45 0.317 -13.530 2.848
320 HD3 LYS 45 HD3 LYS 45 1.111 -11.980 3.122
321 HE2 LYS 45 HE2 LYS 45 0.450 -11.909 5.364
322 HE3 LYS 45 HE3 LYS 45 -0.682 -13.240 5.161
323 HZ1 LYS 45 HZ1 LYS 45 2.287 -13.383 5.112
324 HZ2 LYS 45 HZ2 LYS 45 1.271 -14.689 4.734
325 HZ3 LYS 45 HZ3 LYS 45 1.252 -14.025 6.293
326 H THR 46 H THR 46 -3.212 -11.459 0.180
327 HA THR 46 HA THR 46 -3.571 -12.076 -2.604
328 HB THR 46 HB THR 46 -5.266 -13.682 -0.698
329 HG1 THR 46 HG1 THR 46 -3.422 -14.710 -0.273
330 HG21 THR 46 HG21 THR 46 -6.089 -13.431 -2.974
331 HG22 THR 46 HG22 THR 46 -5.646 -15.105 -2.644
332 HG23 THR 46 HG23 THR 46 -4.577 -14.080 -3.602
333 HA PRO 47 HA PRO 47 -6.464 -8.755 -2.135
334 HB2 PRO 47 HB2 PRO 47 -8.373 -10.457 -3.664
335 HB3 PRO 47 HB3 PRO 47 -7.932 -8.762 -3.916
336 HG2 PRO 47 HG2 PRO 47 -6.897 -10.615 -5.492
337 HG3 PRO 47 HG3 PRO 47 -5.869 -9.309 -4.873
338 HD2 PRO 47 HD2 PRO 47 -6.045 -12.161 -4.008
339 HD3 PRO 47 HD3 PRO 47 -4.623 -11.115 -4.133
340 H ALA 48 H ALA 48 -8.036 -11.953 -1.798
341 HA ALA 48 HA ALA 48 -10.125 -10.972 -0.158
342 HB1 ALA 48 HB1 ALA 48 -10.004 -13.144 -1.542
343 HB2 ALA 48 HB2 ALA 48 -10.869 -13.136 -0.013
344 HB3 ALA 48 HB3 ALA 48 -9.248 -13.826 -0.097
345 H GLU 49 H GLU 49 -6.988 -12.416 0.560
346 HA GLU 49 HA GLU 49 -7.334 -12.728 3.315
347 HB2 GLU 49 HB2 GLU 49 -4.853 -12.267 1.669
348 HB3 GLU 49 HB3 GLU 49 -4.793 -12.516 3.412
349 HG2 GLU 49 HG2 GLU 49 -6.001 -14.666 3.073
350 HG3 GLU 49 HG3 GLU 49 -5.841 -14.424 1.336
351 H GLN 50 H GLN 50 -6.615 -9.881 1.403
352 HA GLN 50 HA GLN 50 -5.759 -8.135 3.399
353 HB2 GLN 50 HB2 GLN 50 -7.611 -7.438 1.125
354 HB3 GLN 50 HB3 GLN 50 -6.506 -6.356 1.959
355 HG2 GLN 50 HG2 GLN 50 -4.609 -7.548 1.038
356 HG3 GLN 50 HG3 GLN 50 -5.701 -8.701 0.261
357 HE21 GLN 50 HE21 GLN 50 -4.921 -8.180 -1.799
358 HE22 GLN 50 HE22 GLN 50 -5.294 -6.684 -2.574
359 H LEU 51 H LEU 51 -9.050 -9.139 2.506
360 HA LEU 51 HA LEU 51 -10.395 -6.926 3.543
361 HB2 LEU 51 HB2 LEU 51 -12.395 -8.096 3.202
362 HB3 LEU 51 HB3 LEU 51 -11.295 -8.615 1.946
363 HG LEU 51 HG LEU 51 -10.880 -10.582 3.725
364 HD11 LEU 51 HD11 LEU 51 -13.768 -9.788 4.086
365 HD12 LEU 51 HD12 LEU 51 -12.511 -9.708 5.321
366 HD13 LEU 51 HD13 LEU 51 -13.015 -11.270 4.676
367 HD21 LEU 51 HD21 LEU 51 -12.422 -11.897 2.349
368 HD22 LEU 51 HD22 LEU 51 -11.399 -10.824 1.381
369 HD23 LEU 51 HD23 LEU 51 -13.091 -10.402 1.686
370 H LEU 52 H LEU 52 -9.361 -9.853 5.165
371 HA LEU 52 HA LEU 52 -10.960 -9.438 7.498
372 HB2 LEU 52 HB2 LEU 52 -8.393 -11.013 7.369
373 HB3 LEU 52 HB3 LEU 52 -9.714 -11.214 8.501
374 HG LEU 52 HG LEU 52 -11.084 -11.806 6.338
375 HD11 LEU 52 HD11 LEU 52 -8.327 -12.641 5.483
376 HD12 LEU 52 HD12 LEU 52 -9.123 -11.183 4.885
377 HD13 LEU 52 HD13 LEU 52 -9.837 -12.771 4.576
378 HD21 LEU 52 HD21 LEU 52 -10.505 -14.162 6.655
379 HD22 LEU 52 HD22 LEU 52 -10.688 -13.325 8.198
380 HD23 LEU 52 HD23 LEU 52 -9.078 -13.685 7.577
381 H SER 53 H SER 53 -7.699 -8.656 6.524
382 HA SER 53 HA SER 53 -6.925 -7.601 9.090
383 HB2 SER 53 HB2 SER 53 -5.517 -7.321 6.438
384 HB3 SER 53 HB3 SER 53 -4.801 -7.227 8.051
385 HG SER 53 HG SER 53 -4.450 -9.275 7.057
386 H LYS 54 H LYS 54 -6.891 -6.199 5.855
387 HA LYS 54 HA LYS 54 -7.978 -3.667 6.846
388 HB2 LYS 54 HB2 LYS 54 -5.331 -3.911 5.391
389 HB3 LYS 54 HB3 LYS 54 -6.169 -2.398 5.694
390 HG2 LYS 54 HG2 LYS 54 -5.182 -4.246 7.853
391 HG3 LYS 54 HG3 LYS 54 -4.290 -2.852 7.246
392 HD2 LYS 54 HD2 LYS 54 -6.203 -1.418 7.901
393 HD3 LYS 54 HD3 LYS 54 -6.978 -2.832 8.613
394 HE2 LYS 54 HE2 LYS 54 -4.292 -1.721 9.417
395 HE3 LYS 54 HE3 LYS 54 -5.801 -1.453 10.284
396 HZ1 LYS 54 HZ1 LYS 54 -5.956 -3.798 10.734
397 HZ2 LYS 54 HZ2 LYS 54 -4.452 -3.226 11.265
398 HZ3 LYS 54 HZ3 LYS 54 -4.559 -4.112 9.826
399 H CYS 55 H CYS 55 -9.147 -2.603 5.294
400 HA CYS 55 HA CYS 55 -10.213 -4.179 3.239
401 HB2 CYS 55 HB2 CYS 55 -11.180 -1.868 2.515
402 HB3 CYS 55 HB3 CYS 55 -11.667 -2.566 4.056
403 HG CYS 55 HG CYS 55 -11.300 -0.218 5.098
404 HA PRO 56 HA PRO 56 -7.461 -3.825 -0.172
405 HB2 PRO 56 HB2 PRO 56 -9.951 -3.733 -1.799
406 HB3 PRO 56 HB3 PRO 56 -8.573 -4.835 -1.906
407 HG2 PRO 56 HG2 PRO 56 -10.848 -5.677 -0.850
408 HG3 PRO 56 HG3 PRO 56 -9.297 -6.122 -0.104
409 HD2 PRO 56 HD2 PRO 56 -11.262 -4.016 0.731
410 HD3 PRO 56 HD3 PRO 56 -10.375 -5.185 1.733
411 H TRP 57 H TRP 57 -9.989 -1.517 0.339
412 HA TRP 57 HA TRP 57 -8.595 0.428 -1.356
413 HB2 TRP 57 HB2 TRP 57 -11.216 0.595 0.153
414 HB3 TRP 57 HB3 TRP 57 -10.505 1.932 -0.746
415 HD1 TRP 57 HD1 TRP 57 -10.521 1.770 -3.419
416 HE1 TRP 57 HE1 TRP 57 -12.009 0.398 -5.021
417 HE3 TRP 57 HE3 TRP 57 -12.397 -1.640 -0.098
418 HZ2 TRP 57 HZ2 TRP 57 -13.730 -1.833 -4.895
419 HZ3 TRP 57 HZ3 TRP 57 -13.951 -3.359 -0.920
420 HH2 TRP 57 HH2 TRP 57 -14.603 -3.452 -3.268
421 H LYS 58 H LYS 58 -7.076 1.659 -0.395
422 HA LYS 58 HA LYS 58 -7.254 1.971 2.506
423 HB2 LYS 58 HB2 LYS 58 -5.282 0.430 1.039
424 HB3 LYS 58 HB3 LYS 58 -4.557 1.597 2.137
425 HG2 LYS 58 HG2 LYS 58 -5.929 0.683 3.970
426 HG3 LYS 58 HG3 LYS 58 -6.599 -0.508 2.855
427 HD2 LYS 58 HD2 LYS 58 -3.701 -0.228 3.639
428 HD3 LYS 58 HD3 LYS 58 -4.814 -1.487 4.185
429 HE2 LYS 58 HE2 LYS 58 -4.193 -0.997 1.292
430 HE3 LYS 58 HE3 LYS 58 -3.236 -2.094 2.292
431 HZ1 LYS 58 HZ1 LYS 58 -6.147 -2.341 1.727
432 HZ2 LYS 58 HZ2 LYS 58 -5.243 -3.386 2.700
433 HZ3 LYS 58 HZ3 LYS 58 -4.910 -3.286 1.045
434 H GLU 59 H GLU 59 -6.524 3.754 3.374
435 HA GLU 59 HA GLU 59 -5.229 5.755 1.651
436 HB2 GLU 59 HB2 GLU 59 -7.270 6.701 2.306
437 HB3 GLU 59 HB3 GLU 59 -7.223 5.956 3.892
438 HG2 GLU 59 HG2 GLU 59 -5.160 7.993 3.268
439 HG3 GLU 59 HG3 GLU 59 -6.817 8.543 3.507
440 H TYR 60 H TYR 60 -3.124 6.066 2.117
441 HA TYR 60 HA TYR 60 -2.360 6.078 4.937
442 HB2 TYR 60 HB2 TYR 60 -0.255 4.827 4.441
443 HB3 TYR 60 HB3 TYR 60 -1.710 3.855 4.268
444 HD1 TYR 60 HD1 TYR 60 0.910 5.663 2.381
445 HD2 TYR 60 HD2 TYR 60 -2.236 2.808 2.224
446 HE1 TYR 60 HE1 TYR 60 1.622 5.001 0.129
447 HE2 TYR 60 HE2 TYR 60 -1.522 2.136 -0.027
448 HH TYR 60 HH TYR 60 1.454 2.990 -1.336
449 H LYS 61 H LYS 61 -0.460 7.324 5.371
450 HA LYS 61 HA LYS 61 0.151 9.244 3.256
451 HB2 LYS 61 HB2 LYS 61 0.861 9.270 6.186
452 HB3 LYS 61 HB3 LYS 61 1.340 10.507 5.037
453 HG2 LYS 61 HG2 LYS 61 -1.146 10.811 4.593
454 HG3 LYS 61 HG3 LYS 61 -1.396 9.855 6.052
455 HD2 LYS 61 HD2 LYS 61 0.025 12.501 5.801
456 HD3 LYS 61 HD3 LYS 61 -1.467 12.158 6.677
457 HE2 LYS 61 HE2 LYS 61 1.266 11.084 7.341
458 HE3 LYS 61 HE3 LYS 61 0.432 12.381 8.197
459 HZ1 LYS 61 HZ1 LYS 61 0.192 10.269 9.354
460 HZ2 LYS 61 HZ2 LYS 61 -0.514 9.571 7.981
461 HZ3 LYS 61 HZ3 LYS 61 -1.314 10.822 8.796
462 H SER 62 H SER 62 2.137 9.451 2.395
463 HA SER 62 HA SER 62 3.976 7.312 2.548
464 HB2 SER 62 HB2 SER 62 4.871 9.982 1.580
465 HB3 SER 62 HB3 SER 62 5.077 8.391 0.841
466 HG SER 62 HG SER 62 2.578 8.656 0.702
467 H ASP 63 H ASP 63 6.466 8.060 2.898
468 HA ASP 63 HA ASP 63 6.808 8.729 5.613
469 HB2 ASP 63 HB2 ASP 63 9.189 8.924 5.093
470 HB3 ASP 63 HB3 ASP 63 8.508 7.510 4.296
471 H SER 64 H SER 64 6.570 10.632 2.717
472 HA SER 64 HA SER 64 7.313 13.122 3.920
473 HB2 SER 64 HB2 SER 64 5.655 12.766 1.424
474 HB3 SER 64 HB3 SER 64 6.768 14.079 1.820
475 HG SER 64 HG SER 64 8.477 12.499 1.715
476 H GLY 65 H GLY 65 4.550 11.165 4.051
477 HA2 GLY 65 HA2 GLY 65 2.670 11.527 5.371
478 HA3 GLY 65 HA3 GLY 65 3.098 13.219 5.496
479 H LYS 66 H LYS 66 2.994 11.853 2.328
480 HA LYS 66 HA LYS 66 0.608 13.367 1.671
481 HB2 LYS 66 HB2 LYS 66 2.526 13.251 0.112
482 HB3 LYS 66 HB3 LYS 66 2.291 11.520 -0.039
483 HG2 LYS 66 HG2 LYS 66 1.396 12.804 -1.944
484 HG3 LYS 66 HG3 LYS 66 0.175 11.839 -1.115
485 HD2 LYS 66 HD2 LYS 66 -0.586 14.128 -1.734
486 HD3 LYS 66 HD3 LYS 66 -0.697 13.779 -0.008
487 HE2 LYS 66 HE2 LYS 66 1.372 14.990 0.385
488 HE3 LYS 66 HE3 LYS 66 1.534 15.309 -1.342
489 HZ1 LYS 66 HZ1 LYS 66 0.599 17.176 -0.030
490 HZ2 LYS 66 HZ2 LYS 66 -0.767 16.224 0.294
491 HZ3 LYS 66 HZ3 LYS 66 -0.398 16.666 -1.299
492 H THR 67 H THR 67 -1.414 12.547 1.861
493 HA THR 67 HA THR 67 -1.764 9.678 2.090
494 HB THR 67 HB THR 67 -4.307 10.767 2.019
495 HG1 THR 67 HG1 THR 67 -4.150 12.576 3.425
496 HG21 THR 67 HG21 THR 67 -3.187 9.053 3.526
497 HG22 THR 67 HG22 THR 67 -4.397 10.108 4.269
498 HG23 THR 67 HG23 THR 67 -2.680 10.423 4.522
499 H TYR 68 H TYR 68 -2.514 8.374 0.611
500 HA TYR 68 HA TYR 68 -4.166 9.462 -1.531
501 HB2 TYR 68 HB2 TYR 68 -1.607 8.039 -1.909
502 HB3 TYR 68 HB3 TYR 68 -2.943 7.461 -2.898
503 HD1 TYR 68 HD2 TYR 68 -0.718 10.294 -2.209
504 HD2 TYR 68 HD1 TYR 68 -3.912 8.853 -4.626
505 HE1 TYR 68 HE2 TYR 68 -0.364 12.152 -3.775
506 HE2 TYR 68 HE1 TYR 68 -3.564 10.713 -6.200
507 HH TYR 68 HH TYR 68 -0.819 12.570 -6.264
508 H TYR 69 H TYR 69 -5.553 7.900 -2.491
509 HA TYR 69 HA TYR 69 -6.147 5.637 -0.701
510 HB2 TYR 69 HB2 TYR 69 -7.682 7.736 -0.678
511 HB3 TYR 69 HB3 TYR 69 -8.212 7.183 -2.260
512 HD1 TYR 69 HD2 TYR 69 -9.562 5.153 -2.480
513 HD2 TYR 69 HD1 TYR 69 -8.283 6.576 1.325
514 HE1 TYR 69 HE2 TYR 69 -11.221 3.701 -1.390
515 HE2 TYR 69 HE1 TYR 69 -9.941 5.124 2.426
516 HH TYR 69 HH TYR 69 -11.492 2.611 0.898
517 H TYR 70 H TYR 70 -6.237 3.690 -1.772
518 HA TYR 70 HA TYR 70 -6.463 3.839 -4.692
519 HB2 TYR 70 HB2 TYR 70 -4.553 2.443 -5.041
520 HB3 TYR 70 HB3 TYR 70 -4.048 3.750 -3.972
521 HD1 TYR 70 HD2 TYR 70 -3.951 3.240 -1.450
522 HD2 TYR 70 HD1 TYR 70 -4.277 0.208 -4.421
523 HE1 TYR 70 HE2 TYR 70 -3.179 1.566 0.181
524 HE2 TYR 70 HE1 TYR 70 -3.513 -1.475 -2.798
525 HH TYR 70 HH TYR 70 -2.384 -1.687 -0.786
526 H ASN 71 H ASN 71 -7.304 2.156 -5.728
527 HA ASN 71 HA ASN 71 -8.690 0.110 -4.194
528 HB2 ASN 71 HB2 ASN 71 -8.513 0.564 -7.195
529 HB3 ASN 71 HB3 ASN 71 -9.599 -0.557 -6.394
530 HD21 ASN 71 HD21 ASN 71 -11.416 0.346 -7.251
531 HD22 ASN 71 HD22 ASN 71 -12.021 1.897 -6.761
532 H SER 72 H SER 72 -7.304 -1.502 -3.495
533 HA SER 72 HA SER 72 -4.862 -2.032 -4.847
534 HB2 SER 72 HB2 SER 72 -5.210 -2.249 -2.384
535 HB3 SER 72 HB3 SER 72 -6.137 -3.708 -2.689
536 HG SER 72 HG SER 72 -3.928 -4.119 -2.186
537 H GLN 73 H GLN 73 -7.998 -3.674 -4.861
538 HA GLN 73 HA GLN 73 -7.029 -6.059 -6.038
539 HB2 GLN 73 HB2 GLN 73 -9.364 -6.572 -6.561
540 HB3 GLN 73 HB3 GLN 73 -9.155 -6.101 -4.885
541 HG2 GLN 73 HG2 GLN 73 -10.142 -4.243 -7.034
542 HG3 GLN 73 HG3 GLN 73 -11.207 -5.257 -6.068
543 HE21 GLN 73 HE21 GLN 73 -9.312 -2.403 -6.176
544 HE22 GLN 73 HE22 GLN 73 -9.754 -1.802 -4.613
545 H THR 74 H THR 74 -8.047 -3.026 -7.379
546 HA THR 74 HA THR 74 -7.872 -4.163 -10.079
547 HB THR 74 HB THR 74 -9.201 -2.084 -10.713
548 HG1 THR 74 HG1 THR 74 -10.436 -1.320 -8.765
549 HG21 THR 74 HG21 THR 74 -10.329 -4.213 -8.884
550 HG22 THR 74 HG22 THR 74 -10.324 -4.190 -10.654
551 HG23 THR 74 HG23 THR 74 -11.342 -3.058 -9.763
552 H LYS 75 H LYS 75 -6.196 -2.478 -7.883
553 HA LYS 75 HA LYS 75 -4.361 -1.207 -7.841
554 HB2 LYS 75 HB2 LYS 75 -4.040 -2.601 -10.476
555 HB3 LYS 75 HB3 LYS 75 -2.802 -1.519 -9.842
556 HG2 LYS 75 HG2 LYS 75 -3.872 -4.004 -8.521
557 HG3 LYS 75 HG3 LYS 75 -2.267 -3.788 -9.238
558 HD2 LYS 75 HD2 LYS 75 -1.728 -2.097 -7.583
559 HD3 LYS 75 HD3 LYS 75 -3.355 -2.198 -6.911
560 HE2 LYS 75 HE2 LYS 75 -2.899 -4.599 -6.395
561 HE3 LYS 75 HE3 LYS 75 -1.225 -4.322 -6.879
562 HZ1 LYS 75 HZ1 LYS 75 -2.674 -3.023 -4.642
563 HZ2 LYS 75 HZ2 LYS 75 -1.132 -2.548 -5.163
564 HZ3 LYS 75 HZ3 LYS 75 -1.380 -4.105 -4.528
565 H GLU 76 H GLU 76 -6.605 0.229 -8.513
566 HA GLU 76 HA GLU 76 -5.465 2.303 -10.258
567 HB2 GLU 76 HB2 GLU 76 -7.733 1.665 -10.882
568 HB3 GLU 76 HB3 GLU 76 -8.292 1.933 -9.236
569 HG2 GLU 76 HG2 GLU 76 -7.889 4.292 -9.428
570 HG3 GLU 76 HG3 GLU 76 -7.155 4.077 -11.016
571 H SER 77 H SER 77 -5.203 4.414 -9.421
572 HA SER 77 HA SER 77 -5.452 4.554 -6.497
573 HB2 SER 77 HB2 SER 77 -3.407 6.071 -6.577
574 HB3 SER 77 HB3 SER 77 -3.124 4.360 -6.888
575 HG SER 77 HG SER 77 -2.212 5.024 -8.650
576 H ARG 78 H ARG 78 -6.376 6.308 -5.650
577 HA ARG 78 HA ARG 78 -7.251 8.443 -7.488
578 HB2 ARG 78 HB2 ARG 78 -9.506 8.215 -6.801
579 HB3 ARG 78 HB3 ARG 78 -8.966 6.565 -7.092
580 HG2 ARG 78 HG2 ARG 78 -8.429 6.541 -4.563
581 HG3 ARG 78 HG3 ARG 78 -9.484 7.951 -4.488
582 HD2 ARG 78 HD2 ARG 78 -10.196 5.172 -5.408
583 HD3 ARG 78 HD3 ARG 78 -10.773 6.009 -3.973
584 HE ARG 78 HE ARG 78 -11.551 7.600 -6.060
585 HH11 ARG 78 HH11 ARG 78 -11.994 4.250 -5.206
586 HH12 ARG 78 HH12 ARG 78 -13.577 4.126 -5.906
587 HH21 ARG 78 HH21 ARG 78 -13.642 7.468 -7.015
588 HH22 ARG 78 HH22 ARG 78 -14.528 5.967 -6.926
589 H TRP 79 H TRP 79 -8.162 10.334 -6.255
590 HA TRP 79 HA TRP 79 -7.262 10.358 -3.451
591 HB2 TRP 79 HB2 TRP 79 -7.161 12.873 -3.660
592 HB3 TRP 79 HB3 TRP 79 -5.939 12.004 -4.577
593 HD1 TRP 79 HD1 TRP 79 -6.330 11.911 -7.301
594 HE1 TRP 79 HE1 TRP 79 -7.469 13.611 -8.857
595 HE3 TRP 79 HE3 TRP 79 -8.976 14.560 -3.814
596 HZ2 TRP 79 HZ2 TRP 79 -9.245 15.789 -8.638
597 HZ3 TRP 79 HZ3 TRP 79 -10.372 16.436 -4.574
598 HH2 TRP 79 HH2 TRP 79 -10.503 17.038 -6.936
599 H ALA 80 H ALA 80 -8.950 9.961 -2.272
600 HA ALA 80 HA ALA 80 -11.138 11.434 -1.711
601 HB1 ALA 80 HB1 ALA 80 -13.007 10.379 -2.938
602 HB2 ALA 80 HB2 ALA 80 -11.842 9.504 -3.934
603 HB3 ALA 80 HB3 ALA 80 -11.929 11.264 -4.018
604 H LYS 81 H LYS 81 -12.371 10.375 -0.098
605 HA LYS 81 HA LYS 81 -11.767 7.527 0.278
606 HB2 LYS 81 HB2 LYS 81 -11.371 7.994 2.727
607 HB3 LYS 81 HB3 LYS 81 -10.115 8.553 1.631
608 HG2 LYS 81 HG2 LYS 81 -11.032 10.828 1.765
609 HG3 LYS 81 HG3 LYS 81 -12.261 10.253 2.892
610 HD2 LYS 81 HD2 LYS 81 -10.445 9.536 4.422
611 HD3 LYS 81 HD3 LYS 81 -9.276 10.256 3.313
612 HE2 LYS 81 HE2 LYS 81 -9.787 11.775 5.153
613 HE3 LYS 81 HE3 LYS 81 -10.327 12.438 3.610
614 HZ1 LYS 81 HZ1 LYS 81 -12.568 11.833 4.109
615 HZ2 LYS 81 HZ2 LYS 81 -11.957 12.690 5.438
616 HZ3 LYS 81 HZ3 LYS 81 -12.100 11.003 5.511
617 HA PRO 82 HA PRO 82 -16.277 8.495 1.148
618 HB2 PRO 82 HB2 PRO 82 -17.273 6.629 -0.558
619 HB3 PRO 82 HB3 PRO 82 -16.946 8.297 -1.041
620 HG2 PRO 82 HG2 PRO 82 -15.285 5.844 -1.462
621 HG3 PRO 82 HG3 PRO 82 -15.650 7.160 -2.588
622 HD2 PRO 82 HD2 PRO 82 -13.305 7.005 -1.250
623 HD3 PRO 82 HD3 PRO 82 -14.060 8.558 -1.665
624 H LYS 83 H LYS 83 -17.157 7.444 2.819
625 HA LYS 83 HA LYS 83 -16.034 5.046 3.841
626 HB2 LYS 83 HB2 LYS 83 -17.466 5.245 5.646
627 HB3 LYS 83 HB3 LYS 83 -17.308 6.908 5.117
628 HG2 LYS 83 HG2 LYS 83 -19.632 5.072 4.563
629 HG3 LYS 83 HG3 LYS 83 -19.596 6.406 5.714
630 HD2 LYS 83 HD2 LYS 83 -19.065 7.890 3.704
631 HD3 LYS 83 HD3 LYS 83 -19.540 6.514 2.715
632 HE2 LYS 83 HE2 LYS 83 -21.742 6.500 3.704
633 HE3 LYS 83 HE3 LYS 83 -21.287 7.794 4.813
634 HZ1 LYS 83 HZ1 LYS 83 -21.046 9.297 2.984
635 HZ2 LYS 83 HZ2 LYS 83 -22.572 8.567 2.863
636 HZ3 LYS 83 HZ3 LYS 83 -21.307 8.060 1.856
637 H GLU 84 H GLU 84 -18.324 5.614 1.408
638 HA GLU 84 HA GLU 84 -20.040 3.414 1.687
639 HB2 GLU 84 HB2 GLU 84 -19.143 4.913 -0.768
640 HB3 GLU 84 HB3 GLU 84 -20.370 3.653 -0.806
641 HG2 GLU 84 HG2 GLU 84 -21.884 5.182 -0.333
642 HG3 GLU 84 HG3 GLU 84 -21.132 5.382 1.247
643 H LEU 85 H LEU 85 -16.801 3.605 0.375
644 HA LEU 85 HA LEU 85 -16.873 1.045 -0.891
645 HB2 LEU 85 HB2 LEU 85 -14.811 3.090 -0.309
646 HB3 LEU 85 HB3 LEU 85 -14.240 1.443 -0.519
647 HG LEU 85 HG LEU 85 -14.093 2.466 -2.647
648 HD11 LEU 85 HD11 LEU 85 -16.190 1.235 -3.756
649 HD12 LEU 85 HD12 LEU 85 -16.249 0.531 -2.129
650 HD13 LEU 85 HD13 LEU 85 -14.791 0.366 -3.116
651 HD21 LEU 85 HD21 LEU 85 -15.558 4.388 -2.232
652 HD22 LEU 85 HD22 LEU 85 -16.967 3.328 -2.294
653 HD23 LEU 85 HD23 LEU 85 -15.982 3.572 -3.737
654 H GLU 86 H GLU 86 -15.408 2.250 2.035
655 HA GLU 86 HA GLU 86 -14.535 -0.267 3.011
656 HB2 GLU 86 HB2 GLU 86 -13.812 2.207 3.590
657 HB3 GLU 86 HB3 GLU 86 -15.068 2.053 4.813
658 HG2 GLU 86 HG2 GLU 86 -13.072 -0.112 4.681
659 HG3 GLU 86 HG3 GLU 86 -12.527 1.457 5.273
660 H ASP 87 H ASP 87 -17.524 1.399 3.086
661 HA ASP 87 HA ASP 87 -19.591 0.886 3.866
662 HB2 ASP 87 HB2 ASP 87 -19.024 -1.467 3.228
663 HB3 ASP 87 HB3 ASP 87 -18.397 -1.719 4.851
664 H LEU 88 H LEU 88 -17.085 1.723 5.540
665 HA LEU 88 HA LEU 88 -16.550 2.447 7.601
666 HB2 LEU 88 HB2 LEU 88 -18.790 3.591 7.241
667 HB3 LEU 88 HB3 LEU 88 -19.483 2.349 8.263
668 HG LEU 88 HG LEU 88 -18.911 4.607 9.339
669 HD11 LEU 88 HD11 LEU 88 -18.212 3.576 11.434
670 HD12 LEU 88 HD12 LEU 88 -17.797 2.094 10.573
671 HD13 LEU 88 HD13 LEU 88 -19.476 2.630 10.648
672 HD21 LEU 88 HD21 LEU 88 -16.138 3.439 9.158
673 HD22 LEU 88 HD22 LEU 88 -16.598 4.852 10.107
674 HD23 LEU 88 HD23 LEU 88 -16.713 4.897 8.348
675 H GLU 89 H GLU 89 -15.433 0.673 8.206
676 HA GLU 89 HA GLU 89 -14.831 -0.995 9.623
677 HB2 GLU 89 HB2 GLU 89 -17.540 -0.472 10.861
678 HB3 GLU 89 HB3 GLU 89 -16.419 -1.680 11.472
679 HG2 GLU 89 HG2 GLU 89 -15.866 1.271 11.268
680 HG3 GLU 89 HG3 GLU 89 -16.324 0.408 12.735
681 H GLY 90 H GLY 90 -16.483 -1.171 7.121
682 HA2 GLY 90 HA2 GLY 90 -17.498 -3.927 7.491
683 HA3 GLY 90 HA3 GLY 90 -18.006 -2.828 6.211
684 H LEU 91 H LEU 91 -14.888 -2.191 6.447
685 HA LEU 91 HA LEU 91 -13.254 -2.450 4.888
686 HB2 LEU 91 HB2 LEU 91 -12.435 -5.023 5.071
687 HB3 LEU 91 HB3 LEU 91 -12.029 -3.753 6.205
688 HG LEU 91 HG LEU 91 -14.258 -4.594 7.385
689 HD11 LEU 91 HD11 LEU 91 -13.265 -7.054 5.950
690 HD12 LEU 91 HD12 LEU 91 -14.816 -6.255 5.695
691 HD13 LEU 91 HD13 LEU 91 -14.465 -7.027 7.242
692 HD21 LEU 91 HD21 LEU 91 -12.848 -6.036 8.790
693 HD22 LEU 91 HD22 LEU 91 -12.079 -4.490 8.431
694 HD23 LEU 91 HD23 LEU 91 -11.572 -5.948 7.576
695 H GLU 92 H GLU 92 -13.623 -5.767 4.124
696 HA GLU 92 HA GLU 92 -14.954 -5.020 1.605
697 HB2 GLU 92 HB2 GLU 92 -12.457 -5.922 1.713
698 HB3 GLU 92 HB3 GLU 92 -13.266 -7.478 1.798
699 HG2 GLU 92 HG2 GLU 92 -13.940 -5.519 -0.360
700 HG3 GLU 92 HG3 GLU 92 -12.531 -6.565 -0.494
Start of MODEL 9
1 H1 GLY 1 H1 GLY 1 19.600 -13.011 -9.015
2 H2 GLY 1 H2 GLY 1 19.578 -11.629 -8.034
3 H3 GLY 1 H3 GLY 1 18.170 -12.112 -8.844
4 HA2 GLY 1 HA3 GLY 1 18.121 -14.169 -7.537
5 HA3 GLY 1 HA2 GLY 1 19.529 -13.592 -6.657
6 H SER 2 H SER 2 18.614 -10.812 -6.705
7 HA SER 2 HA SER 2 17.441 -9.342 -5.455
8 HB2 SER 2 HB2 SER 2 15.253 -11.436 -5.440
9 HB3 SER 2 HB3 SER 2 15.063 -9.709 -5.131
10 HG SER 2 HG SER 2 14.758 -9.551 -7.207
11 H ASP 3 H ASP 3 19.210 -11.225 -4.186
12 HA ASP 3 HA ASP 3 18.084 -11.999 -1.664
13 HB2 ASP 3 HB2 ASP 3 20.977 -11.629 -2.492
14 HB3 ASP 3 HB3 ASP 3 20.451 -12.360 -0.982
15 H VAL 4 H VAL 4 20.396 -9.489 -2.623
16 HA VAL 4 HA VAL 4 19.790 -7.974 -0.201
17 HB VAL 4 HB VAL 4 22.147 -8.203 -0.706
18 HG11 VAL 4 HG11 VAL 4 21.529 -6.915 -3.361
19 HG12 VAL 4 HG12 VAL 4 22.021 -8.589 -3.097
20 HG13 VAL 4 HG13 VAL 4 23.141 -7.271 -2.746
21 HG21 VAL 4 HG21 VAL 4 21.496 -6.111 0.317
22 HG22 VAL 4 HG22 VAL 4 21.170 -5.405 -1.267
23 HG23 VAL 4 HG23 VAL 4 22.820 -5.833 -0.814
24 H ALA 5 H ALA 5 18.752 -6.031 -0.219
25 HA ALA 5 HA ALA 5 17.350 -4.385 -0.904
26 HB1 ALA 5 HB1 ALA 5 19.295 -3.569 -2.129
27 HB2 ALA 5 HB2 ALA 5 17.811 -3.273 -3.036
28 HB3 ALA 5 HB3 ALA 5 18.877 -4.599 -3.498
29 H ALA 6 H ALA 6 16.271 -6.847 -0.902
30 HA ALA 6 HA ALA 6 15.236 -7.852 -3.301
31 HB1 ALA 6 HB1 ALA 6 13.687 -9.115 -1.908
32 HB2 ALA 6 HB2 ALA 6 14.075 -8.085 -0.529
33 HB3 ALA 6 HB3 ALA 6 15.313 -9.131 -1.223
34 H GLY 7 H GLY 7 14.025 -5.350 -1.141
35 HA2 GLY 7 HA2 GLY 7 11.540 -5.111 -2.638
36 HA3 GLY 7 HA3 GLY 7 12.044 -4.111 -1.281
37 H THR 8 H THR 8 14.454 -3.204 -2.116
38 HA THR 8 HA THR 8 13.944 -1.007 -3.676
39 HB THR 8 HB THR 8 16.633 -2.363 -3.594
40 HG1 THR 8 HG1 THR 8 16.033 -0.555 -1.587
41 HG21 THR 8 HG21 THR 8 17.471 -0.073 -3.550
42 HG22 THR 8 HG22 THR 8 15.820 0.546 -3.541
43 HG23 THR 8 HG23 THR 8 16.429 -0.319 -4.952
44 H ALA 9 H ALA 9 15.042 -4.215 -4.690
45 HA ALA 9 HA ALA 9 15.203 -3.416 -7.477
46 HB1 ALA 9 HB1 ALA 9 15.530 -6.132 -6.203
47 HB2 ALA 9 HB2 ALA 9 16.831 -5.003 -6.582
48 HB3 ALA 9 HB3 ALA 9 15.885 -5.727 -7.882
49 H SER 10 H SER 10 12.663 -3.136 -6.183
50 HA SER 10 HA SER 10 10.489 -3.296 -6.760
51 HB2 SER 10 HB2 SER 10 11.510 -4.996 -9.042
52 HB3 SER 10 HB3 SER 10 9.840 -4.455 -8.866
53 HG SER 10 HG SER 10 10.568 -2.316 -9.003
54 H GLY 11 H GLY 11 9.889 -4.313 -4.897
55 HA2 GLY 11 HA2 GLY 11 9.890 -7.189 -4.672
56 HA3 GLY 11 HA3 GLY 11 9.148 -6.046 -3.555
57 H ALA 12 H ALA 12 7.781 -8.344 -4.252
58 HA ALA 12 HA ALA 12 5.859 -7.397 -6.251
59 HB1 ALA 12 HB1 ALA 12 6.451 -10.253 -5.521
60 HB2 ALA 12 HB2 ALA 12 7.216 -9.380 -6.850
61 HB3 ALA 12 HB3 ALA 12 5.472 -9.670 -6.873
62 H LYS 13 H LYS 13 3.771 -9.049 -5.839
63 HA LYS 13 HA LYS 13 1.873 -9.283 -4.603
64 HB2 LYS 13 HB2 LYS 13 3.457 -8.674 -2.110
65 HB3 LYS 13 HB3 LYS 13 1.998 -9.647 -2.261
66 HG2 LYS 13 HG2 LYS 13 3.167 -11.429 -3.283
67 HG3 LYS 13 HG3 LYS 13 4.595 -10.415 -3.573
68 HD2 LYS 13 HD2 LYS 13 3.577 -11.102 -0.819
69 HD3 LYS 13 HD3 LYS 13 4.786 -12.065 -1.674
70 HE2 LYS 13 HE2 LYS 13 5.031 -9.131 -1.005
71 HE3 LYS 13 HE3 LYS 13 5.809 -10.449 -0.126
72 HZ1 LYS 13 HZ1 LYS 13 7.374 -9.517 -1.632
73 HZ2 LYS 13 HZ2 LYS 13 6.295 -9.626 -2.927
74 HZ3 LYS 13 HZ3 LYS 13 6.937 -11.037 -2.248
75 H SER 14 H SER 14 3.710 -6.682 -4.852
76 HA SER 14 HA SER 14 1.881 -4.666 -4.958
77 HB2 SER 14 HB2 SER 14 2.319 -3.410 -2.842
78 HB3 SER 14 HB3 SER 14 1.494 -4.936 -2.531
79 HG SER 14 HG SER 14 4.012 -5.531 -2.425
80 H MET 15 H MET 15 3.014 -3.061 -6.061
81 HA MET 15 HA MET 15 5.815 -3.604 -6.472
82 HB2 MET 15 HB2 MET 15 4.048 -1.365 -7.476
83 HB3 MET 15 HB3 MET 15 5.724 -1.590 -7.956
84 HG2 MET 15 HG2 MET 15 5.132 -3.800 -8.870
85 HG3 MET 15 HG3 MET 15 3.448 -3.492 -8.451
86 HE1 MET 15 HE1 MET 15 4.427 -4.295 -11.388
87 HE2 MET 15 HE2 MET 15 3.463 -3.190 -12.365
88 HE3 MET 15 HE3 MET 15 2.739 -3.995 -10.973
89 H TRP 16 H TRP 16 7.154 -3.125 -4.880
90 HA TRP 16 HA TRP 16 7.140 -0.397 -3.848
91 HB2 TRP 16 HB2 TRP 16 7.329 -1.090 -1.552
92 HB3 TRP 16 HB3 TRP 16 5.895 -1.842 -2.230
93 HD1 TRP 16 HD1 TRP 16 6.080 -4.516 -2.752
94 HE1 TRP 16 HE1 TRP 16 7.465 -6.346 -1.582
95 HE3 TRP 16 HE3 TRP 16 9.492 -1.549 -0.385
96 HZ2 TRP 16 HZ2 TRP 16 9.699 -6.503 0.126
97 HZ3 TRP 16 HZ3 TRP 16 11.220 -2.618 1.002
98 HH2 TRP 16 HH2 TRP 16 11.321 -5.043 1.251
99 H THR 17 H THR 17 9.113 0.306 -3.023
100 HA THR 17 HA THR 17 11.415 -1.504 -3.356
101 HB THR 17 HB THR 17 12.762 0.317 -4.250
102 HG1 THR 17 HG1 THR 17 10.494 1.970 -4.511
103 HG21 THR 17 HG21 THR 17 10.941 -1.030 -5.655
104 HG22 THR 17 HG22 THR 17 12.024 0.151 -6.389
105 HG23 THR 17 HG23 THR 17 10.370 0.605 -5.968
106 H GLU 18 H GLU 18 13.010 -1.228 -1.810
107 HA GLU 18 HA GLU 18 12.130 0.062 0.618
108 HB2 GLU 18 HB2 GLU 18 13.360 -2.176 0.469
109 HB3 GLU 18 HB3 GLU 18 14.809 -1.240 0.131
110 HG2 GLU 18 HG2 GLU 18 14.495 -0.057 2.277
111 HG3 GLU 18 HG3 GLU 18 13.122 -1.108 2.616
112 H HIS 19 H HIS 19 12.640 2.066 1.209
113 HA HIS 19 HA HIS 19 14.998 3.371 0.040
114 HB2 HIS 19 HB2 HIS 19 12.151 4.330 -0.111
115 HB3 HIS 19 HB3 HIS 19 13.469 5.490 -0.061
116 HD1 HIS 19 HD1 HIS 19 14.595 2.642 -1.959
117 HD2 HIS 19 HD2 HIS 19 12.227 5.975 -2.728
118 HE1 HIS 19 HE1 HIS 19 14.577 2.900 -4.461
119 HE2 HIS 19 HE2 HIS 19 13.090 4.888 -4.917
120 H LYS 20 H LYS 20 16.070 4.644 1.480
121 HA LYS 20 HA LYS 20 14.789 4.896 4.112
122 HB2 LYS 20 HB2 LYS 20 16.727 4.365 5.168
123 HB3 LYS 20 HB3 LYS 20 17.042 3.532 3.656
124 HG2 LYS 20 HG2 LYS 20 17.913 6.315 3.645
125 HG3 LYS 20 HG3 LYS 20 18.702 5.333 4.877
126 HD2 LYS 20 HD2 LYS 20 20.017 5.277 2.882
127 HD3 LYS 20 HD3 LYS 20 19.291 3.689 3.115
128 HE2 LYS 20 HE2 LYS 20 19.129 4.260 0.793
129 HE3 LYS 20 HE3 LYS 20 17.516 4.326 1.498
130 HZ1 LYS 20 HZ1 LYS 20 17.926 6.209 0.039
131 HZ2 LYS 20 HZ2 LYS 20 19.270 6.671 0.966
132 HZ3 LYS 20 HZ3 LYS 20 17.713 6.733 1.635
133 H SER 21 H SER 21 14.775 6.793 5.160
134 HA SER 21 HA SER 21 15.225 9.259 3.840
135 HB2 SER 21 HB2 SER 21 13.655 8.911 5.763
136 HB3 SER 21 HB3 SER 21 15.044 8.652 6.814
137 HG SER 21 HG SER 21 15.135 10.726 7.038
138 HA PRO 22 HA PRO 22 19.607 9.762 4.101
139 HB2 PRO 22 HB2 PRO 22 19.728 12.357 5.127
140 HB3 PRO 22 HB3 PRO 22 19.614 11.920 3.420
141 HG2 PRO 22 HG2 PRO 22 17.464 12.744 5.319
142 HG3 PRO 22 HG3 PRO 22 17.657 13.139 3.600
143 HD2 PRO 22 HD2 PRO 22 15.883 11.310 4.397
144 HD3 PRO 22 HD3 PRO 22 16.827 11.072 2.910
145 H ASP 23 H ASP 23 17.652 10.305 6.919
146 HA ASP 23 HA ASP 23 19.840 10.446 8.769
147 HB2 ASP 23 HB2 ASP 23 17.960 10.259 10.442
148 HB3 ASP 23 HB3 ASP 23 17.886 11.644 9.371
149 H GLY 24 H GLY 24 18.397 7.922 7.093
150 HA2 GLY 24 HA2 GLY 24 19.371 5.732 7.349
151 HA3 GLY 24 HA3 GLY 24 19.442 6.017 9.079
152 H ARG 25 H ARG 25 16.536 7.176 8.761
153 HA ARG 25 HA ARG 25 15.291 4.709 9.504
154 HB2 ARG 25 HB2 ARG 25 14.566 6.859 10.460
155 HB3 ARG 25 HB3 ARG 25 14.000 7.373 8.875
156 HG2 ARG 25 HG2 ARG 25 12.192 6.570 10.358
157 HG3 ARG 25 HG3 ARG 25 12.321 5.654 8.853
158 HD2 ARG 25 HD2 ARG 25 13.669 3.959 10.082
159 HD3 ARG 25 HD3 ARG 25 13.342 4.840 11.571
160 HE ARG 25 HE ARG 25 10.885 4.393 10.915
161 HH11 ARG 25 HH11 ARG 25 13.586 2.240 10.313
162 HH12 ARG 25 HH12 ARG 25 12.627 0.795 10.396
163 HH21 ARG 25 HH21 ARG 25 9.600 2.486 11.010
164 HH22 ARG 25 HH22 ARG 25 10.354 0.931 10.787
165 H THR 26 H THR 26 14.532 3.202 8.205
166 HA THR 26 HA THR 26 14.251 3.820 5.367
167 HB THR 26 HB THR 26 14.204 1.125 6.741
168 HG1 THR 26 HG1 THR 26 16.231 2.546 6.726
169 HG21 THR 26 HG21 THR 26 14.560 1.862 3.832
170 HG22 THR 26 HG22 THR 26 13.119 1.132 4.542
171 HG23 THR 26 HG23 THR 26 14.637 0.234 4.507
172 H TYR 27 H TYR 27 12.374 3.780 4.278
173 HA TYR 27 HA TYR 27 10.058 2.488 5.528
174 HB2 TYR 27 HB2 TYR 27 8.689 4.293 4.236
175 HB3 TYR 27 HB3 TYR 27 9.383 4.693 5.799
176 HD1 TYR 27 HD1 TYR 27 10.402 4.809 2.192
177 HD2 TYR 27 HD2 TYR 27 10.365 6.756 5.971
178 HE1 TYR 27 HE1 TYR 27 11.485 6.775 1.184
179 HE2 TYR 27 HE2 TYR 27 11.454 8.723 4.981
180 HH TYR 27 HH TYR 27 12.680 9.417 3.125
181 H TYR 28 H TYR 28 8.266 2.443 3.606
182 HA TYR 28 HA TYR 28 9.692 1.126 1.391
183 HB2 TYR 28 HB2 TYR 28 7.057 0.304 2.630
184 HB3 TYR 28 HB3 TYR 28 7.883 -0.516 1.304
185 HD1 TYR 28 HD2 TYR 28 10.576 -0.818 2.043
186 HD2 TYR 28 HD1 TYR 28 7.164 -0.933 4.578
187 HE1 TYR 28 HE2 TYR 28 11.834 -2.173 3.661
188 HE2 TYR 28 HE1 TYR 28 8.414 -2.286 6.207
189 HH TYR 28 HH TYR 28 11.789 -2.677 6.060
190 H TYR 29 H TYR 29 9.130 1.716 -0.638
191 HA TYR 29 HA TYR 29 6.936 3.664 -0.800
192 HB2 TYR 29 HB2 TYR 29 8.649 5.028 -1.331
193 HB3 TYR 29 HB3 TYR 29 9.700 3.702 -1.788
194 HD1 TYR 29 HD1 TYR 29 6.622 5.421 -3.135
195 HD2 TYR 29 HD2 TYR 29 10.382 3.631 -3.917
196 HE1 TYR 29 HE1 TYR 29 6.411 6.045 -5.515
197 HE2 TYR 29 HE2 TYR 29 10.198 4.244 -6.293
198 HH TYR 29 HH TYR 29 8.676 4.913 -7.916
199 H ASN 30 H ASN 30 5.296 3.144 -1.921
200 HA ASN 30 HA ASN 30 5.352 0.819 -3.665
201 HB2 ASN 30 HB2 ASN 30 3.193 2.454 -2.371
202 HB3 ASN 30 HB3 ASN 30 2.802 1.470 -3.779
203 HD21 ASN 30 HD21 ASN 30 1.484 0.062 -2.719
204 HD22 ASN 30 HD22 ASN 30 2.045 -1.056 -1.531
205 H THR 31 H THR 31 5.829 1.109 -5.715
206 HA THR 31 HA THR 31 5.940 3.689 -6.914
207 HB THR 31 HB THR 31 6.697 2.518 -8.908
208 HG1 THR 31 HG1 THR 31 6.116 0.506 -9.276
209 HG21 THR 31 HG21 THR 31 7.728 1.344 -6.327
210 HG22 THR 31 HG22 THR 31 8.353 2.764 -7.175
211 HG23 THR 31 HG23 THR 31 8.539 1.157 -7.884
212 H GLU 32 H GLU 32 3.514 1.383 -6.528
213 HA GLU 32 HA GLU 32 1.949 1.727 -8.823
214 HB2 GLU 32 HB2 GLU 32 0.195 1.254 -6.720
215 HB3 GLU 32 HB3 GLU 32 0.934 0.047 -7.761
216 HG2 GLU 32 HG2 GLU 32 2.906 0.151 -6.135
217 HG3 GLU 32 HG3 GLU 32 1.787 0.970 -5.048
218 H THR 33 H THR 33 1.753 3.228 -5.641
219 HA THR 33 HA THR 33 -0.037 5.291 -6.681
220 HB THR 33 HB THR 33 -0.281 5.971 -4.310
221 HG1 THR 33 HG1 THR 33 0.726 4.161 -2.868
222 HG21 THR 33 HG21 THR 33 -0.617 2.995 -4.763
223 HG22 THR 33 HG22 THR 33 -1.782 4.248 -5.208
224 HG23 THR 33 HG23 THR 33 -1.422 3.941 -3.507
225 H LYS 34 H LYS 34 3.164 4.688 -6.270
226 HA LYS 34 HA LYS 34 5.069 5.891 -6.372
227 HB2 LYS 34 HB2 LYS 34 3.159 8.045 -7.265
228 HB3 LYS 34 HB3 LYS 34 4.908 8.264 -7.225
229 HG2 LYS 34 HG2 LYS 34 3.696 5.948 -8.648
230 HG3 LYS 34 HG3 LYS 34 3.789 7.533 -9.432
231 HD2 LYS 34 HD2 LYS 34 6.199 7.552 -9.142
232 HD3 LYS 34 HD3 LYS 34 6.130 6.029 -8.254
233 HE2 LYS 34 HE2 LYS 34 5.318 4.887 -10.241
234 HE3 LYS 34 HE3 LYS 34 5.308 6.407 -11.133
235 HZ1 LYS 34 HZ1 LYS 34 7.760 5.240 -9.933
236 HZ2 LYS 34 HZ2 LYS 34 7.662 6.532 -11.026
237 HZ3 LYS 34 HZ3 LYS 34 7.283 4.959 -11.531
238 H GLN 35 H GLN 35 3.468 5.695 -3.947
239 HA GLN 35 HA GLN 35 4.387 8.111 -2.535
240 HB2 GLN 35 HB2 GLN 35 2.161 6.202 -1.828
241 HB3 GLN 35 HB3 GLN 35 2.708 7.521 -0.804
242 HG2 GLN 35 HG2 GLN 35 2.142 9.094 -2.639
243 HG3 GLN 35 HG3 GLN 35 1.439 7.733 -3.514
244 HE21 GLN 35 HE21 GLN 35 0.221 10.181 -2.458
245 HE22 GLN 35 HE22 GLN 35 -1.050 9.648 -1.402
246 H SER 36 H SER 36 5.370 7.863 -0.505
247 HA SER 36 HA SER 36 6.516 5.209 -0.048
248 HB2 SER 36 HB2 SER 36 8.235 6.519 1.269
249 HB3 SER 36 HB3 SER 36 8.215 6.846 -0.460
250 HG SER 36 HG SER 36 8.250 8.819 0.483
251 H THR 37 H THR 37 6.344 4.270 1.973
252 HA THR 37 HA THR 37 4.496 5.500 3.853
253 HB THR 37 HB THR 37 3.138 4.411 2.031
254 HG1 THR 37 HG1 THR 37 2.088 4.588 3.955
255 HG21 THR 37 HG21 THR 37 4.480 1.928 3.104
256 HG22 THR 37 HG22 THR 37 4.464 2.523 1.441
257 HG23 THR 37 HG23 THR 37 2.982 1.900 2.168
258 H TRP 38 H TRP 38 4.118 4.081 5.741
259 HA TRP 38 HA TRP 38 6.520 3.014 6.784
260 HB2 TRP 38 HB2 TRP 38 4.764 2.099 8.554
261 HB3 TRP 38 HB3 TRP 38 5.212 3.797 8.489
262 HD1 TRP 38 HD1 TRP 38 3.196 5.290 8.778
263 HE1 TRP 38 HE1 TRP 38 0.705 5.229 8.137
264 HE3 TRP 38 HE3 TRP 38 3.076 0.774 6.365
265 HZ2 TRP 38 HZ2 TRP 38 -1.072 3.504 6.789
266 HZ3 TRP 38 HZ3 TRP 38 0.938 -0.004 5.437
267 HH2 TRP 38 HH2 TRP 38 -1.092 1.333 5.642
268 H GLU 39 H GLU 39 6.374 0.754 7.934
269 HA GLU 39 HA GLU 39 6.414 -1.257 6.022
270 HB2 GLU 39 HB2 GLU 39 6.218 -2.820 8.040
271 HB3 GLU 39 HB3 GLU 39 7.578 -1.707 8.008
272 HG2 GLU 39 HG2 GLU 39 6.374 -0.211 9.531
273 HG3 GLU 39 HG3 GLU 39 5.028 -1.349 9.571
274 H LYS 40 H LYS 40 4.852 -2.158 4.901
275 HA LYS 40 HA LYS 40 2.142 -1.491 5.428
276 HB2 LYS 40 HB2 LYS 40 3.347 -3.311 3.342
277 HB3 LYS 40 HB3 LYS 40 1.656 -2.845 3.399
278 HG2 LYS 40 HG2 LYS 40 2.486 -0.440 3.250
279 HG3 LYS 40 HG3 LYS 40 4.044 -1.137 2.798
280 HD2 LYS 40 HD2 LYS 40 1.424 -1.654 1.385
281 HD3 LYS 40 HD3 LYS 40 2.680 -0.548 0.828
282 HE2 LYS 40 HE2 LYS 40 3.242 -3.455 1.339
283 HE3 LYS 40 HE3 LYS 40 2.604 -2.893 -0.209
284 HZ1 LYS 40 HZ1 LYS 40 4.532 -1.410 -0.392
285 HZ2 LYS 40 HZ2 LYS 40 4.993 -3.038 -0.296
286 HZ3 LYS 40 HZ3 LYS 40 5.151 -2.034 1.057
287 HA PRO 41 HA PRO 41 0.473 -5.046 7.541
288 HB2 PRO 41 HB2 PRO 41 -1.818 -5.311 6.004
289 HB3 PRO 41 HB3 PRO 41 -1.640 -4.228 7.388
290 HG2 PRO 41 HG2 PRO 41 -1.374 -3.638 4.472
291 HG3 PRO 41 HG3 PRO 41 -2.151 -2.674 5.745
292 HD2 PRO 41 HD2 PRO 41 0.266 -2.026 4.838
293 HD3 PRO 41 HD3 PRO 41 -0.114 -1.900 6.567
294 H ASP 42 H ASP 42 -0.913 -7.036 6.711
295 HA ASP 42 HA ASP 42 0.780 -8.940 5.655
296 HB2 ASP 42 HB2 ASP 42 -2.237 -8.892 5.706
297 HB3 ASP 42 HB3 ASP 42 -1.254 -10.325 5.411
298 H ASP 43 H ASP 43 -0.147 -6.476 3.707
299 HA ASP 43 HA ASP 43 -1.001 -7.699 1.320
300 HB2 ASP 43 HB2 ASP 43 0.554 -5.200 1.911
301 HB3 ASP 43 HB3 ASP 43 0.317 -5.719 0.250
302 H LEU 44 H LEU 44 2.117 -7.355 2.806
303 HA LEU 44 HA LEU 44 3.576 -8.321 0.511
304 HB2 LEU 44 HB2 LEU 44 4.541 -7.948 3.342
305 HB3 LEU 44 HB3 LEU 44 5.521 -8.068 1.889
306 HG LEU 44 HG LEU 44 3.533 -5.875 1.996
307 HD11 LEU 44 HD11 LEU 44 6.063 -5.926 3.626
308 HD12 LEU 44 HD12 LEU 44 4.410 -5.695 4.204
309 HD13 LEU 44 HD13 LEU 44 5.181 -4.455 3.212
310 HD21 LEU 44 HD21 LEU 44 5.334 -4.690 0.826
311 HD22 LEU 44 HD22 LEU 44 4.901 -6.201 0.027
312 HD23 LEU 44 HD23 LEU 44 6.367 -6.110 1.003
313 H LYS 45 H LYS 45 1.748 -9.669 2.924
314 HA LYS 45 HA LYS 45 3.217 -12.148 3.163
315 HB2 LYS 45 HB2 LYS 45 0.415 -11.585 4.109
316 HB3 LYS 45 HB3 LYS 45 1.580 -12.729 4.769
317 HG2 LYS 45 HG2 LYS 45 2.186 -9.805 4.790
318 HG3 LYS 45 HG3 LYS 45 1.117 -10.504 6.007
319 HD2 LYS 45 HD2 LYS 45 3.807 -11.669 5.416
320 HD3 LYS 45 HD3 LYS 45 3.588 -10.350 6.575
321 HE2 LYS 45 HE2 LYS 45 2.161 -11.609 7.914
322 HE3 LYS 45 HE3 LYS 45 1.962 -12.852 6.686
323 HZ1 LYS 45 HZ1 LYS 45 4.332 -12.318 8.383
324 HZ2 LYS 45 HZ2 LYS 45 4.426 -13.272 6.988
325 HZ3 LYS 45 HZ3 LYS 45 3.426 -13.747 8.270
326 H THR 46 H THR 46 -0.224 -11.647 2.507
327 HA THR 46 HA THR 46 -0.246 -12.994 -0.012
328 HB THR 46 HB THR 46 -1.662 -14.481 2.194
329 HG1 THR 46 HG1 THR 46 0.348 -14.918 2.858
330 HG21 THR 46 HG21 THR 46 -0.772 -15.233 -0.574
331 HG22 THR 46 HG22 THR 46 -2.428 -14.992 -0.019
332 HG23 THR 46 HG23 THR 46 -1.489 -16.363 0.575
333 HA PRO 47 HA PRO 47 -3.810 -10.392 -0.338
334 HB2 PRO 47 HB2 PRO 47 -5.141 -12.731 -1.617
335 HB3 PRO 47 HB3 PRO 47 -5.040 -11.055 -2.176
336 HG2 PRO 47 HG2 PRO 47 -3.487 -12.884 -3.286
337 HG3 PRO 47 HG3 PRO 47 -2.817 -11.294 -2.878
338 HD2 PRO 47 HD2 PRO 47 -2.508 -13.907 -1.458
339 HD3 PRO 47 HD3 PRO 47 -1.311 -12.631 -1.723
340 H ALA 48 H ALA 48 -4.646 -13.756 0.509
341 HA ALA 48 HA ALA 48 -7.049 -13.021 1.827
342 HB1 ALA 48 HB1 ALA 48 -6.385 -15.297 0.848
343 HB2 ALA 48 HB2 ALA 48 -7.335 -15.238 2.325
344 HB3 ALA 48 HB3 ALA 48 -5.605 -15.570 2.411
345 H GLU 49 H GLU 49 -3.739 -13.249 2.886
346 HA GLU 49 HA GLU 49 -4.319 -13.149 5.668
347 HB2 GLU 49 HB2 GLU 49 -1.841 -12.401 4.120
348 HB3 GLU 49 HB3 GLU 49 -1.944 -12.327 5.874
349 HG2 GLU 49 HG2 GLU 49 -2.531 -14.760 5.857
350 HG3 GLU 49 HG3 GLU 49 -2.178 -14.768 4.130
351 H GLN 50 H GLN 50 -4.027 -10.773 3.117
352 HA GLN 50 HA GLN 50 -3.744 -8.439 4.629
353 HB2 GLN 50 HB2 GLN 50 -5.345 -8.720 2.092
354 HB3 GLN 50 HB3 GLN 50 -4.583 -7.260 2.705
355 HG2 GLN 50 HG2 GLN 50 -2.394 -8.228 2.320
356 HG3 GLN 50 HG3 GLN 50 -3.154 -9.730 1.774
357 HE21 GLN 50 HE21 GLN 50 -2.189 -9.560 -0.265
358 HE22 GLN 50 HE22 GLN 50 -2.707 -8.405 -1.440
359 H LEU 51 H LEU 51 -6.641 -10.301 3.783
360 HA LEU 51 HA LEU 51 -8.488 -8.256 3.914
361 HB2 LEU 51 HB2 LEU 51 -10.178 -9.911 3.902
362 HB3 LEU 51 HB3 LEU 51 -8.835 -10.492 2.940
363 HG LEU 51 HG LEU 51 -8.212 -11.698 5.230
364 HD11 LEU 51 HD11 LEU 51 -11.221 -11.506 5.291
365 HD12 LEU 51 HD12 LEU 51 -10.116 -10.796 6.467
366 HD13 LEU 51 HD13 LEU 51 -10.228 -12.549 6.311
367 HD21 LEU 51 HD21 LEU 51 -9.327 -13.676 4.294
368 HD22 LEU 51 HD22 LEU 51 -8.470 -12.734 3.067
369 HD23 LEU 51 HD23 LEU 51 -10.230 -12.628 3.195
370 H LEU 52 H LEU 52 -7.245 -10.153 6.582
371 HA LEU 52 HA LEU 52 -9.229 -9.342 8.466
372 HB2 LEU 52 HB2 LEU 52 -6.432 -10.254 9.134
373 HB3 LEU 52 HB3 LEU 52 -7.854 -10.331 10.154
374 HG LEU 52 HG LEU 52 -8.770 -11.923 8.289
375 HD11 LEU 52 HD11 LEU 52 -5.807 -12.322 7.938
376 HD12 LEU 52 HD12 LEU 52 -6.831 -11.462 6.787
377 HD13 LEU 52 HD13 LEU 52 -7.116 -13.176 7.115
378 HD21 LEU 52 HD21 LEU 52 -8.352 -12.584 10.587
379 HD22 LEU 52 HD22 LEU 52 -6.632 -12.759 10.242
380 HD23 LEU 52 HD23 LEU 52 -7.800 -13.834 9.473
381 H SER 53 H SER 53 -6.012 -8.252 7.635
382 HA SER 53 HA SER 53 -5.921 -6.167 9.605
383 HB2 SER 53 HB2 SER 53 -4.208 -6.650 7.159
384 HB3 SER 53 HB3 SER 53 -3.783 -5.625 8.531
385 HG SER 53 HG SER 53 -3.004 -7.969 8.426
386 H LYS 54 H LYS 54 -5.702 -6.098 6.081
387 HA LYS 54 HA LYS 54 -7.430 -3.727 6.005
388 HB2 LYS 54 HB2 LYS 54 -4.678 -3.915 4.766
389 HB3 LYS 54 HB3 LYS 54 -5.837 -2.643 4.413
390 HG2 LYS 54 HG2 LYS 54 -4.600 -3.217 7.095
391 HG3 LYS 54 HG3 LYS 54 -4.163 -1.901 6.001
392 HD2 LYS 54 HD2 LYS 54 -6.846 -2.297 7.322
393 HD3 LYS 54 HD3 LYS 54 -5.629 -1.109 7.785
394 HE2 LYS 54 HE2 LYS 54 -5.855 -0.012 5.622
395 HE3 LYS 54 HE3 LYS 54 -7.030 -1.224 5.113
396 HZ1 LYS 54 HZ1 LYS 54 -8.512 -0.482 6.858
397 HZ2 LYS 54 HZ2 LYS 54 -8.098 0.822 5.856
398 HZ3 LYS 54 HZ3 LYS 54 -7.378 0.661 7.385
399 H CYS 55 H CYS 55 -8.917 -3.960 4.506
400 HA CYS 55 HA CYS 55 -9.093 -6.205 2.827
401 HB2 CYS 55 HB2 CYS 55 -11.085 -5.161 1.950
402 HB3 CYS 55 HB3 CYS 55 -11.008 -4.817 3.673
403 HG CYS 55 HG CYS 55 -11.754 -2.400 3.011
404 HA PRO 56 HA PRO 56 -6.963 -5.395 -0.985
405 HB2 PRO 56 HB2 PRO 56 -9.642 -5.073 -2.284
406 HB3 PRO 56 HB3 PRO 56 -8.229 -5.987 -2.832
407 HG2 PRO 56 HG2 PRO 56 -10.254 -7.258 -1.704
408 HG3 PRO 56 HG3 PRO 56 -8.586 -7.705 -1.296
409 HD2 PRO 56 HD2 PRO 56 -10.580 -6.164 0.287
410 HD3 PRO 56 HD3 PRO 56 -9.323 -7.283 0.845
411 H TRP 57 H TRP 57 -9.694 -3.213 -0.334
412 HA TRP 57 HA TRP 57 -8.414 -1.072 -1.842
413 HB2 TRP 57 HB2 TRP 57 -11.010 -1.140 -0.291
414 HB3 TRP 57 HB3 TRP 57 -10.427 0.246 -1.209
415 HD1 TRP 57 HD1 TRP 57 -10.119 -0.218 -3.944
416 HE1 TRP 57 HE1 TRP 57 -11.614 -1.635 -5.496
417 HE3 TRP 57 HE3 TRP 57 -12.494 -3.080 -0.423
418 HZ2 TRP 57 HZ2 TRP 57 -13.541 -3.687 -5.261
419 HZ3 TRP 57 HZ3 TRP 57 -14.146 -4.744 -1.170
420 HH2 TRP 57 HH2 TRP 57 -14.658 -5.040 -3.541
421 H LYS 58 H LYS 58 -7.041 0.299 -0.932
422 HA LYS 58 HA LYS 58 -7.115 0.606 1.984
423 HB2 LYS 58 HB2 LYS 58 -5.004 -0.576 0.326
424 HB3 LYS 58 HB3 LYS 58 -4.429 0.622 1.481
425 HG2 LYS 58 HG2 LYS 58 -5.152 -0.620 3.307
426 HG3 LYS 58 HG3 LYS 58 -6.284 -1.567 2.341
427 HD2 LYS 58 HD2 LYS 58 -3.290 -1.723 2.055
428 HD3 LYS 58 HD3 LYS 58 -4.234 -2.801 3.085
429 HE2 LYS 58 HE2 LYS 58 -5.542 -2.881 0.641
430 HE3 LYS 58 HE3 LYS 58 -3.834 -2.846 0.211
431 HZ1 LYS 58 HZ1 LYS 58 -5.151 -4.790 2.023
432 HZ2 LYS 58 HZ2 LYS 58 -3.479 -4.709 1.748
433 HZ3 LYS 58 HZ3 LYS 58 -4.528 -5.106 0.482
434 H GLU 59 H GLU 59 -6.405 2.497 2.815
435 HA GLU 59 HA GLU 59 -5.564 4.600 0.940
436 HB2 GLU 59 HB2 GLU 59 -7.856 5.078 1.434
437 HB3 GLU 59 HB3 GLU 59 -7.624 4.748 3.146
438 HG2 GLU 59 HG2 GLU 59 -5.977 6.725 3.068
439 HG3 GLU 59 HG3 GLU 59 -6.776 7.124 1.547
440 H TYR 60 H TYR 60 -3.626 5.388 1.509
441 HA TYR 60 HA TYR 60 -3.081 5.768 4.355
442 HB2 TYR 60 HB2 TYR 60 -0.772 4.913 4.145
443 HB3 TYR 60 HB3 TYR 60 -1.971 3.654 3.890
444 HD1 TYR 60 HD1 TYR 60 0.279 5.993 2.037
445 HD2 TYR 60 HD2 TYR 60 -1.878 2.320 1.993
446 HE1 TYR 60 HE1 TYR 60 1.354 5.382 -0.077
447 HE2 TYR 60 HE2 TYR 60 -0.798 1.707 -0.127
448 HH TYR 60 HH TYR 60 1.897 3.366 -1.354
449 H LYS 61 H LYS 61 -1.224 7.248 4.702
450 HA LYS 61 HA LYS 61 -1.117 9.225 2.544
451 HB2 LYS 61 HB2 LYS 61 -0.244 9.518 5.409
452 HB3 LYS 61 HB3 LYS 61 -0.341 10.798 4.213
453 HG2 LYS 61 HG2 LYS 61 -2.796 10.413 4.104
454 HG3 LYS 61 HG3 LYS 61 -2.621 9.281 5.444
455 HD2 LYS 61 HD2 LYS 61 -2.152 12.248 5.417
456 HD3 LYS 61 HD3 LYS 61 -3.225 11.310 6.462
457 HE2 LYS 61 HE2 LYS 61 -0.215 11.217 6.480
458 HE3 LYS 61 HE3 LYS 61 -1.215 12.083 7.647
459 HZ1 LYS 61 HZ1 LYS 61 -1.344 9.146 7.206
460 HZ2 LYS 61 HZ2 LYS 61 -2.118 10.029 8.429
461 HZ3 LYS 61 HZ3 LYS 61 -0.426 9.881 8.425
462 H SER 62 H SER 62 0.757 9.816 1.625
463 HA SER 62 HA SER 62 3.071 8.208 1.807
464 HB2 SER 62 HB2 SER 62 3.807 10.618 0.656
465 HB3 SER 62 HB3 SER 62 3.217 9.196 -0.213
466 HG SER 62 HG SER 62 1.235 10.078 -0.328
467 H ASP 63 H ASP 63 5.305 9.520 2.031
468 HA ASP 63 HA ASP 63 5.630 10.522 4.623
469 HB2 ASP 63 HB2 ASP 63 7.521 9.746 3.294
470 HB3 ASP 63 HB3 ASP 63 7.292 11.061 2.149
471 H SER 64 H SER 64 4.825 12.111 1.602
472 HA SER 64 HA SER 64 4.845 14.763 2.671
473 HB2 SER 64 HB2 SER 64 3.430 13.716 0.206
474 HB3 SER 64 HB3 SER 64 3.818 15.399 0.561
475 HG SER 64 HG SER 64 6.090 14.548 0.669
476 H GLY 65 H GLY 65 2.773 12.116 2.927
477 HA2 GLY 65 HA2 GLY 65 0.975 11.944 4.394
478 HA3 GLY 65 HA3 GLY 65 0.937 13.690 4.543
479 H LYS 66 H LYS 66 1.002 12.531 1.340
480 HA LYS 66 HA LYS 66 -1.711 13.364 0.863
481 HB2 LYS 66 HB2 LYS 66 0.032 13.726 -0.835
482 HB3 LYS 66 HB3 LYS 66 0.295 11.997 -0.944
483 HG2 LYS 66 HG2 LYS 66 -1.030 12.874 -2.813
484 HG3 LYS 66 HG3 LYS 66 -1.906 11.671 -1.868
485 HD2 LYS 66 HD2 LYS 66 -3.270 13.652 -2.530
486 HD3 LYS 66 HD3 LYS 66 -3.206 13.367 -0.790
487 HE2 LYS 66 HE2 LYS 66 -1.614 15.119 -0.492
488 HE3 LYS 66 HE3 LYS 66 -1.412 15.307 -2.235
489 HZ1 LYS 66 HZ1 LYS 66 -3.623 16.138 -2.425
490 HZ2 LYS 66 HZ2 LYS 66 -2.845 17.016 -1.199
491 HZ3 LYS 66 HZ3 LYS 66 -3.964 15.804 -0.798
492 H THR 67 H THR 67 -3.447 12.081 1.149
493 HA THR 67 HA THR 67 -3.074 9.243 1.515
494 HB THR 67 HB THR 67 -5.823 9.704 1.307
495 HG1 THR 67 HG1 THR 67 -5.034 11.609 3.163
496 HG21 THR 67 HG21 THR 67 -4.407 8.309 2.887
497 HG22 THR 67 HG22 THR 67 -5.825 9.105 3.584
498 HG23 THR 67 HG23 THR 67 -4.216 9.781 3.847
499 H TYR 68 H TYR 68 -3.393 7.700 0.086
500 HA TYR 68 HA TYR 68 -4.878 8.355 -2.362
501 HB2 TYR 68 HB2 TYR 68 -2.149 7.428 -2.135
502 HB3 TYR 68 HB3 TYR 68 -3.126 6.259 -3.018
503 HD1 TYR 68 HD2 TYR 68 -2.327 9.898 -2.908
504 HD2 TYR 68 HD1 TYR 68 -3.538 6.584 -5.286
505 HE1 TYR 68 HE2 TYR 68 -2.165 11.294 -4.925
506 HE2 TYR 68 HE1 TYR 68 -3.381 7.973 -7.310
507 HH TYR 68 HH TYR 68 -3.483 10.397 -7.899
508 H TYR 69 H TYR 69 -6.152 6.745 -3.203
509 HA TYR 69 HA TYR 69 -6.731 4.516 -1.360
510 HB2 TYR 69 HB2 TYR 69 -8.436 6.439 -1.656
511 HB3 TYR 69 HB3 TYR 69 -8.691 5.794 -3.271
512 HD1 TYR 69 HD1 TYR 69 -8.783 4.868 0.315
513 HD2 TYR 69 HD2 TYR 69 -10.246 4.068 -3.615
514 HE1 TYR 69 HE1 TYR 69 -10.432 3.295 1.252
515 HE2 TYR 69 HE2 TYR 69 -11.893 2.492 -2.680
516 HH TYR 69 HH TYR 69 -12.460 2.230 0.737
517 H TYR 70 H TYR 70 -6.486 2.501 -2.275
518 HA TYR 70 HA TYR 70 -6.435 2.405 -5.199
519 HB2 TYR 70 HB2 TYR 70 -4.278 1.335 -5.291
520 HB3 TYR 70 HB3 TYR 70 -4.111 2.836 -4.389
521 HD1 TYR 70 HD2 TYR 70 -3.837 2.758 -1.912
522 HD2 TYR 70 HD1 TYR 70 -3.833 -0.774 -4.281
523 HE1 TYR 70 HE2 TYR 70 -2.828 1.511 -0.045
524 HE2 TYR 70 HE1 TYR 70 -2.822 -2.031 -2.425
525 HH TYR 70 HH TYR 70 -2.572 -0.750 0.737
526 H ASN 71 H ASN 71 -6.875 0.516 -6.133
527 HA ASN 71 HA ASN 71 -7.982 -1.638 -4.507
528 HB2 ASN 71 HB2 ASN 71 -7.657 -1.431 -7.522
529 HB3 ASN 71 HB3 ASN 71 -8.604 -2.637 -6.667
530 HD21 ASN 71 HD21 ASN 71 -10.481 -2.150 -7.701
531 HD22 ASN 71 HD22 ASN 71 -11.348 -0.668 -7.443
532 H SER 72 H SER 72 -6.389 -2.918 -3.596
533 HA SER 72 HA SER 72 -3.785 -2.986 -4.720
534 HB2 SER 72 HB2 SER 72 -4.342 -3.148 -2.265
535 HB3 SER 72 HB3 SER 72 -4.801 -4.819 -2.553
536 HG SER 72 HG SER 72 -2.606 -4.570 -1.843
537 H GLN 73 H GLN 73 -6.525 -5.177 -5.091
538 HA GLN 73 HA GLN 73 -4.972 -7.416 -5.867
539 HB2 GLN 73 HB2 GLN 73 -7.027 -8.374 -6.765
540 HB3 GLN 73 HB3 GLN 73 -7.277 -7.737 -5.152
541 HG2 GLN 73 HG2 GLN 73 -7.972 -6.091 -7.543
542 HG3 GLN 73 HG3 GLN 73 -9.046 -7.385 -7.019
543 HE21 GLN 73 HE21 GLN 73 -7.823 -4.236 -6.349
544 HE22 GLN 73 HE22 GLN 73 -8.875 -3.890 -5.019
545 H THR 74 H THR 74 -6.513 -4.848 -7.733
546 HA THR 74 HA THR 74 -5.402 -5.994 -10.185
547 HB THR 74 HB THR 74 -6.948 -4.358 -11.307
548 HG1 THR 74 HG1 THR 74 -8.294 -3.135 -10.086
549 HG21 THR 74 HG21 THR 74 -8.038 -6.416 -9.383
550 HG22 THR 74 HG22 THR 74 -7.691 -6.610 -11.107
551 HG23 THR 74 HG23 THR 74 -9.040 -5.598 -10.587
552 H LYS 75 H LYS 75 -4.639 -3.860 -7.864
553 HA LYS 75 HA LYS 75 -3.193 -2.176 -7.584
554 HB2 LYS 75 HB2 LYS 75 -2.055 -3.439 -10.066
555 HB3 LYS 75 HB3 LYS 75 -1.258 -2.110 -9.226
556 HG2 LYS 75 HG2 LYS 75 -1.955 -4.802 -8.057
557 HG3 LYS 75 HG3 LYS 75 -0.338 -4.228 -8.497
558 HD2 LYS 75 HD2 LYS 75 -0.516 -2.444 -6.833
559 HD3 LYS 75 HD3 LYS 75 -2.139 -2.988 -6.408
560 HE2 LYS 75 HE2 LYS 75 -1.186 -5.156 -5.703
561 HE3 LYS 75 HE3 LYS 75 0.427 -4.536 -6.058
562 HZ1 LYS 75 HZ1 LYS 75 -0.021 -2.733 -4.427
563 HZ2 LYS 75 HZ2 LYS 75 0.023 -4.286 -3.743
564 HZ3 LYS 75 HZ3 LYS 75 -1.462 -3.529 -4.002
565 H GLU 76 H GLU 76 -5.587 -1.451 -8.719
566 HA GLU 76 HA GLU 76 -4.890 0.749 -10.517
567 HB2 GLU 76 HB2 GLU 76 -6.906 -0.388 -11.152
568 HB3 GLU 76 HB3 GLU 76 -7.535 -0.308 -9.511
569 HG2 GLU 76 HG2 GLU 76 -7.833 2.048 -9.666
570 HG3 GLU 76 HG3 GLU 76 -6.994 2.111 -11.212
571 H SER 77 H SER 77 -5.004 2.891 -9.845
572 HA SER 77 HA SER 77 -5.359 3.217 -6.945
573 HB2 SER 77 HB2 SER 77 -3.429 4.894 -7.108
574 HB3 SER 77 HB3 SER 77 -3.006 3.186 -7.229
575 HG SER 77 HG SER 77 -2.202 4.881 -8.878
576 H ARG 78 H ARG 78 -6.537 4.905 -6.314
577 HA ARG 78 HA ARG 78 -7.111 7.040 -8.272
578 HB2 ARG 78 HB2 ARG 78 -9.435 6.984 -7.781
579 HB3 ARG 78 HB3 ARG 78 -8.975 5.308 -8.054
580 HG2 ARG 78 HG2 ARG 78 -8.841 4.964 -5.622
581 HG3 ARG 78 HG3 ARG 78 -9.353 6.632 -5.371
582 HD2 ARG 78 HD2 ARG 78 -10.929 4.392 -6.616
583 HD3 ARG 78 HD3 ARG 78 -11.252 5.214 -5.097
584 HE ARG 78 HE ARG 78 -11.382 7.239 -6.861
585 HH11 ARG 78 HH11 ARG 78 -12.826 4.046 -6.948
586 HH12 ARG 78 HH12 ARG 78 -14.281 4.595 -7.729
587 HH21 ARG 78 HH21 ARG 78 -13.284 7.945 -7.892
588 HH22 ARG 78 HH22 ARG 78 -14.543 6.798 -8.257
589 H TRP 79 H TRP 79 -7.921 9.052 -7.223
590 HA TRP 79 HA TRP 79 -7.498 9.059 -4.318
591 HB2 TRP 79 HB2 TRP 79 -5.938 10.606 -5.316
592 HB3 TRP 79 HB3 TRP 79 -7.212 11.342 -6.279
593 HD1 TRP 79 HD1 TRP 79 -7.166 13.752 -5.367
594 HE1 TRP 79 HE1 TRP 79 -7.582 14.849 -3.072
595 HE3 TRP 79 HE3 TRP 79 -7.326 9.536 -2.431
596 HZ2 TRP 79 HZ2 TRP 79 -7.941 14.041 -0.403
597 HZ3 TRP 79 HZ3 TRP 79 -7.714 9.802 -0.026
598 HH2 TRP 79 HH2 TRP 79 -8.013 12.008 0.970
599 H ALA 80 H ALA 80 -9.316 8.816 -3.385
600 HA ALA 80 HA ALA 80 -11.488 10.457 -3.263
601 HB1 ALA 80 HB1 ALA 80 -13.227 9.297 -4.564
602 HB2 ALA 80 HB2 ALA 80 -12.003 8.230 -5.255
603 HB3 ALA 80 HB3 ALA 80 -11.978 9.956 -5.620
604 H LYS 81 H LYS 81 -12.555 9.776 -1.431
605 HA LYS 81 HA LYS 81 -11.919 7.015 -0.614
606 HB2 LYS 81 HB2 LYS 81 -11.620 7.914 1.695
607 HB3 LYS 81 HB3 LYS 81 -10.425 8.468 0.530
608 HG2 LYS 81 HG2 LYS 81 -11.689 10.570 0.280
609 HG3 LYS 81 HG3 LYS 81 -12.806 10.016 1.528
610 HD2 LYS 81 HD2 LYS 81 -10.912 9.864 3.104
611 HD3 LYS 81 HD3 LYS 81 -9.848 10.508 1.852
612 HE2 LYS 81 HE2 LYS 81 -10.513 12.274 3.364
613 HE3 LYS 81 HE3 LYS 81 -11.213 12.550 1.769
614 HZ1 LYS 81 HZ1 LYS 81 -12.619 11.396 4.118
615 HZ2 LYS 81 HZ2 LYS 81 -13.302 11.615 2.583
616 HZ3 LYS 81 HZ3 LYS 81 -12.827 12.960 3.497
617 HA PRO 82 HA PRO 82 -16.493 7.713 0.477
618 HB2 PRO 82 HB2 PRO 82 -17.655 6.320 -1.539
619 HB3 PRO 82 HB3 PRO 82 -17.444 8.074 -1.600
620 HG2 PRO 82 HG2 PRO 82 -15.775 5.922 -2.841
621 HG3 PRO 82 HG3 PRO 82 -16.341 7.446 -3.547
622 HD2 PRO 82 HD2 PRO 82 -13.833 7.147 -2.593
623 HD3 PRO 82 HD3 PRO 82 -14.706 8.689 -2.488
624 H LYS 83 H LYS 83 -17.078 6.099 1.875
625 HA LYS 83 HA LYS 83 -15.567 3.711 2.008
626 HB2 LYS 83 HB2 LYS 83 -16.653 3.242 3.958
627 HB3 LYS 83 HB3 LYS 83 -16.999 4.950 3.857
628 HG2 LYS 83 HG2 LYS 83 -18.855 2.723 3.063
629 HG3 LYS 83 HG3 LYS 83 -18.950 3.673 4.542
630 HD2 LYS 83 HD2 LYS 83 -19.251 5.707 3.079
631 HD3 LYS 83 HD3 LYS 83 -19.398 4.604 1.714
632 HE2 LYS 83 HE2 LYS 83 -21.279 3.487 2.818
633 HE3 LYS 83 HE3 LYS 83 -21.154 4.615 4.166
634 HZ1 LYS 83 HZ1 LYS 83 -21.842 5.289 1.355
635 HZ2 LYS 83 HZ2 LYS 83 -21.620 6.425 2.592
636 HZ3 LYS 83 HZ3 LYS 83 -22.887 5.304 2.690
637 H GLU 84 H GLU 84 -18.195 4.626 0.136
638 HA GLU 84 HA GLU 84 -19.638 2.240 -0.147
639 HB2 GLU 84 HB2 GLU 84 -20.401 4.498 -0.821
640 HB3 GLU 84 HB3 GLU 84 -19.271 4.454 -2.164
641 HG2 GLU 84 HG2 GLU 84 -20.455 2.551 -3.113
642 HG3 GLU 84 HG3 GLU 84 -21.575 2.565 -1.750
643 H LEU 85 H LEU 85 -16.577 3.182 -1.461
644 HA LEU 85 HA LEU 85 -16.543 1.520 -3.738
645 HB2 LEU 85 HB2 LEU 85 -14.807 3.303 -2.538
646 HB3 LEU 85 HB3 LEU 85 -13.986 1.767 -2.343
647 HG LEU 85 HG LEU 85 -13.300 2.995 -4.382
648 HD11 LEU 85 HD11 LEU 85 -14.747 0.408 -4.924
649 HD12 LEU 85 HD12 LEU 85 -13.118 0.552 -4.262
650 HD13 LEU 85 HD13 LEU 85 -13.456 1.107 -5.902
651 HD21 LEU 85 HD21 LEU 85 -14.805 3.268 -6.218
652 HD22 LEU 85 HD22 LEU 85 -15.552 3.991 -4.790
653 HD23 LEU 85 HD23 LEU 85 -16.085 2.411 -5.363
654 H GLU 86 H GLU 86 -15.156 0.969 -0.498
655 HA GLU 86 HA GLU 86 -14.935 -1.856 -0.834
656 HB2 GLU 86 HB2 GLU 86 -13.574 -0.576 0.783
657 HB3 GLU 86 HB3 GLU 86 -15.022 -0.218 1.713
658 HG2 GLU 86 HG2 GLU 86 -15.321 -2.709 1.960
659 HG3 GLU 86 HG3 GLU 86 -13.683 -2.868 1.319
660 H ASP 87 H ASP 87 -17.282 0.337 0.456
661 HA ASP 87 HA ASP 87 -19.430 0.199 1.098
662 HB2 ASP 87 HB2 ASP 87 -19.640 -1.141 -1.041
663 HB3 ASP 87 HB3 ASP 87 -19.494 -2.594 -0.058
664 H LEU 88 H LEU 88 -17.527 -0.297 3.025
665 HA LEU 88 HA LEU 88 -19.023 -1.884 4.867
666 HB2 LEU 88 HB2 LEU 88 -17.772 -3.599 3.556
667 HB3 LEU 88 HB3 LEU 88 -16.283 -2.911 4.172
668 HG LEU 88 HG LEU 88 -16.897 -3.522 6.445
669 HD11 LEU 88 HD11 LEU 88 -19.404 -4.666 5.219
670 HD12 LEU 88 HD12 LEU 88 -19.317 -3.249 6.264
671 HD13 LEU 88 HD13 LEU 88 -18.902 -4.841 6.901
672 HD21 LEU 88 HD21 LEU 88 -15.705 -5.159 5.091
673 HD22 LEU 88 HD22 LEU 88 -17.238 -5.804 4.503
674 HD23 LEU 88 HD23 LEU 88 -16.812 -5.954 6.208
675 H GLU 89 H GLU 89 -15.547 -1.793 5.372
676 HA GLU 89 HA GLU 89 -15.995 0.338 7.358
677 HB2 GLU 89 HB2 GLU 89 -15.117 -2.477 7.972
678 HB3 GLU 89 HB3 GLU 89 -14.910 -1.141 9.093
679 HG2 GLU 89 HG2 GLU 89 -17.568 -1.996 7.982
680 HG3 GLU 89 HG3 GLU 89 -16.903 -2.582 9.506
681 H GLY 90 H GLY 90 -13.711 -1.548 5.458
682 HA2 GLY 90 HA2 GLY 90 -11.577 -0.184 5.075
683 HA3 GLY 90 HA3 GLY 90 -11.471 -0.168 6.829
684 H LEU 91 H LEU 91 -12.766 -3.028 6.322
685 HA LEU 91 HA LEU 91 -10.569 -4.549 5.334
686 HB2 LEU 91 HB2 LEU 91 -9.941 -5.697 7.338
687 HB3 LEU 91 HB3 LEU 91 -9.760 -3.981 7.594
688 HG LEU 91 HG LEU 91 -10.557 -4.821 9.620
689 HD11 LEU 91 HD11 LEU 91 -12.802 -3.909 9.931
690 HD12 LEU 91 HD12 LEU 91 -12.979 -3.774 8.182
691 HD13 LEU 91 HD13 LEU 91 -11.755 -2.820 9.019
692 HD21 LEU 91 HD21 LEU 91 -12.397 -6.344 9.905
693 HD22 LEU 91 HD22 LEU 91 -11.212 -7.031 8.791
694 HD23 LEU 91 HD23 LEU 91 -12.708 -6.338 8.170
695 H GLU 92 H GLU 92 -11.068 -7.004 5.763
696 HA GLU 92 HA GLU 92 -13.826 -7.311 4.857
697 HB2 GLU 92 HB2 GLU 92 -11.516 -9.261 4.904
698 HB3 GLU 92 HB3 GLU 92 -13.101 -9.597 4.226
699 HG2 GLU 92 HG2 GLU 92 -11.391 -7.333 3.255
700 HG3 GLU 92 HG3 GLU 92 -11.250 -8.968 2.614
Start of MODEL 10
1 H1 GLY 1 H1 GLY 1 19.832 -0.750 -12.390
2 H2 GLY 1 H2 GLY 1 20.591 0.696 -11.933
3 H3 GLY 1 H3 GLY 1 20.102 0.463 -13.540
4 HA2 GLY 1 HA3 GLY 1 17.777 0.386 -12.830
5 HA3 GLY 1 HA2 GLY 1 18.314 0.701 -11.185
6 H SER 2 H SER 2 16.493 2.338 -12.562
7 HA SER 2 HA SER 2 18.064 4.812 -12.702
8 HB2 SER 2 HB2 SER 2 15.938 4.017 -14.707
9 HB3 SER 2 HB3 SER 2 16.799 5.555 -14.669
10 HG SER 2 HG SER 2 17.532 3.335 -15.884
11 H ASP 3 H ASP 3 14.752 3.461 -12.655
12 HA ASP 3 HA ASP 3 13.947 5.792 -11.033
13 HB2 ASP 3 HB2 ASP 3 11.808 5.839 -12.151
14 HB3 ASP 3 HB3 ASP 3 13.083 5.912 -13.359
15 H VAL 4 H VAL 4 13.637 2.341 -11.562
16 HA VAL 4 HA VAL 4 12.142 2.182 -9.027
17 HB VAL 4 HB VAL 4 11.210 -0.010 -9.882
18 HG11 VAL 4 HG11 VAL 4 10.430 2.515 -11.341
19 HG12 VAL 4 HG12 VAL 4 9.863 2.013 -9.748
20 HG13 VAL 4 HG13 VAL 4 9.430 1.072 -11.176
21 HG21 VAL 4 HG21 VAL 4 12.174 1.071 -12.530
22 HG22 VAL 4 HG22 VAL 4 11.118 -0.324 -12.307
23 HG23 VAL 4 HG23 VAL 4 12.779 -0.370 -11.715
24 H ALA 5 H ALA 5 14.698 2.284 -8.688
25 HA ALA 5 HA ALA 5 15.509 -0.458 -8.141
26 HB1 ALA 5 HB1 ALA 5 17.328 1.664 -9.273
27 HB2 ALA 5 HB2 ALA 5 16.696 0.274 -10.154
28 HB3 ALA 5 HB3 ALA 5 17.803 0.033 -8.802
29 H ALA 6 H ALA 6 18.080 0.478 -7.104
30 HA ALA 6 HA ALA 6 19.016 1.074 -5.129
31 HB1 ALA 6 HB1 ALA 6 16.732 3.043 -4.920
32 HB2 ALA 6 HB2 ALA 6 18.284 3.348 -5.700
33 HB3 ALA 6 HB3 ALA 6 18.215 3.058 -3.962
34 H GLY 7 H GLY 7 17.669 -1.183 -5.108
35 HA2 GLY 7 HA2 GLY 7 17.306 -2.190 -2.757
36 HA3 GLY 7 HA3 GLY 7 15.879 -1.160 -2.774
37 H THR 8 H THR 8 14.111 -1.752 -3.915
38 HA THR 8 HA THR 8 12.578 -3.272 -4.669
39 HB THR 8 HB THR 8 14.634 -3.833 -6.811
40 HG1 THR 8 HG1 THR 8 13.689 -1.860 -7.773
41 HG21 THR 8 HG21 THR 8 12.656 -3.880 -8.275
42 HG22 THR 8 HG22 THR 8 11.622 -3.562 -6.882
43 HG23 THR 8 HG23 THR 8 12.524 -5.074 -6.983
44 H ALA 9 H ALA 9 13.695 -4.424 -2.615
45 HA ALA 9 HA ALA 9 15.244 -6.703 -2.921
46 HB1 ALA 9 HB1 ALA 9 14.840 -5.596 -0.772
47 HB2 ALA 9 HB2 ALA 9 14.519 -7.328 -0.694
48 HB3 ALA 9 HB3 ALA 9 13.178 -6.186 -0.787
49 H SER 10 H SER 10 11.690 -6.486 -2.703
50 HA SER 10 HA SER 10 11.453 -8.940 -4.217
51 HB2 SER 10 HB2 SER 10 11.782 -9.696 -1.858
52 HB3 SER 10 HB3 SER 10 10.339 -8.794 -1.403
53 HG SER 10 HG SER 10 10.348 -10.827 -3.389
54 H GLY 11 H GLY 11 10.648 -6.047 -4.346
55 HA2 GLY 11 HA2 GLY 11 7.869 -5.834 -4.011
56 HA3 GLY 11 HA3 GLY 11 8.845 -4.842 -5.077
57 H ALA 12 H ALA 12 6.892 -7.746 -4.828
58 HA ALA 12 HA ALA 12 6.042 -7.233 -7.549
59 HB1 ALA 12 HB1 ALA 12 6.872 -9.983 -6.602
60 HB2 ALA 12 HB2 ALA 12 7.680 -9.023 -7.842
61 HB3 ALA 12 HB3 ALA 12 6.048 -9.632 -8.120
62 H LYS 13 H LYS 13 3.998 -8.748 -7.907
63 HA LYS 13 HA LYS 13 1.806 -9.039 -7.340
64 HB2 LYS 13 HB2 LYS 13 2.538 -9.041 -4.422
65 HB3 LYS 13 HB3 LYS 13 1.254 -9.931 -5.234
66 HG2 LYS 13 HG2 LYS 13 2.822 -11.437 -6.222
67 HG3 LYS 13 HG3 LYS 13 4.186 -10.439 -5.668
68 HD2 LYS 13 HD2 LYS 13 2.243 -11.596 -3.699
69 HD3 LYS 13 HD3 LYS 13 3.551 -12.587 -4.351
70 HE2 LYS 13 HE2 LYS 13 4.009 -9.887 -3.090
71 HE3 LYS 13 HE3 LYS 13 4.032 -11.394 -2.170
72 HZ1 LYS 13 HZ1 LYS 13 5.849 -10.606 -4.377
73 HZ2 LYS 13 HZ2 LYS 13 5.769 -12.180 -3.770
74 HZ3 LYS 13 HZ3 LYS 13 6.255 -10.906 -2.760
75 H SER 14 H SER 14 3.678 -6.596 -6.575
76 HA SER 14 HA SER 14 2.085 -4.426 -6.595
77 HB2 SER 14 HB2 SER 14 1.845 -3.781 -4.220
78 HB3 SER 14 HB3 SER 14 0.967 -5.274 -4.543
79 HG SER 14 HG SER 14 3.198 -6.189 -3.838
80 H MET 15 H MET 15 3.472 -2.546 -6.291
81 HA MET 15 HA MET 15 6.245 -3.445 -6.468
82 HB2 MET 15 HB2 MET 15 4.944 -0.826 -7.184
83 HB3 MET 15 HB3 MET 15 6.655 -1.167 -7.386
84 HG2 MET 15 HG2 MET 15 6.178 -2.873 -8.996
85 HG3 MET 15 HG3 MET 15 4.446 -2.726 -8.699
86 HE1 MET 15 HE1 MET 15 3.701 0.858 -10.111
87 HE2 MET 15 HE2 MET 15 4.148 0.458 -8.453
88 HE3 MET 15 HE3 MET 15 3.019 -0.571 -9.334
89 H TRP 16 H TRP 16 7.213 -3.561 -4.582
90 HA TRP 16 HA TRP 16 7.367 -1.138 -2.972
91 HB2 TRP 16 HB2 TRP 16 7.117 -2.365 -0.879
92 HB3 TRP 16 HB3 TRP 16 5.682 -2.582 -1.871
93 HD1 TRP 16 HD1 TRP 16 5.264 -5.028 -2.898
94 HE1 TRP 16 HE1 TRP 16 6.133 -7.347 -2.193
95 HE3 TRP 16 HE3 TRP 16 9.143 -3.576 0.101
96 HZ2 TRP 16 HZ2 TRP 16 8.172 -8.417 -0.578
97 HZ3 TRP 16 HZ3 TRP 16 10.503 -5.312 1.185
98 HH2 TRP 16 HH2 TRP 16 10.027 -7.684 0.852
99 H THR 17 H THR 17 9.209 -1.213 -1.455
100 HA THR 17 HA THR 17 11.339 -3.046 -2.308
101 HB THR 17 HB THR 17 12.944 -1.193 -2.487
102 HG1 THR 17 HG1 THR 17 10.704 0.543 -2.129
103 HG21 THR 17 HG21 THR 17 11.324 -1.868 -4.424
104 HG22 THR 17 HG22 THR 17 12.344 -0.440 -4.593
105 HG23 THR 17 HG23 THR 17 10.643 -0.264 -4.158
106 H GLU 18 H GLU 18 12.978 -3.305 -0.684
107 HA GLU 18 HA GLU 18 12.074 -2.580 2.001
108 HB2 GLU 18 HB2 GLU 18 12.580 -4.948 1.553
109 HB3 GLU 18 HB3 GLU 18 14.222 -4.517 1.104
110 HG2 GLU 18 HG2 GLU 18 13.313 -3.695 3.795
111 HG3 GLU 18 HG3 GLU 18 13.552 -5.418 3.520
112 H HIS 19 H HIS 19 13.000 -0.994 3.107
113 HA HIS 19 HA HIS 19 15.818 -0.350 2.575
114 HB2 HIS 19 HB2 HIS 19 13.566 1.662 2.823
115 HB3 HIS 19 HB3 HIS 19 15.269 2.083 2.941
116 HD1 HIS 19 HD1 HIS 19 12.921 2.791 0.706
117 HD2 HIS 19 HD2 HIS 19 16.373 0.505 0.293
118 HE1 HIS 19 HE1 HIS 19 13.451 2.798 -1.757
119 HE2 HIS 19 HE2 HIS 19 15.621 1.527 -1.962
120 H LYS 20 H LYS 20 16.961 -0.242 4.440
121 HA LYS 20 HA LYS 20 15.420 0.349 6.866
122 HB2 LYS 20 HB2 LYS 20 16.395 -1.312 8.030
123 HB3 LYS 20 HB3 LYS 20 16.692 -1.998 6.443
124 HG2 LYS 20 HG2 LYS 20 18.787 -0.172 7.302
125 HG3 LYS 20 HG3 LYS 20 18.567 -1.544 8.388
126 HD2 LYS 20 HD2 LYS 20 20.187 -2.135 6.749
127 HD3 LYS 20 HD3 LYS 20 18.715 -3.047 6.410
128 HE2 LYS 20 HE2 LYS 20 19.477 -2.268 4.313
129 HE3 LYS 20 HE3 LYS 20 18.133 -1.221 4.752
130 HZ1 LYS 20 HZ1 LYS 20 21.015 -0.571 5.081
131 HZ2 LYS 20 HZ2 LYS 20 19.721 0.437 5.512
132 HZ3 LYS 20 HZ3 LYS 20 19.988 0.052 3.883
133 H SER 21 H SER 21 16.051 1.964 8.090
134 HA SER 21 HA SER 21 18.192 3.678 7.220
135 HB2 SER 21 HB2 SER 21 16.454 3.828 9.701
136 HB3 SER 21 HB3 SER 21 17.438 5.131 9.033
137 HG SER 21 HG SER 21 16.046 4.547 7.029
138 HA PRO 22 HA PRO 22 21.713 2.117 9.127
139 HB2 PRO 22 HB2 PRO 22 21.891 4.678 10.664
140 HB3 PRO 22 HB3 PRO 22 23.139 3.829 9.742
141 HG2 PRO 22 HG2 PRO 22 21.922 5.931 8.692
142 HG3 PRO 22 HG3 PRO 22 22.267 4.507 7.692
143 HD2 PRO 22 HD2 PRO 22 19.680 5.444 8.828
144 HD3 PRO 22 HD3 PRO 22 20.005 4.589 7.307
145 H ASP 23 H ASP 23 19.299 3.347 11.350
146 HA ASP 23 HA ASP 23 20.532 2.195 13.683
147 HB2 ASP 23 HB2 ASP 23 17.823 3.409 13.178
148 HB3 ASP 23 HB3 ASP 23 18.230 2.650 14.712
149 H GLY 24 H GLY 24 19.287 0.658 11.116
150 HA2 GLY 24 HA2 GLY 24 18.964 -1.666 11.023
151 HA3 GLY 24 HA3 GLY 24 18.612 -1.671 12.744
152 H ARG 25 H ARG 25 16.776 0.733 12.100
153 HA ARG 25 HA ARG 25 14.366 -0.736 12.064
154 HB2 ARG 25 HB2 ARG 25 14.475 1.464 13.096
155 HB3 ARG 25 HB3 ARG 25 14.858 2.202 11.546
156 HG2 ARG 25 HG2 ARG 25 12.507 2.514 12.228
157 HG3 ARG 25 HG3 ARG 25 12.679 1.669 10.688
158 HD2 ARG 25 HD2 ARG 25 12.403 -0.479 11.907
159 HD3 ARG 25 HD3 ARG 25 12.080 0.439 13.375
160 HE ARG 25 HE ARG 25 10.300 1.415 11.543
161 HH11 ARG 25 HH11 ARG 25 10.971 -1.730 12.948
162 HH12 ARG 25 HH12 ARG 25 9.384 -2.348 12.601
163 HH21 ARG 25 HH21 ARG 25 8.217 0.586 11.101
164 HH22 ARG 25 HH22 ARG 25 7.836 -1.050 11.571
165 H THR 26 H THR 26 13.423 -1.691 10.425
166 HA THR 26 HA THR 26 14.110 -0.863 7.698
167 HB THR 26 HB THR 26 12.958 -3.495 8.647
168 HG1 THR 26 HG1 THR 26 15.332 -2.715 9.106
169 HG21 THR 26 HG21 THR 26 14.043 -2.623 5.963
170 HG22 THR 26 HG22 THR 26 12.389 -3.104 6.342
171 HG23 THR 26 HG23 THR 26 13.691 -4.293 6.402
172 H TYR 27 H TYR 27 12.573 -0.193 6.325
173 HA TYR 27 HA TYR 27 9.792 -0.871 6.879
174 HB2 TYR 27 HB2 TYR 27 9.184 1.474 5.996
175 HB3 TYR 27 HB3 TYR 27 9.683 1.322 7.671
176 HD1 TYR 27 HD1 TYR 27 11.421 1.809 4.378
177 HD2 TYR 27 HD2 TYR 27 10.954 3.064 8.414
178 HE1 TYR 27 HE1 TYR 27 13.095 3.577 4.018
179 HE2 TYR 27 HE2 TYR 27 12.627 4.829 8.070
180 HH TYR 27 HH TYR 27 14.372 5.466 6.652
181 H TYR 28 H TYR 28 8.491 0.002 4.822
182 HA TYR 28 HA TYR 28 9.995 -1.033 2.519
183 HB2 TYR 28 HB2 TYR 28 7.058 -1.524 3.010
184 HB3 TYR 28 HB3 TYR 28 8.110 -2.327 1.846
185 HD1 TYR 28 HD2 TYR 28 9.731 -4.040 2.607
186 HD2 TYR 28 HD1 TYR 28 7.023 -2.195 5.320
187 HE1 TYR 28 HE2 TYR 28 10.190 -5.804 4.261
188 HE2 TYR 28 HE1 TYR 28 7.482 -3.945 6.982
189 HH TYR 28 HH TYR 28 8.304 -6.161 7.160
190 H TYR 29 H TYR 29 9.664 0.000 0.571
191 HA TYR 29 HA TYR 29 7.962 2.392 0.729
192 HB2 TYR 29 HB2 TYR 29 10.037 3.333 0.539
193 HB3 TYR 29 HB3 TYR 29 10.688 1.972 -0.355
194 HD1 TYR 29 HD1 TYR 29 7.920 4.457 -1.020
195 HD2 TYR 29 HD2 TYR 29 11.473 2.576 -2.351
196 HE1 TYR 29 HE1 TYR 29 7.807 5.751 -3.122
197 HE2 TYR 29 HE2 TYR 29 11.383 3.848 -4.453
198 HH TYR 29 HH TYR 29 9.938 5.077 -5.799
199 H ASN 30 H ASN 30 6.306 2.406 -0.493
200 HA ASN 30 HA ASN 30 6.027 0.422 -2.607
201 HB2 ASN 30 HB2 ASN 30 4.050 2.270 -1.247
202 HB3 ASN 30 HB3 ASN 30 3.624 1.228 -2.600
203 HD21 ASN 30 HD21 ASN 30 2.109 0.140 -1.342
204 HD22 ASN 30 HD22 ASN 30 2.576 -0.977 -0.107
205 H THR 31 H THR 31 6.748 1.049 -4.529
206 HA THR 31 HA THR 31 7.123 3.778 -5.245
207 HB THR 31 HB THR 31 7.842 2.939 -7.404
208 HG1 THR 31 HG1 THR 31 6.840 1.229 -8.152
209 HG21 THR 31 HG21 THR 31 8.656 1.175 -5.100
210 HG22 THR 31 HG22 THR 31 9.439 2.670 -5.624
211 HG23 THR 31 HG23 THR 31 9.505 1.233 -6.648
212 H GLU 32 H GLU 32 4.507 1.683 -5.292
213 HA GLU 32 HA GLU 32 2.984 2.535 -7.466
214 HB2 GLU 32 HB2 GLU 32 1.230 1.981 -5.340
215 HB3 GLU 32 HB3 GLU 32 1.707 0.900 -6.641
216 HG2 GLU 32 HG2 GLU 32 3.758 0.409 -5.173
217 HG3 GLU 32 HG3 GLU 32 2.812 1.130 -3.875
218 H THR 33 H THR 33 3.023 3.591 -4.113
219 HA THR 33 HA THR 33 1.429 5.944 -4.839
220 HB THR 33 HB THR 33 0.899 6.089 -2.416
221 HG1 THR 33 HG1 THR 33 1.515 3.911 -1.336
222 HG21 THR 33 HG21 THR 33 0.381 3.352 -3.604
223 HG22 THR 33 HG22 THR 33 -0.575 4.804 -3.920
224 HG23 THR 33 HG23 THR 33 -0.540 4.109 -2.299
225 H LYS 34 H LYS 34 4.516 4.995 -4.285
226 HA LYS 34 HA LYS 34 6.483 6.090 -3.984
227 HB2 LYS 34 HB2 LYS 34 4.693 8.485 -4.315
228 HB3 LYS 34 HB3 LYS 34 6.429 8.633 -4.065
229 HG2 LYS 34 HG2 LYS 34 5.373 6.879 -6.220
230 HG3 LYS 34 HG3 LYS 34 5.479 8.629 -6.468
231 HD2 LYS 34 HD2 LYS 34 7.860 8.560 -5.935
232 HD3 LYS 34 HD3 LYS 34 7.755 6.820 -5.656
233 HE2 LYS 34 HE2 LYS 34 7.226 6.421 -7.952
234 HE3 LYS 34 HE3 LYS 34 7.079 8.149 -8.272
235 HZ1 LYS 34 HZ1 LYS 34 9.197 7.284 -9.053
236 HZ2 LYS 34 HZ2 LYS 34 9.583 6.746 -7.493
237 HZ3 LYS 34 HZ3 LYS 34 9.431 8.404 -7.801
238 H GLN 35 H GLN 35 4.785 5.283 -1.760
239 HA GLN 35 HA GLN 35 5.572 7.245 0.281
240 HB2 GLN 35 HB2 GLN 35 3.303 5.270 0.189
241 HB3 GLN 35 HB3 GLN 35 3.755 6.151 1.643
242 HG2 GLN 35 HG2 GLN 35 3.336 8.264 0.492
243 HG3 GLN 35 HG3 GLN 35 2.875 7.374 -0.958
244 HE21 GLN 35 HE21 GLN 35 1.428 9.211 0.898
245 HE22 GLN 35 HE22 GLN 35 -0.007 8.351 1.325
246 H SER 36 H SER 36 6.356 6.480 2.290
247 HA SER 36 HA SER 36 7.472 3.764 2.186
248 HB2 SER 36 HB2 SER 36 9.050 5.758 2.442
249 HB3 SER 36 HB3 SER 36 8.347 5.989 4.043
250 HG SER 36 HG SER 36 9.093 3.406 3.600
251 H THR 37 H THR 37 6.886 2.325 3.739
252 HA THR 37 HA THR 37 4.891 3.101 5.707
253 HB THR 37 HB THR 37 3.714 2.918 3.486
254 HG1 THR 37 HG1 THR 37 2.766 0.734 4.941
255 HG21 THR 37 HG21 THR 37 4.669 0.067 3.694
256 HG22 THR 37 HG22 THR 37 5.013 1.226 2.405
257 HG23 THR 37 HG23 THR 37 3.379 0.597 2.612
258 H TRP 38 H TRP 38 4.164 1.165 6.962
259 HA TRP 38 HA TRP 38 6.322 -0.754 7.250
260 HB2 TRP 38 HB2 TRP 38 5.403 -1.346 9.294
261 HB3 TRP 38 HB3 TRP 38 4.921 0.335 9.167
262 HD1 TRP 38 HD1 TRP 38 3.570 -2.519 10.568
263 HE1 TRP 38 HE1 TRP 38 1.006 -2.668 10.444
264 HE3 TRP 38 HE3 TRP 38 2.736 0.886 6.833
265 HZ2 TRP 38 HZ2 TRP 38 -1.087 -1.508 8.957
266 HZ3 TRP 38 HZ3 TRP 38 0.417 1.301 6.125
267 HH2 TRP 38 HH2 TRP 38 -1.452 0.126 7.162
268 H GLU 39 H GLU 39 5.442 -3.173 7.593
269 HA GLU 39 HA GLU 39 4.725 -3.986 5.007
270 HB2 GLU 39 HB2 GLU 39 4.327 -6.256 6.189
271 HB3 GLU 39 HB3 GLU 39 5.947 -5.580 6.130
272 HG2 GLU 39 HG2 GLU 39 5.429 -4.611 8.435
273 HG3 GLU 39 HG3 GLU 39 4.061 -5.728 8.451
274 H LYS 40 H LYS 40 2.899 -4.134 4.015
275 HA LYS 40 HA LYS 40 0.536 -3.224 5.372
276 HB2 LYS 40 HB2 LYS 40 -0.389 -3.122 3.059
277 HB3 LYS 40 HB3 LYS 40 1.110 -2.221 3.260
278 HG2 LYS 40 HG2 LYS 40 2.349 -4.099 2.284
279 HG3 LYS 40 HG3 LYS 40 0.828 -4.954 2.036
280 HD2 LYS 40 HD2 LYS 40 0.062 -3.162 0.557
281 HD3 LYS 40 HD3 LYS 40 1.585 -2.303 0.814
282 HE2 LYS 40 HE2 LYS 40 2.813 -4.183 -0.142
283 HE3 LYS 40 HE3 LYS 40 1.302 -5.054 -0.378
284 HZ1 LYS 40 HZ1 LYS 40 2.097 -3.982 -2.410
285 HZ2 LYS 40 HZ2 LYS 40 1.953 -2.463 -1.675
286 HZ3 LYS 40 HZ3 LYS 40 0.571 -3.412 -1.940
287 HA PRO 41 HA PRO 41 -2.019 -6.896 5.560
288 HB2 PRO 41 HB2 PRO 41 -4.125 -6.131 3.904
289 HB3 PRO 41 HB3 PRO 41 -3.988 -5.785 5.631
290 HG2 PRO 41 HG2 PRO 41 -3.316 -4.060 3.291
291 HG3 PRO 41 HG3 PRO 41 -4.082 -3.619 4.829
292 HD2 PRO 41 HD2 PRO 41 -1.522 -3.057 4.381
293 HD3 PRO 41 HD3 PRO 41 -2.056 -3.624 5.977
294 H ASP 42 H ASP 42 -3.611 -8.096 3.923
295 HA ASP 42 HA ASP 42 -2.035 -9.842 2.500
296 HB2 ASP 42 HB2 ASP 42 -4.986 -9.311 2.233
297 HB3 ASP 42 HB3 ASP 42 -4.163 -10.731 1.589
298 H ASP 43 H ASP 43 -2.117 -6.894 1.330
299 HA ASP 43 HA ASP 43 -2.736 -7.004 -1.410
300 HB2 ASP 43 HB2 ASP 43 -1.372 -5.300 0.364
301 HB3 ASP 43 HB3 ASP 43 -0.193 -5.727 -0.844
302 H LEU 44 H LEU 44 -0.059 -8.049 0.482
303 HA LEU 44 HA LEU 44 1.648 -8.691 -1.709
304 HB2 LEU 44 HB2 LEU 44 1.931 -9.604 1.139
305 HB3 LEU 44 HB3 LEU 44 3.192 -9.411 -0.076
306 HG LEU 44 HG LEU 44 1.589 -7.026 0.696
307 HD11 LEU 44 HD11 LEU 44 3.809 -8.235 2.335
308 HD12 LEU 44 HD12 LEU 44 2.160 -7.870 2.851
309 HD13 LEU 44 HD13 LEU 44 3.282 -6.558 2.478
310 HD21 LEU 44 HD21 LEU 44 3.836 -5.967 0.307
311 HD22 LEU 44 HD22 LEU 44 3.085 -6.721 -1.099
312 HD23 LEU 44 HD23 LEU 44 4.396 -7.546 -0.251
313 H LYS 45 H LYS 45 -0.992 -10.318 -0.339
314 HA LYS 45 HA LYS 45 -0.017 -12.928 -1.209
315 HB2 LYS 45 HB2 LYS 45 -2.879 -12.596 -0.576
316 HB3 LYS 45 HB3 LYS 45 -1.760 -13.855 -0.087
317 HG2 LYS 45 HG2 LYS 45 -1.916 -11.107 1.115
318 HG3 LYS 45 HG3 LYS 45 -2.628 -12.566 1.798
319 HD2 LYS 45 HD2 LYS 45 -0.202 -13.485 1.626
320 HD3 LYS 45 HD3 LYS 45 0.223 -11.774 1.580
321 HE2 LYS 45 HE2 LYS 45 -0.956 -11.368 3.610
322 HE3 LYS 45 HE3 LYS 45 -1.511 -13.040 3.671
323 HZ1 LYS 45 HZ1 LYS 45 0.818 -13.732 3.880
324 HZ2 LYS 45 HZ2 LYS 45 0.375 -12.693 5.147
325 HZ3 LYS 45 HZ3 LYS 45 1.316 -12.111 3.859
326 H THR 46 H THR 46 -3.069 -11.221 -1.796
327 HA THR 46 HA THR 46 -3.071 -11.540 -4.626
328 HB THR 46 HB THR 46 -4.971 -13.369 -3.153
329 HG1 THR 46 HG1 THR 46 -3.212 -14.546 -2.799
330 HG21 THR 46 HG21 THR 46 -4.132 -13.146 -6.022
331 HG22 THR 46 HG22 THR 46 -5.725 -12.812 -5.343
332 HG23 THR 46 HG23 THR 46 -5.113 -14.467 -5.390
333 HA PRO 47 HA PRO 47 -5.961 -8.244 -4.047
334 HB2 PRO 47 HB2 PRO 47 -7.587 -9.567 -6.161
335 HB3 PRO 47 HB3 PRO 47 -7.075 -7.879 -6.035
336 HG2 PRO 47 HG2 PRO 47 -5.814 -9.485 -7.710
337 HG3 PRO 47 HG3 PRO 47 -4.880 -8.366 -6.697
338 HD2 PRO 47 HD2 PRO 47 -5.311 -11.310 -6.380
339 HD3 PRO 47 HD3 PRO 47 -3.842 -10.361 -6.105
340 H ALA 48 H ALA 48 -7.557 -11.396 -4.555
341 HA ALA 48 HA ALA 48 -9.906 -10.597 -3.156
342 HB1 ALA 48 HB1 ALA 48 -9.680 -12.409 -4.947
343 HB2 ALA 48 HB2 ALA 48 -10.753 -12.688 -3.580
344 HB3 ALA 48 HB3 ALA 48 -9.165 -13.453 -3.617
345 H GLU 49 H GLU 49 -6.913 -12.085 -2.175
346 HA GLU 49 HA GLU 49 -7.814 -12.968 0.363
347 HB2 GLU 49 HB2 GLU 49 -5.057 -12.272 -0.656
348 HB3 GLU 49 HB3 GLU 49 -5.340 -12.888 0.977
349 HG2 GLU 49 HG2 GLU 49 -6.496 -14.853 -0.103
350 HG3 GLU 49 HG3 GLU 49 -5.886 -14.266 -1.646
351 H GLN 50 H GLN 50 -6.771 -9.900 -0.913
352 HA GLN 50 HA GLN 50 -6.263 -8.524 1.462
353 HB2 GLN 50 HB2 GLN 50 -7.534 -7.376 -1.014
354 HB3 GLN 50 HB3 GLN 50 -6.584 -6.516 0.186
355 HG2 GLN 50 HG2 GLN 50 -4.591 -7.689 -0.496
356 HG3 GLN 50 HG3 GLN 50 -5.533 -8.674 -1.624
357 HE21 GLN 50 HE21 GLN 50 -4.334 -7.949 -3.405
358 HE22 GLN 50 HE22 GLN 50 -4.475 -6.342 -4.024
359 H LEU 51 H LEU 51 -9.340 -9.148 -0.216
360 HA LEU 51 HA LEU 51 -10.752 -6.963 0.733
361 HB2 LEU 51 HB2 LEU 51 -12.735 -8.022 -0.049
362 HB3 LEU 51 HB3 LEU 51 -11.423 -8.377 -1.152
363 HG LEU 51 HG LEU 51 -11.295 -10.586 0.342
364 HD11 LEU 51 HD11 LEU 51 -14.208 -9.818 0.373
365 HD12 LEU 51 HD12 LEU 51 -13.159 -9.938 1.786
366 HD13 LEU 51 HD13 LEU 51 -13.540 -11.381 0.845
367 HD21 LEU 51 HD21 LEU 51 -12.611 -11.656 -1.429
368 HD22 LEU 51 HD22 LEU 51 -11.452 -10.480 -2.061
369 HD23 LEU 51 HD23 LEU 51 -13.166 -10.065 -1.957
370 H LEU 52 H LEU 52 -10.276 -10.055 2.289
371 HA LEU 52 HA LEU 52 -12.250 -9.768 4.290
372 HB2 LEU 52 HB2 LEU 52 -9.625 -11.243 4.509
373 HB3 LEU 52 HB3 LEU 52 -11.035 -11.478 5.520
374 HG LEU 52 HG LEU 52 -12.224 -12.155 3.311
375 HD11 LEU 52 HD11 LEU 52 -9.394 -12.778 2.512
376 HD12 LEU 52 HD12 LEU 52 -10.268 -11.363 1.922
377 HD13 LEU 52 HD13 LEU 52 -10.868 -12.988 1.564
378 HD21 LEU 52 HD21 LEU 52 -11.488 -14.468 3.602
379 HD22 LEU 52 HD22 LEU 52 -11.760 -13.681 5.157
380 HD23 LEU 52 HD23 LEU 52 -10.117 -13.914 4.562
381 H SER 53 H SER 53 -8.784 -9.098 4.299
382 HA SER 53 HA SER 53 -8.741 -7.930 6.913
383 HB2 SER 53 HB2 SER 53 -6.722 -7.697 4.679
384 HB3 SER 53 HB3 SER 53 -6.396 -7.533 6.402
385 HG SER 53 HG SER 53 -5.951 -9.662 5.285
386 H LYS 54 H LYS 54 -8.004 -6.656 3.718
387 HA LYS 54 HA LYS 54 -9.363 -4.141 4.284
388 HB2 LYS 54 HB2 LYS 54 -6.413 -4.337 3.634
389 HB3 LYS 54 HB3 LYS 54 -7.341 -2.850 3.521
390 HG2 LYS 54 HG2 LYS 54 -6.987 -4.452 6.040
391 HG3 LYS 54 HG3 LYS 54 -6.014 -3.043 5.599
392 HD2 LYS 54 HD2 LYS 54 -8.086 -1.698 5.506
393 HD3 LYS 54 HD3 LYS 54 -9.000 -3.100 6.050
394 HE2 LYS 54 HE2 LYS 54 -6.761 -1.794 7.590
395 HE3 LYS 54 HE3 LYS 54 -8.474 -1.498 7.863
396 HZ1 LYS 54 HZ1 LYS 54 -8.758 -3.827 8.439
397 HZ2 LYS 54 HZ2 LYS 54 -7.592 -3.101 9.430
398 HZ3 LYS 54 HZ3 LYS 54 -7.108 -4.123 8.164
399 H CYS 55 H CYS 55 -10.462 -3.575 2.529
400 HA CYS 55 HA CYS 55 -10.587 -5.280 0.301
401 HB2 CYS 55 HB2 CYS 55 -12.168 -3.620 -0.611
402 HB3 CYS 55 HB3 CYS 55 -12.493 -3.954 1.084
403 HG CYS 55 HG CYS 55 -10.475 -1.320 0.563
404 HA PRO 56 HA PRO 56 -7.703 -4.196 -2.853
405 HB2 PRO 56 HB2 PRO 56 -10.060 -3.016 -4.295
406 HB3 PRO 56 HB3 PRO 56 -8.739 -4.006 -4.935
407 HG2 PRO 56 HG2 PRO 56 -11.088 -5.109 -4.373
408 HG3 PRO 56 HG3 PRO 56 -9.581 -5.963 -4.005
409 HD2 PRO 56 HD2 PRO 56 -11.513 -4.674 -2.180
410 HD3 PRO 56 HD3 PRO 56 -10.379 -5.998 -1.871
411 H TRP 57 H TRP 57 -10.138 -1.620 -2.424
412 HA TRP 57 HA TRP 57 -8.211 0.471 -2.836
413 HB2 TRP 57 HB2 TRP 57 -11.036 0.487 -1.760
414 HB3 TRP 57 HB3 TRP 57 -10.068 1.940 -1.976
415 HD1 TRP 57 HD1 TRP 57 -9.779 2.872 -4.422
416 HE1 TRP 57 HE1 TRP 57 -10.959 2.335 -6.647
417 HE3 TRP 57 HE3 TRP 57 -12.055 -1.512 -3.099
418 HZ2 TRP 57 HZ2 TRP 57 -12.621 0.317 -7.702
419 HZ3 TRP 57 HZ3 TRP 57 -13.419 -2.687 -4.777
420 HH2 TRP 57 HH2 TRP 57 -13.694 -1.786 -7.030
421 H LYS 58 H LYS 58 -6.785 1.130 -1.370
422 HA LYS 58 HA LYS 58 -7.391 0.737 1.471
423 HB2 LYS 58 HB2 LYS 58 -5.351 -0.602 -0.097
424 HB3 LYS 58 HB3 LYS 58 -4.671 0.230 1.299
425 HG2 LYS 58 HG2 LYS 58 -6.145 -0.976 2.779
426 HG3 LYS 58 HG3 LYS 58 -6.972 -1.718 1.410
427 HD2 LYS 58 HD2 LYS 58 -4.059 -2.091 2.093
428 HD3 LYS 58 HD3 LYS 58 -5.350 -3.239 2.464
429 HE2 LYS 58 HE2 LYS 58 -4.695 -2.274 -0.304
430 HE3 LYS 58 HE3 LYS 58 -4.036 -3.758 0.390
431 HZ1 LYS 58 HZ1 LYS 58 -6.887 -3.139 -0.174
432 HZ2 LYS 58 HZ2 LYS 58 -6.377 -4.503 0.686
433 HZ3 LYS 58 HZ3 LYS 58 -5.919 -4.309 -0.934
434 H GLU 59 H GLU 59 -6.420 2.153 2.897
435 HA GLU 59 HA GLU 59 -4.818 4.329 1.723
436 HB2 GLU 59 HB2 GLU 59 -7.021 5.229 2.146
437 HB3 GLU 59 HB3 GLU 59 -7.037 4.545 3.769
438 HG2 GLU 59 HG2 GLU 59 -4.936 6.003 4.132
439 HG3 GLU 59 HG3 GLU 59 -5.504 6.874 2.709
440 H TYR 60 H TYR 60 -2.925 4.661 2.730
441 HA TYR 60 HA TYR 60 -2.782 4.145 5.601
442 HB2 TYR 60 HB2 TYR 60 -0.511 3.084 5.350
443 HB3 TYR 60 HB3 TYR 60 -1.851 2.099 4.771
444 HD1 TYR 60 HD1 TYR 60 0.947 4.277 3.682
445 HD2 TYR 60 HD2 TYR 60 -1.942 1.367 2.529
446 HE1 TYR 60 HE1 TYR 60 2.086 3.994 1.530
447 HE2 TYR 60 HE2 TYR 60 -0.801 1.085 0.371
448 HH TYR 60 HH TYR 60 2.309 2.325 -0.235
449 H LYS 61 H LYS 61 -1.046 5.297 6.644
450 HA LYS 61 HA LYS 61 -0.234 7.653 5.104
451 HB2 LYS 61 HB2 LYS 61 -0.141 7.128 8.076
452 HB3 LYS 61 HB3 LYS 61 0.458 8.589 7.310
453 HG2 LYS 61 HG2 LYS 61 -1.919 8.808 6.367
454 HG3 LYS 61 HG3 LYS 61 -2.354 7.637 7.607
455 HD2 LYS 61 HD2 LYS 61 -1.114 10.354 8.018
456 HD3 LYS 61 HD3 LYS 61 -2.747 9.852 8.456
457 HE2 LYS 61 HE2 LYS 61 -0.194 8.750 9.610
458 HE3 LYS 61 HE3 LYS 61 -1.249 9.927 10.392
459 HZ1 LYS 61 HZ1 LYS 61 -1.555 7.539 11.083
460 HZ2 LYS 61 HZ2 LYS 61 -2.227 7.257 9.550
461 HZ3 LYS 61 HZ3 LYS 61 -2.960 8.359 10.605
462 H SER 62 H SER 62 1.828 8.109 4.690
463 HA SER 62 HA SER 62 3.816 6.098 4.876
464 HB2 SER 62 HB2 SER 62 4.531 8.958 4.441
465 HB3 SER 62 HB3 SER 62 5.093 7.520 3.575
466 HG SER 62 HG SER 62 2.554 7.622 3.085
467 H ASP 63 H ASP 63 6.109 6.975 5.767
468 HA ASP 63 HA ASP 63 6.027 7.309 8.531
469 HB2 ASP 63 HB2 ASP 63 8.058 6.651 7.371
470 HB3 ASP 63 HB3 ASP 63 8.142 8.209 6.562
471 H SER 64 H SER 64 5.913 9.642 5.935
472 HA SER 64 HA SER 64 6.083 11.977 7.572
473 HB2 SER 64 HB2 SER 64 5.036 12.949 5.358
474 HB3 SER 64 HB3 SER 64 6.712 12.381 5.372
475 HG SER 64 HG SER 64 5.375 11.591 3.598
476 H GLY 65 H GLY 65 3.666 9.703 7.028
477 HA2 GLY 65 HA2 GLY 65 1.499 9.644 7.845
478 HA3 GLY 65 HA3 GLY 65 1.659 11.313 8.358
479 H LYS 66 H LYS 66 2.621 11.112 5.172
480 HA LYS 66 HA LYS 66 0.317 12.238 4.010
481 HB2 LYS 66 HB2 LYS 66 2.482 12.391 2.920
482 HB3 LYS 66 HB3 LYS 66 2.581 10.647 2.778
483 HG2 LYS 66 HG2 LYS 66 2.037 11.794 0.662
484 HG3 LYS 66 HG3 LYS 66 0.822 10.616 1.155
485 HD2 LYS 66 HD2 LYS 66 -0.161 12.707 0.287
486 HD3 LYS 66 HD3 LYS 66 -0.619 12.378 1.958
487 HE2 LYS 66 HE2 LYS 66 1.078 13.945 2.737
488 HE3 LYS 66 HE3 LYS 66 1.551 14.276 1.066
489 HZ1 LYS 66 HZ1 LYS 66 -0.656 15.161 0.650
490 HZ2 LYS 66 HZ2 LYS 66 0.057 15.980 1.951
491 HZ3 LYS 66 HZ3 LYS 66 -1.131 14.801 2.235
492 H THR 67 H THR 67 -1.617 11.310 3.581
493 HA THR 67 HA THR 67 -1.769 8.389 3.536
494 HB THR 67 HB THR 67 -4.360 9.385 3.206
495 HG1 THR 67 HG1 THR 67 -4.174 11.363 4.024
496 HG21 THR 67 HG21 THR 67 -3.407 7.438 4.524
497 HG22 THR 67 HG22 THR 67 -4.748 8.322 5.270
498 HG23 THR 67 HG23 THR 67 -3.094 8.601 5.818
499 H TYR 68 H TYR 68 -2.137 7.264 1.784
500 HA TYR 68 HA TYR 68 -3.406 8.623 -0.481
501 HB2 TYR 68 HB2 TYR 68 -0.895 7.082 -0.467
502 HB3 TYR 68 HB3 TYR 68 -2.035 6.627 -1.731
503 HD1 TYR 68 HD2 TYR 68 -0.105 9.457 -0.331
504 HD2 TYR 68 HD1 TYR 68 -2.374 7.998 -3.625
505 HE1 TYR 68 HE2 TYR 68 0.620 11.385 -1.688
506 HE2 TYR 68 HE1 TYR 68 -1.658 9.918 -4.984
507 HH TYR 68 HH TYR 68 0.903 11.833 -4.257
508 H TYR 69 H TYR 69 -4.871 7.463 -1.613
509 HA TYR 69 HA TYR 69 -5.764 4.919 -0.406
510 HB2 TYR 69 HB2 TYR 69 -7.205 7.067 -0.205
511 HB3 TYR 69 HB3 TYR 69 -7.472 6.892 -1.932
512 HD1 TYR 69 HD1 TYR 69 -7.948 5.230 1.332
513 HD2 TYR 69 HD2 TYR 69 -9.127 5.421 -2.756
514 HE1 TYR 69 HE1 TYR 69 -9.849 3.734 1.813
515 HE2 TYR 69 HE2 TYR 69 -11.023 3.930 -2.283
516 HH TYR 69 HH TYR 69 -11.963 3.105 0.928
517 H TYR 70 H TYR 70 -5.670 3.204 -1.875
518 HA TYR 70 HA TYR 70 -5.280 4.012 -4.673
519 HB2 TYR 70 HB2 TYR 70 -3.337 2.619 -4.912
520 HB3 TYR 70 HB3 TYR 70 -3.083 3.682 -3.532
521 HD1 TYR 70 HD2 TYR 70 -3.154 2.752 -1.230
522 HD2 TYR 70 HD1 TYR 70 -3.472 0.244 -4.653
523 HE1 TYR 70 HE2 TYR 70 -2.668 0.785 0.168
524 HE2 TYR 70 HE1 TYR 70 -2.987 -1.727 -3.270
525 HH TYR 70 HH TYR 70 -2.102 -2.370 -1.241
526 H ASN 71 H ASN 71 -5.864 2.659 -6.237
527 HA ASN 71 HA ASN 71 -7.571 0.390 -5.609
528 HB2 ASN 71 HB2 ASN 71 -6.593 1.435 -8.291
529 HB3 ASN 71 HB3 ASN 71 -7.862 0.245 -8.057
530 HD21 ASN 71 HD21 ASN 71 -9.367 1.447 -9.165
531 HD22 ASN 71 HD22 ASN 71 -10.057 2.902 -8.529
532 H SER 72 H SER 72 -6.464 -1.452 -5.008
533 HA SER 72 HA SER 72 -3.696 -1.690 -5.565
534 HB2 SER 72 HB2 SER 72 -4.727 -2.503 -3.478
535 HB3 SER 72 HB3 SER 72 -5.523 -3.778 -4.387
536 HG SER 72 HG SER 72 -3.392 -4.209 -3.281
537 H GLN 73 H GLN 73 -6.518 -3.315 -7.015
538 HA GLN 73 HA GLN 73 -5.030 -5.359 -8.257
539 HB2 GLN 73 HB2 GLN 73 -6.956 -5.750 -9.669
540 HB3 GLN 73 HB3 GLN 73 -7.443 -5.570 -7.998
541 HG2 GLN 73 HG2 GLN 73 -7.724 -3.514 -10.182
542 HG3 GLN 73 HG3 GLN 73 -9.008 -4.546 -9.568
543 HE21 GLN 73 HE21 GLN 73 -7.321 -1.632 -9.219
544 HE22 GLN 73 HE22 GLN 73 -8.107 -1.087 -7.776
545 H THR 74 H THR 74 -5.654 -2.108 -9.163
546 HA THR 74 HA THR 74 -4.459 -2.582 -11.800
547 HB THR 74 HB THR 74 -5.606 -0.398 -12.388
548 HG1 THR 74 HG1 THR 74 -7.019 0.463 -10.945
549 HG21 THR 74 HG21 THR 74 -7.199 -2.830 -11.540
550 HG22 THR 74 HG22 THR 74 -6.574 -2.443 -13.153
551 HG23 THR 74 HG23 THR 74 -7.888 -1.487 -12.468
552 H LYS 75 H LYS 75 -3.841 -1.446 -8.802
553 HA LYS 75 HA LYS 75 -2.309 -0.174 -7.792
554 HB2 LYS 75 HB2 LYS 75 -0.860 -1.002 -10.282
555 HB3 LYS 75 HB3 LYS 75 -0.072 -0.035 -9.036
556 HG2 LYS 75 HG2 LYS 75 -1.337 -2.749 -8.668
557 HG3 LYS 75 HG3 LYS 75 0.395 -2.381 -8.674
558 HD2 LYS 75 HD2 LYS 75 0.184 -1.064 -6.679
559 HD3 LYS 75 HD3 LYS 75 -1.572 -1.187 -6.724
560 HE2 LYS 75 HE2 LYS 75 -1.395 -3.610 -6.354
561 HE3 LYS 75 HE3 LYS 75 0.360 -3.459 -6.281
562 HZ1 LYS 75 HZ1 LYS 75 0.154 -2.047 -4.351
563 HZ2 LYS 75 HZ2 LYS 75 -0.667 -3.509 -4.067
564 HZ3 LYS 75 HZ3 LYS 75 -1.535 -2.110 -4.440
565 H GLU 76 H GLU 76 -4.258 1.295 -9.027
566 HA GLU 76 HA GLU 76 -2.883 3.719 -9.916
567 HB2 GLU 76 HB2 GLU 76 -4.865 3.099 -11.187
568 HB3 GLU 76 HB3 GLU 76 -5.818 2.998 -9.714
569 HG2 GLU 76 HG2 GLU 76 -5.519 5.402 -9.370
570 HG3 GLU 76 HG3 GLU 76 -4.603 5.497 -10.873
571 H SER 77 H SER 77 -3.283 5.726 -8.726
572 HA SER 77 HA SER 77 -4.051 5.210 -5.936
573 HB2 SER 77 HB2 SER 77 -2.179 6.653 -5.180
574 HB3 SER 77 HB3 SER 77 -1.627 5.200 -6.008
575 HG SER 77 HG SER 77 -1.595 6.662 -7.951
576 H ARG 78 H ARG 78 -5.243 6.677 -4.959
577 HA ARG 78 HA ARG 78 -5.633 9.323 -6.214
578 HB2 ARG 78 HB2 ARG 78 -7.982 9.234 -5.794
579 HB3 ARG 78 HB3 ARG 78 -7.581 7.699 -6.557
580 HG2 ARG 78 HG2 ARG 78 -7.595 6.591 -4.401
581 HG3 ARG 78 HG3 ARG 78 -7.896 8.126 -3.589
582 HD2 ARG 78 HD2 ARG 78 -9.744 6.620 -5.435
583 HD3 ARG 78 HD3 ARG 78 -9.959 6.945 -3.722
584 HE ARG 78 HE ARG 78 -9.748 9.407 -5.020
585 HH11 ARG 78 HH11 ARG 78 -11.918 6.669 -4.890
586 HH12 ARG 78 HH12 ARG 78 -13.331 7.603 -5.284
587 HH21 ARG 78 HH21 ARG 78 -11.589 10.634 -5.546
588 HH22 ARG 78 HH22 ARG 78 -13.138 9.857 -5.683
589 H TRP 79 H TRP 79 -6.480 10.936 -4.593
590 HA TRP 79 HA TRP 79 -5.925 10.126 -1.825
591 HB2 TRP 79 HB2 TRP 79 -5.514 12.605 -1.393
592 HB3 TRP 79 HB3 TRP 79 -4.274 11.749 -2.299
593 HD1 TRP 79 HD1 TRP 79 -4.105 12.310 -4.955
594 HE1 TRP 79 HE1 TRP 79 -4.762 14.423 -6.267
595 HE3 TRP 79 HE3 TRP 79 -7.156 14.493 -1.486
596 HZ2 TRP 79 HZ2 TRP 79 -6.362 16.720 -5.875
597 HZ3 TRP 79 HZ3 TRP 79 -8.210 16.644 -2.028
598 HH2 TRP 79 HH2 TRP 79 -7.819 17.736 -4.177
599 H ALA 80 H ALA 80 -7.746 9.741 -0.890
600 HA ALA 80 HA ALA 80 -9.695 11.355 -0.017
601 HB1 ALA 80 HB1 ALA 80 -11.613 11.076 -1.562
602 HB2 ALA 80 HB2 ALA 80 -10.525 10.339 -2.739
603 HB3 ALA 80 HB3 ALA 80 -10.311 12.028 -2.280
604 H LYS 81 H LYS 81 -10.788 10.097 1.443
605 HA LYS 81 HA LYS 81 -11.159 7.270 0.689
606 HB2 LYS 81 HB2 LYS 81 -10.805 6.632 3.044
607 HB3 LYS 81 HB3 LYS 81 -9.382 7.359 2.317
608 HG2 LYS 81 HG2 LYS 81 -9.572 9.297 3.568
609 HG3 LYS 81 HG3 LYS 81 -11.285 9.024 3.908
610 HD2 LYS 81 HD2 LYS 81 -10.693 7.104 5.303
611 HD3 LYS 81 HD3 LYS 81 -8.985 7.399 4.974
612 HE2 LYS 81 HE2 LYS 81 -9.205 9.624 6.007
613 HE3 LYS 81 HE3 LYS 81 -10.884 9.252 6.398
614 HZ1 LYS 81 HZ1 LYS 81 -9.502 8.831 8.299
615 HZ2 LYS 81 HZ2 LYS 81 -8.479 7.828 7.398
616 HZ3 LYS 81 HZ3 LYS 81 -10.072 7.348 7.709
617 HA PRO 82 HA PRO 82 -15.349 8.826 1.890
618 HB2 PRO 82 HB2 PRO 82 -16.599 7.478 -0.131
619 HB3 PRO 82 HB3 PRO 82 -16.042 9.148 -0.275
620 HG2 PRO 82 HG2 PRO 82 -14.747 6.630 -1.247
621 HG3 PRO 82 HG3 PRO 82 -14.886 8.205 -2.040
622 HD2 PRO 82 HD2 PRO 82 -12.619 7.386 -0.804
623 HD3 PRO 82 HD3 PRO 82 -13.109 9.092 -0.866
624 H LYS 83 H LYS 83 -16.248 7.605 3.454
625 HA LYS 83 HA LYS 83 -15.765 4.830 3.738
626 HB2 LYS 83 HB2 LYS 83 -17.222 4.807 5.564
627 HB3 LYS 83 HB3 LYS 83 -16.472 6.384 5.604
628 HG2 LYS 83 HG2 LYS 83 -19.261 5.711 4.701
629 HG3 LYS 83 HG3 LYS 83 -18.790 6.589 6.153
630 HD2 LYS 83 HD2 LYS 83 -17.780 8.322 4.613
631 HD3 LYS 83 HD3 LYS 83 -18.584 7.484 3.293
632 HE2 LYS 83 HE2 LYS 83 -20.014 8.534 5.722
633 HE3 LYS 83 HE3 LYS 83 -19.856 9.428 4.209
634 HZ1 LYS 83 HZ1 LYS 83 -21.069 6.719 4.360
635 HZ2 LYS 83 HZ2 LYS 83 -21.129 7.820 3.071
636 HZ3 LYS 83 HZ3 LYS 83 -21.974 8.147 4.502
637 H GLU 84 H GLU 84 -17.852 6.590 1.748
638 HA GLU 84 HA GLU 84 -19.895 4.690 1.328
639 HB2 GLU 84 HB2 GLU 84 -19.824 7.076 0.489
640 HB3 GLU 84 HB3 GLU 84 -18.698 6.535 -0.746
641 HG2 GLU 84 HG2 GLU 84 -20.322 5.227 -1.811
642 HG3 GLU 84 HG3 GLU 84 -21.412 5.307 -0.425
643 H LEU 85 H LEU 85 -16.641 5.040 0.051
644 HA LEU 85 HA LEU 85 -16.770 2.746 -1.658
645 HB2 LEU 85 HB2 LEU 85 -15.071 4.893 -1.345
646 HB3 LEU 85 HB3 LEU 85 -14.128 3.564 -0.700
647 HG LEU 85 HG LEU 85 -13.625 3.943 -3.055
648 HD11 LEU 85 HD11 LEU 85 -15.185 1.386 -2.728
649 HD12 LEU 85 HD12 LEU 85 -13.567 1.653 -2.082
650 HD13 LEU 85 HD13 LEU 85 -13.836 1.688 -3.825
651 HD21 LEU 85 HD21 LEU 85 -15.213 3.837 -4.768
652 HD22 LEU 85 HD22 LEU 85 -15.991 4.803 -3.506
653 HD23 LEU 85 HD23 LEU 85 -16.427 3.108 -3.719
654 H GLU 86 H GLU 86 -15.248 3.435 1.478
655 HA GLU 86 HA GLU 86 -14.128 0.884 1.859
656 HB2 GLU 86 HB2 GLU 86 -14.859 2.956 3.928
657 HB3 GLU 86 HB3 GLU 86 -13.783 1.593 4.183
658 HG2 GLU 86 HG2 GLU 86 -12.279 2.508 2.445
659 HG3 GLU 86 HG3 GLU 86 -13.326 3.923 2.338
660 H ASP 87 H ASP 87 -17.167 2.283 2.916
661 HA ASP 87 HA ASP 87 -19.179 1.366 3.360
662 HB2 ASP 87 HB2 ASP 87 -18.731 -0.220 1.557
663 HB3 ASP 87 HB3 ASP 87 -17.862 -1.266 2.672
664 H LEU 88 H LEU 88 -16.568 1.065 5.258
665 HA LEU 88 HA LEU 88 -17.896 0.385 7.619
666 HB2 LEU 88 HB2 LEU 88 -17.855 -1.859 6.246
667 HB3 LEU 88 HB3 LEU 88 -16.192 -1.939 6.782
668 HG LEU 88 HG LEU 88 -17.815 -3.265 8.154
669 HD11 LEU 88 HD11 LEU 88 -16.906 -2.611 10.310
670 HD12 LEU 88 HD12 LEU 88 -16.353 -1.083 9.623
671 HD13 LEU 88 HD13 LEU 88 -15.658 -2.605 9.065
672 HD21 LEU 88 HD21 LEU 88 -19.705 -1.764 8.097
673 HD22 LEU 88 HD22 LEU 88 -18.787 -0.530 8.960
674 HD23 LEU 88 HD23 LEU 88 -19.210 -2.040 9.768
675 H GLU 89 H GLU 89 -14.820 -1.059 6.707
676 HA GLU 89 HA GLU 89 -13.330 1.118 7.980
677 HB2 GLU 89 HB2 GLU 89 -13.221 -1.800 8.754
678 HB3 GLU 89 HB3 GLU 89 -11.914 -0.684 9.116
679 HG2 GLU 89 HG2 GLU 89 -14.709 -0.091 9.986
680 HG3 GLU 89 HG3 GLU 89 -13.683 -1.180 10.916
681 H GLY 90 H GLY 90 -13.793 0.011 5.238
682 HA2 GLY 90 HA2 GLY 90 -12.443 -0.100 3.352
683 HA3 GLY 90 HA3 GLY 90 -11.031 -0.083 4.402
684 H LEU 91 H LEU 91 -13.827 -2.254 4.213
685 HA LEU 91 HA LEU 91 -12.197 -4.429 3.280
686 HB2 LEU 91 HB2 LEU 91 -12.773 -5.890 5.187
687 HB3 LEU 91 HB3 LEU 91 -11.713 -4.561 5.608
688 HG LEU 91 HG LEU 91 -14.052 -3.432 6.242
689 HD11 LEU 91 HD11 LEU 91 -14.467 -6.376 6.722
690 HD12 LEU 91 HD12 LEU 91 -15.403 -5.351 5.634
691 HD13 LEU 91 HD13 LEU 91 -15.467 -5.080 7.376
692 HD21 LEU 91 HD21 LEU 91 -13.525 -3.937 8.522
693 HD22 LEU 91 HD22 LEU 91 -12.021 -3.730 7.616
694 HD23 LEU 91 HD23 LEU 91 -12.585 -5.348 8.035
695 H GLU 92 H GLU 92 -13.486 -6.304 2.690
696 HA GLU 92 HA GLU 92 -16.294 -5.553 2.215
697 HB2 GLU 92 HB2 GLU 92 -14.491 -7.321 0.553
698 HB3 GLU 92 HB3 GLU 92 -16.188 -7.005 0.216
699 HG2 GLU 92 HG2 GLU 92 -15.671 -4.619 -0.056
700 HG3 GLU 92 HG3 GLU 92 -13.968 -4.970 0.234