***deleted:
A47.HN; V34.HB
A47.HN; I33.HA
A124.HN; H125.HD2 or V34.HN (would be 4.8+1.9=6.7): 7.5 or 6.2: V34.HN fits better at this point, but I guess is because of the I33 kink... delete it!
***what if that is F141 arom sc? (7.24 ppm)
V50.HN; E48.HB2/1 (3.2+1.3=4.5): 6.4/5.2
L122.HN; M112.HB1/2 (7.22A instead of 2.8+1.1): 7.2/5.5 (PCB contact with Met9 or Met10?)
V113.HN; R76.HD1/2 (would be 4.8+1.9=6.7; 2b deleted?): 9.3/9.0: deleted!
V113.HN; F119.HE1/2 (4.3+1.7=6.0): 6.7/9.6: deleted!
A21.HN; S49.HB1/2 (6.96A instead of 3.0+1.2) (2b deleted): 7.0/5.8: deleted!
V104.HN; L102.HD2#/1# or L99.HD1#/2# (3.0+1.2): 6.6/7.4/6.7/6.8/6.1/5.3 or 6.5/4.9/5.4/6.9/5.8/5.8: deleted
D85.HN; I86.HG2#/HD1# (7.8/6.1 instead of 3.2+1.3): 8.4/7.2/7.8/6.1/5.3/7.0: deleted


***reassigned:
A57.HN; V45.HG2# reassigned to V50.HG2#
A57.HN; R58.HG1 reassigned to E48.HB2
F119.HN; M112.HB2 reassigned to I114.HB
Y35.HN; G120.HA1 reassigned to A36.HA
A51.HN; E52.HG1 reassigned to Q56.HG2
I62.HN; E63.HG1 reassigned to Y35.HB2
V109.HN; I80.HA reassigned to A82.HA
L122.HN; I123.HN reassigned to V110.HN
A36.HN; G120.HA2 reassigned to T44.HB
A36.HN; F37.HN reassigned to  V46.HN
Q81.HN; I80.HG2# reassigned to V109.HG2#
Q126.HN; R105.HB1 reassigned to V104.HB
Q126.HN; R105.HD1 reassigned to V104.HA
R79.HN; G78.HA1 reassigned to Y75.HA
R105.HN; R105.HG2 reassigned to I86.HN; R105.HG2
I123.HN; V32.HA reassigned to A124.HA
***I123.HN; L122.HN reassigned to I33.HN
E48.HN; A47.HB# reassigned to R58.HG2
E48.HN; R58.HD1 reassigned to R58.HA
E48.HN; Q56.HA reassigned to S49.HA
A89.HN; F87.HD1 reassigned to D85.HN
S49.HN; V20.HG2# reassigned to V32.HG1#
A145.HN; V110.HG1# reassigned to K88.HN; T83.HG2#
K88.HN; D85.HN reassigned to F87.HD1
E25.HN; E25.HB1 reassigned to R24.HG1
V34.HN; V20.HG2# reassigned to V32.HG1#
V34.HN; A47.HB# reassigned to I33.HG11
F67.HN; P65.HD1 reassigned to R68.HA
R68.HN; P65.HA reassigned to F67.HA
Y75.HN; E73.HG1 reassigned to P111.HG2
K22.HN; E25.HB1 reassigned to R24.HG1
K22.HN; G23.HA1 reassigned to L19.HA
I33.HN; A124.HA reassigned to V32.HA
N107.HN; A106.HA reassigned to T84.HA
H125.HN; I33.HG2# reassigned to A124.HB#
H125.HN; R31.HD1 reassigned to C29.HB1
H125.HN; A124.HA reassigned to V32.HA
H125.HN; H125.HD2 reassigned to D30.HN
D30.HN; V32.HN reassigned to Q126.HN
E69.HN; L91.HD2# reassigned to V72.HG1#
T92.HN; L99.HD2# reassigned to L91.HD1#
G120.HN; L121.HA reassigned to V113.HA


***calculate distances for:
A127.HN; R31.HG2/1 (4.7+1.9=6.6): 6.7/7.6: kept
A82.HN; T83.HG2# (4.2+1.7=5.9): 6.1/7.3/7.0: kept
A82.HN; L108.HD1#/2# (4.0+1.6=5.6): 8.0/7.8/6.3/6.2/5.6/7.0: kept
A82.HN; L108.HA (4.3+1.7=6.0): 5.4: kept
F119.HN; F37.HE1/2 (would be 4.8+1.9=6.7): 9.5/7.9: ???
E63.HN; V61.HG2#/1# (2.8+1.1=3.9): 7.9/7.7/7.8/4.3/6.0/5.5  (PCB contact with Met18?): kept
D64.HN; V61.HG2#/1# (3.6+1.4=5.0): 10.2/9.3/9.4/6.0/7.0/6.7  (PCB contact with Met18?): borderline but kept
D64.HN; P65.HG2/1 (4.2+1.7=5.9): 6.2/5.4: kept
D64.HN; P65.HB2/1 (3.9+1.6=5.5): 6.5/5.2: kept
A124.HN; L108.HD2#/1# or L122.HD2#/1# (would be 3.3+1.3=4.6): 6.1/6.5/7.0/4.2/5.9/5.3/ or 5.0/3.6/4.6/6.8/7.7/7.2: kept L108.HD2#
I62.HN; Y35.HE1/2 (would be 4.1+1.6=5.7): 7.7/6.2: kept
V109.HN; Q81.HG1/2 (3.6+1.5=5.1): 6.2/5.1: kept
L122.HN; F141.HD1/2 (weak): 7.9/9.7: not assigned yet... maybe later!
A36.HN; Y35.HE1/2 (7.31A instead of 4.4+1.8=6.2): 7.3/5.8: kept
T84.HN; I86.HG11/12 or R131.HB2/1 (7.02A or 6.87A instead of 4.7+1.9=6.6): 7.0/8.8 or 6.9/5.7: kept R131.HB2/1
T84.HN; I86.HD1#/HG2# (weak; would be 4.6+1.8=6.4): 7.9/7.0/8.8/9.6/8.1/8.9: assigned!
T84.HN; R131.HG1/HG2 (weak; would be 4.8+1.9=6.7): 7.7/7.9: not assigned yet... maybe later!
T84.HN; P130.HB2/1 (6.22A instead of 3.6+1.5=5.1): 6.2/5.6: kept
Q81.HN; I80.HG2#/HD1# or V109.HG2#/1# (2.9+1.1=4.0): 4.3/5.1/5.0/4.4/3.4/5.1 or 4.5/3.9/5.0/4.9/3.7/4.4: kept V109.HG2#
A21.HN; S49.HA (8.08A) can be much closer?: 8.1: not assigned yet... maybe later!
F141.HN; L27.HD1#/2# (would be 2.7+1.1=3.8): 5.8/6.7/5.2/5.7/7.4/6.7 (can be closer): assigned!
L118.HN; F37.HE1/2 (4.0+1.6=5.6): 8.2/5.3: kept
E48.HN; V46.HG2#/1# (would be 4.1+1.6=5.7): 7.9/6.9/6.8/8.2/8.4/9.0: not assigned yet... maybe later!
E137.HN; L108.HD2#/1# (would be 4.0+1.6=5.6): 8.7/8.3/7.0/9.7/8.1/9.4: not assigned yet... maybe later!
A74.HN; V72.HG1#/2# (6.11/6.52 instead of 3.6+1.4/3.2+1.3=5.0/4.5): 6.9/6.0/5.6/6.7/7.0/6.0: kept
A74.HN; Y75.HB1/2 (6.11 instead of 3.2+1.3=4.5): 6.1/4.7: kept
E52.HN; V50.HG1#/2# (8.18 instead of 3.4+1.4=4.8): 8.2/8.4/8.1/5.3/6.8/6.9: kept
A145.HN; L122.HD2#/1# (medium-strong; would be 2.5+1.0=3.5): 6.2/6.9/5.4/3.3/3.8/4.1: assigned!
A14.HN; I15.HD1#/HG2# (7.65A instead of 3.9+1.6=5.5): 7.6/7.1/8.4/5.8/6.3/4.6: kept
F37.HN; V46.HG2#/1# (would be 3.6+1.4=5.0): 6.1/7.6/6.4/6.1/7.5/6.3: not assigned yet... maybe later!
I80.HN; Q81.HG1/2 (weak; would be 4.8+1.9=6.7): 7.1/7.9: kept
Q13.HN; I15.HD1#/HG2# (8.11A instead of 3.6+1.5=5.0): 7.8/7.6/9.1/5.8/6.7/5.0: kept
D30.HN; R31.HG2/1 (6.6A instead of 4.0+1.6=6.0): 6.6/6.4: kept
M112.HN; P111.HD1/2 or G120.HA1/2 (3.5+1.4=4.9): 5.7/5.4 or 5.0/5.3: kept G120.HA1/2

H70.HN; V72.HG1#/2# (7.6A instead of 4.0+1.6=5.6):
H70.HN; W71.HB1/2 (3.5+1.4=4.9):
C29.HN; V32.HG2#/1# (would be 2.9+1.2=4.1):
C29.HN; L26.HD1#/2# (would be 4.1+1.6=5.7):
S128.HN; R105.HG2/1 (7.4A instead of 4.8+1.9=6.7):
S128.HN; K103.HG1/2 (10.6A instead of 4.8+1.9=6.7):
G23.HN; L122.HD2#/1# instead of L27.HG (7.6A instead of 3.6+1.4=5.0):
G23.HN; L144.HD1#/2#  or L26.HD2#/1# (5.6A/7.2A instead of 2.1+0.8=2.9):
G23.HN; V32.HG1#/2#  or L26.HD1#/2# or V20.HG2#/1# (6.8A/6.3A/6.3 instead of 2.5+1.0=3.5):
G23.HN; F141.HD1/2 (7.0A instead of what would be 3.4+1.4=4.8):
G78.HN; R79.HB1/2 or V113.HG1#/2# or L118.HD1#/2# (2.4+1.0=3.4):
5.4/3.9 or 4.7/6.4 or 5.7/ :
G78.HN; A74.HB# (5.5A instead of 3.1+1.2=4.3):
G78.HN; Y75.HE1/2 (7.0A instead of 4.5+1.8=6.3):
G120.HN; I114.HD1#/HG2# (7.5A instead of what would be 3.6+1.4=5.0):
G120.HN; A36.HB# or L122.HB2/1 (6.7/7.3A instead of what would be 3.5+1.4=4.9):


***nice:
A106.HN; Q126.HN
I123.HN; I33.HN
L108.HN; A124.HN
V46.HN; A36.HN
T83.HN; N107.HN and the symmetric one
T44.HN; A36.HN
G120.HN; M112.HN

***new contacts:
Q134 with L108, A82
R24.HN; C29.HN

***what?!?
F141.HN sees (strong) -0.03 ppm (L108.HD2#/1#, L122.HD2#,1#?)
T83.HN; L108.HD1# (strong) 0.47 ppm
T83.HN; H125.HA (medium) 5.83 ppm
I138.HN; L108.HD2# (medium-strong) -0.02 ppm
I138.HN ; L108.HD1# (medium-strong) 0.48 ppm
C66.HN sees (v. strong) 5.59 ppm (PCB contact?)
***5.59 ppm is seen by other HN too (e.g., Y41)!!!
C66.HN sees 11.51 and 12.52 ppm (His sc and/or Trp sc)
S142.HN sees (v. strong) -0.03 ppm
***try L27.HG for all -0.03 ppm
strong NOEs from unassigned 8.31/103.9 ppm that sees: 12.52 (Hsc3), 11.50 (Hsc8), strong 5.13, weak 0.66 (PCB-Met1 or R131.HG2  or I114.HG2#), etc.
7.78/103.3 ppm?