A0A087WXQ7_HUMAN Loading...

POTE ankyrin domain family member C

AlphaFold DB , UniProt , Accession A0A087WXQ7, Species HUMAN (Homo sapiens, Human), Gene POTEC, Length 381 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M42Very low32Very low245 Ų245145.4 Ų145.4100%1.20788%0.877SS**  088.60-73.7177.7172.100107.9
2V32.1Very low31.7Very low142 Ų142142.4 Ų142.486%0.86187%0.868SS**  trans-139.4111169.3-172.50000104.6
3T32.3Very low31.4Very low137 Ų137138.9 Ų138.984%0.8486%0.863SS**  trans-86.5112.7179.843.20000108.9
4E34.1Very low31.3Very low192 Ų192138.6 Ų138.690%0.89786%0.86SS**  trans-74.1139.2169.7-75.2-176.9150.600111.1
5V32Very low31.3Very low129 Ų129142.6 Ų142.678%0.78286%0.86SS**  trans-85.9114.8179.7175.70000108.4S7V5-S7 PolarHBondContact O-N 3.45Å
6C29.6Very low31.3Very low129 Ų129144.6 Ų144.687%0.87285%0.854SS**PPolyproline II helixtrans-65.9116.2168.7-88.40000110.4
7S29.4Very low31.3Very low114 Ų114143.3 Ų143.380%0.79785%0.85SS**PPolyproline II helixtrans-87125.6168-62.80000109.4V5V5-S7 PolarHBondContact O-N 3.45Å
8M33Very low31.2Very low180 Ų180145.3 Ų145.389%0.88785%0.847SS**PPolyproline II helixtrans-85.1144.2171.7-63.1-173.784.100110.9
9P29.8Very low31.1Very low129 Ų129144.6 Ų144.684%0.83884%0.839SS**PPolyproline II helixtrans-80.3144.717930.9-31.3000112.7
10A27.8Very low31.3Very low102 Ų102142.5 Ų142.584%0.84382%0.824SS**PPolyproline II helixtrans-68144.2-176.300000113.7
11A30.1Very low31.3Very low100 Ų100147.2 Ų147.283%0.82683%0.828SS**PPolyproline II helixtrans-61135.7177.600000113
12S28.7Very low30.8Very low110 Ų110140.5 Ų140.577%0.76981%0.805SS**PPolyproline II helixtrans-59128.8174.953.90000112.5V14S12-V14 PolarHBondContact O-N 3.33Å
13A27.6Very low30.7Very low97 Ų97141.5 Ų141.580%0.80280%0.798SS**  trans-61.6114.8174.500000112.1K15A13-K15 PolarHBondContact O-N 3.21Å
14V29.8Very low31Very low135 Ų135137.7 Ų137.782%0.81877%0.772SS**  trans-75.4113.4165.81780000107.9S12 K16S12-V14 PolarHBondContact O-N 3.33Å; V14-K16 PolarHBondContact O-N 2.74Å
15K30.6Very low30.7Very low198 Ų198131.5 Ų131.586%0.86176%0.759SS**  trans-62.5118.6175.9-72.8177.2177.1175.70109.7A13A13-K15 PolarHBondContact O-N 3.21Å
16K31.9Very low30.8Very low174 Ų174134.5 Ų134.576%0.75776%0.761SS**  trans-63.7132.6167.9-65.3178.9179.3-179.90109.5V14 F18V14-K16 PolarHBondContact O-N 2.74Å; K16-F18 HydrophobicContact CB-CD2 4.35Å; K16-F18 HydrophobicContact CD-CE2 4.32Å; K16-F18 PolarHBondContact O-N 3.33Å
17P31.3Very low31.2Very low123 Ų123134.4 Ų134.480%0.79974%0.743SS**  trans-80.7106.3167.730.3-26.9000108.9
18F28.9Very low31.2Very low179 Ų179138 Ų13879%0.78575%0.745SS**  trans-87.9155.5165.5-97.5-88.5000110.7K16K16-F18 HydrophobicContact CB-CD2 4.35Å; K16-F18 HydrophobicContact CD-CE2 4.32Å; K16-F18 PolarHBondContact O-N 3.33Å
19D29.9Very low31Very low132 Ų132137 Ų13771%0.70674%0.738SS**  trans83.165.9177.4-72.3-20.1000119.4
20L35.2Very low31Very low102 Ų102139.8 Ų139.853%0.53474%0.739SS.*  trans-102.7-10.9162.5-90.7155.3000114.6S22 K23 M24L20-S22 VanDerWaalsContact C-N 3.28Å; L20-S22 PolarHBondContact O-N 3.14Å; L20-K23 PolarHBondContact O-N 3.29Å; L20-M24 PolarHBondContact O-N 3.08Å
21R32.3Very low31.1Very low242 Ų242146 Ų14691%0.91374%0.74SS**THydrogen-bonded Turntrans-66-26.4-176.4-146.5177.9-164-158.13.7113.6
22S30.8Very low30.8Very low104 Ų104150.4 Ų150.473%0.72774%0.741SS**THydrogen-bonded Turntrans-87.3-22.8-178.971.60000114.4L20L20-S22 VanDerWaalsContact C-N 3.28Å; L20-S22 PolarHBondContact O-N 3.14Å
23K30.7Very low30.7Very low163 Ų163151.3 Ų151.371%0.70975%0.745SS**THydrogen-bonded Turntrans-91-15.5-179.9-79179178.9170.50113.8L20L20-K23 PolarHBondContact O-N 3.29Å
24M37Very low30.7Very low58 Ų58151.5 Ų151.529%0.28674%0.739SS.*G310 helixtrans-88.8-11.1-178.2-80.7173.3138.200115.1L20 K26 W27 L223L20-M24 PolarHBondContact O-N 3.08Å; M24-K26 PolarHBondContact O-N 3.38Å; M24-W27 WeakPolarHBondContact O-CB 3.21Å; M24-W27 PolarHBondContact O-N 3.13Å; M24-L223 HydrophobicContact CE-CD1 4.36Å
25G27.9Very low30.6Very low61 Ų61151.8 Ų151.863%0.62975%0.745SS**G310 helixtrans-60.6-10.7175.100000115.1
26K35.2Very low30.5Very low192 Ų192151.9 Ų151.984%0.83575%0.746SS**G310 helixtrans-97.3-0.9174.7-67.2-178.1178.7-179.60114.4M24M24-K26 PolarHBondContact O-N 3.38Å
27W37.4Very low30.3Very low127 Ų127147.5 Ų147.548%0.48175%0.75SS.*SBendtrans-79.5-20.9-180-76.161.3000113.5M24 L253M24-W27 WeakPolarHBondContact O-CB 3.21Å; M24-W27 PolarHBondContact O-N 3.13Å; W27-L253 HydrophobicContact CH2-CD2 4.22Å; W27-L253 HydrophobicContact CZ3-CB 4.17Å; W27-L253 HydrophobicContact CZ3-CD1 4.11Å; W27-L253 HydrophobicContact CZ3-CD2 4.19Å; W27-L253 HydrophobicContact CZ3-CG 4.39Å
28F28.8Very low30.2Very low191 Ų191147.6 Ų147.684%0.83875%0.753SS**SBendtrans-93.74.8-172.3-78.4-74.7000116.2
29H28.6Very low30Very low159 Ų159142.7 Ų142.774%0.73675%0.754SS**SBendtrans-115.783.5174.1-79-64.3000110.3
30H31.4Very low30Very low186 Ų186146.5 Ų146.586%0.86176%0.764SS**SBendtrans163.574.1139.3-91-70.9000111.3
31R28.3Very low29.6Very low232 Ų232147.5 Ų147.588%0.87578%0.78SS**  trans-175.2109.5142.8-122.2168.7170.5-168.8-4.3108.2
32F24.6Very low29.4Very low194 Ų194143.1 Ų143.185%0.85177%0.774SS**  trans165.5119.8148.5-86.9-61.6000109
33P27.8Very low29.2Very low129 Ų129146.7 Ų146.784%0.83878%0.782SS**  trans-82.3111.3148.31.117.8000107.9
34C27.4Very low28.8Very low101 Ų101142 Ų14268%0.68278%0.779SS**  trans-73.3123.6170.9-75.40000110.8K36C34-K36 PolarHBondContact O-N 3.47Å
35C26.1Very low28.4Very low141 Ų141145.7 Ų145.795%0.95381%0.805SS**  trans-83.892153.2-75.30000108.7
36K30Very low28.4Very low200 Ų200148.5 Ų148.587%0.8782%0.816SS**  trans-81.9111.1164.8-86.6-177.2174.7176.90108.8C34C34-K36 PolarHBondContact O-N 3.47Å
37G26.1Very low28Very low82 Ų82142.6 Ų142.685%0.84581%0.809SS**  trans-94.7106.7163.300000109.9
38S29.6Very low27.5Very low124 Ų124144.2 Ų144.287%0.86783%0.827SS**  trans-78.2131.7170.351.50000110.8
39G26Very low28Very low77 Ų77143.5 Ų143.579%0.79483%0.826SS**  trans-162.9106.5167.300000111.1
40K29.1Very low28.2Very low211 Ų211143.3 Ų143.392%0.91783%0.83SS**  trans-83.3137.5167-71.5178.2175.6177.50109
41S27.1Very low28.6Very low124 Ų124139.9 Ų139.987%0.86782%0.818SS**  trans-164.9137.4138.749.60000111.3
42N27Very low29Very low149 Ų149133 Ų13380%0.79781%0.806SS**  trans-80.9151.1168.7-90.8-11.3000110.5
43M26.5Very low29.5Very low180 Ų180130.5 Ų130.589%0.88780%0.795SS**  trans142.9129.9130.3-75-59.3-177.100113.1
44G23.5Very low29.9Very low64 Ų64130.1 Ų130.166%0.6678%0.783SS**  trans78.5100.9130.200000121
45T28.1Very low30.2Very low135 Ų135132.2 Ų132.283%0.82878%0.781SS**  trans37.6136.9134.8570000123.5
46S27.1Very low30.5Very low121 Ų121130.1 Ų130.185%0.84676%0.758SS**  trans82.4131.4146.472.20000120.4
47G27.7Very low30.5Very low67 Ų67124.1 Ų124.169%0.69174%0.735SS**  trans86.1103.3130.300000117.9
48D27.1Very low30.9Very low161 Ų161130 Ų13086%0.86173%0.732SS**  trans71.2143.5147.4-57.4-30.6000121.5
49H39.6Very low31.1Very low176 Ų176127.4 Ų127.482%0.81571%0.714SS**  trans-53.6139.5-176.3-70.5-88000113.2
50D32.1Very low31.4Very low155 Ų155130.7 Ų130.783%0.82971%0.706SS**  trans-150.6129.9151.8-99.6-34.2000116.6S52D50-S52 PolarHBondContact O-N 3.07Å
51D40.1Very low31.5Very low114 Ų114127.7 Ų127.761%0.6170%0.698SS**THydrogen-bonded Turntrans-6725.6-175.2-163.323.7000114.2
52S35.9Very low31.9Very low88 Ų88124 Ų12462%0.61568%0.679SS**Hα-helixtrans-84.2-38.1-175.4163.20000112.4D50 M54 K55 M56D50-S52 PolarHBondContact O-N 3.07Å; S52-M54 PolarHBondContact O-N 3.01Å; S52-K55 PolarHBondContact O-N 3.08Å; S52-M56 PolarHBondContact O-N 2.91Å
53F35.8Very low32.2Very low141 Ų141124.8 Ų124.862%0.61868%0.675SS**Hα-helixtrans-69.3-34.8-176.5-159.8-99.1000112.7M56 L57F53-M56 HydrophobicContact CE2-CE 4.33Å; F53-M56 PolarHBondContact O-N 3.43Å; F53-L57 HydrophobicContact CD1-CD1 3.81Å; F53-L57 HydrophobicContact CE1-CD1 3.73Å; F53-L57 PolarHBondContact O-N 3.05Å
54M35.6Very low32.2Very low122 Ų122121.8 Ų121.860%0.60167%0.671SS**Hα-helixtrans-74.8-26.8178-73-63-169.100113.2S52 L57 R58S52-M54 PolarHBondContact O-N 3.01Å; M54-L57 HydrophobicContact SD-CD1 4.38Å; M54-R58 PolarHBondContact O-N 3.46Å
55K34.8Very low32.5Very low145 Ų145123.9 Ų123.963%0.6367%0.674SS**Hα-helixtrans-72.4-36.2171.4-84.9174.7177.9164.10112.1S52 R58 S59S52-K55 PolarHBondContact O-N 3.08Å; K55-R58 PolarHBondContact O-N 3.01Å; K55-S59 PolarHBondContact O-N 3.4Å; K55-S59 VanDerWaalsContact O-N 3.14Å
56M31.6Very low32.6Very low96 Ų96125.4 Ų125.447%0.47367%0.672SS.*Hα-helixtrans-68.3-37.4175.6-168.1177.771.600112.5S52 F53 S59 K60S52-M56 PolarHBondContact O-N 2.91Å; F53-M56 HydrophobicContact CE2-CE 4.33Å; F53-M56 PolarHBondContact O-N 3.43Å; M56-S59 PolarHBondContact O-N 3.03Å; M56-K60 PolarHBondContact O-N 3.27Å; M56-K60 VanDerWaalsContact O-N 3.13Å
57L31Very low32.8Very low75 Ų75128.5 Ų128.539%0.39367%0.672SS.*Hα-helixtrans-66.2-37.7174.5-90157.4000112.5F53 M54 K60 M61F53-L57 HydrophobicContact CD1-CD1 3.81Å; F53-L57 HydrophobicContact CE1-CD1 3.73Å; F53-L57 PolarHBondContact O-N 3.05Å; M54-L57 HydrophobicContact SD-CD1 4.38Å; L57-K60 PolarHBondContact O-N 3.21Å; L57-M61 PolarHBondContact O-N 3.06Å
58R33.2Very low32.9Very low204 Ų204130.4 Ų130.477%0.7767%0.674SS**Hα-helixtrans-66.1-36174.7-121.3179.3-93.4-129.71.4112.8M54 K55 G62M54-R58 PolarHBondContact O-N 3.46Å; K55-R58 PolarHBondContact O-N 3.01Å; R58-G62 PolarHBondContact O-N 3.18Å
59S34.3Very low32.8Very low71 Ų71132.3 Ų132.350%0.49768%0.675SS.*Hα-helixtrans-70.2-34.9175.7169.90000113.3K55 M56K55-S59 PolarHBondContact O-N 3.4Å; K55-S59 VanDerWaalsContact O-N 3.14Å; M56-S59 PolarHBondContact O-N 3.03Å
60K32Very low32.2Very low145 Ų145129.3 Ų129.363%0.6367%0.671SS**Hα-helixtrans-80.1-27.6177.5-89.7175.9173.6174.40114M56 L57 G62M56-K60 PolarHBondContact O-N 3.27Å; M56-K60 VanDerWaalsContact O-N 3.13Å; L57-K60 PolarHBondContact O-N 3.21Å; K60-G62 VanDerWaalsContact C-N 3.3Å
61M31.5Very low31.9Very low149 Ų149127.8 Ų127.873%0.73467%0.671SS**Hα-helixtrans-72.7-21.4170.3-79.9-178.3170.900113.2L57 K63L57-M61 PolarHBondContact O-N 3.06Å; M61-K63 VanDerWaalsContact C-N 3.34Å; M61-K63 PolarHBondContact O-N 3.39Å
62G35Very low31.3Very low47 Ų47129 Ų12949%0.48569%0.687SS.*THydrogen-bonded Turntrans-77.4-8.8175.800000115.7R58 K60R58-G62 PolarHBondContact O-N 3.18Å; K60-G62 VanDerWaalsContact C-N 3.3Å
63K33.9Very low30.9Very low164 Ų164137.3 Ų137.371%0.71371%0.705SS**THydrogen-bonded Turntrans-104.4-7.4-176.6-72.7-179.2178.5179.50115M61M61-K63 VanDerWaalsContact C-N 3.34Å; M61-K63 PolarHBondContact O-N 3.39Å
64C26.9Very low30.4Very low118 Ų118134.2 Ų134.280%0.79771%0.712SS**SBendtrans-91.7-4.1175.4-77.30000114.3
65C29.5Very low30.1Very low107 Ų107134.6 Ų134.672%0.72373%0.727SS**SBendtrans-92.28.6177.3-75.60000114.6
66H30.3Very low29.7Very low167 Ų167131.3 Ų131.377%0.77374%0.735SS**SBendtrans-97.79.6-175.1-93.1-60000116.3
67H31.2Very low29.3Very low186 Ų186133.4 Ų133.486%0.86175%0.753SS**SBendtrans-1163.4179.9-105.8-47000117.2
68C29.3Very low29.1Very low107 Ų107134.6 Ų134.672%0.72377%0.768SS**SBendtrans-128.1118168.9-69.70000108.4
69F25.6Very low28.7Very low202 Ų202131.8 Ų131.889%0.88677%0.768SS**  trans108.292.8179.4-66.5-72.5000116
70P26.4Very low28.4Very low113 Ų113135.1 Ų135.173%0.73479%0.785SS**  trans-75154.4147.531.2-23.6000109.7
71C26.4Very low28.1Very low123 Ų123131.8 Ų131.883%0.83179%0.791SS**  trans85.883.3173.4-57.60000117.1
72C26.6Very low27.9Very low138 Ų138131.1 Ų131.193%0.93280%0.796SS**  -161.585.1125.3-96.80000108.4G74C72-G74 PolarHBondContact O-N 2.86Å
73R27.6Very low27.5Very low264 Ų264134.8 Ų134.8100%0.99681%0.814SS**  trans-72.6118.6158.4-90.2-175.6172.6-159.6-0.8107.1
74G26.4Very low27.1Very low75 Ų75130.6 Ų130.677%0.77382%0.817SS**  trans-154100.2170.600000108.8C72C72-G74 PolarHBondContact O-N 2.86Å
75S28.3Very low27.3Very low130 Ų130132 Ų13291%0.90982%0.817SS**  trans-58.2139.517946.30000113.8
76G25.9Very low27.3Very low77 Ų77135.1 Ų135.179%0.79482%0.821SS**  trans176.185.9167.200000113.5
77T24.8Very low27.3Very low139 Ų139133.4 Ų133.485%0.85382%0.817SS**  trans-59.1153.2156.750.90000109.3
78S26.2Very low27.8Very low101 Ų101131 Ų13171%0.70681%0.81SS**  cis-175.5159.124.437.80000110.1
79N25.1Very low28.1Very low145 Ų145129.5 Ų129.578%0.77580%0.801SS**  trans67.4116.6138.4-75.33.9000125.7
80V28.2Very low28.4Very low141 Ų141127.1 Ų127.186%0.85579%0.791SS**  69.1128.1126.3-170.90000120.2
81G24.3Very low28.7Very low74 Ų74128.1 Ų128.176%0.76379%0.787SS**  trans159.3122.815200000115.3
82T28.7Very low29Very low135 Ų135129.8 Ų129.883%0.82878%0.781SS**  trans-77.7164.1-179.844.80000114.6
83S26.5Very low29.3Very low124 Ų124126.5 Ų126.587%0.86776%0.757SS**  trans90.7144.7152.980.20000119.7
84G25.7Very low29.3Very low76 Ų76117.6 Ų117.678%0.78473%0.728SS**  trans108.2120.5150.700000116.6
85D30.2Very low29.6Very low149 Ų149123.9 Ų123.980%0.79773%0.729SS**  trans-60.7163.8174-69.2-59.7000114.8
86H30.1Very low30Very low171 Ų171121 Ų12179%0.79271%0.708SS**  trans82.9102.4169.8-59.9-73.4000117.7
87D30.2Very low30.3Very low132 Ų132124.4 Ų124.471%0.70670%0.701SS**  176.9118.299.6-92.3-26000113.5S89D87-S89 PolarHBondContact O-N 3.4Å
88N41.1Very low30.5Very low134 Ų134124.1 Ų124.172%0.71769%0.692SS**THydrogen-bonded Turntrans-81.125-176.4-136.9-6.3000113.2
89S35.4Very low30.8Very low76 Ų76121.8 Ų121.853%0.53168%0.684SS.*THydrogen-bonded Turntrans-101.5-28.7-179.584.80000112.7D87 T93D87-S89 PolarHBondContact O-N 3.4Å; S89-T93 PolarHBondContact O-N 3.02Å; S89-T93 PolarHBondContact O-OG1 3.02Å
90F31.3Very low31.4Very low152 Ų152123 Ų12367%0.66768%0.682SS**Hα-helixtrans-72.9-39.1179.3-156.1-102.2000112.1K92 T93 L94F90-K92 VanDerWaalsContact C-N 3.34Å; F90-K92 PolarHBondContact O-N 3.33Å; F90-T93 PolarHBondContact O-N 3.39Å; F90-T93 VanDerWaalsContact O-N 3.17Å; F90-L94 HydrophobicContact CD1-CD1 3.69Å; F90-L94 HydrophobicContact CE1-CD1 3.54Å; F90-L94 PolarHBondContact O-N 2.99Å
91M33.4Very low31.3Very low134 Ų134127.3 Ų127.366%0.6668%0.683SS**Hα-helixtrans-68.8-26.8176.3-78-70.6-109.300113.7R95M91-R95 VanDerWaalsContact O-CB 3.3Å; M91-R95 WeakPolarHBondContact O-CB 3.38Å; M91-R95 PolarHBondContact O-N 3.49Å
92K33.4Very low31.5Very low158 Ų158129 Ų12969%0.68768%0.683SS**Hα-helixtrans-72.7-34.7171.1-78.5-179177.8175.90111.6F90 R95 S96F90-K92 VanDerWaalsContact C-N 3.34Å; F90-K92 PolarHBondContact O-N 3.33Å; K92-R95 PolarHBondContact O-N 3.29Å; K92-S96 PolarHBondContact O-N 3.37Å
93T31.7Very low31.6Very low70 Ų70127.4 Ų127.443%0.42968%0.676SS.*Hα-helixtrans-74.4-37.7179.2-47.50000111.5S89 F90 S96 K97S89-T93 PolarHBondContact O-N 3.02Å; S89-T93 PolarHBondContact O-OG1 3.02Å; F90-T93 PolarHBondContact O-N 3.39Å; F90-T93 VanDerWaalsContact O-N 3.17Å; T93-S96 PolarHBondContact O-N 3.28Å; T93-S96 PolarHBondContact O-OG 2.66Å; T93-K97 PolarHBondContact O-N 3.12Å
94L29.3Very low31.8Very low76 Ų76130 Ų13040%0.39867%0.674SS.*Hα-helixtrans-67.5-38.3171.1-102.3148.6000112.8F90 S96 K97 M98F90-L94 HydrophobicContact CD1-CD1 3.69Å; F90-L94 HydrophobicContact CE1-CD1 3.54Å; F90-L94 PolarHBondContact O-N 2.99Å; L94-S96 VanDerWaalsContact C-N 3.32Å; L94-S96 PolarHBondContact O-N 2.97Å; L94-K97 PolarHBondContact O-N 3.27Å; L94-M98 HydrophobicContact CD2-SD 4.29Å; L94-M98 WeakPolarHBondContact O-CB 3.45Å; L94-M98 PolarHBondContact O-N 3.34Å
95R32.4Very low31.8Very low208 Ų208131.8 Ų131.879%0.78567%0.673SS**Hα-helixtrans-66.5-33.1173.1-163.7178.9-79.2-135.90.8112M91 K92 G99M91-R95 VanDerWaalsContact O-CB 3.3Å; M91-R95 WeakPolarHBondContact O-CB 3.38Å; M91-R95 PolarHBondContact O-N 3.49Å; K92-R95 PolarHBondContact O-N 3.29Å; R95-G99 PolarHBondContact O-N 3.48Å; R95-G99 VanDerWaalsContact O-N 3.13Å
96S35.8Very low31.5Very low69 Ų69134 Ų13448%0.48368%0.676SS.*Hα-helixtrans-74.7-30.3174.390.90000113.7K92 T93 L94K92-S96 PolarHBondContact O-N 3.37Å; T93-S96 PolarHBondContact O-N 3.28Å; T93-S96 PolarHBondContact O-OG 2.66Å; L94-S96 VanDerWaalsContact C-N 3.32Å; L94-S96 PolarHBondContact O-N 2.97Å
97K31.8Very low31.5Very low148 Ų148131.9 Ų131.964%0.64368%0.677SS**Hα-helixtrans-85.3-34.2177.8-77.3-177.1175.2179.30113T93 L94 G99 K100T93-K97 PolarHBondContact O-N 3.12Å; L94-K97 PolarHBondContact O-N 3.27Å; K97-G99 VanDerWaalsContact C-N 3.26Å; K97-G99 PolarHBondContact O-N 2.63Å; K97-K100 PolarHBondContact O-N 2.86Å
98M29.5Very low31.5Very low133 Ų133131.1 Ų131.166%0.65568%0.681SS**Hα-helixtrans-68.6-26.6168.2-77.3169116.200112L94 K100L94-M98 HydrophobicContact CD2-SD 4.29Å; L94-M98 WeakPolarHBondContact O-CB 3.45Å; L94-M98 PolarHBondContact O-N 3.34Å; M98-K100 PolarHBondContact O-N 3.25Å
99G33.1Very low31.1Very low52 Ų52130.7 Ų130.754%0.53669%0.687SS.*THydrogen-bonded Turntrans-69.8-6.9170.100000115.3R95 K97R95-G99 PolarHBondContact O-N 3.48Å; R95-G99 VanDerWaalsContact O-N 3.13Å; K97-G99 VanDerWaalsContact C-N 3.26Å; K97-G99 PolarHBondContact O-N 2.63Å
100K37Very low31.2Very low172 Ų172139.5 Ų139.575%0.74871%0.708SS**THydrogen-bonded Turntrans-111.1-7.8176.6-79.1-179.1175.6179.90114.4K97 M98K97-K100 PolarHBondContact O-N 2.86Å; M98-K100 PolarHBondContact O-N 3.25Å
101W26.2Very low31.2Very low230 Ų230135.5 Ų135.587%0.87171%0.71SS**THydrogen-bonded Turntrans-106.9-12.3-177.3-94.750.1000114.6C103W101-C103 PolarHBondContact O-N 2.89Å
102C28.8Very low31.5Very low111 Ų111135.3 Ų135.375%0.7572%0.722SS**THydrogen-bonded Turntrans-80.21.4171.4-79.30000114.2H104C102-H104 PolarHBondContact O-N 3.39Å
103C31.5Very low31.3Very low101 Ų101130.5 Ų130.568%0.68272%0.717SS**THydrogen-bonded Turntrans-886.7-176.1-61.70000114.8W101W101-C103 PolarHBondContact O-N 2.89Å
104H30.5Very low31.4Very low178 Ų178137.8 Ų137.882%0.82474%0.743SS**SBendtrans-119.75.2-173.2-103.4-47.8000117.5C102C102-H104 PolarHBondContact O-N 3.39Å
105C26Very low31.6Very low114 Ų114137.5 Ų137.577%0.7775%0.747SS**SBendtrans-130.617.2-178.3-64.80000116.3
106F23.8Very low31.6Very low196 Ų196136.2 Ų136.286%0.8676%0.756SS**  trans-127.698.2168.3-88.5-84.4000110.5C108F106-C108 VanDerWaalsContact C-N 3.26Å; F106-C108 PolarHBondContact O-N 3.18Å; F106-C108 VanDerWaalsContact O-N 3.1Å
107P30Very low31.9Very low126 Ų126134.9 Ų134.982%0.81875%0.745SS**  trans-8474.7167.832.4-27.7000109.1
108C29.9Very low32.3Very low115 Ų115131 Ų13178%0.77775%0.747SS**SBendtrans-147.772.6158.9-84.10000108.8F106F106-C108 VanDerWaalsContact C-N 3.26Å; F106-C108 PolarHBondContact O-N 3.18Å; F106-C108 VanDerWaalsContact O-N 3.1Å
109C31.6Very low32.7Very low125 Ų125129.3 Ų129.385%0.84575%0.754SS**  trans39.177.4149.2-58.60000119.2
110R37.8Very low33.6Very low261 Ų261134 Ų13499%0.98576%0.755SS**  -102.476.5128.5-90.3-170177.3-142.10.1107.6S112R110-S112 PolarHBondContact O-N 3.09Å
111G31.1Very low34.2Very low68 Ų68127 Ų12770%0.70173%0.732SS**  trans-81.3102.4177.300000110.2G113G111-G113 PolarHBondContact O-N 3.2Å
112S40.8Very low35.6Very low131 Ų131122.6 Ų122.692%0.91673%0.726SS**  trans-71.871.9151.162.20000108.3R110R110-S112 PolarHBondContact O-N 3.09Å
113G29.5Very low37.4Very low56 Ų56120 Ų12058%0.57770%0.7SS**  trans-99.7127.1160.700000106.7G111 S115G111-G113 PolarHBondContact O-N 3.2Å; G113-S115 PolarHBondContact O-N 2.93Å
114K33.5Very low39.4Very low223 Ų223118.7 Ų118.797%0.9769%0.687SS**  trans-69.182.3169.5-69.7179.1177.8179.10108
115S32.7Very low41.5Very low70 Ų70113.5 Ų113.549%0.4967%0.665SS.*  trans-90.1135.4155.858.50000107.2G113 V117G113-S115 PolarHBondContact O-N 2.93Å; S115-V117 PolarHBondContact O-N 3.35Å
116N33.7Very low44.3Very low182 Ų182110.5 Ų110.597%0.97365%0.645SS**SBendtrans-71.122.3175.3-107.27.4000112.5
117V40.7Very low47Very low41 Ų41101.2 Ų101.225%0.24860%0.604CS.*SBendtrans-96.4121.7-178.6-170.60000106.3S115 A119 Y344S115-V117 PolarHBondContact O-N 3.35Å; V117-A119 PolarHBondContact O-N 3.1Å; V117-Y344 HydrophobicContact CG1-CD1 3.86Å; V117-Y344 HydrophobicContact CG1-CE1 3.6Å
118G40.1Very low49.7Very low66 Ų6695.7 Ų95.768%0.6857%0.568SS**  trans-37.9128-168.600000113.5W120G118-W120 PolarHBondContact O-N 3.24Å
119A38.7Very low51.9Low97 Ų9794.3 Ų94.380%0.80255%0.551SS**  trans-45.112817500000109.5V117 G121V117-A119 PolarHBondContact O-N 3.1Å; A119-G121 VanDerWaalsContact C-N 3.3Å; A119-G121 PolarHBondContact O-N 3.07Å
120W52.3Low54Low150 Ų15093.7 Ų93.757%0.56854%0.535SS*.  trans-51.296.1171.9-67.584.9000108.8G118 D122 C314G118-W120 PolarHBondContact O-N 3.24Å; W120-D122 PolarHBondContact O-N 3.07Å; W120-D122 VanDerWaalsContact O-N 3.16Å; W120-C314 VanDerWaalsContact CH2-C 3.46Å; W120-C314 HydrophobicContact CH2-CB 3.41Å; W120-C314 VanDerWaalsContact CH2-CB 3.41Å; W120-C314 WeakPolarHBondContact CH2-O 3.46Å; W120-C314 HydrophobicContact CZ2-CB 3.93Å; W120-C314 WeakPolarHBondContact CZ2-O 3.37Å; W120-C314 HydrophobicContact CZ3-CB 4.18Å
121G49.4Very low55.9Low25 Ų2584 Ų8426%0.25851%0.507SS..  trans-67.6116.2-176.100000109.7A119 Y123 Y304A119-G121 VanDerWaalsContact C-N 3.3Å; A119-G121 PolarHBondContact O-N 3.07Å; G121-Y123 VanDerWaalsContact C-N 3.33Å; G121-Y123 PolarHBondContact O-N 3.28Å; G121-Y304 WeakPolarHBondContact CA-OH 3.39Å; G121-Y304 PolarHBondContact O-OH 2.98Å
122D55.1Low58.5Low139 Ų13986.6 Ų86.674%0.74350%0.495SS*.  trans37.647.2152.5-50.5-23.5000116.7W120 D124W120-D122 PolarHBondContact O-N 3.07Å; W120-D122 VanDerWaalsContact O-N 3.16Å; D122-D124 PolarHBondContact O-N 3.05Å; D122-D124 VanDerWaalsContact O-N 3.13Å
123Y67.2Low60.7Low56 Ų5681.7 Ų81.722%0.2246%0.457CS..  trans-71.8104.2162.8178.2-107.1000108.1G121 D125 F128 C271 L273 L278 H281 E282G121-Y123 VanDerWaalsContact C-N 3.33Å; G121-Y123 PolarHBondContact O-N 3.28Å; Y123-D125 HydrophobicContact CD1-CB 4.23Å; Y123-D125 HydrophobicContact CE1-CB 3.8Å; Y123-D125 PolarHBondContact O-N 2.85Å; Y123-F128 WeakPolarHBondContact OH-CE2 3.26Å; Y123-C271 HydrophobicContact CD2-CB 4.46Å; Y123-L273 HydrophobicContact CD2-CD1 3.97Å; Y123-L273 HydrophobicContact CE2-CD1 3.53Å; Y123-L278 HydrophobicContact CE2-CD1 4.45Å; Y123-L278 WeakPolarHBondContact OH-CD1 3Å; Y123-H281 AromaticContact CD1-CE1 3.35Å; Y123-H281 WeakPolarHBondContact CD1-CE1 3.38Å; Y123-H281 AromaticContact CE1-CE1 3.6Å; Y123-H281 AromaticContact CE1-ND1 3.82Å; Y123-H281 AromaticContact CG-CE1 3.62Å; Y123-E282 PolarHBondContact OH-OE1 2.94Å
124D72.3Confident63.3Low74 Ų7485.5 Ų85.540%0.39646%0.459SS..  trans-84.4100.5178.2-176.18.8000110.6D122 S126 Y238D122-D124 PolarHBondContact O-N 3.05Å; D122-D124 VanDerWaalsContact O-N 3.13Å; D124-S126 VanDerWaalsContact C-N 3.27Å; D124-S126 WeakPolarHBondContact OD1-CB 3.47Å; D124-S126 PolarHBondContact OD1-N 2.96Å; D124-S126 PolarHBondContact OD1-OG 3.14Å; D124-Y238 WeakPolarHBondContact OD2-CE1 3.29Å
125D76.3Confident65.6Low69 Ų6976.8 Ų76.837%0.36943%0.425SS..G310 helixtrans-84.94176.667.80.9000113.5Y123 A127 F128 M129Y123-D125 HydrophobicContact CD1-CB 4.23Å; Y123-D125 HydrophobicContact CE1-CB 3.8Å; Y123-D125 PolarHBondContact O-N 2.85Å; D125-A127 PolarHBondContact O-N 3.02Å; D125-F128 PolarHBondContact O-N 3.12Å; D125-M129 HydrophobicContact CB-CE 4.1Å; D125-M129 VanDerWaalsContact CG-CE 3.47Å; D125-M129 PolarHBondContact O-N 3.42Å; D125-M129 WeakPolarHBondContact OD2-CE 3.26Å
126S83.1Confident67.8Low51 Ų5182.5 Ų82.536%0.35744%0.436SS..G310 helixtrans-56.5-24.5-179.8-58.90000113.1D124 F128D124-S126 VanDerWaalsContact C-N 3.27Å; D124-S126 WeakPolarHBondContact OD1-CB 3.47Å; D124-S126 PolarHBondContact OD1-N 2.96Å; D124-S126 PolarHBondContact OD1-OG 3.14Å; S126-F128 VanDerWaalsContact C-N 3.25Å; S126-F128 PolarHBondContact O-N 2.93Å
127A81.8Confident69.7Low0 Ų083.1 Ų83.10%042%0.424CS..G310 helixtrans-59.7-37.5175.400000112.6D125 R207 Q215 Y238 N240 Y245D125-A127 PolarHBondContact O-N 3.02Å; A127-R207 PolarHBondContact O-NH2 2.95Å; A127-Q215 PolarHBondContact O-NE2 3.42Å; A127-Y238 HydrophobicContact CB-CD1 4.2Å; A127-Y238 HydrophobicContact CB-CD2 3.26Å; A127-Y238 HydrophobicContact CB-CE2 3.74Å; A127-Y238 HydrophobicContact CB-CG 3.52Å; A127-N240 VanDerWaalsContact CB-ND2 3.32Å; A127-N240 WeakPolarHBondContact CB-ND2 3.28Å; A127-Y245 PolarHBondContact O-OH 2.87Å
128F86.8Confident71.4Confident10 Ų1089.4 Ų89.44%0.04445%0.451CS..THydrogen-bonded Turntrans-92.4-24.9-174.4-55.5-72.4000112.5Y123 D125 S126 Q215 N240 Y245 H248 L278Y123-F128 WeakPolarHBondContact OH-CE2 3.26Å; D125-F128 PolarHBondContact O-N 3.12Å; S126-F128 VanDerWaalsContact C-N 3.25Å; S126-F128 PolarHBondContact O-N 2.93Å; F128-Q215 PolarHBondContact O-NE2 3.34Å; F128-N240 HydrophobicContact CZ-CB 4.49Å; F128-Y245 AromaticContact CD1-CD1 3.69Å; F128-Y245 HydrophobicContact CD1-CD1 3.69Å; F128-Y245 AromaticContact CD1-CE1 3.63Å; F128-Y245 HydrophobicContact CD1-CE1 3.63Å; F128-Y245 HydrophobicContact CD1-CG 4.47Å; F128-Y245 AromaticContact CE1-CD1 3.97Å; F128-Y245 HydrophobicContact CE1-CD1 3.97Å; F128-Y245 HydrophobicContact CE1-CE1 4.04Å; F128-Y245 HydrophobicContact CE1-CG 4.31Å; F128-H248 WeakPolarHBondContact CB-CE1 3.35Å; F128-H248 WeakPolarHBondContact CB-NE2 3.46Å; F128-H248 HydrophobicContact CD1-CB 3.6Å; F128-H248 AromaticContact CD1-CD2 3.84Å; F128-H248 AromaticContact CD1-CG 3.39Å; F128-H248 AromaticContact CD1-ND1 3.68Å; F128-H248 AromaticContact CD2-ND1 3.76Å; F128-H248 HydrophobicContact CE1-CB 3.73Å; F128-H248 AromaticContact CE1-CG 3.98Å; F128-H248 HydrophobicContact CG-CB 4.27Å; F128-H248 AromaticContact CG-CD2 3.92Å; F128-H248 AromaticContact CG-CE1 3.67Å; F128-H248 AromaticContact CG-CG 3.59Å; F128-H248 AromaticContact CG-ND1 3.41Å; F128-H248 WeakPolarHBondContact CG-ND1 3.41Å; F128-H248 AromaticContact CG-NE2 3.99Å; F128-H248 HydrophobicContact CZ-CB 4.48Å; F128-L278 HydrophobicContact CE1-CD2 4.41Å; F128-L278 HydrophobicContact CE2-CD1 4.38Å; F128-L278 HydrophobicContact CZ-CD1 4.33Å; F128-L278 HydrophobicContact CZ-CD2 3.89Å
129M76.1Confident72.9Confident87 Ų8787.5 Ų87.543%0.42943%0.425SS..SBendtrans-63.1147.1173.6-58.9-55.7152.800111.6D125D125-M129 HydrophobicContact CB-CE 4.1Å; D125-M129 VanDerWaalsContact CG-CE 3.47Å; D125-M129 PolarHBondContact O-N 3.42Å; D125-M129 WeakPolarHBondContact OD2-CE 3.26Å
130E76.1Confident75Confident111 Ų11183.1 Ų83.152%0.51939%0.388SS..  trans59.473.2-179-53.7-177.1172.900113.9R132 H134E130-R132 VanDerWaalsContact C-N 3.32Å; E130-R132 PolarHBondContact O-N 2.73Å; E130-H134 IonicContact OE1-CE1 3.47Å; E130-H134 IonicContact OE2-CE1 2.81Å; E130-H134 PolarHBondContact OE2-CE1 2.83Å; E130-H134 VanDerWaalsContact OE2-CE1 3.26Å; E130-H134 IonicContact OE2-ND1 3.98Å; E130-H134 PolarHBondContact OE2-ND1 2.9Å; E130-H134 VanDerWaalsContact OE2-ND1 3.1Å
131P76.5Confident76.7Confident59 Ų5978.9 Ų78.938%0.38338%0.377SS..  trans-64.2-37-177.124.2-33.1000112.1K212 Q215 C216P131-K212 WeakPolarHBondContact O-CE 3.39Å; P131-K212 PolarHBondContact O-NZ 3.41Å; P131-Q215 HydrophobicContact CB-CG 3.96Å; P131-Q215 WeakPolarHBondContact CB-O 3.41Å; P131-C216 PolarHBondContact O-SG 3.13Å
132R86.2Confident78.5Confident122 Ų12284.7 Ų84.746%0.4640%0.395SS..SBendtrans-90.9150.7179-63.8-168.6-174-82.7-1.4111.4E130 A182 E218E130-R132 VanDerWaalsContact C-N 3.32Å; E130-R132 PolarHBondContact O-N 2.73Å; R132-A182 PolarHBondContact NH1-O 3.32Å; R132-E218 IonicContact CZ-OE1 3.58Å; R132-E218 IonicContact NH1-OE1 3.73Å; R132-E218 PolarHBondContact NH1-OE1 3.27Å; R132-E218 IonicContact NH2-OE1 3.26Å; R132-E218 PolarHBondContact NH2-OE1 3.3Å
133Y87.5Confident80.2Confident28 Ų2878.2 Ų78.211%0.1136%0.36CS..PPolyproline II helixtrans-67.7137.8175.7-73.5-60.3000111.8W148 R174 H178 L179 A182 D203 K212Y133-W148 HydrophobicContact CD2-CZ3 4.31Å; Y133-W148 VanDerWaalsContact O-CH2 3.24Å; Y133-W148 WeakPolarHBondContact O-CH2 3.49Å; Y133-R174 VanDerWaalsContact CE1-CD 3.46Å; Y133-R174 HydrophobicContact CE1-CG 4.09Å; Y133-H178 HydrophobicContact CE2-CB 4.01Å; Y133-H178 PolarHBondContact OH-CD2 3.49Å; Y133-H178 VanDerWaalsContact OH-CD2 3.32Å; Y133-L179 HydrophobicContact CD2-CD2 3.88Å; Y133-L179 HydrophobicContact CE2-CD2 4.34Å; Y133-L179 HydrophobicContact CG-CD2 4.46Å; Y133-A182 HydrophobicContact CD2-CB 3.75Å; Y133-A182 HydrophobicContact CE2-CB 3.86Å; Y133-D203 VanDerWaalsContact CE1-OD2 3.3Å; Y133-D203 WeakPolarHBondContact CE1-OD2 3.49Å; Y133-D203 PolarHBondContact OH-OD2 3.38Å; Y133-K212 HydrophobicContact CE1-CD 4.08Å; Y133-K212 HydrophobicContact CE2-CD 4.25Å; Y133-K212 HydrophobicContact CE2-CG 4.04Å; Y133-K212 VanDerWaalsContact OH-CG 3.25Å; Y133-K212 WeakPolarHBondContact OH-CG 3.47Å
134H83.4Confident81.4Confident135 Ų13575.7 Ų75.763%0.62535%0.35SS*.PPolyproline II helixtrans-80.4117.5161.6-69.899.4000108.7E130 R174E130-H134 IonicContact OE1-CE1 3.47Å; E130-H134 IonicContact OE2-CE1 2.81Å; E130-H134 PolarHBondContact OE2-CE1 2.83Å; E130-H134 VanDerWaalsContact OE2-CE1 3.26Å; E130-H134 IonicContact OE2-ND1 3.98Å; E130-H134 PolarHBondContact OE2-ND1 2.9Å; E130-H134 VanDerWaalsContact OE2-ND1 3.1Å; H134-R174 PolarHBondContact O-NH1 3.48Å; H134-R174 VanDerWaalsContact O-NH1 3.14Å
135V81.5Confident82.2Confident40 Ų4076.3 Ų76.324%0.24235%0.347CS..  trans-128.2125.9-173.5179.20000110.1L140 W148 L179V135-L140 HydrophobicContact CG1-CD1 3.36Å; V135-L140 HydrophobicContact CG1-CD2 3.84Å; V135-L140 HydrophobicContact CG1-CG 3.52Å; V135-W148 HydrophobicContact CB-CH2 4.31Å; V135-W148 HydrophobicContact CB-CZ2 4.1Å; V135-W148 HydrophobicContact CG2-CD2 4.07Å; V135-W148 HydrophobicContact CG2-CE3 3.8Å; V135-W148 HydrophobicContact CG2-CH2 3.52Å; V135-W148 HydrophobicContact CG2-CZ2 3.8Å; V135-W148 HydrophobicContact CG2-CZ3 3.54Å; V135-L179 HydrophobicContact CG2-CD2 4.27Å
136R80Confident82.9Confident191 Ų19173.2 Ų73.272%0.72133%0.331SS*.  trans-96.8141.7167.9-61.7-177.3177.4-173.90.2109.6E138 D139R136-E138 PolarHBondContact O-N 3.29Å; R136-D139 PolarHBondContact O-N 3.38Å; R136-D139 VanDerWaalsContact O-N 3.09Å
137R73.1Confident83.3Confident195 Ų19570.8 Ų70.874%0.73631%0.314SS*.G310 helixtrans-58.4-33.7-175.5-77.9-174.1172.9-177.3-1.5113.4D139R137-D139 PolarHBondContact O-N 3.1Å
138E76.3Confident83.7Confident172 Ų17273.1 Ų73.180%0.80432%0.323SS*.G310 helixtrans-71.5-16.9-178.9-66.7157.5-150.400113.5R136R136-E138 PolarHBondContact O-N 3.29Å
139D72.4Confident83.8Confident27 Ų2778.2 Ų78.214%0.14434%0.342CS..G310 helixtrans-89.7-10.7-176.2-66.5-23.8000113.2R136 R137 K171 Q172R136-D139 PolarHBondContact O-N 3.38Å; R136-D139 VanDerWaalsContact O-N 3.09Å; R137-D139 PolarHBondContact O-N 3.1Å; D139-K171 WeakPolarHBondContact OD1-CD 3.4Å; D139-K171 WeakPolarHBondContact OD1-CE 3.35Å; D139-K171 IonicContact OD1-NZ 3.57Å; D139-K171 PolarHBondContact OD1-NZ 2.93Å; D139-Q172 PolarHBondContact OD2-NE2 2.93Å
140L82.6Confident84.3Confident5 Ų575 Ų753%0.02633%0.331CS..  trans-107.6130.9-172.4-63.1-164.6000112.9V135 H144 R145 W148 D170 L179V135-L140 HydrophobicContact CG1-CD1 3.36Å; V135-L140 HydrophobicContact CG1-CD2 3.84Å; V135-L140 HydrophobicContact CG1-CG 3.52Å; L140-H144 HydrophobicContact CB-CB 3.95Å; L140-H144 HydrophobicContact CD1-CB 4.35Å; L140-H144 HydrophobicContact CD2-CB 3.93Å; L140-H144 HydrophobicContact CG-CB 4.29Å; L140-R145 HydrophobicContact CB-CG 3.6Å; L140-R145 HydrophobicContact CD1-CG 4.11Å; L140-R145 PolarHBondContact O-NH1 3.33Å; L140-W148 HydrophobicContact CD1-CB 4.13Å; L140-W148 HydrophobicContact CD1-CG 4.38Å; L140-D170 HydrophobicContact CD2-CB 4.48Å; L140-L179 HydrophobicContact CD1-CD1 4.23Å; L140-L179 HydrophobicContact CD2-CD1 3.88Å
141D86.7Confident84.5Confident61 Ų6179 Ų7933%0.32635%0.346SS..  trans-71.8173.1166.3-71.1-39.1000112.1L143 H144 R145 K168D141-L143 VanDerWaalsContact C-N 3.33Å; D141-L143 PolarHBondContact O-N 3.36Å; D141-H144 PolarHBondContact O-N 3.45Å; D141-R145 VanDerWaalsContact O-CB 3.32Å; D141-R145 WeakPolarHBondContact O-CB 3.4Å; D141-R145 WeakPolarHBondContact O-CG 3.49Å; D141-R145 PolarHBondContact O-N 3.45Å; D141-K168 IonicContact OD1-NZ 3.49Å; D141-K168 VanDerWaalsContact OD2-CD 3.27Å; D141-K168 WeakPolarHBondContact OD2-CD 3.33Å; D141-K168 WeakPolarHBondContact OD2-CE 3.34Å; D141-K168 IonicContact OD2-NZ 3.58Å; D141-K168 PolarHBondContact OD2-NZ 2.66Å
142K88.2Confident84.8Confident146 Ų14677.7 Ų77.764%0.63534%0.337SS*.Hα-helixtrans-53.4-46.1-179.9-66.8-179.4-177.9176.10112.7R145 A146 M160K142-R145 WeakPolarHBondContact O-CB 3.47Å; K142-R145 PolarHBondContact O-N 3.48Å; K142-A146 PolarHBondContact O-N 3.23Å; K142-M160 HydrophobicContact CB-SD 4.44Å
143L90.2Very high84.7Confident3 Ų375.1 Ų75.12%0.01634%0.337CS..Hα-helixtrans-68.9-43.7-179.8-178.562.9000112D141 R145 A146 A147 L157 L161 T164 A176D141-L143 VanDerWaalsContact C-N 3.33Å; D141-L143 PolarHBondContact O-N 3.36Å; L143-R145 VanDerWaalsContact C-N 3.29Å; L143-R145 PolarHBondContact O-N 3.2Å; L143-A146 PolarHBondContact O-N 3.31Å; L143-A147 WeakPolarHBondContact O-CB 3.45Å; L143-A147 PolarHBondContact O-N 3.16Å; L143-L157 HydrophobicContact CD1-CD1 3.91Å; L143-L161 HydrophobicContact CD1-CD2 3.62Å; L143-L161 HydrophobicContact CD1-CG 4.18Å; L143-L161 HydrophobicContact CD2-CD2 3.74Å; L143-L161 HydrophobicContact CG-CD2 4.34Å; L143-T164 HydrophobicContact CB-CG2 4.3Å; L143-T164 HydrophobicContact CD2-CG2 4.37Å; L143-A176 HydrophobicContact CD2-CB 3.92Å; L143-A176 HydrophobicContact CG-CB 3.76Å
144H91.6Very high84.5Confident3 Ų379.6 Ų79.61%0.01435%0.353CS..Hα-helixtrans-60.3-40.5175.7-65.298.8000112.1L140 D141 A147 W148 K168 R174 L179L140-H144 HydrophobicContact CB-CB 3.95Å; L140-H144 HydrophobicContact CD1-CB 4.35Å; L140-H144 HydrophobicContact CD2-CB 3.93Å; L140-H144 HydrophobicContact CG-CB 4.29Å; D141-H144 PolarHBondContact O-N 3.45Å; H144-A147 PolarHBondContact O-N 3.47Å; H144-W148 WeakPolarHBondContact O-CB 3.41Å; H144-W148 PolarHBondContact O-N 3.11Å; H144-K168 PolarHBondContact CE1-O 2.93Å; H144-K168 PolarHBondContact NE2-O 3.17Å; H144-R174 PolarHBondContact NE2-O 2.97Å; H144-R174 VanDerWaalsContact NE2-O 3.14Å; H144-L179 HydrophobicContact CB-CD1 3.53Å; H144-L179 WeakPolarHBondContact O-CD1 3.47Å
145R89.8Confident84.6Confident88 Ų8880.2 Ų80.233%0.33235%0.354SS..Hα-helixtrans-59.8-49.3173.5-85-165.6-56.7-117.511112L140 D141 K142 L143 A147 W148 W149L140-R145 HydrophobicContact CB-CG 3.6Å; L140-R145 HydrophobicContact CD1-CG 4.11Å; L140-R145 PolarHBondContact O-NH1 3.33Å; D141-R145 VanDerWaalsContact O-CB 3.32Å; D141-R145 WeakPolarHBondContact O-CB 3.4Å; D141-R145 WeakPolarHBondContact O-CG 3.49Å; D141-R145 PolarHBondContact O-N 3.45Å; K142-R145 WeakPolarHBondContact O-CB 3.47Å; K142-R145 PolarHBondContact O-N 3.48Å; L143-R145 VanDerWaalsContact C-N 3.29Å; L143-R145 PolarHBondContact O-N 3.2Å; R145-A147 VanDerWaalsContact C-N 3.31Å; R145-A147 PolarHBondContact O-N 3.05Å; R145-W148 PolarHBondContact O-N 3.3Å; R145-W149 HydrophobicContact CB-CE3 3.81Å; R145-W149 HydrophobicContact CB-CH2 4.08Å; R145-W149 HydrophobicContact CB-CZ3 3.28Å; R145-W149 VanDerWaalsContact CD-CZ3 3.49Å; R145-W149 HydrophobicContact CG-CE3 4.31Å; R145-W149 HydrophobicContact CG-CH2 3.64Å; R145-W149 HydrophobicContact CG-CZ3 3.37Å; R145-W149 PolarHBondContact O-N 2.92Å
146A90.7Very high84.7Confident4 Ų481.4 Ų81.43%0.03336%0.359CS..Hα-helixtrans-58.2-45.2176.100000111.7K142 L143 W148 W149 G150 V152 L157 M160K142-A146 PolarHBondContact O-N 3.23Å; L143-A146 PolarHBondContact O-N 3.31Å; A146-W148 PolarHBondContact O-N 2.95Å; A146-W149 PolarHBondContact O-N 3.33Å; A146-G150 PolarHBondContact O-N 2.86Å; A146-V152 HydrophobicContact CB-CB 4.27Å; A146-V152 HydrophobicContact CB-CG2 3.64Å; A146-L157 HydrophobicContact CB-CD1 3.82Å; A146-M160 HydrophobicContact CB-SD 4.13Å
147A92.2Very high84.8Confident0 Ų072.5 Ų72.50%033%0.326CS..Hα-helixtrans-65.4-34.2177.300000113.9L143 H144 R145 A176 L179 A180 N185 V188L143-A147 WeakPolarHBondContact O-CB 3.45Å; L143-A147 PolarHBondContact O-N 3.16Å; H144-A147 PolarHBondContact O-N 3.47Å; R145-A147 VanDerWaalsContact C-N 3.31Å; R145-A147 PolarHBondContact O-N 3.05Å; A147-A176 HydrophobicContact CB-CB 3.93Å; A147-A176 VanDerWaalsContact CB-O 3.26Å; A147-A176 WeakPolarHBondContact CB-O 3.48Å; A147-L179 HydrophobicContact CB-CB 4.28Å; A147-A180 HydrophobicContact CB-CB 4.03Å; A147-A180 VanDerWaalsContact O-CA 3.26Å; A147-A180 WeakPolarHBondContact O-CA 3.4Å; A147-N185 PolarHBondContact O-ND2 3.22Å; A147-V188 HydrophobicContact CB-CG1 4.08Å
148W90.9Very high85.3Confident49 Ų4965.3 Ų65.319%0.18630%0.302CS..Hα-helixtrans-69.9-45.9176.9-178.8-100.1000112.3Y133 V135 L140 H144 R145 A146 L179 N183 N185Y133-W148 HydrophobicContact CD2-CZ3 4.31Å; Y133-W148 VanDerWaalsContact O-CH2 3.24Å; Y133-W148 WeakPolarHBondContact O-CH2 3.49Å; V135-W148 HydrophobicContact CB-CH2 4.31Å; V135-W148 HydrophobicContact CB-CZ2 4.1Å; V135-W148 HydrophobicContact CG2-CD2 4.07Å; V135-W148 HydrophobicContact CG2-CE3 3.8Å; V135-W148 HydrophobicContact CG2-CH2 3.52Å; V135-W148 HydrophobicContact CG2-CZ2 3.8Å; V135-W148 HydrophobicContact CG2-CZ3 3.54Å; L140-W148 HydrophobicContact CD1-CB 4.13Å; L140-W148 HydrophobicContact CD1-CG 4.38Å; H144-W148 WeakPolarHBondContact O-CB 3.41Å; H144-W148 PolarHBondContact O-N 3.11Å; R145-W148 PolarHBondContact O-N 3.3Å; A146-W148 PolarHBondContact O-N 2.95Å; W148-L179 HydrophobicContact CB-CB 4.49Å; W148-L179 HydrophobicContact CE3-CB 4.13Å; W148-L179 HydrophobicContact CE3-CD2 3.67Å; W148-L179 HydrophobicContact CE3-CG 4.4Å; W148-L179 HydrophobicContact CZ3-CD2 4.02Å; W148-N183 WeakPolarHBondContact CZ3-OD1 3.31Å; W148-N183 PolarHBondContact O-ND2 2.95Å; W148-N185 PolarHBondContact O-ND2 3.31Å
149W88.1Confident85.6Confident117 Ų11761 Ų6144%0.44329%0.287SS..Hα-helixtrans-85.3-27.8-175.5-71.4-61000114.5R145 A146 K151R145-W149 HydrophobicContact CB-CE3 3.81Å; R145-W149 HydrophobicContact CB-CH2 4.08Å; R145-W149 HydrophobicContact CB-CZ3 3.28Å; R145-W149 VanDerWaalsContact CD-CZ3 3.49Å; R145-W149 HydrophobicContact CG-CE3 4.31Å; R145-W149 HydrophobicContact CG-CH2 3.64Å; R145-W149 HydrophobicContact CG-CZ3 3.37Å; R145-W149 PolarHBondContact O-N 2.92Å; A146-W149 PolarHBondContact O-N 3.33Å; W149-K151 PolarHBondContact O-N 3.11Å
150G86.6Confident86.1Confident19 Ų1962.4 Ų62.420%0.19629%0.293CS..  trans69.3-17-178.100000115.2A146 V152 N185A146-G150 PolarHBondContact O-N 2.86Å; G150-V152 PolarHBondContact O-N 3.25Å; G150-N185 VanDerWaalsContact CA-CG 3.44Å; G150-N185 WeakPolarHBondContact CA-OD1 3.35Å; G150-N185 PolarHBondContact N-ND2 2.96Å
151K80.6Confident86.1Confident194 Ų19463 Ų6384%0.84330%0.296SS*.  trans-83.250-179.3-61.2-176.5-178.1-176.30112.8W149W149-K151 PolarHBondContact O-N 3.11Å
152V81.6Confident85.8Confident32 Ų3269.4 Ų69.419%0.19432%0.316CS..SBendtrans-121.2123.9177.3-176.20000108.6A146 G150 R154 D156 L157 M160A146-V152 HydrophobicContact CB-CB 4.27Å; A146-V152 HydrophobicContact CB-CG2 3.64Å; G150-V152 PolarHBondContact O-N 3.25Å; V152-R154 PolarHBondContact O-N 3.18Å; V152-D156 HydrophobicContact CG1-CB 3.88Å; V152-L157 HydrophobicContact CG1-CB 4.48Å; V152-M160 HydrophobicContact CG1-CE 4.36Å
153P85.4Confident85.2Confident69 Ų6969.1 Ų69.145%0.44832%0.321SS..  trans-52.5135.8176.1-2634.4000111.1K155 D156 L157P153-K155 HydrophobicContact CB-CG 4.04Å; P153-K155 PolarHBondContact O-N 3.4Å; P153-D156 WeakPolarHBondContact CD-OD2 3.16Å; P153-D156 WeakPolarHBondContact CG-OD2 3.39Å; P153-D156 PolarHBondContact O-N 2.96Å; P153-L157 PolarHBondContact O-N 3.35Å
154R82.6Confident84.8Confident121 Ų12170.9 Ų70.946%0.45733%0.333SS..Hα-helixtrans-49.9-37.9-177.4-174.5176.8176.385.6-2.4113.2V152 D156 L157 I158 D194V152-R154 PolarHBondContact O-N 3.18Å; R154-D156 PolarHBondContact O-N 3.21Å; R154-L157 PolarHBondContact O-N 3Å; R154-I158 HydrophobicContact CG-CD1 4.14Å; R154-I158 VanDerWaalsContact O-CG1 3.31Å; R154-I158 WeakPolarHBondContact O-CG1 3.31Å; R154-I158 PolarHBondContact O-N 3.46Å; R154-D194 IonicContact NH2-OD2 2.69Å
155K84.6Confident84.5Confident149 Ų14975.6 Ų75.665%0.64836%0.358SS*.Hα-helixtrans-58.9-42.8176.462.1176-172.3177.40112.9P153 I158 V159P153-K155 HydrophobicContact CB-CG 4.04Å; P153-K155 PolarHBondContact O-N 3.4Å; K155-I158 PolarHBondContact O-N 2.93Å; K155-V159 WeakPolarHBondContact O-CG2 3.49Å; K155-V159 PolarHBondContact O-N 3.42Å; K155-V159 VanDerWaalsContact O-N 3.15Å
156D84.1Confident84.3Confident64 Ų6472.7 Ų72.734%0.34235%0.348SS..Hα-helixtrans-73.9-36.1-176.7-58.4-28.8000109.6V152 P153 R154 V159 M160V152-D156 HydrophobicContact CG1-CB 3.88Å; P153-D156 WeakPolarHBondContact CD-OD2 3.16Å; P153-D156 WeakPolarHBondContact CG-OD2 3.39Å; P153-D156 PolarHBondContact O-N 2.96Å; R154-D156 PolarHBondContact O-N 3.21Å; D156-V159 PolarHBondContact O-N 2.72Å; D156-M160 WeakPolarHBondContact O-CG 3.43Å; D156-M160 PolarHBondContact O-N 3.45Å
157L82.9Confident84.2Confident4 Ų474.3 Ų74.32%0.02136%0.356CS..Hα-helixtrans-63.8-41.4173.9-165.865.8000111.8L143 A146 V152 P153 R154 V159 M160 L161 V188 L191L143-L157 HydrophobicContact CD1-CD1 3.91Å; A146-L157 HydrophobicContact CB-CD1 3.82Å; V152-L157 HydrophobicContact CG1-CB 4.48Å; P153-L157 PolarHBondContact O-N 3.35Å; R154-L157 PolarHBondContact O-N 3Å; L157-V159 VanDerWaalsContact C-N 3.32Å; L157-V159 PolarHBondContact O-N 3Å; L157-M160 PolarHBondContact O-N 3.07Å; L157-L161 HydrophobicContact CG-CD1 4.3Å; L157-L161 WeakPolarHBondContact O-CG 3.47Å; L157-L161 PolarHBondContact O-N 3.15Å; L157-V188 HydrophobicContact CD2-CB 4.23Å; L157-V188 HydrophobicContact CD2-CG1 3.99Å; L157-V188 HydrophobicContact CD2-CG2 3.95Å; L157-L191 HydrophobicContact CB-CD2 3.93Å; L157-L191 HydrophobicContact CD2-CB 4.39Å; L157-L191 HydrophobicContact CD2-CD2 3.37Å; L157-L191 HydrophobicContact CD2-CG 4.48Å; L157-L191 HydrophobicContact CG-CD2 3.54Å
158I83.2Confident84.2Confident45 Ų4578.7 Ų78.723%0.23138%0.376CS..Hα-helixtrans-61-41.8174.6-70.4165.1000111.3R154 K155 L161 R162 L191R154-I158 HydrophobicContact CG-CD1 4.14Å; R154-I158 VanDerWaalsContact O-CG1 3.31Å; R154-I158 WeakPolarHBondContact O-CG1 3.31Å; R154-I158 PolarHBondContact O-N 3.46Å; K155-I158 PolarHBondContact O-N 2.93Å; I158-L161 PolarHBondContact O-N 3.48Å; I158-R162 PolarHBondContact O-N 3.33Å; I158-L191 HydrophobicContact CG1-CD1 4.03Å; I158-L191 HydrophobicContact CG1-CD2 4.01Å
159V82.6Confident84.2Confident82 Ų8281.9 Ų81.950%0.49739%0.388SS..Hα-helixtrans-63.4-47.1176.8174.10000110.3K155 D156 L157 L161 R162K155-V159 WeakPolarHBondContact O-CG2 3.49Å; K155-V159 PolarHBondContact O-N 3.42Å; K155-V159 VanDerWaalsContact O-N 3.15Å; D156-V159 PolarHBondContact O-N 2.72Å; L157-V159 VanDerWaalsContact C-N 3.32Å; L157-V159 PolarHBondContact O-N 3Å; V159-L161 PolarHBondContact O-N 2.85Å; V159-R162 WeakPolarHBondContact O-CB 3.43Å; V159-R162 PolarHBondContact O-N 3.47Å
160M83.4Confident84.4Confident55 Ų5577 Ų7727%0.27137%0.37SS..Hα-helixtrans-57.9-37.2177.3-69.3-177.3-162.900112.9K142 A146 V152 D156 L157 R162 D163 T164K142-M160 HydrophobicContact CB-SD 4.44Å; A146-M160 HydrophobicContact CB-SD 4.13Å; V152-M160 HydrophobicContact CG1-CE 4.36Å; D156-M160 WeakPolarHBondContact O-CG 3.43Å; D156-M160 PolarHBondContact O-N 3.45Å; L157-M160 PolarHBondContact O-N 3.07Å; M160-R162 VanDerWaalsContact C-N 3.29Å; M160-R162 PolarHBondContact O-N 3.36Å; M160-D163 PolarHBondContact O-N 3.44Å; M160-T164 WeakPolarHBondContact O-CB 3.35Å; M160-T164 PolarHBondContact O-N 3.22Å; M160-T164 VanDerWaalsContact O-N 3.16Å; M160-T164 PolarHBondContact O-OG1 3Å
161L82.3Confident84.6Confident17 Ų1782.7 Ų82.79%0.08939%0.389CS..Hα-helixtrans-74.9-13.1179.4-67.8169.4000113.9L143 L157 I158 V159 M166 L191 L192L143-L161 HydrophobicContact CD1-CD2 3.62Å; L143-L161 HydrophobicContact CD1-CG 4.18Å; L143-L161 HydrophobicContact CD2-CD2 3.74Å; L143-L161 HydrophobicContact CG-CD2 4.34Å; L157-L161 HydrophobicContact CG-CD1 4.3Å; L157-L161 WeakPolarHBondContact O-CG 3.47Å; L157-L161 PolarHBondContact O-N 3.15Å; I158-L161 PolarHBondContact O-N 3.48Å; V159-L161 PolarHBondContact O-N 2.85Å; L161-M166 HydrophobicContact CD1-CE 4.45Å; L161-M166 HydrophobicContact CD2-CB 4.46Å; L161-M166 HydrophobicContact CD2-CE 3.76Å; L161-M166 HydrophobicContact CD2-CG 3.57Å; L161-M166 HydrophobicContact CD2-SD 3.89Å; L161-L191 HydrophobicContact CD1-CD2 3.42Å; L161-L191 VanDerWaalsContact CD1-CD2 3.42Å; L161-L191 HydrophobicContact CD1-CG 3.74Å; L161-L192 HydrophobicContact CD2-CD2 3.77Å
162R80.6Confident85Confident196 Ų19676 Ų7674%0.7436%0.361SS*.Hα-helixtrans-74.8-39.2172.1-72.3-177.9179.8-141.60.8111.8I158 V159 M160I158-R162 PolarHBondContact O-N 3.33Å; V159-R162 WeakPolarHBondContact O-CB 3.43Å; V159-R162 PolarHBondContact O-N 3.47Å; M160-R162 VanDerWaalsContact C-N 3.29Å; M160-R162 PolarHBondContact O-N 3.36Å
163D75Confident85.6Confident140 Ų14079.3 Ų79.375%0.74937%0.373SS*.Hα-helixtrans-99.7-10.4-170.4-55.9-29.5000113M160M160-D163 PolarHBondContact O-N 3.44Å
164T81.4Confident86.1Confident41 Ų4176.3 Ų76.325%0.25235%0.353SS..SBendtrans-118.8135.6-174.1-44.50000111.2L143 M160 M166L143-T164 HydrophobicContact CB-CG2 4.3Å; L143-T164 HydrophobicContact CD2-CG2 4.37Å; M160-T164 WeakPolarHBondContact O-CB 3.35Å; M160-T164 PolarHBondContact O-N 3.22Å; M160-T164 VanDerWaalsContact O-N 3.16Å; M160-T164 PolarHBondContact O-OG1 3Å; T164-M166 PolarHBondContact O-N 3.14Å; T164-M166 VanDerWaalsContact O-N 3.17Å
165D86Confident86.7Confident102 Ų10270.6 Ų70.655%0.54533%0.331SS..  trans-61.2117166.1178.76.1000110.2N167 K168D165-N167 PolarHBondContact O-N 2.84Å; D165-N167 PolarHBondContact OD1-N 3.45Å; D165-K168 HydrophobicContact CB-CB 4.3Å; D165-K168 WeakPolarHBondContact O-CB 3.24Å; D165-K168 PolarHBondContact O-N 3.04Å; D165-K168 VanDerWaalsContact O-N 3.1Å
166M85.2Confident87.2Confident27 Ų2763.5 Ų63.513%0.13330%0.301CS..THydrogen-bonded Turntrans-63.8-27-178.9-60.6-171.452.700113.3L161 T164 K168 L192 R195 C197L161-M166 HydrophobicContact CD1-CE 4.45Å; L161-M166 HydrophobicContact CD2-CB 4.46Å; L161-M166 HydrophobicContact CD2-CE 3.76Å; L161-M166 HydrophobicContact CD2-CG 3.57Å; L161-M166 HydrophobicContact CD2-SD 3.89Å; T164-M166 PolarHBondContact O-N 3.14Å; T164-M166 VanDerWaalsContact O-N 3.17Å; M166-K168 VanDerWaalsContact C-N 3.32Å; M166-L192 HydrophobicContact CE-CB 4.23Å; M166-L192 HydrophobicContact CE-CD2 3.48Å; M166-L192 VanDerWaalsContact CE-CD2 3.48Å; M166-L192 HydrophobicContact CE-CG 4.44Å; M166-R195 HydrophobicContact CE-CB 3.33Å; M166-R195 HydrophobicContact CE-CG 4.02Å; M166-R195 HydrophobicContact SD-CB 3.45Å; M166-R195 WeakPolarHBondContact SD-CB 3.31Å; M166-R195 HydrophobicContact SD-CG 4.04Å; M166-C197 HydrophobicContact CE-CB 4.12Å
167N89.3Confident87.8Confident37 Ų3760.7 Ų60.720%0.19829%0.285CS..THydrogen-bonded Turntrans-94.26.6179.8-56.5-53.1000111.9D165 R169 Q198D165-N167 PolarHBondContact O-N 2.84Å; D165-N167 PolarHBondContact OD1-N 3.45Å; N167-R169 PolarHBondContact O-N 3.14Å; N167-Q198 PolarHBondContact OD1-N 2.97Å
168K91.1Very high88.5Confident93 Ų9360.5 Ų60.540%0.40428%0.284SS..  trans-55.6135.1176.6-169.6176.5-173.8-166.60110.3D141 H144 D165 M166D141-K168 IonicContact OD1-NZ 3.49Å; D141-K168 VanDerWaalsContact OD2-CD 3.27Å; D141-K168 WeakPolarHBondContact OD2-CD 3.33Å; D141-K168 WeakPolarHBondContact OD2-CE 3.34Å; D141-K168 IonicContact OD2-NZ 3.58Å; D141-K168 PolarHBondContact OD2-NZ 2.66Å; H144-K168 PolarHBondContact CE1-O 2.93Å; H144-K168 PolarHBondContact NE2-O 3.17Å; D165-K168 HydrophobicContact CB-CB 4.3Å; D165-K168 WeakPolarHBondContact O-CB 3.24Å; D165-K168 PolarHBondContact O-N 3.04Å; D165-K168 VanDerWaalsContact O-N 3.1Å; M166-K168 VanDerWaalsContact C-N 3.32Å
169R92.4Very high89Confident116 Ų11658.4 Ų58.444%0.43827%0.273SS..  trans-103.3137.7-176.9-63172.579.2-176.718.1110N167 K173 R174 T175 L202N167-R169 PolarHBondContact O-N 3.14Å; R169-K173 PolarHBondContact NE-O 2.89Å; R169-K173 VanDerWaalsContact NH2-CB 3.34Å; R169-R174 WeakPolarHBondContact CA-O 3.38Å; R169-T175 HydrophobicContact CG-CG2 4.2Å; R169-L202 PolarHBondContact NH2-O 2.99Å
170D91.1Very high89.7Confident14 Ų1454.5 Ų54.58%0.07525%0.25CC..  trans-77.4-176.8169.572.16.8000111.7L140 Q172 K173 R174L140-D170 HydrophobicContact CD2-CB 4.48Å; D170-Q172 PolarHBondContact O-N 2.72Å; D170-Q172 VanDerWaalsContact O-N 3.15Å; D170-Q172 VanDerWaalsContact OD1-C 3.22Å; D170-Q172 VanDerWaalsContact OD1-CA 3.32Å; D170-Q172 WeakPolarHBondContact OD1-CA 3.45Å; D170-Q172 PolarHBondContact OD1-N 3.15Å; D170-K173 WeakPolarHBondContact O-CA 3.43Å; D170-K173 PolarHBondContact O-N 3.18Å; D170-K173 PolarHBondContact OD1-N 3.39Å; D170-K173 VanDerWaalsContact OD1-N 3.09Å; D170-R174 PolarHBondContact N-O 3.02Å; D170-R174 WeakPolarHBondContact OD1-CB 3.35Å; D170-R174 PolarHBondContact OD1-N 3.35Å; D170-R174 IonicContact OD1-NE 2.79Å; D170-R174 IonicContact OD2-CZ 2.66Å; D170-R174 IonicContact OD2-NE 3.1Å; D170-R174 PolarHBondContact OD2-NE 2.81Å; D170-R174 IonicContact OD2-NH2 3.78Å; D170-R174 PolarHBondContact OD2-NH2 3.28Å
171K90.3Very high90.3Very high139 Ų13951.9 Ų51.960%0.60424%0.237SC*.THydrogen-bonded Turntrans-61.1-23.3179.9-61.3-178.4-167.8159.50113.1D139 K173D139-K171 WeakPolarHBondContact OD1-CD 3.4Å; D139-K171 WeakPolarHBondContact OD1-CE 3.35Å; D139-K171 IonicContact OD1-NZ 3.57Å; D139-K171 PolarHBondContact OD1-NZ 2.93Å; K171-K173 VanDerWaalsContact C-N 3.29Å
172Q90.7Very high90.9Very high53 Ų5351 Ų5125%0.24823%0.233CC..THydrogen-bonded Turntrans-95.715.4177.4-66.178.46.700112D139 D170 R174 N204D139-Q172 PolarHBondContact OD2-NE2 2.93Å; D170-Q172 PolarHBondContact O-N 2.72Å; D170-Q172 VanDerWaalsContact O-N 3.15Å; D170-Q172 VanDerWaalsContact OD1-C 3.22Å; D170-Q172 VanDerWaalsContact OD1-CA 3.32Å; D170-Q172 WeakPolarHBondContact OD1-CA 3.45Å; D170-Q172 PolarHBondContact OD1-N 3.15Å; Q172-R174 HydrophobicContact CB-CG 4.15Å; Q172-R174 PolarHBondContact O-N 3.31Å; Q172-N204 VanDerWaalsContact C-CG 3.47Å; Q172-N204 WeakPolarHBondContact CA-ND2 3.19Å; Q172-N204 WeakPolarHBondContact O-CB 3.4Å; Q172-N204 VanDerWaalsContact O-CG 3.26Å; Q172-N204 PolarHBondContact O-N 3.26Å; Q172-N204 PolarHBondContact O-OD1 2.85Å
173K94.1Very high91.6Very high102 Ų10243.4 Ų43.444%0.44321%0.207SC..SBendtrans64.213.2179.5-73.6-178.5-161.5176.50114.7R169 D170 K171 N204R169-K173 PolarHBondContact NE-O 2.89Å; R169-K173 VanDerWaalsContact NH2-CB 3.34Å; D170-K173 WeakPolarHBondContact O-CA 3.43Å; D170-K173 PolarHBondContact O-N 3.18Å; D170-K173 PolarHBondContact OD1-N 3.39Å; D170-K173 VanDerWaalsContact OD1-N 3.09Å; K171-K173 VanDerWaalsContact C-N 3.29Å; K173-N204 VanDerWaalsContact CB-OD1 3.28Å; K173-N204 WeakPolarHBondContact CB-OD1 3.34Å; K173-N204 WeakPolarHBondContact CD-OD1 3.48Å; K173-N204 WeakPolarHBondContact CE-OD1 3.21Å; K173-N204 WeakPolarHBondContact CG-OD1 3.32Å
174R94.9Very high92.5Very high5 Ų537.8 Ų37.82%0.01918%0.181CC..  trans-83.4141.3-178-54.4173.5-61.9-153.8-1.4110.6Y133 H134 H144 R169 D170 Q172 H178 D203Y133-R174 VanDerWaalsContact CE1-CD 3.46Å; Y133-R174 HydrophobicContact CE1-CG 4.09Å; H134-R174 PolarHBondContact O-NH1 3.48Å; H134-R174 VanDerWaalsContact O-NH1 3.14Å; H144-R174 PolarHBondContact NE2-O 2.97Å; H144-R174 VanDerWaalsContact NE2-O 3.14Å; R169-R174 WeakPolarHBondContact CA-O 3.38Å; D170-R174 PolarHBondContact N-O 3.02Å; D170-R174 WeakPolarHBondContact OD1-CB 3.35Å; D170-R174 PolarHBondContact OD1-N 3.35Å; D170-R174 IonicContact OD1-NE 2.79Å; D170-R174 IonicContact OD2-CZ 2.66Å; D170-R174 IonicContact OD2-NE 3.1Å; D170-R174 PolarHBondContact OD2-NE 2.81Å; D170-R174 IonicContact OD2-NH2 3.78Å; D170-R174 PolarHBondContact OD2-NH2 3.28Å; Q172-R174 HydrophobicContact CB-CG 4.15Å; Q172-R174 PolarHBondContact O-N 3.31Å; R174-H178 HydrophobicContact CB-CB 4.12Å; R174-D203 HydrophobicContact CG-CB 3.93Å
175T95.4Very high93.2Very high2 Ų237.4 Ų37.41%0.01218%0.178CC..  trans-91.6169.4169.865.40000110.8R169 L177 H178 L179 V201R169-T175 HydrophobicContact CG-CG2 4.2Å; T175-L177 PolarHBondContact O-N 3.39Å; T175-L177 PolarHBondContact OG1-N 3.19Å; T175-H178 PolarHBondContact N-ND1 2.85Å; T175-H178 WeakPolarHBondContact O-CB 3.3Å; T175-H178 PolarHBondContact O-N 3.46Å; T175-H178 VanDerWaalsContact O-N 3.15Å; T175-H178 PolarHBondContact OG1-ND1 2.94Å; T175-L179 PolarHBondContact O-N 3.21Å; T175-V201 HydrophobicContact CG2-CB 3.97Å; T175-V201 HydrophobicContact CG2-CG1 3.64Å; T175-V201 HydrophobicContact CG2-CG2 4.23Å
176A94.8Very high93.6Very high0 Ų033.6 Ų33.60%016%0.159CC..Hα-helixtrans-55.2-36.3170.600000111.9L143 A147 H178 L179 A180 L192L143-A176 HydrophobicContact CD2-CB 3.92Å; L143-A176 HydrophobicContact CG-CB 3.76Å; A147-A176 HydrophobicContact CB-CB 3.93Å; A147-A176 VanDerWaalsContact CB-O 3.26Å; A147-A176 WeakPolarHBondContact CB-O 3.48Å; A176-H178 PolarHBondContact O-N 3.24Å; A176-L179 PolarHBondContact O-N 3.01Å; A176-A180 WeakPolarHBondContact O-CB 3.43Å; A176-A180 PolarHBondContact O-N 3.27Å; A176-L192 HydrophobicContact CB-CD1 4.05Å; A176-L192 HydrophobicContact CB-CD2 4.39Å
177L96.9Very high93.9Very high4 Ų438.9 Ų38.92%0.02118%0.184CC..Hα-helixtrans-61.4-40.9177.6-170.867.1000112.3T175 L179 S181 V189 L192 L199 A209 L225T175-L177 PolarHBondContact O-N 3.39Å; T175-L177 PolarHBondContact OG1-N 3.19Å; L177-L179 PolarHBondContact O-N 3.12Å; L177-S181 WeakPolarHBondContact O-CB 3.34Å; L177-S181 PolarHBondContact O-N 2.91Å; L177-S181 PolarHBondContact O-OG 3.24Å; L177-V189 HydrophobicContact CD1-CG1 4.11Å; L177-V189 HydrophobicContact CD1-CG2 4.49Å; L177-L192 HydrophobicContact CB-CD1 4.14Å; L177-L192 HydrophobicContact CD1-CB 4.16Å; L177-L192 HydrophobicContact CD1-CD1 4.07Å; L177-L199 HydrophobicContact CD2-CD2 4.02Å; L177-A209 HydrophobicContact CB-CB 4.36Å; L177-A209 HydrophobicContact CD2-CB 3.88Å; L177-A209 HydrophobicContact CG-CB 3.73Å; L177-L225 HydrophobicContact CD1-CD2 4.11Å; L177-L225 HydrophobicContact CD2-CD2 3.93Å; L177-L225 HydrophobicContact CG-CD2 4.24Å
178H96.9Very high94.1Very high1 Ų137.3 Ų37.31%0.00518%0.175CC..Hα-helixtrans-59.9-46.7176.7-72.684.7000111.7Y133 R174 T175 A176 A182 V201 R207 A209Y133-H178 HydrophobicContact CE2-CB 4.01Å; Y133-H178 PolarHBondContact OH-CD2 3.49Å; Y133-H178 VanDerWaalsContact OH-CD2 3.32Å; R174-H178 HydrophobicContact CB-CB 4.12Å; T175-H178 PolarHBondContact N-ND1 2.85Å; T175-H178 WeakPolarHBondContact O-CB 3.3Å; T175-H178 PolarHBondContact O-N 3.46Å; T175-H178 VanDerWaalsContact O-N 3.15Å; T175-H178 PolarHBondContact OG1-ND1 2.94Å; A176-H178 PolarHBondContact O-N 3.24Å; H178-A182 VanDerWaalsContact O-CB 3.26Å; H178-A182 WeakPolarHBondContact O-CB 3.5Å; H178-A182 PolarHBondContact O-N 3.18Å; H178-V201 PolarHBondContact CE1-O 2.98Å; H178-V201 PolarHBondContact NE2-O 3.14Å; H178-V201 VanDerWaalsContact NE2-O 3.11Å; H178-R207 PolarHBondContact NE2-O 3.44Å; H178-R207 VanDerWaalsContact NE2-O 3.1Å; H178-A209 PolarHBondContact NE2-N 3.25Å
179L95.1Very high94.4Very high0 Ų032.9 Ų32.90%016%0.156CC..Hα-helixtrans-69.5-42.2-177-62.1175.4000111.8Y133 V135 L140 H144 A147 W148 T175 A176 L177 N183Y133-L179 HydrophobicContact CD2-CD2 3.88Å; Y133-L179 HydrophobicContact CE2-CD2 4.34Å; Y133-L179 HydrophobicContact CG-CD2 4.46Å; V135-L179 HydrophobicContact CG2-CD2 4.27Å; L140-L179 HydrophobicContact CD1-CD1 4.23Å; L140-L179 HydrophobicContact CD2-CD1 3.88Å; H144-L179 HydrophobicContact CB-CD1 3.53Å; H144-L179 WeakPolarHBondContact O-CD1 3.47Å; A147-L179 HydrophobicContact CB-CB 4.28Å; W148-L179 HydrophobicContact CB-CB 4.49Å; W148-L179 HydrophobicContact CE3-CB 4.13Å; W148-L179 HydrophobicContact CE3-CD2 3.67Å; W148-L179 HydrophobicContact CE3-CG 4.4Å; W148-L179 HydrophobicContact CZ3-CD2 4.02Å; T175-L179 PolarHBondContact O-N 3.21Å; A176-L179 PolarHBondContact O-N 3.01Å; L177-L179 PolarHBondContact O-N 3.12Å; L179-N183 PolarHBondContact O-N 3.1Å
180A95.9Very high94.5Very high0 Ų030.4 Ų30.40%015%0.149CC..Hα-helixtrans-63.9-45176.400000111.6A147 A176 N183 G184 N185 V188 V189A147-A180 HydrophobicContact CB-CB 4.03Å; A147-A180 VanDerWaalsContact O-CA 3.26Å; A147-A180 WeakPolarHBondContact O-CA 3.4Å; A176-A180 WeakPolarHBondContact O-CB 3.43Å; A176-A180 PolarHBondContact O-N 3.27Å; A180-N183 PolarHBondContact O-N 2.89Å; A180-G184 PolarHBondContact O-N 3.45Å; A180-G184 VanDerWaalsContact O-N 3.15Å; A180-N185 HydrophobicContact CB-CB 4.27Å; A180-N185 PolarHBondContact O-N 3.03Å; A180-V188 HydrophobicContact CB-CB 4.02Å; A180-V188 HydrophobicContact CB-CG1 3.85Å; A180-V189 HydrophobicContact CB-CG2 3.68Å
181S96.9Very high94.5Very high0 Ų030 Ų300%015%0.147CC..Hα-helixtrans-68.5-37-178.4-52.30000112.5L177 N183L177-S181 WeakPolarHBondContact O-CB 3.34Å; L177-S181 PolarHBondContact O-N 2.91Å; L177-S181 PolarHBondContact O-OG 3.24Å; S181-N183 VanDerWaalsContact C-N 3.27Å; S181-N183 PolarHBondContact O-N 3.14Å
182A95.6Very high94.7Very high0 Ų023.4 Ų23.40%012%0.118CC..Hα-helixtrans-71.4-19.4177.100000113.9R132 Y133 H178 K212 C216R132-A182 PolarHBondContact NH1-O 3.32Å; Y133-A182 HydrophobicContact CD2-CB 3.75Å; Y133-A182 HydrophobicContact CE2-CB 3.86Å; H178-A182 VanDerWaalsContact O-CB 3.26Å; H178-A182 WeakPolarHBondContact O-CB 3.5Å; H178-A182 PolarHBondContact O-N 3.18Å; A182-K212 HydrophobicContact CB-CB 4.29Å; A182-C216 WeakPolarHBondContact O-CB 3.31Å; A182-C216 PolarHBondContact O-SG 3.16Å
183N93.8Very high94.9Very high36 Ų3621.2 Ų21.219%0.19311%0.108CC..THydrogen-bonded Turntrans-109.15.6-178.8-7513.1000113.2W148 L179 A180 S181 N185W148-N183 WeakPolarHBondContact CZ3-OD1 3.31Å; W148-N183 PolarHBondContact O-ND2 2.95Å; L179-N183 PolarHBondContact O-N 3.1Å; A180-N183 PolarHBondContact O-N 2.89Å; S181-N183 VanDerWaalsContact C-N 3.27Å; S181-N183 PolarHBondContact O-N 3.14Å; N183-N185 VanDerWaalsContact C-N 3.27Å; N183-N185 PolarHBondContact O-N 3.16Å
184G94.5Very high94.8Very high21 Ų2120.2 Ų20.222%0.21611%0.108CC..THydrogen-bonded Turntrans69.521.7178.500000114.1A180 S186 E218A180-G184 PolarHBondContact O-N 3.45Å; A180-G184 VanDerWaalsContact O-N 3.15Å; G184-S186 PolarHBondContact O-N 2.98Å; G184-E218 WeakPolarHBondContact CA-OE2 3.49Å
185N95.4Very high94.6Very high33 Ų3326.2 Ų26.218%0.17613%0.131CC..  trans-80.670.1-178.3-66.7-37.2000110.5A147 W148 G150 A180 N183 E187 V188 V189A147-N185 PolarHBondContact O-ND2 3.22Å; W148-N185 PolarHBondContact O-ND2 3.31Å; G150-N185 VanDerWaalsContact CA-CG 3.44Å; G150-N185 WeakPolarHBondContact CA-OD1 3.35Å; G150-N185 PolarHBondContact N-ND2 2.96Å; A180-N185 HydrophobicContact CB-CB 4.27Å; A180-N185 PolarHBondContact O-N 3.03Å; N183-N185 VanDerWaalsContact C-N 3.27Å; N183-N185 PolarHBondContact O-N 3.16Å; N185-E187 VanDerWaalsContact C-N 3.33Å; N185-E187 PolarHBondContact O-N 3.35Å; N185-V188 HydrophobicContact CB-CB 4.26Å; N185-V188 HydrophobicContact CB-CG2 4.15Å; N185-V188 WeakPolarHBondContact O-CB 3.27Å; N185-V188 PolarHBondContact O-N 3.19Å; N185-V189 PolarHBondContact O-N 3.04Å
186S94.7Very high94.3Very high22 Ų2237.1 Ų37.115%0.15417%0.172CC..Hα-helixtrans-59.6-37.5-170.152.70000113.8G184 V188 V189 Q190 E220 M224G184-S186 PolarHBondContact O-N 2.98Å; S186-V188 VanDerWaalsContact C-N 3.29Å; S186-V188 PolarHBondContact O-N 3.04Å; S186-V189 PolarHBondContact O-N 3.19Å; S186-Q190 WeakPolarHBondContact O-CB 3.39Å; S186-Q190 PolarHBondContact O-N 2.99Å; S186-E220 VanDerWaalsContact CB-CD 3.49Å; S186-E220 WeakPolarHBondContact CB-OE2 3.3Å; S186-E220 PolarHBondContact OG-OE2 2.99Å; S186-M224 VanDerWaalsContact CB-CE 3.46Å
187E92.6Very high94.2Very high139 Ų13937.7 Ų37.765%0.6518%0.175SC*.Hα-helixtrans-60.6-38175.1-64.4-173.4179.300113.1N185 L191N185-E187 VanDerWaalsContact C-N 3.33Å; N185-E187 PolarHBondContact O-N 3.35Å; E187-L191 PolarHBondContact O-N 2.9Å; E187-L191 VanDerWaalsContact O-N 3.17Å
188V94.1Very high94.1Very high4 Ų443.1 Ų43.12%0.02420%0.201CC..Hα-helixtrans-71.6-44.3176.7-179.60000109.7A147 L157 A180 N185 S186 Q190 L191 L192A147-V188 HydrophobicContact CB-CG1 4.08Å; L157-V188 HydrophobicContact CD2-CB 4.23Å; L157-V188 HydrophobicContact CD2-CG1 3.99Å; L157-V188 HydrophobicContact CD2-CG2 3.95Å; A180-V188 HydrophobicContact CB-CB 4.02Å; A180-V188 HydrophobicContact CB-CG1 3.85Å; N185-V188 HydrophobicContact CB-CB 4.26Å; N185-V188 HydrophobicContact CB-CG2 4.15Å; N185-V188 WeakPolarHBondContact O-CB 3.27Å; N185-V188 PolarHBondContact O-N 3.19Å; S186-V188 VanDerWaalsContact C-N 3.29Å; S186-V188 PolarHBondContact O-N 3.04Å; V188-Q190 PolarHBondContact O-N 3.43Å; V188-L191 PolarHBondContact O-N 3.07Å; V188-L192 HydrophobicContact CG1-CD1 3.99Å; V188-L192 HydrophobicContact CG1-CG 4.26Å; V188-L192 VanDerWaalsContact O-CG 3.27Å; V188-L192 WeakPolarHBondContact O-CG 3.35Å; V188-L192 PolarHBondContact O-N 3Å
189V96.1Very high94.1Very high0 Ų044.3 Ų44.30%021%0.207CC..Hα-helixtrans-56.2-51.3175.3173.50000110.2L177 A180 N185 S186 L191 L192 L193 C221 M224L177-V189 HydrophobicContact CD1-CG1 4.11Å; L177-V189 HydrophobicContact CD1-CG2 4.49Å; A180-V189 HydrophobicContact CB-CG2 3.68Å; N185-V189 PolarHBondContact O-N 3.04Å; S186-V189 PolarHBondContact O-N 3.19Å; V189-L191 VanDerWaalsContact C-N 3.32Å; V189-L191 PolarHBondContact O-N 2.94Å; V189-L192 PolarHBondContact O-N 3.27Å; V189-L192 VanDerWaalsContact O-N 3.09Å; V189-L193 HydrophobicContact CG1-CD1 3.69Å; V189-L193 HydrophobicContact CG1-CG 4.15Å; V189-L193 VanDerWaalsContact O-CG 3.24Å; V189-L193 WeakPolarHBondContact O-CG 3.42Å; V189-L193 PolarHBondContact O-N 2.81Å; V189-C221 HydrophobicContact CG2-CB 4.48Å; V189-M224 HydrophobicContact CB-CE 3.85Å; V189-M224 HydrophobicContact CG1-CB 4.49Å; V189-M224 HydrophobicContact CG1-CE 3.75Å
190Q94.2Very high94.2Very high63 Ų6347.6 Ų47.629%0.29422%0.224SC..Hα-helixtrans-55.2-46.1178.6-174.862.750.700111.8S186 V188 L192 L193 D194 M224S186-Q190 WeakPolarHBondContact O-CB 3.39Å; S186-Q190 PolarHBondContact O-N 2.99Å; V188-Q190 PolarHBondContact O-N 3.43Å; Q190-L192 PolarHBondContact O-N 3.25Å; Q190-L193 PolarHBondContact O-N 3.13Å; Q190-D194 PolarHBondContact NE2-OD1 3.45Å; Q190-D194 PolarHBondContact O-N 3.18Å; Q190-M224 HydrophobicContact CB-SD 4.09Å; Q190-M224 PolarHBondContact OE1-SD 3.26Å; Q190-M224 VanDerWaalsContact OE1-SD 3.35Å
191L92.8Very high94.3Very high5 Ų548.3 Ų48.33%0.02623%0.229CC..Hα-helixtrans-65.4-38.9178.8-17469.3000112.7L157 I158 L161 E187 V188 V189 L193 R195L157-L191 HydrophobicContact CB-CD2 3.93Å; L157-L191 HydrophobicContact CD2-CB 4.39Å; L157-L191 HydrophobicContact CD2-CD2 3.37Å; L157-L191 HydrophobicContact CD2-CG 4.48Å; L157-L191 HydrophobicContact CG-CD2 3.54Å; I158-L191 HydrophobicContact CG1-CD1 4.03Å; I158-L191 HydrophobicContact CG1-CD2 4.01Å; L161-L191 HydrophobicContact CD1-CD2 3.42Å; L161-L191 VanDerWaalsContact CD1-CD2 3.42Å; L161-L191 HydrophobicContact CD1-CG 3.74Å; E187-L191 PolarHBondContact O-N 2.9Å; E187-L191 VanDerWaalsContact O-N 3.17Å; V188-L191 PolarHBondContact O-N 3.07Å; V189-L191 VanDerWaalsContact C-N 3.32Å; V189-L191 PolarHBondContact O-N 2.94Å; L191-L193 VanDerWaalsContact C-N 3.3Å; L191-R195 WeakPolarHBondContact O-CG 3.43Å; L191-R195 PolarHBondContact O-N 2.97Å
192L93.6Very high94.3Very high1 Ų151.1 Ų51.11%0.00524%0.244CC..Hα-helixtrans-64.6-37.5176.2-67.4173.3000111.2L161 M166 A176 L177 V188 V189 Q190 R195 C197L161-L192 HydrophobicContact CD2-CD2 3.77Å; M166-L192 HydrophobicContact CE-CB 4.23Å; M166-L192 HydrophobicContact CE-CD2 3.48Å; M166-L192 VanDerWaalsContact CE-CD2 3.48Å; M166-L192 HydrophobicContact CE-CG 4.44Å; A176-L192 HydrophobicContact CB-CD1 4.05Å; A176-L192 HydrophobicContact CB-CD2 4.39Å; L177-L192 HydrophobicContact CB-CD1 4.14Å; L177-L192 HydrophobicContact CD1-CB 4.16Å; L177-L192 HydrophobicContact CD1-CD1 4.07Å; V188-L192 HydrophobicContact CG1-CD1 3.99Å; V188-L192 HydrophobicContact CG1-CG 4.26Å; V188-L192 VanDerWaalsContact O-CG 3.27Å; V188-L192 WeakPolarHBondContact O-CG 3.35Å; V188-L192 PolarHBondContact O-N 3Å; V189-L192 PolarHBondContact O-N 3.27Å; V189-L192 VanDerWaalsContact O-N 3.09Å; Q190-L192 PolarHBondContact O-N 3.25Å; L192-R195 PolarHBondContact O-N 2.93Å; L192-C197 VanDerWaalsContact C-SG 3.58Å; L192-C197 WeakPolarHBondContact O-CB 3.43Å; L192-C197 PolarHBondContact O-N 3.1Å; L192-C197 PolarHBondContact O-SG 3.42Å
193L94.4Very high94.2Very high7 Ų751.5 Ų51.54%0.03725%0.245CC..Hα-helixtrans-69.6-44.7176.3-67.1177.1000112.6V189 Q190 L191 R195 R196 L199 M224 L225 H228V189-L193 HydrophobicContact CG1-CD1 3.69Å; V189-L193 HydrophobicContact CG1-CG 4.15Å; V189-L193 VanDerWaalsContact O-CG 3.24Å; V189-L193 WeakPolarHBondContact O-CG 3.42Å; V189-L193 PolarHBondContact O-N 2.81Å; Q190-L193 PolarHBondContact O-N 3.13Å; L191-L193 VanDerWaalsContact C-N 3.3Å; L193-R195 PolarHBondContact O-N 3.04Å; L193-R196 PolarHBondContact O-N 3.21Å; L193-L199 HydrophobicContact CD2-CD2 3.22Å; L193-M224 HydrophobicContact CD1-CB 3.84Å; L193-L225 HydrophobicContact CD2-CD2 4.19Å; L193-H228 HydrophobicContact CD1-CB 4.45Å; L193-H228 HydrophobicContact CD2-CB 4.04Å
194D92.1Very high94.3Very high81 Ų8153.5 Ų53.543%0.43326%0.256SS..Hα-helixtrans-54.6-30.7175.8-68.8-18.7000111.7R154 Q190R154-D194 IonicContact NH2-OD2 2.69Å; Q190-D194 PolarHBondContact NE2-OD1 3.45Å; Q190-D194 PolarHBondContact O-N 3.18Å
195R90Very high94.2Very high132 Ų13255.7 Ų55.750%0.49826%0.26SS..THydrogen-bonded Turntrans-91.57.6179.3-66.7-69.5-173.8-179.7-0.8114.1M166 L191 L192 L193 C197M166-R195 HydrophobicContact CE-CB 3.33Å; M166-R195 HydrophobicContact CE-CG 4.02Å; M166-R195 HydrophobicContact SD-CB 3.45Å; M166-R195 WeakPolarHBondContact SD-CB 3.31Å; M166-R195 HydrophobicContact SD-CG 4.04Å; L191-R195 WeakPolarHBondContact O-CG 3.43Å; L191-R195 PolarHBondContact O-N 2.97Å; L192-R195 PolarHBondContact O-N 2.93Å; L193-R195 PolarHBondContact O-N 3.04Å; R195-C197 PolarHBondContact O-N 3.49Å
196R89.9Confident94.3Very high231 Ų23159.9 Ų59.987%0.87228%0.276SS*.THydrogen-bonded Turntrans5844.4177.3-53.6-175.6178.6-167.7-0.4113.6L193L193-R196 PolarHBondContact O-N 3.21Å
197C92.4Very high94.4Very high11 Ų1159 Ų597%0.07427%0.27CS..  trans-60.8159.8170.468.40000112.1M166 L192 R195 L199M166-C197 HydrophobicContact CE-CB 4.12Å; L192-C197 VanDerWaalsContact C-SG 3.58Å; L192-C197 WeakPolarHBondContact O-CB 3.43Å; L192-C197 PolarHBondContact O-N 3.1Å; L192-C197 PolarHBondContact O-SG 3.42Å; R195-C197 PolarHBondContact O-N 3.49Å; C197-L199 PolarHBondContact O-N 3.22Å
198Q95.8Very high94.6Very high119 Ų11952.4 Ų52.456%0.55624%0.239SC*.  trans-73.2121176.5-66.4179.412.300110.1N167 V201N167-Q198 PolarHBondContact OD1-N 2.97Å; Q198-V201 HydrophobicContact CB-CG2 3.45Å; Q198-V201 VanDerWaalsContact CB-CG2 3.45Å; Q198-V201 HydrophobicContact CG-CG2 4.5Å
199L96.3Very high94.8Very high25 Ų2552.2 Ų52.213%0.13124%0.238CC..SBendtrans-81.4-34.4-175.4-52.2-176000113.1L177 L193 C197 V201 L225 H228 A230L177-L199 HydrophobicContact CD2-CD2 4.02Å; L193-L199 HydrophobicContact CD2-CD2 3.22Å; C197-L199 PolarHBondContact O-N 3.22Å; L199-V201 PolarHBondContact O-N 3.32Å; L199-L225 HydrophobicContact CD2-CD2 4.48Å; L199-H228 HydrophobicContact CD1-CB 4.04Å; L199-H228 WeakPolarHBondContact CD1-O 3.41Å; L199-A230 HydrophobicContact CB-CB 4.14Å; L199-A230 HydrophobicContact CD1-CB 4.19Å
200N96.9Very high94.9Very high69 Ų6952.3 Ų52.337%0.36924%0.238SC..SBendtrans-98.924.7-169.5-62.8-18.4000112.8D231 I234N200-D231 WeakPolarHBondContact ND2-CB 3.18Å; N200-D231 PolarHBondContact OD1-N 3.2Å; N200-I234 HydrophobicContact CB-CD1 3.57Å
201V97.3Very high95.1Very high15 Ų1549.3 Ų49.39%0.09122%0.224CC..  trans-70.1143.1173.6-176.60000109T175 H178 Q198 L199T175-V201 HydrophobicContact CG2-CB 3.97Å; T175-V201 HydrophobicContact CG2-CG1 3.64Å; T175-V201 HydrophobicContact CG2-CG2 4.23Å; H178-V201 PolarHBondContact CE1-O 2.98Å; H178-V201 PolarHBondContact NE2-O 3.14Å; H178-V201 VanDerWaalsContact NE2-O 3.11Å; Q198-V201 HydrophobicContact CB-CG2 3.45Å; Q198-V201 VanDerWaalsContact CB-CG2 3.45Å; Q198-V201 HydrophobicContact CG-CG2 4.5Å; L199-V201 PolarHBondContact O-N 3.32Å
202L97.2Very high95.3Very high60 Ų6049.2 Ų49.231%0.31422%0.223SC..  trans-104.2135.3-177.1-52.6-176.5000111.5R169 K206 R207 T208 I234R169-L202 PolarHBondContact NH2-O 2.99Å; L202-K206 HydrophobicContact CD1-CB 4.4Å; L202-R207 WeakPolarHBondContact CA-O 3.35Å; L202-T208 HydrophobicContact CD2-CG2 3.77Å; L202-I234 HydrophobicContact CD2-CG2 3.83Å
203D95.2Very high95.5Very high7 Ų749.1 Ų49.14%0.03722%0.223CC..  trans-77.3-174.8167.876.29.5000112.6Y133 R174 K205 K206 R207Y133-D203 VanDerWaalsContact CE1-OD2 3.3Å; Y133-D203 WeakPolarHBondContact CE1-OD2 3.49Å; Y133-D203 PolarHBondContact OH-OD2 3.38Å; R174-D203 HydrophobicContact CG-CB 3.93Å; D203-K205 PolarHBondContact O-N 3.25Å; D203-K205 WeakPolarHBondContact OD1-CA 3.47Å; D203-K205 PolarHBondContact OD1-N 3.12Å; D203-K206 PolarHBondContact O-N 3.48Å; D203-K206 PolarHBondContact OD1-N 2.87Å; D203-R207 PolarHBondContact N-O 3.14Å; D203-R207 WeakPolarHBondContact OD1-CB 3.37Å; D203-R207 PolarHBondContact OD1-N 3.47Å
204N93.9Very high95.6Very high78 Ų7849 Ų4942%0.41722%0.222SC..THydrogen-bonded Turntrans-60-27179.3-91.11.3000114.4Q172 K173 K206Q172-N204 VanDerWaalsContact C-CG 3.47Å; Q172-N204 WeakPolarHBondContact CA-ND2 3.19Å; Q172-N204 WeakPolarHBondContact O-CB 3.4Å; Q172-N204 VanDerWaalsContact O-CG 3.26Å; Q172-N204 PolarHBondContact O-N 3.26Å; Q172-N204 PolarHBondContact O-OD1 2.85Å; K173-N204 VanDerWaalsContact CB-OD1 3.28Å; K173-N204 WeakPolarHBondContact CB-OD1 3.34Å; K173-N204 WeakPolarHBondContact CD-OD1 3.48Å; K173-N204 WeakPolarHBondContact CE-OD1 3.21Å; K173-N204 WeakPolarHBondContact CG-OD1 3.32Å; N204-K206 VanDerWaalsContact C-N 3.27Å
205K93.9Very high95.8Very high67 Ų6745.3 Ų45.329%0.29120%0.203SC..THydrogen-bonded Turntrans-9416.1177-62.7-161.6172.2-173.50112.1D203 R207 E237D203-K205 PolarHBondContact O-N 3.25Å; D203-K205 WeakPolarHBondContact OD1-CA 3.47Å; D203-K205 PolarHBondContact OD1-N 3.12Å; K205-R207 HydrophobicContact CB-CG 4.13Å; K205-R207 PolarHBondContact O-N 2.97Å; K205-E237 HydrophobicContact CB-CG 4.35Å; K205-E237 WeakPolarHBondContact CB-OE1 3.36Å; K205-E237 WeakPolarHBondContact CD-OE1 3.45Å; K205-E237 WeakPolarHBondContact CG-OE1 3.34Å; K205-E237 WeakPolarHBondContact O-CB 3.44Å; K205-E237 WeakPolarHBondContact O-CG 3.35Å; K205-E237 PolarHBondContact O-N 2.9Å
206K96.4Very high96.1Very high121 Ų12139.6 Ų39.653%0.52618%0.183SC..SBendtrans57.325-173.5-54.8-174.4178.9-176.80114.2L202 D203 N204 E237L202-K206 HydrophobicContact CD1-CB 4.4Å; D203-K206 PolarHBondContact O-N 3.48Å; D203-K206 PolarHBondContact OD1-N 2.87Å; N204-K206 VanDerWaalsContact C-N 3.27Å; K206-E237 HydrophobicContact CB-CB 4.39Å; K206-E237 HydrophobicContact CD-CB 4.38Å; K206-E237 HydrophobicContact CG-CB 4.29Å
207R96.9Very high96.4Very high4 Ų434.1 Ų34.12%0.01517%0.167CC..  trans-87.8143.3178.6-60.9175.2-174.1169.410.3110.1A127 H178 L202 D203 K205 I211 K212 D236 Y245A127-R207 PolarHBondContact O-NH2 2.95Å; H178-R207 PolarHBondContact NE2-O 3.44Å; H178-R207 VanDerWaalsContact NE2-O 3.1Å; L202-R207 WeakPolarHBondContact CA-O 3.35Å; D203-R207 PolarHBondContact N-O 3.14Å; D203-R207 WeakPolarHBondContact OD1-CB 3.37Å; D203-R207 PolarHBondContact OD1-N 3.47Å; K205-R207 HydrophobicContact CB-CG 4.13Å; K205-R207 PolarHBondContact O-N 2.97Å; R207-I211 HydrophobicContact CB-CB 4.29Å; R207-I211 HydrophobicContact CB-CG2 3.98Å; R207-I211 HydrophobicContact CG-CG2 3.96Å; R207-K212 HydrophobicContact CB-CD 4.28Å; R207-K212 HydrophobicContact CB-CG 4.35Å; R207-D236 HydrophobicContact CG-CB 3.69Å; R207-D236 IonicContact NE-OD2 3.11Å; R207-Y245 VanDerWaalsContact CZ-OH 3.31Å; R207-Y245 PolarHBondContact NE-OH 3.37Å; R207-Y245 VanDerWaalsContact NE-OH 3.17Å; R207-Y245 PolarHBondContact NH2-OH 2.99Å
208T97.8Very high96.6Very high0 Ų035.7 Ų35.70%017%0.173CC..  trans-83.7165.3168.762.10000110.8L202 L210 I211 K212 I234L202-T208 HydrophobicContact CD2-CG2 3.77Å; T208-L210 PolarHBondContact O-N 3.42Å; T208-I211 PolarHBondContact O-N 3.27Å; T208-I211 PolarHBondContact OG1-N 2.94Å; T208-K212 PolarHBondContact O-N 2.81Å; T208-K212 VanDerWaalsContact O-N 3.16Å; T208-I234 HydrophobicContact CG2-CB 4.03Å; T208-I234 HydrophobicContact CG2-CD1 3.99Å; T208-I234 HydrophobicContact CG2-CG2 3.86Å
209A97.6Very high96.6Very high0 Ų033.7 Ų33.70%017%0.167CC..Hα-helixtrans-58.6-33171.800000112.2L177 H178 K212 A213 L225L177-A209 HydrophobicContact CB-CB 4.36Å; L177-A209 HydrophobicContact CD2-CB 3.88Å; L177-A209 HydrophobicContact CG-CB 3.73Å; H178-A209 PolarHBondContact NE2-N 3.25Å; A209-K212 PolarHBondContact O-N 2.86Å; A209-A213 PolarHBondContact O-N 3.16Å; A209-L225 HydrophobicContact CB-CD1 4.46Å
210L98.4Very high96.6Very high2 Ų238.3 Ų38.31%0.0119%0.187CC..Hα-helixtrans-65.4-48176176.662.7000112.3T208 K212 A213 V214 V222 L225 L226 A230 Q232 T242T208-L210 PolarHBondContact O-N 3.42Å; L210-K212 PolarHBondContact O-N 2.99Å; L210-A213 PolarHBondContact O-N 3.01Å; L210-V214 PolarHBondContact O-N 3.34Å; L210-V222 HydrophobicContact CD1-CB 4.43Å; L210-V222 HydrophobicContact CD1-CG1 3.74Å; L210-L225 HydrophobicContact CB-CD1 4.25Å; L210-L225 HydrophobicContact CD1-CB 4.15Å; L210-L225 HydrophobicContact CD1-CD1 4.39Å; L210-L226 HydrophobicContact CD1-CD2 4.17Å; L210-L226 HydrophobicContact CD1-CG 4.08Å; L210-L226 HydrophobicContact CD2-CD2 3.77Å; L210-A230 HydrophobicContact CB-CB 4.36Å; L210-A230 HydrophobicContact CD2-CB 4.08Å; L210-Q232 HydrophobicContact CD2-CB 3.71Å; L210-T242 HydrophobicContact CD1-CG2 4.44Å; L210-T242 HydrophobicContact CD2-CG2 4.28Å; L210-T242 HydrophobicContact CG-CG2 3.9Å
211I97.8Very high96.7Very high0 Ų035 Ų350%017%0.17CC..Hα-helixtrans-55.6-43.5174.6-75172.5000110.3R207 T208 V214 Q215 I234 D236 Y245R207-I211 HydrophobicContact CB-CB 4.29Å; R207-I211 HydrophobicContact CB-CG2 3.98Å; R207-I211 HydrophobicContact CG-CG2 3.96Å; T208-I211 PolarHBondContact O-N 3.27Å; T208-I211 PolarHBondContact OG1-N 2.94Å; I211-V214 PolarHBondContact O-N 3.18Å; I211-Q215 VanDerWaalsContact O-CB 3.3Å; I211-Q215 WeakPolarHBondContact O-CB 3.35Å; I211-Q215 PolarHBondContact O-N 2.73Å; I211-I234 WeakPolarHBondContact CD1-O 3.5Å; I211-D236 HydrophobicContact CD1-CB 4.33Å; I211-Y245 HydrophobicContact CG2-CD2 3.63Å; I211-Y245 HydrophobicContact CG2-CE2 3.4Å; I211-Y245 VanDerWaalsContact CG2-CE2 3.4Å; I211-Y245 HydrophobicContact CG2-CG 4.32Å
212K96.8Very high96.7Very high3 Ų334.3 Ų34.31%0.01317%0.166CC..Hα-helixtrans-66.8-40.9179.4-69.5-58.3-49.5175.50113.4P131 Y133 A182 R207 T208 A209 L210 V214 Q215 C216P131-K212 WeakPolarHBondContact O-CE 3.39Å; P131-K212 PolarHBondContact O-NZ 3.41Å; Y133-K212 HydrophobicContact CE1-CD 4.08Å; Y133-K212 HydrophobicContact CE2-CD 4.25Å; Y133-K212 HydrophobicContact CE2-CG 4.04Å; Y133-K212 VanDerWaalsContact OH-CG 3.25Å; Y133-K212 WeakPolarHBondContact OH-CG 3.47Å; A182-K212 HydrophobicContact CB-CB 4.29Å; R207-K212 HydrophobicContact CB-CD 4.28Å; R207-K212 HydrophobicContact CB-CG 4.35Å; T208-K212 PolarHBondContact O-N 2.81Å; T208-K212 VanDerWaalsContact O-N 3.16Å; A209-K212 PolarHBondContact O-N 2.86Å; L210-K212 PolarHBondContact O-N 2.99Å; K212-V214 VanDerWaalsContact C-N 3.32Å; K212-V214 PolarHBondContact O-N 2.85Å; K212-Q215 PolarHBondContact O-N 2.99Å; K212-C216 WeakPolarHBondContact O-CB 3.47Å; K212-C216 PolarHBondContact O-N 3.32Å; K212-C216 PolarHBondContact O-SG 3.41Å; K212-C216 VanDerWaalsContact O-SG 3.4Å
213A97.7Very high96.8Very high0 Ų033.9 Ų33.90%016%0.163CC..Hα-helixtrans-58.5-46175.300000110.9A209 L210 C216 Q217 E218 C221 V222 L225A209-A213 PolarHBondContact O-N 3.16Å; L210-A213 PolarHBondContact O-N 3.01Å; A213-C216 CarbonylContact O-C 3.56Å; A213-C216 PolarHBondContact O-N 2.91Å; A213-Q217 PolarHBondContact O-N 3.38Å; A213-E218 PolarHBondContact O-N 3.03Å; A213-C221 HydrophobicContact CB-CB 4.24Å; A213-V222 HydrophobicContact CB-CG2 3.49Å; A213-V222 VanDerWaalsContact CB-CG2 3.49Å; A213-L225 HydrophobicContact CB-CD1 4.18Å
214V97.9Very high96.9Very high3 Ų334.4 Ų34.42%0.01817%0.166CC..Hα-helixtrans-66.4-44.8176.5174.30000111.5L210 I211 K212 C216 Q217 V222 T242 A246 N249 M254L210-V214 PolarHBondContact O-N 3.34Å; I211-V214 PolarHBondContact O-N 3.18Å; K212-V214 VanDerWaalsContact C-N 3.32Å; K212-V214 PolarHBondContact O-N 2.85Å; V214-C216 PolarHBondContact O-N 2.89Å; V214-Q217 PolarHBondContact O-N 3.2Å; V214-V222 HydrophobicContact CB-CG2 4.43Å; V214-V222 HydrophobicContact CG2-CB 4.37Å; V214-V222 HydrophobicContact CG2-CG1 3.87Å; V214-V222 HydrophobicContact CG2-CG2 3.53Å; V214-T242 HydrophobicContact CB-CG2 4.05Å; V214-T242 HydrophobicContact CG1-CG2 4.45Å; V214-T242 HydrophobicContact CG2-CG2 3.51Å; V214-A246 HydrophobicContact CG1-CB 4.09Å; V214-N249 PolarHBondContact O-ND2 2.84Å; V214-M254 HydrophobicContact CG1-CG 4.14Å; V214-M254 HydrophobicContact CG2-CG 4.08Å; V214-M254 HydrophobicContact CG2-SD 4.17Å
215Q96.1Very high97.1Very high4 Ų430.7 Ų30.72%0.01915%0.146CC..Hα-helixtrans-58.8-35.8177.9-169.5179.819.300111.8A127 F128 P131 I211 K212 Y245A127-Q215 PolarHBondContact O-NE2 3.42Å; F128-Q215 PolarHBondContact O-NE2 3.34Å; P131-Q215 HydrophobicContact CB-CG 3.96Å; P131-Q215 WeakPolarHBondContact CB-O 3.41Å; I211-Q215 VanDerWaalsContact O-CB 3.3Å; I211-Q215 WeakPolarHBondContact O-CB 3.35Å; I211-Q215 PolarHBondContact O-N 2.73Å; K212-Q215 PolarHBondContact O-N 2.99Å; Q215-Y245 HydrophobicContact CB-CD1 3.88Å; Q215-Y245 HydrophobicContact CB-CE1 4.18Å; Q215-Y245 HydrophobicContact CG-CD1 3.8Å; Q215-Y245 HydrophobicContact CG-CE1 3.8Å
216C95.3Very high97.3Very high12 Ų1227.8 Ų27.88%0.08113%0.134CC..THydrogen-bonded Turntrans-86.7-2.8176.5-65.90000114.5P131 A182 K212 A213 V214 E218P131-C216 PolarHBondContact O-SG 3.13Å; A182-C216 WeakPolarHBondContact O-CB 3.31Å; A182-C216 PolarHBondContact O-SG 3.16Å; K212-C216 WeakPolarHBondContact O-CB 3.47Å; K212-C216 PolarHBondContact O-N 3.32Å; K212-C216 PolarHBondContact O-SG 3.41Å; K212-C216 VanDerWaalsContact O-SG 3.4Å; A213-C216 CarbonylContact O-C 3.56Å; A213-C216 PolarHBondContact O-N 2.91Å; V214-C216 PolarHBondContact O-N 2.89Å; C216-E218 VanDerWaalsContact C-N 3.34Å; C216-E218 HydrophobicContact CB-CG 3.69Å
217Q96.1Very high97.3Very high116 Ų11627.7 Ų27.754%0.54214%0.135SC..THydrogen-bonded Turntrans59.340.1-176.9-58.9172.155.900113.3A213 V214 D219 N249A213-Q217 PolarHBondContact O-N 3.38Å; V214-Q217 PolarHBondContact O-N 3.2Å; Q217-D219 PolarHBondContact O-N 3.18Å; Q217-N249 HydrophobicContact CG-CB 4.48Å
218E97.3Very high97.3Very high44 Ų4431.4 Ų31.421%0.20615%0.152CC..  trans-97.171.9-179.4-53.8-66.1174.900110.2R132 G184 A213 C216 E220 C221 V222R132-E218 IonicContact CZ-OE1 3.58Å; R132-E218 IonicContact NH1-OE1 3.73Å; R132-E218 PolarHBondContact NH1-OE1 3.27Å; R132-E218 IonicContact NH2-OE1 3.26Å; R132-E218 PolarHBondContact NH2-OE1 3.3Å; G184-E218 WeakPolarHBondContact CA-OE2 3.49Å; A213-E218 PolarHBondContact O-N 3.03Å; C216-E218 VanDerWaalsContact C-N 3.34Å; C216-E218 HydrophobicContact CB-CG 3.69Å; E218-E220 VanDerWaalsContact C-N 3.34Å; E218-E220 PolarHBondContact O-N 2.93Å; E218-C221 HydrophobicContact CB-CB 4.32Å; E218-C221 WeakPolarHBondContact O-CB 3.33Å; E218-C221 PolarHBondContact O-N 3.27Å; E218-V222 PolarHBondContact O-N 3Å; E218-V222 VanDerWaalsContact O-N 3.13Å
219D96.1Very high97.2Very high78 Ų7834 Ų3442%0.41718%0.179SC..Hα-helixtrans-54-41.2-167.6-65.5-13000114.9Q217 C221 V222 L223 M254Q217-D219 PolarHBondContact O-N 3.18Å; D219-C221 VanDerWaalsContact C-N 3.32Å; D219-C221 PolarHBondContact O-N 3.5Å; D219-V222 WeakPolarHBondContact O-CB 3.36Å; D219-V222 PolarHBondContact O-N 3.08Å; D219-L223 WeakPolarHBondContact O-CG 3.37Å; D219-L223 PolarHBondContact O-N 3.47Å; D219-M254 HydrophobicContact CB-CE 4.08Å; D219-M254 WeakPolarHBondContact OD1-CE 3.33Å
220E97Very high97.2Very high121 Ų12134.1 Ų34.157%0.56518%0.18SC*.Hα-helixtrans-61.8-42.2179.3-171.8179.1-155.600111S186 E218 L223 M224S186-E220 VanDerWaalsContact CB-CD 3.49Å; S186-E220 WeakPolarHBondContact CB-OE2 3.3Å; S186-E220 PolarHBondContact OG-OE2 2.99Å; E218-E220 VanDerWaalsContact C-N 3.34Å; E218-E220 PolarHBondContact O-N 2.93Å; E220-L223 PolarHBondContact O-N 3.27Å; E220-M224 HydrophobicContact CG-CE 4.29Å; E220-M224 WeakPolarHBondContact O-CG 3.4Å; E220-M224 PolarHBondContact O-N 3.37Å; E220-M224 VanDerWaalsContact O-N 3.12Å
221C97.7Very high97.2Very high1 Ų136.8 Ų36.81%0.00719%0.194CC..Hα-helixtrans-66.2-39.6176.4-66.80000111.4V189 A213 E218 D219 M224 L225V189-C221 HydrophobicContact CG2-CB 4.48Å; A213-C221 HydrophobicContact CB-CB 4.24Å; E218-C221 HydrophobicContact CB-CB 4.32Å; E218-C221 WeakPolarHBondContact O-CB 3.33Å; E218-C221 PolarHBondContact O-N 3.27Å; D219-C221 VanDerWaalsContact C-N 3.32Å; D219-C221 PolarHBondContact O-N 3.5Å; C221-M224 HydrophobicContact CB-CE 4.5Å; C221-M224 PolarHBondContact O-N 3.44Å; C221-L225 WeakPolarHBondContact O-CB 3.48Å; C221-L225 WeakPolarHBondContact O-CD1 3.42Å; C221-L225 WeakPolarHBondContact O-CG 3.38Å; C221-L225 PolarHBondContact O-N 2.79Å
222V98.2Very high97.2Very high0 Ų037.6 Ų37.60%020%0.198CC..Hα-helixtrans-60.3-49.4177.1177.10000111.1L210 A213 V214 E218 D219 M224 L225 L226 M254L210-V222 HydrophobicContact CD1-CB 4.43Å; L210-V222 HydrophobicContact CD1-CG1 3.74Å; A213-V222 HydrophobicContact CB-CG2 3.49Å; A213-V222 VanDerWaalsContact CB-CG2 3.49Å; V214-V222 HydrophobicContact CB-CG2 4.43Å; V214-V222 HydrophobicContact CG2-CB 4.37Å; V214-V222 HydrophobicContact CG2-CG1 3.87Å; V214-V222 HydrophobicContact CG2-CG2 3.53Å; E218-V222 PolarHBondContact O-N 3Å; E218-V222 VanDerWaalsContact O-N 3.13Å; D219-V222 WeakPolarHBondContact O-CB 3.36Å; D219-V222 PolarHBondContact O-N 3.08Å; V222-M224 PolarHBondContact O-N 3.28Å; V222-L225 PolarHBondContact O-N 3.09Å; V222-L226 HydrophobicContact CG1-CD1 3.75Å; V222-L226 HydrophobicContact CG1-CG 4.3Å; V222-L226 WeakPolarHBondContact O-CG 3.39Å; V222-L226 PolarHBondContact O-N 3.24Å; V222-M254 HydrophobicContact CB-CE 3.82Å; V222-M254 HydrophobicContact CB-SD 4.03Å; V222-M254 HydrophobicContact CG1-CE 3.84Å; V222-M254 HydrophobicContact CG1-SD 3.34Å; V222-M254 WeakPolarHBondContact CG1-SD 3.31Å; V222-M254 HydrophobicContact CG2-CE 3.9Å; V222-M254 HydrophobicContact CG2-SD 4.28Å
223L97.8Very high97.2Very high51 Ų5140.3 Ų40.327%0.26721%0.213SC..Hα-helixtrans-61.8-46.2-179.1-68.7175.6000111.6M24 D219 E220 L225 L226 E227 A257M24-L223 HydrophobicContact CE-CD1 4.36Å; D219-L223 WeakPolarHBondContact O-CG 3.37Å; D219-L223 PolarHBondContact O-N 3.47Å; E220-L223 PolarHBondContact O-N 3.27Å; L223-L225 VanDerWaalsContact C-N 3.32Å; L223-L225 PolarHBondContact O-N 2.93Å; L223-L226 PolarHBondContact O-N 3.36Å; L223-E227 WeakPolarHBondContact O-CB 3.36Å; L223-E227 VanDerWaalsContact O-CG 3.3Å; L223-E227 WeakPolarHBondContact O-CG 3.3Å; L223-E227 PolarHBondContact O-N 3.07Å; L223-A257 HydrophobicContact CD2-CB 4.47Å
224M97.8Very high97.2Very high17 Ų1741.8 Ų41.88%0.08422%0.22CC..Hα-helixtrans-59-42.6176.8-71.8-173.5-64.200112.3S186 V189 Q190 L193 E220 C221 V222 E227 H228S186-M224 VanDerWaalsContact CB-CE 3.46Å; V189-M224 HydrophobicContact CB-CE 3.85Å; V189-M224 HydrophobicContact CG1-CB 4.49Å; V189-M224 HydrophobicContact CG1-CE 3.75Å; Q190-M224 HydrophobicContact CB-SD 4.09Å; Q190-M224 PolarHBondContact OE1-SD 3.26Å; Q190-M224 VanDerWaalsContact OE1-SD 3.35Å; L193-M224 HydrophobicContact CD1-CB 3.84Å; E220-M224 HydrophobicContact CG-CE 4.29Å; E220-M224 WeakPolarHBondContact O-CG 3.4Å; E220-M224 PolarHBondContact O-N 3.37Å; E220-M224 VanDerWaalsContact O-N 3.12Å; C221-M224 HydrophobicContact CB-CE 4.5Å; C221-M224 PolarHBondContact O-N 3.44Å; V222-M224 PolarHBondContact O-N 3.28Å; M224-E227 PolarHBondContact O-N 3.38Å; M224-H228 PolarHBondContact O-N 3.22Å; M224-H228 PolarHBondContact O-ND1 3.41Å
225L98Very high97.2Very high1 Ų144.8 Ų44.81%0.00524%0.24CC..Hα-helixtrans-63.8-44.7178.4-73.3167.7000111.8L177 L193 L199 A209 L210 A213 C221 V222 L223 H228 G229 A230L177-L225 HydrophobicContact CD1-CD2 4.11Å; L177-L225 HydrophobicContact CD2-CD2 3.93Å; L177-L225 HydrophobicContact CG-CD2 4.24Å; L193-L225 HydrophobicContact CD2-CD2 4.19Å; L199-L225 HydrophobicContact CD2-CD2 4.48Å; A209-L225 HydrophobicContact CB-CD1 4.46Å; L210-L225 HydrophobicContact CB-CD1 4.25Å; L210-L225 HydrophobicContact CD1-CB 4.15Å; L210-L225 HydrophobicContact CD1-CD1 4.39Å; A213-L225 HydrophobicContact CB-CD1 4.18Å; C221-L225 WeakPolarHBondContact O-CB 3.48Å; C221-L225 WeakPolarHBondContact O-CD1 3.42Å; C221-L225 WeakPolarHBondContact O-CG 3.38Å; C221-L225 PolarHBondContact O-N 2.79Å; V222-L225 PolarHBondContact O-N 3.09Å; L223-L225 VanDerWaalsContact C-N 3.32Å; L223-L225 PolarHBondContact O-N 2.93Å; L225-H228 PolarHBondContact O-N 2.92Å; L225-G229 PolarHBondContact O-N 3.34Å; L225-A230 HydrophobicContact CB-CB 4Å; L225-A230 WeakPolarHBondContact O-CB 3.34Å; L225-A230 PolarHBondContact O-N 2.97Å
226L97.8Very high97.2Very high6 Ų644.9 Ų44.93%0.03124%0.241CC..Hα-helixtrans-64.6-42.6178.1-70.1170.9000111.9L210 V222 L223 H228 G229 Q232 L258 Y261L210-L226 HydrophobicContact CD1-CD2 4.17Å; L210-L226 HydrophobicContact CD1-CG 4.08Å; L210-L226 HydrophobicContact CD2-CD2 3.77Å; V222-L226 HydrophobicContact CG1-CD1 3.75Å; V222-L226 HydrophobicContact CG1-CG 4.3Å; V222-L226 WeakPolarHBondContact O-CG 3.39Å; V222-L226 PolarHBondContact O-N 3.24Å; L223-L226 PolarHBondContact O-N 3.36Å; L226-H228 PolarHBondContact O-N 3.28Å; L226-G229 PolarHBondContact O-N 3.42Å; L226-Q232 HydrophobicContact CD2-CB 4.23Å; L226-L258 HydrophobicContact CD1-CD2 4.04Å; L226-L258 HydrophobicContact CD2-CD2 4.17Å; L226-Y261 HydrophobicContact CB-CD1 3.99Å; L226-Y261 HydrophobicContact CB-CD2 3.97Å; L226-Y261 HydrophobicContact CB-CE1 4.02Å; L226-Y261 HydrophobicContact CB-CE2 4Å; L226-Y261 HydrophobicContact CB-CG 3.97Å; L226-Y261 HydrophobicContact CD1-CD2 3.8Å; L226-Y261 HydrophobicContact CD1-CE2 4.19Å; L226-Y261 HydrophobicContact CD1-CG 4.31Å; L226-Y261 HydrophobicContact CD2-CG 4.3Å; L226-Y261 HydrophobicContact CG-CD2 4.35Å; L226-Y261 HydrophobicContact CG-CG 4.43Å
227E97.1Very high97.2Very high119 Ų11947.1 Ų47.156%0.55625%0.25SC*.Hα-helixtrans-61.2-30.3176.8-74.8175.9177.400112.8L223 M224 G229 Y261L223-E227 WeakPolarHBondContact O-CB 3.36Å; L223-E227 VanDerWaalsContact O-CG 3.3Å; L223-E227 WeakPolarHBondContact O-CG 3.3Å; L223-E227 PolarHBondContact O-N 3.07Å; M224-E227 PolarHBondContact O-N 3.38Å; E227-G229 VanDerWaalsContact C-N 3.32Å; E227-Y261 VanDerWaalsContact CG-OH 3.3Å; E227-Y261 WeakPolarHBondContact CG-OH 3.42Å
228H97.3Very high97.2Very high81 Ų8143.8 Ų43.838%0.37523%0.232SC..THydrogen-bonded Turntrans-88.54.5176.3-71.173.3000113.6L193 L199 M224 L225 L226L193-H228 HydrophobicContact CD1-CB 4.45Å; L193-H228 HydrophobicContact CD2-CB 4.04Å; L199-H228 HydrophobicContact CD1-CB 4.04Å; L199-H228 WeakPolarHBondContact CD1-O 3.41Å; M224-H228 PolarHBondContact O-N 3.22Å; M224-H228 PolarHBondContact O-ND1 3.41Å; L225-H228 PolarHBondContact O-N 2.92Å; L226-H228 PolarHBondContact O-N 3.28Å
229G95.9Very high97.1Very high54 Ų5442.3 Ų42.356%0.55723%0.229SC*.THydrogen-bonded Turntrans83.930.2174.300000114.6L225 L226 E227L225-G229 PolarHBondContact O-N 3.34Å; L226-G229 PolarHBondContact O-N 3.42Å; E227-G229 VanDerWaalsContact C-N 3.32Å
230A97.5Very high97.1Very high3 Ų338.7 Ų38.73%0.02521%0.21CC..  trans-61.4135.9167.600000110.3L199 L210 L225 Q232L199-A230 HydrophobicContact CB-CB 4.14Å; L199-A230 HydrophobicContact CD1-CB 4.19Å; L210-A230 HydrophobicContact CB-CB 4.36Å; L210-A230 HydrophobicContact CD2-CB 4.08Å; L225-A230 HydrophobicContact CB-CB 4Å; L225-A230 WeakPolarHBondContact O-CB 3.34Å; L225-A230 PolarHBondContact O-N 2.97Å; A230-Q232 PolarHBondContact O-N 3.25Å; A230-Q232 PolarHBondContact O-OE1 3.29Å
231D97.8Very high97.2Very high59 Ų5933.2 Ų33.232%0.31619%0.185SC..  trans-82.7113.6-179.2-175.4-9.7000110.5N200 N233 I234N200-D231 WeakPolarHBondContact ND2-CB 3.18Å; N200-D231 PolarHBondContact OD1-N 3.2Å; D231-N233 WeakPolarHBondContact OD1-CB 3.37Å; D231-N233 PolarHBondContact OD1-N 3.28Å; D231-I234 HydrophobicContact CB-CD1 3.79Å; D231-I234 HydrophobicContact CB-CG1 3.95Å
232Q97.3Very high97.2Very high16 Ų1633.1 Ų33.18%0.07518%0.184CC..THydrogen-bonded Turntrans-81.6-11.9-178.869.5-87.334.300114.5L210 L226 A230 T242 L258 Y261 A263L210-Q232 HydrophobicContact CD2-CB 3.71Å; L226-Q232 HydrophobicContact CD2-CB 4.23Å; A230-Q232 PolarHBondContact O-N 3.25Å; A230-Q232 PolarHBondContact O-OE1 3.29Å; Q232-T242 WeakPolarHBondContact O-CB 3.39Å; Q232-T242 PolarHBondContact O-N 3.04Å; Q232-T242 PolarHBondContact O-OG1 3.36Å; Q232-L258 HydrophobicContact CB-CD2 4.11Å; Q232-Y261 PolarHBondContact NE2-O 2.81Å; Q232-A263 HydrophobicContact CG-CB 3.75Å
233N98.1Very high97.2Very high60 Ų6033.1 Ų33.132%0.32118%0.184SC..THydrogen-bonded Turntrans-93.5-5.7-176.6-65.3-42.1000113.2D231 P235 G262 A263 D264D231-N233 WeakPolarHBondContact OD1-CB 3.37Å; D231-N233 PolarHBondContact OD1-N 3.28Å; N233-P235 VanDerWaalsContact O-CD 3.29Å; N233-P235 WeakPolarHBondContact O-CD 3.44Å; N233-G262 PolarHBondContact ND2-O 3.49Å; N233-G262 VanDerWaalsContact ND2-O 3.15Å; N233-A263 WeakPolarHBondContact OD1-CA 3.31Å; N233-D264 PolarHBondContact OD1-N 3.48Å
234I98.1Very high97.2Very high31 Ų3130.7 Ų30.716%0.15917%0.171CC..  trans-63.9121.2173.2-63.4175.8000108.9N200 L202 T208 I211 D231N200-I234 HydrophobicContact CB-CD1 3.57Å; L202-I234 HydrophobicContact CD2-CG2 3.83Å; T208-I234 HydrophobicContact CG2-CB 4.03Å; T208-I234 HydrophobicContact CG2-CD1 3.99Å; T208-I234 HydrophobicContact CG2-CG2 3.86Å; I211-I234 WeakPolarHBondContact CD1-O 3.5Å; D231-I234 HydrophobicContact CB-CD1 3.79Å; D231-I234 HydrophobicContact CB-CG1 3.95Å
235P97.2Very high97.2Very high66 Ų6629.9 Ų29.943%0.42917%0.167SC..  trans-84.3150.5177.232.9-33000111.7N233 N240 T241N233-P235 VanDerWaalsContact O-CD 3.29Å; N233-P235 WeakPolarHBondContact O-CD 3.44Å; P235-N240 WeakPolarHBondContact CA-O 3.45Å; P235-T241 HydrophobicContact CB-CG2 4.37Å
236D96.3Very high97.2Very high7 Ų729.9 Ų29.94%0.03717%0.167CC..  trans-76.9-173.5169.983.1-15.5000112.8R207 I211 Y238 G239 N240 Y245R207-D236 HydrophobicContact CG-CB 3.69Å; R207-D236 IonicContact NE-OD2 3.11Å; I211-D236 HydrophobicContact CD1-CB 4.33Å; D236-Y238 PolarHBondContact O-N 3.15Å; D236-Y238 VanDerWaalsContact O-N 3.11Å; D236-Y238 WeakPolarHBondContact OD1-CA 3.38Å; D236-Y238 WeakPolarHBondContact OD1-CB 3.39Å; D236-Y238 PolarHBondContact OD1-N 3.43Å; D236-Y238 WeakPolarHBondContact OD2-CD2 3.39Å; D236-G239 PolarHBondContact O-N 3.31Å; D236-G239 PolarHBondContact OD1-N 3.01Å; D236-G239 VanDerWaalsContact OD1-N 3.16Å; D236-N240 PolarHBondContact N-O 3.19Å; D236-N240 WeakPolarHBondContact OD1-CB 3.48Å; D236-N240 PolarHBondContact OD1-N 2.93Å; D236-Y245 PolarHBondContact OD2-OH 3.49Å
237E95.6Very high97.3Very high58 Ų5829.6 Ų29.627%0.27117%0.166SC..THydrogen-bonded Turntrans-62.1-18.3179.472.8-177.1145.300114.1K205 K206 K270K205-E237 HydrophobicContact CB-CG 4.35Å; K205-E237 WeakPolarHBondContact CB-OE1 3.36Å; K205-E237 WeakPolarHBondContact CD-OE1 3.45Å; K205-E237 WeakPolarHBondContact CG-OE1 3.34Å; K205-E237 WeakPolarHBondContact O-CB 3.44Å; K205-E237 WeakPolarHBondContact O-CG 3.35Å; K205-E237 PolarHBondContact O-N 2.9Å; K206-E237 HydrophobicContact CB-CB 4.39Å; K206-E237 HydrophobicContact CD-CB 4.38Å; K206-E237 HydrophobicContact CG-CB 4.29Å; E237-K270 WeakPolarHBondContact O-CE 3.5Å; E237-K270 PolarHBondContact O-NZ 3.11Å
238Y94.6Very high97.2Very high46 Ų4625.7 Ų25.718%0.1815%0.147CC..THydrogen-bonded Turntrans-96.81.2178-57.6-85.9000112.4D124 A127 D236 N240 K270D124-Y238 WeakPolarHBondContact OD2-CE1 3.29Å; A127-Y238 HydrophobicContact CB-CD1 4.2Å; A127-Y238 HydrophobicContact CB-CD2 3.26Å; A127-Y238 HydrophobicContact CB-CE2 3.74Å; A127-Y238 HydrophobicContact CB-CG 3.52Å; D236-Y238 PolarHBondContact O-N 3.15Å; D236-Y238 VanDerWaalsContact O-N 3.11Å; D236-Y238 WeakPolarHBondContact OD1-CA 3.38Å; D236-Y238 WeakPolarHBondContact OD1-CB 3.39Å; D236-Y238 PolarHBondContact OD1-N 3.43Å; D236-Y238 WeakPolarHBondContact OD2-CD2 3.39Å; Y238-N240 VanDerWaalsContact C-N 3.25Å; Y238-K270 VanDerWaalsContact O-CB 3.29Å; Y238-K270 WeakPolarHBondContact O-CB 3.33Å; Y238-K270 VanDerWaalsContact O-CG 3.32Å; Y238-K270 WeakPolarHBondContact O-CG 3.45Å; Y238-K270 PolarHBondContact O-N 2.93Å
239G95.7Very high97.1Very high13 Ų1323.5 Ų23.513%0.13414%0.139CC..SBendtrans80.64.8-174.400000113.2D236 T241 N269D236-G239 PolarHBondContact O-N 3.31Å; D236-G239 PolarHBondContact OD1-N 3.01Å; D236-G239 VanDerWaalsContact OD1-N 3.16Å; G239-T241 PolarHBondContact O-N 3.45Å; G239-N269 WeakPolarHBondContact O-CA 3.36Å
240N97.2Very high97.2Very high3 Ų325 Ų252%0.01613%0.131CC..  trans-79.7122.6-179.5-67.6-49.5000109.6A127 F128 P235 D236 Y238 H244 Y245 N269A127-N240 VanDerWaalsContact CB-ND2 3.32Å; A127-N240 WeakPolarHBondContact CB-ND2 3.28Å; F128-N240 HydrophobicContact CZ-CB 4.49Å; P235-N240 WeakPolarHBondContact CA-O 3.45Å; D236-N240 PolarHBondContact N-O 3.19Å; D236-N240 WeakPolarHBondContact OD1-CB 3.48Å; D236-N240 PolarHBondContact OD1-N 2.93Å; Y238-N240 VanDerWaalsContact C-N 3.25Å; N240-H244 HydrophobicContact CB-CB 3.94Å; N240-Y245 HydrophobicContact CB-CD2 4.35Å; N240-Y245 HydrophobicContact CB-CE2 3.87Å; N240-N269 VanDerWaalsContact OD1-CB 3.28Å; N240-N269 WeakPolarHBondContact OD1-CB 3.42Å; N240-N269 PolarHBondContact OD1-ND2 2.72Å
241T98.1Very high97.2Very high5 Ų526.3 Ų26.33%0.03114%0.138CC..  trans-82.4173170.864.40000110.9P235 G239 L243 H244 Y245 S267P235-T241 HydrophobicContact CB-CG2 4.37Å; G239-T241 PolarHBondContact O-N 3.45Å; T241-L243 PolarHBondContact O-N 3.13Å; T241-H244 PolarHBondContact N-ND1 3.4Å; T241-H244 VanDerWaalsContact N-ND1 3.2Å; T241-H244 WeakPolarHBondContact O-CB 3.47Å; T241-H244 PolarHBondContact O-N 2.94Å; T241-H244 PolarHBondContact OG1-ND1 2.95Å; T241-Y245 WeakPolarHBondContact O-CD2 3.21Å; T241-Y245 PolarHBondContact O-N 3.12Å; T241-S267 PolarHBondContact OG1-OG 3.46Å
242T97.9Very high97.2Very high0 Ų028 Ų280%014%0.142CC..Hα-helixtrans-56.4-35.1177.2-45.70000112.3L210 V214 Q232 Y245 A246 L258L210-T242 HydrophobicContact CD1-CG2 4.44Å; L210-T242 HydrophobicContact CD2-CG2 4.28Å; L210-T242 HydrophobicContact CG-CG2 3.9Å; V214-T242 HydrophobicContact CB-CG2 4.05Å; V214-T242 HydrophobicContact CG1-CG2 4.45Å; V214-T242 HydrophobicContact CG2-CG2 3.51Å; Q232-T242 WeakPolarHBondContact O-CB 3.39Å; Q232-T242 PolarHBondContact O-N 3.04Å; Q232-T242 PolarHBondContact O-OG1 3.36Å; T242-Y245 PolarHBondContact O-N 2.96Å; T242-A246 PolarHBondContact O-N 2.93Å; T242-A246 VanDerWaalsContact O-N 3.13Å; T242-L258 HydrophobicContact CG2-CD1 3.84Å; T242-L258 HydrophobicContact CG2-CD2 3.57Å; T242-L258 HydrophobicContact CG2-CG 4.38Å
243L98.4Very high97.1Very high0 Ų031.9 Ų31.90%016%0.163CC..Hα-helixtrans-67.3-35.1178.2-175.258.3000112.4T241 Y245 A246 V247 A255 L258 L259 A263 P275T241-L243 PolarHBondContact O-N 3.13Å; L243-Y245 VanDerWaalsContact C-N 3.31Å; L243-Y245 PolarHBondContact O-N 3.3Å; L243-A246 PolarHBondContact O-N 3.37Å; L243-V247 VanDerWaalsContact O-CG2 3.31Å; L243-V247 WeakPolarHBondContact O-CG2 3.37Å; L243-V247 PolarHBondContact O-N 3.04Å; L243-A255 HydrophobicContact CD1-CB 3.9Å; L243-L258 HydrophobicContact CD1-CB 4.44Å; L243-L258 HydrophobicContact CD1-CD1 4.38Å; L243-L259 HydrophobicContact CD2-CD2 3.8Å; L243-L259 HydrophobicContact CD2-CG 4.45Å; L243-A263 HydrophobicContact CB-CB 4.37Å; L243-A263 HydrophobicContact CD2-CB 4.3Å; L243-P275 HydrophobicContact CB-CG 4.38Å; L243-P275 HydrophobicContact CD2-CB 4.02Å; L243-P275 HydrophobicContact CD2-CG 3.71Å; L243-P275 HydrophobicContact CG-CB 3.99Å; L243-P275 HydrophobicContact CG-CG 3.89Å
244H98.3Very high97.2Very high0 Ų029.5 Ų29.50%015%0.15CC..Hα-helixtrans-60.7-42.1173.9-69.682.2000111.4N240 T241 V247 H248 S267 L273 L278N240-H244 HydrophobicContact CB-CB 3.94Å; T241-H244 PolarHBondContact N-ND1 3.4Å; T241-H244 VanDerWaalsContact N-ND1 3.2Å; T241-H244 WeakPolarHBondContact O-CB 3.47Å; T241-H244 PolarHBondContact O-N 2.94Å; T241-H244 PolarHBondContact OG1-ND1 2.95Å; H244-V247 WeakPolarHBondContact O-CB 3.4Å; H244-V247 PolarHBondContact O-N 3.16Å; H244-H248 PolarHBondContact O-N 3.01Å; H244-S267 PolarHBondContact CE1-O 3.44Å; H244-S267 PolarHBondContact CE1-OG 3.26Å; H244-S267 PolarHBondContact NE2-O 2.99Å; H244-L273 PolarHBondContact NE2-O 2.89Å; H244-L273 VanDerWaalsContact NE2-O 3.14Å; H244-L278 HydrophobicContact CB-CD2 3.78Å; H244-L278 WeakPolarHBondContact O-CD2 3.35Å
245Y97.9Very high97.2Very high0 Ų028 Ų280%014%0.142CC..Hα-helixtrans-65.1-39.7176.3-78.9-80.4000112.9A127 F128 R207 I211 Q215 D236 N240 T241 T242 L243 V247 H248 N249A127-Y245 PolarHBondContact O-OH 2.87Å; F128-Y245 AromaticContact CD1-CD1 3.69Å; F128-Y245 HydrophobicContact CD1-CD1 3.69Å; F128-Y245 AromaticContact CD1-CE1 3.63Å; F128-Y245 HydrophobicContact CD1-CE1 3.63Å; F128-Y245 HydrophobicContact CD1-CG 4.47Å; F128-Y245 AromaticContact CE1-CD1 3.97Å; F128-Y245 HydrophobicContact CE1-CD1 3.97Å; F128-Y245 HydrophobicContact CE1-CE1 4.04Å; F128-Y245 HydrophobicContact CE1-CG 4.31Å; R207-Y245 VanDerWaalsContact CZ-OH 3.31Å; R207-Y245 PolarHBondContact NE-OH 3.37Å; R207-Y245 VanDerWaalsContact NE-OH 3.17Å; R207-Y245 PolarHBondContact NH2-OH 2.99Å; I211-Y245 HydrophobicContact CG2-CD2 3.63Å; I211-Y245 HydrophobicContact CG2-CE2 3.4Å; I211-Y245 VanDerWaalsContact CG2-CE2 3.4Å; I211-Y245 HydrophobicContact CG2-CG 4.32Å; Q215-Y245 HydrophobicContact CB-CD1 3.88Å; Q215-Y245 HydrophobicContact CB-CE1 4.18Å; Q215-Y245 HydrophobicContact CG-CD1 3.8Å; Q215-Y245 HydrophobicContact CG-CE1 3.8Å; D236-Y245 PolarHBondContact OD2-OH 3.49Å; N240-Y245 HydrophobicContact CB-CD2 4.35Å; N240-Y245 HydrophobicContact CB-CE2 3.87Å; T241-Y245 WeakPolarHBondContact O-CD2 3.21Å; T241-Y245 PolarHBondContact O-N 3.12Å; T242-Y245 PolarHBondContact O-N 2.96Å; L243-Y245 VanDerWaalsContact C-N 3.31Å; L243-Y245 PolarHBondContact O-N 3.3Å; Y245-V247 VanDerWaalsContact C-N 3.31Å; Y245-V247 PolarHBondContact O-N 3.11Å; Y245-H248 PolarHBondContact O-N 2.96Å; Y245-N249 PolarHBondContact O-N 2.65Å; Y245-N249 VanDerWaalsContact O-N 3.08Å
246A98.1Very high97.2Very high0 Ų029.2 Ų29.20%014%0.141CC..Hα-helixtrans-63.5-38.5174.600000112V214 T242 L243 E250 D251 M254 A255 L258V214-A246 HydrophobicContact CG1-CB 4.09Å; T242-A246 PolarHBondContact O-N 2.93Å; T242-A246 VanDerWaalsContact O-N 3.13Å; L243-A246 PolarHBondContact O-N 3.37Å; A246-E250 PolarHBondContact O-N 2.86Å; A246-D251 PolarHBondContact O-N 2.85Å; A246-M254 HydrophobicContact CB-CB 4.19Å; A246-M254 HydrophobicContact CB-CG 4.02Å; A246-A255 HydrophobicContact CB-CB 4.29Å; A246-L258 HydrophobicContact CB-CD1 3.71Å
247V98Very high97.3Very high0 Ų029.5 Ų29.50%014%0.144CC..Hα-helixtrans-63.8-48.7174173.20000111.2L243 H244 Y245 N249 E250 P275 L278 K284 V287 L291L243-V247 VanDerWaalsContact O-CG2 3.31Å; L243-V247 WeakPolarHBondContact O-CG2 3.37Å; L243-V247 PolarHBondContact O-N 3.04Å; H244-V247 WeakPolarHBondContact O-CB 3.4Å; H244-V247 PolarHBondContact O-N 3.16Å; Y245-V247 VanDerWaalsContact C-N 3.31Å; Y245-V247 PolarHBondContact O-N 3.11Å; V247-N249 PolarHBondContact O-N 3.23Å; V247-E250 PolarHBondContact O-N 3.35Å; V247-P275 WeakPolarHBondContact CG1-O 3.45Å; V247-P275 HydrophobicContact CG2-CB 3.98Å; V247-L278 HydrophobicContact CB-CD2 4.36Å; V247-L278 HydrophobicContact CG1-CB 4.45Å; V247-L278 HydrophobicContact CG1-CD2 4.32Å; V247-L278 HydrophobicContact CG1-CG 4.23Å; V247-K284 WeakPolarHBondContact O-CG 3.44Å; V247-V287 HydrophobicContact CB-CG1 4.3Å; V247-V287 HydrophobicContact CG1-CG1 4.35Å; V247-V287 HydrophobicContact CG2-CG1 3.76Å; V247-L291 HydrophobicContact CG2-CD1 3.98Å
248H96.4Very high97.4Very high37 Ų3726.7 Ų26.717%0.17113%0.131CC..Hα-helixtrans-55.8-40.9179.2-17982000112F128 H244 Y245 E250 E282 K284F128-H248 WeakPolarHBondContact CB-CE1 3.35Å; F128-H248 WeakPolarHBondContact CB-NE2 3.46Å; F128-H248 HydrophobicContact CD1-CB 3.6Å; F128-H248 AromaticContact CD1-CD2 3.84Å; F128-H248 AromaticContact CD1-CG 3.39Å; F128-H248 AromaticContact CD1-ND1 3.68Å; F128-H248 AromaticContact CD2-ND1 3.76Å; F128-H248 HydrophobicContact CE1-CB 3.73Å; F128-H248 AromaticContact CE1-CG 3.98Å; F128-H248 HydrophobicContact CG-CB 4.27Å; F128-H248 AromaticContact CG-CD2 3.92Å; F128-H248 AromaticContact CG-CE1 3.67Å; F128-H248 AromaticContact CG-CG 3.59Å; F128-H248 AromaticContact CG-ND1 3.41Å; F128-H248 WeakPolarHBondContact CG-ND1 3.41Å; F128-H248 AromaticContact CG-NE2 3.99Å; F128-H248 HydrophobicContact CZ-CB 4.48Å; H244-H248 PolarHBondContact O-N 3.01Å; Y245-H248 PolarHBondContact O-N 2.96Å; H248-E250 PolarHBondContact O-N 2.93Å; H248-E282 WeakPolarHBondContact CA-OE2 3.36Å; H248-E282 IonicContact CE1-OE1 2.71Å; H248-E282 PolarHBondContact CE1-OE1 3.44Å; H248-E282 IonicContact CE1-OE2 3.05Å; H248-E282 IonicContact CG-OE1 2.76Å; H248-E282 IonicContact CG-OE2 2.81Å; H248-E282 IonicContact ND1-OE1 3.19Å; H248-E282 PolarHBondContact ND1-OE1 2.94Å; H248-E282 IonicContact ND1-OE2 2.73Å; H248-E282 PolarHBondContact ND1-OE2 2.74Å; H248-K284 WeakPolarHBondContact O-CE 3.38Å; H248-K284 PolarHBondContact O-NZ 2.96Å
249N95.6Very high97.6Very high36 Ų3626.2 Ų26.219%0.19313%0.131CC..THydrogen-bonded Turntrans-73.7-2177.8-70.7-13.3000114.3V214 Q217 Y245 V247 D251V214-N249 PolarHBondContact O-ND2 2.84Å; Q217-N249 HydrophobicContact CG-CB 4.48Å; Y245-N249 PolarHBondContact O-N 2.65Å; Y245-N249 VanDerWaalsContact O-N 3.08Å; V247-N249 PolarHBondContact O-N 3.23Å; N249-D251 HydrophobicContact CB-CB 4.34Å; N249-D251 PolarHBondContact O-N 2.86Å
250E96.8Very high97.6Very high85 Ų8531.9 Ų31.940%0.39716%0.158SC..THydrogen-bonded Turntrans57.124.6-169.8-149.3174.9-179.900113.8A246 V247 H248 K252 K284 V287A246-E250 PolarHBondContact O-N 2.86Å; V247-E250 PolarHBondContact O-N 3.35Å; H248-E250 PolarHBondContact O-N 2.93Å; E250-K252 PolarHBondContact O-N 3.27Å; E250-K284 HydrophobicContact CB-CD 3.95Å; E250-K284 HydrophobicContact CG-CB 4.17Å; E250-K284 HydrophobicContact CG-CD 4.09Å; E250-V287 VanDerWaalsContact C-CG2 3.45Å; E250-V287 HydrophobicContact CG-CG2 4.23Å
251D97.3Very high97.7Very high31 Ų3136 Ų3617%0.16617%0.174CC..  trans-9189.7-175.3-167.5-17.9000111.8A246 N249 L253 M254 A255A246-D251 PolarHBondContact O-N 2.85Å; N249-D251 HydrophobicContact CB-CB 4.34Å; N249-D251 PolarHBondContact O-N 2.86Å; D251-L253 VanDerWaalsContact C-N 3.29Å; D251-L253 PolarHBondContact O-N 3.07Å; D251-L253 PolarHBondContact OD1-N 3.18Å; D251-M254 HydrophobicContact CB-CB 3.89Å; D251-M254 PolarHBondContact O-N 3.26Å; D251-M254 PolarHBondContact OD1-N 3.41Å; D251-M254 WeakPolarHBondContact OD2-CB 3.47Å; D251-A255 WeakPolarHBondContact O-CB 3.46Å; D251-A255 PolarHBondContact O-N 3.04Å
252K97.5Very high97.6Very high94 Ų9437.9 Ų37.941%0.40919%0.194SC..Hα-helixtrans-62-33.8175.9177.2-177.7166.9-167.20113.1E250 K256 V287 F290E250-K252 PolarHBondContact O-N 3.27Å; K252-K256 WeakPolarHBondContact O-CB 3.34Å; K252-K256 PolarHBondContact O-N 2.83Å; K252-V287 HydrophobicContact CB-CG2 4.24Å; K252-F290 HydrophobicContact CD-CB 4.08Å; K252-F290 HydrophobicContact CD-CG 4.4Å; K252-F290 HydrophobicContact CG-CB 3.9Å; K252-F290 HydrophobicContact CG-CD1 4.29Å; K252-F290 HydrophobicContact CG-CD2 4.19Å; K252-F290 HydrophobicContact CG-CG 3.86Å
253L97.1Very high97.6Very high97 Ų9738.3 Ų38.351%0.50820%0.198SC..Hα-helixtrans-72.7-42.8-177.9-67-179.7000109.9W27 D251 K256 A257W27-L253 HydrophobicContact CH2-CD2 4.22Å; W27-L253 HydrophobicContact CZ3-CB 4.17Å; W27-L253 HydrophobicContact CZ3-CD1 4.11Å; W27-L253 HydrophobicContact CZ3-CD2 4.19Å; W27-L253 HydrophobicContact CZ3-CG 4.39Å; D251-L253 VanDerWaalsContact C-N 3.29Å; D251-L253 PolarHBondContact O-N 3.07Å; D251-L253 PolarHBondContact OD1-N 3.18Å; L253-K256 WeakPolarHBondContact O-CB 3.34Å; L253-K256 PolarHBondContact O-N 2.82Å; L253-A257 PolarHBondContact O-N 3.37Å
254M98.2Very high97.6Very high10 Ų1042 Ų425%0.04922%0.217CC..Hα-helixtrans-64.5-45.3174.3-169.754.767.100111.8V214 D219 V222 A246 D251 K256 A257 L258V214-M254 HydrophobicContact CG1-CG 4.14Å; V214-M254 HydrophobicContact CG2-CG 4.08Å; V214-M254 HydrophobicContact CG2-SD 4.17Å; D219-M254 HydrophobicContact CB-CE 4.08Å; D219-M254 WeakPolarHBondContact OD1-CE 3.33Å; V222-M254 HydrophobicContact CB-CE 3.82Å; V222-M254 HydrophobicContact CB-SD 4.03Å; V222-M254 HydrophobicContact CG1-CE 3.84Å; V222-M254 HydrophobicContact CG1-SD 3.34Å; V222-M254 WeakPolarHBondContact CG1-SD 3.31Å; V222-M254 HydrophobicContact CG2-CE 3.9Å; V222-M254 HydrophobicContact CG2-SD 4.28Å; A246-M254 HydrophobicContact CB-CB 4.19Å; A246-M254 HydrophobicContact CB-CG 4.02Å; D251-M254 HydrophobicContact CB-CB 3.89Å; D251-M254 PolarHBondContact O-N 3.26Å; D251-M254 PolarHBondContact OD1-N 3.41Å; D251-M254 WeakPolarHBondContact OD2-CB 3.47Å; M254-K256 PolarHBondContact O-N 2.81Å; M254-A257 WeakPolarHBondContact O-CB 3.31Å; M254-A257 PolarHBondContact O-N 3.28Å; M254-L258 HydrophobicContact CG-CD1 4.11Å; M254-L258 HydrophobicContact CG-CG 4.44Å; M254-L258 WeakPolarHBondContact O-CG 3.5Å; M254-L258 PolarHBondContact O-N 3.03Å; M254-L258 HydrophobicContact SD-CG 4.47Å
255A98.2Very high97.6Very high0 Ų043.4 Ų43.40%023%0.225CC..Hα-helixtrans-56.9-4017400000111.8L243 A246 D251 L259 V287 F290L243-A255 HydrophobicContact CD1-CB 3.9Å; A246-A255 HydrophobicContact CB-CB 4.29Å; D251-A255 WeakPolarHBondContact O-CB 3.46Å; D251-A255 PolarHBondContact O-N 3.04Å; A255-L259 VanDerWaalsContact O-CG 3.31Å; A255-L259 WeakPolarHBondContact O-CG 3.43Å; A255-L259 PolarHBondContact O-N 3.5Å; A255-L259 VanDerWaalsContact O-N 3.1Å; A255-V287 HydrophobicContact CB-CG1 4.42Å; A255-F290 HydrophobicContact CB-CD1 4.32Å; A255-F290 HydrophobicContact CB-CE1 4.08Å
256K98.1Very high97.6Very high91 Ų9146.1 Ų46.140%0.39624%0.237SC..Hα-helixtrans-64.2-43.3174.7-178.1-175.1175.1-172.30112.2K252 L253 M254 L260 F290K252-K256 WeakPolarHBondContact O-CB 3.34Å; K252-K256 PolarHBondContact O-N 2.83Å; L253-K256 WeakPolarHBondContact O-CB 3.34Å; L253-K256 PolarHBondContact O-N 2.82Å; M254-K256 PolarHBondContact O-N 2.81Å; K256-L260 HydrophobicContact CG-CD1 4.29Å; K256-L260 WeakPolarHBondContact O-CG 3.49Å; K256-L260 PolarHBondContact O-N 3.13Å; K256-L260 VanDerWaalsContact O-N 3.14Å; K256-F290 HydrophobicContact CB-CE1 4.22Å; K256-F290 HydrophobicContact CB-CE2 4.14Å; K256-F290 HydrophobicContact CB-CZ 3.59Å; K256-F290 HydrophobicContact CG-CE2 4.31Å; K256-F290 HydrophobicContact CG-CZ 4.02Å
257A97.7Very high97.5Very high13 Ų1346.8 Ų46.811%0.10724%0.242CC..Hα-helixtrans-61.8-50.5177.300000110.8L223 L253 M254 L259 L260 Y261L223-A257 HydrophobicContact CD2-CB 4.47Å; L253-A257 PolarHBondContact O-N 3.37Å; M254-A257 WeakPolarHBondContact O-CB 3.31Å; M254-A257 PolarHBondContact O-N 3.28Å; A257-L259 VanDerWaalsContact C-N 3.34Å; A257-L259 PolarHBondContact O-N 3.5Å; A257-L260 WeakPolarHBondContact O-CB 3.48Å; A257-L260 PolarHBondContact O-N 3.08Å; A257-Y261 WeakPolarHBondContact O-CD2 3.46Å; A257-Y261 PolarHBondContact O-N 3.3Å; A257-Y261 VanDerWaalsContact O-N 3.12Å
258L98.2Very high97.4Very high0 Ų052.4 Ų52.40%027%0.267CS..Hα-helixtrans-57.2-44.2179.8-68169000112.6L226 Q232 T242 L243 A246 M254 L260 Y261 G262 A263L226-L258 HydrophobicContact CD1-CD2 4.04Å; L226-L258 HydrophobicContact CD2-CD2 4.17Å; Q232-L258 HydrophobicContact CB-CD2 4.11Å; T242-L258 HydrophobicContact CG2-CD1 3.84Å; T242-L258 HydrophobicContact CG2-CD2 3.57Å; T242-L258 HydrophobicContact CG2-CG 4.38Å; L243-L258 HydrophobicContact CD1-CB 4.44Å; L243-L258 HydrophobicContact CD1-CD1 4.38Å; A246-L258 HydrophobicContact CB-CD1 3.71Å; M254-L258 HydrophobicContact CG-CD1 4.11Å; M254-L258 HydrophobicContact CG-CG 4.44Å; M254-L258 WeakPolarHBondContact O-CG 3.5Å; M254-L258 PolarHBondContact O-N 3.03Å; M254-L258 HydrophobicContact SD-CG 4.47Å; L258-L260 VanDerWaalsContact C-N 3.33Å; L258-L260 PolarHBondContact O-N 3.36Å; L258-Y261 PolarHBondContact O-N 2.76Å; L258-G262 PolarHBondContact O-N 2.92Å; L258-A263 VanDerWaalsContact C-CB 3.49Å; L258-A263 HydrophobicContact CB-CB 3.9Å; L258-A263 WeakPolarHBondContact O-CB 3.3Å; L258-A263 PolarHBondContact O-N 3.35Å
259L98Very high97.4Very high35 Ų3551.2 Ų51.218%0.18326%0.261CS..Hα-helixtrans-64.5-35.4176-70.1175.9000112.8L243 A255 A257 Y261 G262 A263 I265 F290 L291 K294L243-L259 HydrophobicContact CD2-CD2 3.8Å; L243-L259 HydrophobicContact CD2-CG 4.45Å; A255-L259 VanDerWaalsContact O-CG 3.31Å; A255-L259 WeakPolarHBondContact O-CG 3.43Å; A255-L259 PolarHBondContact O-N 3.5Å; A255-L259 VanDerWaalsContact O-N 3.1Å; A257-L259 VanDerWaalsContact C-N 3.34Å; A257-L259 PolarHBondContact O-N 3.5Å; L259-Y261 VanDerWaalsContact C-N 3.27Å; L259-Y261 PolarHBondContact O-N 3.05Å; L259-G262 PolarHBondContact O-N 3.21Å; L259-G262 VanDerWaalsContact O-N 3.16Å; L259-A263 HydrophobicContact CD2-CB 4.35Å; L259-A263 WeakPolarHBondContact CD2-O 3.43Å; L259-I265 HydrophobicContact CD1-CD1 4.24Å; L259-I265 HydrophobicContact CD2-CB 3.84Å; L259-I265 HydrophobicContact CD2-CD1 4.28Å; L259-I265 HydrophobicContact CD2-CG1 4.19Å; L259-F290 HydrophobicContact CD1-CE1 3.75Å; L259-F290 HydrophobicContact CD1-CZ 4.06Å; L259-L291 HydrophobicContact CD1-CD2 4.4Å; L259-K294 HydrophobicContact CD1-CB 4.33Å; L259-K294 HydrophobicContact CD1-CG 3.99Å
260L97.6Very high97.3Very high132 Ų13257 Ų5769%0.69129%0.285SS*.Hα-helixtrans-64.7-33.8175.1-77164.9000112.2K256 A257 L258 G262K256-L260 HydrophobicContact CG-CD1 4.29Å; K256-L260 WeakPolarHBondContact O-CG 3.49Å; K256-L260 PolarHBondContact O-N 3.13Å; K256-L260 VanDerWaalsContact O-N 3.14Å; A257-L260 WeakPolarHBondContact O-CB 3.48Å; A257-L260 PolarHBondContact O-N 3.08Å; L258-L260 VanDerWaalsContact C-N 3.33Å; L258-L260 PolarHBondContact O-N 3.36Å; L260-G262 VanDerWaalsContact C-N 3.27Å
261Y97.5Very high96.9Very high90 Ų9054 Ų5435%0.35327%0.273SS..THydrogen-bonded Turntrans-81.5-2.9176-79.6-84.2000113.4L226 E227 Q232 A257 L258 L259L226-Y261 HydrophobicContact CB-CD1 3.99Å; L226-Y261 HydrophobicContact CB-CD2 3.97Å; L226-Y261 HydrophobicContact CB-CE1 4.02Å; L226-Y261 HydrophobicContact CB-CE2 4Å; L226-Y261 HydrophobicContact CB-CG 3.97Å; L226-Y261 HydrophobicContact CD1-CD2 3.8Å; L226-Y261 HydrophobicContact CD1-CE2 4.19Å; L226-Y261 HydrophobicContact CD1-CG 4.31Å; L226-Y261 HydrophobicContact CD2-CG 4.3Å; L226-Y261 HydrophobicContact CG-CD2 4.35Å; L226-Y261 HydrophobicContact CG-CG 4.43Å; E227-Y261 VanDerWaalsContact CG-OH 3.3Å; E227-Y261 WeakPolarHBondContact CG-OH 3.42Å; Q232-Y261 PolarHBondContact NE2-O 2.81Å; A257-Y261 WeakPolarHBondContact O-CD2 3.46Å; A257-Y261 PolarHBondContact O-N 3.3Å; A257-Y261 VanDerWaalsContact O-N 3.12Å; L258-Y261 PolarHBondContact O-N 2.76Å; L259-Y261 VanDerWaalsContact C-N 3.27Å; L259-Y261 PolarHBondContact O-N 3.05Å
262G96.8Very high96.7Very high44 Ų4453.2 Ų53.245%0.45427%0.273SS..THydrogen-bonded Turntrans98.428.7177.600000115.3N233 L258 L259 L260N233-G262 PolarHBondContact ND2-O 3.49Å; N233-G262 VanDerWaalsContact ND2-O 3.15Å; L258-G262 PolarHBondContact O-N 2.92Å; L259-G262 PolarHBondContact O-N 3.21Å; L259-G262 VanDerWaalsContact O-N 3.16Å; L260-G262 VanDerWaalsContact C-N 3.27Å
263A97.9Very high96.7Very high10 Ų1049 Ų498%0.08325%0.254CS..  trans-62.7137.8170.600000110.9Q232 N233 L243 L258 L259 I265Q232-A263 HydrophobicContact CG-CB 3.75Å; N233-A263 WeakPolarHBondContact OD1-CA 3.31Å; L243-A263 HydrophobicContact CB-CB 4.37Å; L243-A263 HydrophobicContact CD2-CB 4.3Å; L258-A263 VanDerWaalsContact C-CB 3.49Å; L258-A263 HydrophobicContact CB-CB 3.9Å; L258-A263 WeakPolarHBondContact O-CB 3.3Å; L258-A263 PolarHBondContact O-N 3.35Å; L259-A263 HydrophobicContact CD2-CB 4.35Å; L259-A263 WeakPolarHBondContact CD2-O 3.43Å; A263-I265 PolarHBondContact O-N 3.12Å
264D98Very high96.7Very high76 Ų7644.3 Ų44.341%0.40623%0.23SC..  trans-75.4109.9175.6-179.111.5000110.9N233 E266 S267N233-D264 PolarHBondContact OD1-N 3.48Å; D264-E266 PolarHBondContact O-N 3.21Å; D264-E266 PolarHBondContact OD1-N 2.98Å; D264-S267 PolarHBondContact O-N 3.13Å; D264-S267 PolarHBondContact O-OG 3.21Å; D264-S267 PolarHBondContact OD2-N 3.22Å
265I98.1Very high96.7Very high30 Ų3043.9 Ų43.915%0.15423%0.228CC..THydrogen-bonded Turntrans-68.8-18.4179-163.2168.6000113.1L259 A263 P275 L291 K294 A296L259-I265 HydrophobicContact CD1-CD1 4.24Å; L259-I265 HydrophobicContact CD2-CB 3.84Å; L259-I265 HydrophobicContact CD2-CD1 4.28Å; L259-I265 HydrophobicContact CD2-CG1 4.19Å; A263-I265 PolarHBondContact O-N 3.12Å; I265-P275 WeakPolarHBondContact O-CD 3.34Å; I265-L291 HydrophobicContact CD1-CD2 3.96Å; I265-L291 HydrophobicContact CG1-CD2 4.04Å; I265-K294 HydrophobicContact CD1-CB 3.79Å; I265-A296 HydrophobicContact CD1-CB 3.79Å; I265-A296 HydrophobicContact CG1-CB 4.01Å
266E98Very high96.7Very high57 Ų5743.9 Ų43.927%0.26623%0.228SC..THydrogen-bonded Turntrans-107.95.7-177.1-59.5-53.5140.800113.4D264 K268 A296 N297D264-E266 PolarHBondContact O-N 3.21Å; D264-E266 PolarHBondContact OD1-N 2.98Å; E266-K268 PolarHBondContact O-N 2.92Å; E266-A296 WeakPolarHBondContact OE1-CA 3.49Å; E266-N297 PolarHBondContact OE1-N 2.93Å; E266-N297 VanDerWaalsContact OE2-CB 3.24Å; E266-N297 WeakPolarHBondContact OE2-CB 3.34Å
267S97.3Very high96.6Very high14 Ų1439.5 Ų39.510%0.09821%0.209CC..  trans-55.3132.4177.4540000111T241 H244 D264 T274 P275T241-S267 PolarHBondContact OG1-OG 3.46Å; H244-S267 PolarHBondContact CE1-O 3.44Å; H244-S267 PolarHBondContact CE1-OG 3.26Å; H244-S267 PolarHBondContact NE2-O 2.99Å; D264-S267 PolarHBondContact O-N 3.13Å; D264-S267 PolarHBondContact O-OG 3.21Å; D264-S267 PolarHBondContact OD2-N 3.22Å; S267-T274 WeakPolarHBondContact O-CA 3.32Å; S267-P275 WeakPolarHBondContact O-CD 3.38Å
268K96.2Very high96.6Very high119 Ų11938.9 Ų38.952%0.51720%0.204SC..  trans-103.9131.8179.3-68.1-168.9179.5-160.30111.5E266 L273 T274 L301E266-K268 PolarHBondContact O-N 2.92Å; K268-L273 WeakPolarHBondContact CA-O 3.49Å; K268-T274 HydrophobicContact CG-CG2 3.93Å; K268-L301 PolarHBondContact NZ-O 2.84Å
269N95.3Very high96.5Very high11 Ų1138.9 Ų38.96%0.05920%0.204CC..  trans-78.9179168.675.610.7000112.3G239 N240 C271 G272 L273G239-N269 WeakPolarHBondContact O-CA 3.36Å; N240-N269 VanDerWaalsContact OD1-CB 3.28Å; N240-N269 WeakPolarHBondContact OD1-CB 3.42Å; N240-N269 PolarHBondContact OD1-ND2 2.72Å; N269-C271 PolarHBondContact O-N 3.28Å; N269-C271 VanDerWaalsContact O-N 3.16Å; N269-C271 WeakPolarHBondContact OD1-CA 3.39Å; N269-C271 WeakPolarHBondContact OD1-CB 3.32Å; N269-C271 PolarHBondContact OD1-N 3.08Å; N269-G272 WeakPolarHBondContact O-CA 2.99Å; N269-G272 PolarHBondContact O-N 2.85Å; N269-G272 PolarHBondContact OD1-N 3.36Å; N269-L273 PolarHBondContact N-O 3.24Å; N269-L273 WeakPolarHBondContact OD1-CB 3.29Å; N269-L273 PolarHBondContact OD1-N 3.1Å
270K93.2Very high96.4Very high158 Ų15837.2 Ų37.269%0.68720%0.195SC*.THydrogen-bonded Turntrans-63-20.3-179.7-75.8-176.3174.4177.90114.5E237 Y238E237-K270 WeakPolarHBondContact O-CE 3.5Å; E237-K270 PolarHBondContact O-NZ 3.11Å; Y238-K270 VanDerWaalsContact O-CB 3.29Å; Y238-K270 WeakPolarHBondContact O-CB 3.33Å; Y238-K270 VanDerWaalsContact O-CG 3.32Å; Y238-K270 WeakPolarHBondContact O-CG 3.45Å; Y238-K270 PolarHBondContact O-N 2.93Å
271C89.5Confident96.3Very high22 Ų2232.5 Ų32.515%0.14917%0.169CC..THydrogen-bonded Turntrans-83.82.1172.8-63.90000112.6Y123 N269 L273 R303Y123-C271 HydrophobicContact CD2-CB 4.46Å; N269-C271 PolarHBondContact O-N 3.28Å; N269-C271 VanDerWaalsContact O-N 3.16Å; N269-C271 WeakPolarHBondContact OD1-CA 3.39Å; N269-C271 WeakPolarHBondContact OD1-CB 3.32Å; N269-C271 PolarHBondContact OD1-N 3.08Å; C271-L273 HydrophobicContact CB-CD1 4.15Å; C271-L273 HydrophobicContact CB-CG 3.99Å; C271-L273 PolarHBondContact O-N 2.93Å; C271-R303 WeakPolarHBondContact O-CB 3.25Å; C271-R303 WeakPolarHBondContact O-CG 3.41Å; C271-R303 PolarHBondContact O-N 3.46Å
272G93.3Very high96.1Very high15 Ų1530 Ų3016%0.15516%0.161CC..SBendtrans74.88.8-174.700000113.6N269N269-G272 WeakPolarHBondContact O-CA 2.99Å; N269-G272 PolarHBondContact O-N 2.85Å; N269-G272 PolarHBondContact OD1-N 3.36Å
273L95.8Very high96Very high4 Ų432.7 Ų32.72%0.02116%0.162CC..  trans-81.3129.7-178.8-56.6175.2000109.7Y123 H244 K268 N269 C271 L277 L278 D302 L311Y123-L273 HydrophobicContact CD2-CD1 3.97Å; Y123-L273 HydrophobicContact CE2-CD1 3.53Å; H244-L273 PolarHBondContact NE2-O 2.89Å; H244-L273 VanDerWaalsContact NE2-O 3.14Å; K268-L273 WeakPolarHBondContact CA-O 3.49Å; N269-L273 PolarHBondContact N-O 3.24Å; N269-L273 WeakPolarHBondContact OD1-CB 3.29Å; N269-L273 PolarHBondContact OD1-N 3.1Å; C271-L273 HydrophobicContact CB-CD1 4.15Å; C271-L273 HydrophobicContact CB-CG 3.99Å; C271-L273 PolarHBondContact O-N 2.93Å; L273-L277 HydrophobicContact CB-CB 4.2Å; L273-L277 HydrophobicContact CD2-CB 3.87Å; L273-L278 HydrophobicContact CB-CB 4.45Å; L273-L278 HydrophobicContact CD1-CD1 4.31Å; L273-D302 HydrophobicContact CD2-CB 3.77Å; L273-L311 HydrophobicContact CD2-CD1 4.43Å
274T98Very high95.9Very high0 Ų034.3 Ų34.30%017%0.167CC..  trans-79.1166.3162.167.80000110.1S267 K268 L276 L277 L278 A300S267-T274 WeakPolarHBondContact O-CA 3.32Å; K268-T274 HydrophobicContact CG-CG2 3.93Å; T274-L276 PolarHBondContact O-N 3.27Å; T274-L276 VanDerWaalsContact O-N 3.13Å; T274-L276 PolarHBondContact OG1-N 2.95Å; T274-L277 PolarHBondContact O-N 3.13Å; T274-L277 WeakPolarHBondContact OG1-CG 3.32Å; T274-L277 PolarHBondContact OG1-N 3.39Å; T274-L278 WeakPolarHBondContact O-CB 3.34Å; T274-L278 PolarHBondContact O-N 3.34Å; T274-A300 HydrophobicContact CG2-CB 3.88Å
275P98.1Very high95.8Very high0 Ų034.2 Ų34.20%016%0.164CC..Hα-helixtrans-48.4-38.3170.4-31.734.2000113.8L243 V247 I265 S267 G279 L291L243-P275 HydrophobicContact CB-CG 4.38Å; L243-P275 HydrophobicContact CD2-CB 4.02Å; L243-P275 HydrophobicContact CD2-CG 3.71Å; L243-P275 HydrophobicContact CG-CB 3.99Å; L243-P275 HydrophobicContact CG-CG 3.89Å; V247-P275 WeakPolarHBondContact CG1-O 3.45Å; V247-P275 HydrophobicContact CG2-CB 3.98Å; I265-P275 WeakPolarHBondContact O-CD 3.34Å; S267-P275 WeakPolarHBondContact O-CD 3.38Å; P275-G279 PolarHBondContact O-N 2.86Å; P275-G279 VanDerWaalsContact O-N 3.08Å; P275-L291 HydrophobicContact CB-CD1 4.13Å
276L98.1Very high95.7Very high0 Ų037.5 Ų37.50%018%0.179CC..Hα-helixtrans-66.2-51175.5177.969.7000111.3T274 L278 G279 V280 V288 L291 I292 A296 L298T274-L276 PolarHBondContact O-N 3.27Å; T274-L276 VanDerWaalsContact O-N 3.13Å; T274-L276 PolarHBondContact OG1-N 2.95Å; L276-L278 VanDerWaalsContact C-N 3.31Å; L276-L278 PolarHBondContact O-N 3.49Å; L276-G279 PolarHBondContact O-N 2.56Å; L276-G279 VanDerWaalsContact O-N 3.16Å; L276-V280 WeakPolarHBondContact O-CG2 3.2Å; L276-V280 PolarHBondContact O-N 3Å; L276-V288 HydrophobicContact CD1-CG1 4.1Å; L276-L291 HydrophobicContact CB-CD1 4.34Å; L276-L291 HydrophobicContact CD1-CB 4.04Å; L276-I292 HydrophobicContact CD1-CG1 4Å; L276-A296 HydrophobicContact CB-CB 4.07Å; L276-A296 HydrophobicContact CD2-CB 4.07Å; L276-A296 HydrophobicContact CG-CB 4.47Å; L276-L298 HydrophobicContact CD2-CD2 3.66Å
277L97.1Very high95.7Very high0 Ų034.8 Ų34.80%017%0.166CC..Hα-helixtrans-62.9-38.3-178.6-62.6-172.5000111.9L273 T274 V280 H281 A300 D302 A308 L311L273-L277 HydrophobicContact CB-CB 4.2Å; L273-L277 HydrophobicContact CD2-CB 3.87Å; T274-L277 PolarHBondContact O-N 3.13Å; T274-L277 WeakPolarHBondContact OG1-CG 3.32Å; T274-L277 PolarHBondContact OG1-N 3.39Å; L277-V280 PolarHBondContact O-N 3.16Å; L277-H281 WeakPolarHBondContact O-CB 3.47Å; L277-H281 PolarHBondContact O-N 3.49Å; L277-A300 HydrophobicContact CD1-CB 4.22Å; L277-A300 HydrophobicContact CG-CB 4.42Å; L277-D302 HydrophobicContact CD1-CB 4.14Å; L277-A308 HydrophobicContact CD2-CB 3.77Å; L277-L311 HydrophobicContact CB-CD1 4.09Å; L277-L311 HydrophobicContact CD1-CD1 4.32Å; L277-L311 HydrophobicContact CD2-CD1 3.85Å; L277-L311 HydrophobicContact CG-CD1 4.29Å
278L96.8Very high95.7Very high0 Ų034.1 Ų34.10%016%0.161CC..Hα-helixtrans-59.9-47.8172.7177.364.6000111.2Y123 F128 H244 V247 L273 T274 L276 V280 H281 E282Y123-L278 HydrophobicContact CE2-CD1 4.45Å; Y123-L278 WeakPolarHBondContact OH-CD1 3Å; F128-L278 HydrophobicContact CE1-CD2 4.41Å; F128-L278 HydrophobicContact CE2-CD1 4.38Å; F128-L278 HydrophobicContact CZ-CD1 4.33Å; F128-L278 HydrophobicContact CZ-CD2 3.89Å; H244-L278 HydrophobicContact CB-CD2 3.78Å; H244-L278 WeakPolarHBondContact O-CD2 3.35Å; V247-L278 HydrophobicContact CB-CD2 4.36Å; V247-L278 HydrophobicContact CG1-CB 4.45Å; V247-L278 HydrophobicContact CG1-CD2 4.32Å; V247-L278 HydrophobicContact CG1-CG 4.23Å; L273-L278 HydrophobicContact CB-CB 4.45Å; L273-L278 HydrophobicContact CD1-CD1 4.31Å; T274-L278 WeakPolarHBondContact O-CB 3.34Å; T274-L278 PolarHBondContact O-N 3.34Å; L276-L278 VanDerWaalsContact C-N 3.31Å; L276-L278 PolarHBondContact O-N 3.49Å; L278-V280 VanDerWaalsContact C-N 3.28Å; L278-V280 PolarHBondContact O-N 3.32Å; L278-H281 PolarHBondContact O-N 3.19Å; L278-E282 HydrophobicContact CD1-CG 4.08Å; L278-E282 PolarHBondContact O-N 3.23Å
279G96.8Very high95.8Very high0 Ų032.9 Ų32.90%016%0.156CC..Hα-helixtrans-62.6-35.5178.600000112.7P275 L276 Q283 K284 V288P275-G279 PolarHBondContact O-N 2.86Å; P275-G279 VanDerWaalsContact O-N 3.08Å; L276-G279 PolarHBondContact O-N 2.56Å; L276-G279 VanDerWaalsContact O-N 3.16Å; G279-Q283 CarbonylContact O-C 3.37Å; G279-Q283 PolarHBondContact O-N 2.93Å; G279-Q283 VanDerWaalsContact O-N 3.09Å; G279-K284 PolarHBondContact O-N 3.38Å; G279-V288 WeakPolarHBondContact O-CG2 3.2Å
280V96.2Very high95.9Very high0 Ų033.2 Ų33.20%016%0.157CC..Hα-helixtrans-67-49.7173.4171.30000110.7L276 L277 L278 E282 Q283 V288 A308 L311 A312 I320L276-V280 WeakPolarHBondContact O-CG2 3.2Å; L276-V280 PolarHBondContact O-N 3Å; L277-V280 PolarHBondContact O-N 3.16Å; L278-V280 VanDerWaalsContact C-N 3.28Å; L278-V280 PolarHBondContact O-N 3.32Å; V280-E282 VanDerWaalsContact C-N 3.31Å; V280-E282 PolarHBondContact O-N 3.3Å; V280-Q283 PolarHBondContact O-N 3.16Å; V280-V288 HydrophobicContact CG2-CG1 4.16Å; V280-V288 HydrophobicContact CG2-CG2 4.08Å; V280-A308 WeakPolarHBondContact CG1-O 3.38Å; V280-A308 HydrophobicContact CG2-CB 4.43Å; V280-L311 HydrophobicContact CG1-CB 3.9Å; V280-A312 HydrophobicContact CG1-CB 3.69Å; V280-I320 HydrophobicContact CG1-CG2 4.16Å; V280-I320 HydrophobicContact CG2-CG2 3.98Å
281H94Very high96.1Very high33 Ų3325.7 Ų25.715%0.15312%0.124CC..Hα-helixtrans-57.9-42.5-179.2179.9-93.4000112.2Y123 L277 L278 Q283 C315Y123-H281 AromaticContact CD1-CE1 3.35Å; Y123-H281 WeakPolarHBondContact CD1-CE1 3.38Å; Y123-H281 AromaticContact CE1-CE1 3.6Å; Y123-H281 AromaticContact CE1-ND1 3.82Å; Y123-H281 AromaticContact CG-CE1 3.62Å; L277-H281 WeakPolarHBondContact O-CB 3.47Å; L277-H281 PolarHBondContact O-N 3.49Å; L278-H281 PolarHBondContact O-N 3.19Å; H281-Q283 VanDerWaalsContact C-N 3.33Å; H281-C315 PolarHBondContact O-SG 3.28Å; H281-C315 VanDerWaalsContact O-SG 3.41Å
282E93Very high96.4Very high38 Ų3825.3 Ų25.318%0.17812%0.12CC..THydrogen-bonded Turntrans-91.18.1178.8-61.4-171.1172.300114.1Y123 H248 L278 V280 K284Y123-E282 PolarHBondContact OH-OE1 2.94Å; H248-E282 WeakPolarHBondContact CA-OE2 3.36Å; H248-E282 IonicContact CE1-OE1 2.71Å; H248-E282 PolarHBondContact CE1-OE1 3.44Å; H248-E282 IonicContact CE1-OE2 3.05Å; H248-E282 IonicContact CG-OE1 2.76Å; H248-E282 IonicContact CG-OE2 2.81Å; H248-E282 IonicContact ND1-OE1 3.19Å; H248-E282 PolarHBondContact ND1-OE1 2.94Å; H248-E282 IonicContact ND1-OE2 2.73Å; H248-E282 PolarHBondContact ND1-OE2 2.74Å; L278-E282 HydrophobicContact CD1-CG 4.08Å; L278-E282 PolarHBondContact O-N 3.23Å; V280-E282 VanDerWaalsContact C-N 3.31Å; V280-E282 PolarHBondContact O-N 3.3Å; E282-K284 VanDerWaalsContact C-N 3.3Å; E282-K284 HydrophobicContact CB-CD 4.36Å; E282-K284 HydrophobicContact CB-CG 3.88Å; E282-K284 PolarHBondContact O-N 3.17Å; E282-K284 WeakPolarHBondContact OE2-CE 3.24Å
283Q95.1Very high96.6Very high100 Ų10031.9 Ų31.947%0.46715%0.145SC..THydrogen-bonded Turntrans59.833.2175-50.6-178.245.400114.8G279 V280 H281 Q285 C315 I320G279-Q283 CarbonylContact O-C 3.37Å; G279-Q283 PolarHBondContact O-N 2.93Å; G279-Q283 VanDerWaalsContact O-N 3.09Å; V280-Q283 PolarHBondContact O-N 3.16Å; H281-Q283 VanDerWaalsContact C-N 3.33Å; Q283-Q285 VanDerWaalsContact C-N 3.29Å; Q283-Q285 PolarHBondContact O-N 3.22Å; Q283-C315 HydrophobicContact CG-CB 4.27Å; Q283-C315 PolarHBondContact NE2-O 3.26Å; Q283-I320 HydrophobicContact CB-CD1 4.36Å
284K96.3Very high96.7Very high44 Ų4436.7 Ų36.719%0.19117%0.165CC..  trans-80.366.8-178-54.4-62.5178.4165.20111.9V247 H248 E250 G279 E282 Q286 V287 V288V247-K284 WeakPolarHBondContact O-CG 3.44Å; H248-K284 WeakPolarHBondContact O-CE 3.38Å; H248-K284 PolarHBondContact O-NZ 2.96Å; E250-K284 HydrophobicContact CB-CD 3.95Å; E250-K284 HydrophobicContact CG-CB 4.17Å; E250-K284 HydrophobicContact CG-CD 4.09Å; G279-K284 PolarHBondContact O-N 3.38Å; E282-K284 VanDerWaalsContact C-N 3.3Å; E282-K284 HydrophobicContact CB-CD 4.36Å; E282-K284 HydrophobicContact CB-CG 3.88Å; E282-K284 PolarHBondContact O-N 3.17Å; E282-K284 WeakPolarHBondContact OE2-CE 3.24Å; K284-Q286 VanDerWaalsContact C-N 3.3Å; K284-Q286 PolarHBondContact O-N 2.9Å; K284-Q286 VanDerWaalsContact O-N 3.13Å; K284-V287 PolarHBondContact O-N 3.25Å; K284-V287 VanDerWaalsContact O-N 3.12Å; K284-V288 WeakPolarHBondContact O-CG2 3.42Å; K284-V288 PolarHBondContact O-N 3.39Å
285Q95.6Very high96.5Very high73 Ų7345.8 Ų45.834%0.34121%0.205SC..Hα-helixtrans-51.7-42.2-168.1-170.5-175.11.900114Q283 K289 I320 L323Q283-Q285 VanDerWaalsContact C-N 3.29Å; Q283-Q285 PolarHBondContact O-N 3.22Å; Q285-K289 WeakPolarHBondContact O-CB 3.19Å; Q285-K289 PolarHBondContact O-N 2.92Å; Q285-I320 HydrophobicContact CB-CG1 4.5Å; Q285-I320 HydrophobicContact CG-CG1 4.47Å; Q285-L323 HydrophobicContact CG-CD1 3.78Å
286Q96.4Very high96.4Very high100 Ų10046 Ų4647%0.46721%0.207SC..Hα-helixtrans-67-40.2-176.8-64.7-56.3-37.200112.6K284 F290K284-Q286 VanDerWaalsContact C-N 3.3Å; K284-Q286 PolarHBondContact O-N 2.9Å; K284-Q286 VanDerWaalsContact O-N 3.13Å; Q286-F290 WeakPolarHBondContact O-CB 3.42Å; Q286-F290 PolarHBondContact O-N 2.99Å
287V97.4Very high96.3Very high0 Ų049.6 Ų49.60%023%0.226CC..Hα-helixtrans-76.1-39.5178.4-177.90000110.5V247 E250 K252 A255 K284 K289 F290 L291V247-V287 HydrophobicContact CB-CG1 4.3Å; V247-V287 HydrophobicContact CG1-CG1 4.35Å; V247-V287 HydrophobicContact CG2-CG1 3.76Å; E250-V287 VanDerWaalsContact C-CG2 3.45Å; E250-V287 HydrophobicContact CG-CG2 4.23Å; K252-V287 HydrophobicContact CB-CG2 4.24Å; A255-V287 HydrophobicContact CB-CG1 4.42Å; K284-V287 PolarHBondContact O-N 3.25Å; K284-V287 VanDerWaalsContact O-N 3.12Å; V287-K289 PolarHBondContact O-N 2.81Å; V287-F290 CarbonylContact O-C 3.59Å; V287-F290 WeakPolarHBondContact O-CA 3.39Å; V287-F290 WeakPolarHBondContact O-CB 3.38Å; V287-F290 PolarHBondContact O-N 3.34Å; V287-L291 HydrophobicContact CG1-CD1 4.01Å; V287-L291 HydrophobicContact CG1-CG 4.09Å; V287-L291 WeakPolarHBondContact O-CG 3.1Å; V287-L291 PolarHBondContact O-N 3.26Å
288V97.8Very high96.1Very high0 Ų051 Ų510%023%0.233CC..Hα-helixtrans-55.8-51.9173.3170.60000110.7L276 G279 V280 K284 F290 L291 I292 I320L276-V288 HydrophobicContact CD1-CG1 4.1Å; G279-V288 WeakPolarHBondContact O-CG2 3.2Å; V280-V288 HydrophobicContact CG2-CG1 4.16Å; V280-V288 HydrophobicContact CG2-CG2 4.08Å; K284-V288 WeakPolarHBondContact O-CG2 3.42Å; K284-V288 PolarHBondContact O-N 3.39Å; V288-F290 PolarHBondContact O-N 2.86Å; V288-L291 PolarHBondContact O-N 2.9Å; V288-L291 VanDerWaalsContact O-N 3.13Å; V288-I292 HydrophobicContact CG1-CD1 3.87Å; V288-I292 HydrophobicContact CG1-CG1 4.41Å; V288-I292 VanDerWaalsContact O-CG1 3.3Å; V288-I292 WeakPolarHBondContact O-CG1 3.12Å; V288-I292 PolarHBondContact O-N 2.97Å; V288-I320 HydrophobicContact CG1-CG2 4.25Å; V288-I320 HydrophobicContact CG2-CD1 4.45Å
289K97.5Very high95.9Very high93 Ų9355.9 Ų55.940%0.40426%0.259SS..Hα-helixtrans-57.8-34.5176.7-173.3170.5-172.8165.50112.3Q285 V287 K293 L323Q285-K289 WeakPolarHBondContact O-CB 3.19Å; Q285-K289 PolarHBondContact O-N 2.92Å; V287-K289 PolarHBondContact O-N 2.81Å; K289-K293 WeakPolarHBondContact O-CG 3.34Å; K289-K293 PolarHBondContact O-N 3.27Å; K289-L323 HydrophobicContact CB-CD1 4.25Å; K289-L323 HydrophobicContact CD-CD2 4.05Å; K289-L323 HydrophobicContact CG-CD2 4.29Å
290F98Very high95.7Very high17 Ų1756.1 Ų56.18%0.07526%0.261CS..Hα-helixtrans-71.2-44.7176.1170.4-106.1000112.7K252 A255 K256 L259 Q286 V287 V288 K293 K294K252-F290 HydrophobicContact CD-CB 4.08Å; K252-F290 HydrophobicContact CD-CG 4.4Å; K252-F290 HydrophobicContact CG-CB 3.9Å; K252-F290 HydrophobicContact CG-CD1 4.29Å; K252-F290 HydrophobicContact CG-CD2 4.19Å; K252-F290 HydrophobicContact CG-CG 3.86Å; A255-F290 HydrophobicContact CB-CD1 4.32Å; A255-F290 HydrophobicContact CB-CE1 4.08Å; K256-F290 HydrophobicContact CB-CE1 4.22Å; K256-F290 HydrophobicContact CB-CE2 4.14Å; K256-F290 HydrophobicContact CB-CZ 3.59Å; K256-F290 HydrophobicContact CG-CE2 4.31Å; K256-F290 HydrophobicContact CG-CZ 4.02Å; L259-F290 HydrophobicContact CD1-CE1 3.75Å; L259-F290 HydrophobicContact CD1-CZ 4.06Å; Q286-F290 WeakPolarHBondContact O-CB 3.42Å; Q286-F290 PolarHBondContact O-N 2.99Å; V287-F290 CarbonylContact O-C 3.59Å; V287-F290 WeakPolarHBondContact O-CA 3.39Å; V287-F290 WeakPolarHBondContact O-CB 3.38Å; V287-F290 PolarHBondContact O-N 3.34Å; V288-F290 PolarHBondContact O-N 2.86Å; F290-K293 WeakPolarHBondContact O-CB 3.37Å; F290-K293 PolarHBondContact O-N 3.17Å; F290-K294 HydrophobicContact CD2-CG 4.45Å; F290-K294 HydrophobicContact CE1-CG 4.19Å; F290-K294 HydrophobicContact CE2-CD 4.43Å; F290-K294 HydrophobicContact CE2-CG 3.93Å; F290-K294 HydrophobicContact CZ-CD 4.38Å; F290-K294 HydrophobicContact CZ-CG 3.77Å; F290-K294 WeakPolarHBondContact O-CG 3.49Å; F290-K294 PolarHBondContact O-N 3.48Å
291L97.8Very high95.6Very high0 Ų059.9 Ų59.90%028%0.281CS..Hα-helixtrans-64.4-39.8178.6-68.7175.5000111.8V247 L259 I265 P275 L276 V287 V288 K293 K294 K295 A296V247-L291 HydrophobicContact CG2-CD1 3.98Å; L259-L291 HydrophobicContact CD1-CD2 4.4Å; I265-L291 HydrophobicContact CD1-CD2 3.96Å; I265-L291 HydrophobicContact CG1-CD2 4.04Å; P275-L291 HydrophobicContact CB-CD1 4.13Å; L276-L291 HydrophobicContact CB-CD1 4.34Å; L276-L291 HydrophobicContact CD1-CB 4.04Å; V287-L291 HydrophobicContact CG1-CD1 4.01Å; V287-L291 HydrophobicContact CG1-CG 4.09Å; V287-L291 WeakPolarHBondContact O-CG 3.1Å; V287-L291 PolarHBondContact O-N 3.26Å; V288-L291 PolarHBondContact O-N 2.9Å; V288-L291 VanDerWaalsContact O-N 3.13Å; L291-K293 VanDerWaalsContact C-N 3.34Å; L291-K293 PolarHBondContact O-N 3.46Å; L291-K294 CarbonylContact O-C 3.59Å; L291-K294 WeakPolarHBondContact O-CA 3.49Å; L291-K294 WeakPolarHBondContact O-CB 3.45Å; L291-K294 PolarHBondContact O-N 3.09Å; L291-K295 PolarHBondContact O-N 3.41Å; L291-A296 HydrophobicContact CB-CB 4.13Å; L291-A296 WeakPolarHBondContact O-CB 3.41Å; L291-A296 PolarHBondContact O-N 3.4Å; L291-A296 VanDerWaalsContact O-N 3.11Å
292I96.6Very high95.6Very high15 Ų1558.8 Ų58.88%0.07728%0.276CS..Hα-helixtrans-57.8-47.4172.1-66.7175.1000110.7L276 V288 K294 K295 L298 L324 Q327L276-I292 HydrophobicContact CD1-CG1 4Å; V288-I292 HydrophobicContact CG1-CD1 3.87Å; V288-I292 HydrophobicContact CG1-CG1 4.41Å; V288-I292 VanDerWaalsContact O-CG1 3.3Å; V288-I292 WeakPolarHBondContact O-CG1 3.12Å; V288-I292 PolarHBondContact O-N 2.97Å; I292-K294 PolarHBondContact O-N 3.3Å; I292-K295 WeakPolarHBondContact O-CA 3.48Å; I292-K295 PolarHBondContact O-N 3.48Å; I292-L298 HydrophobicContact CD1-CD2 4.46Å; I292-L298 HydrophobicContact CG1-CD2 3.96Å; I292-L324 HydrophobicContact CD1-CD2 3.87Å; I292-Q327 HydrophobicContact CG2-CG 3.59Å
293K96.9Very high95.5Very high153 Ų15363.3 Ų63.367%0.66529%0.292SS*.Hα-helixtrans-61.7-24.6175-74.6179.5177.2-1660113.3K289 F290 L291 K295K289-K293 WeakPolarHBondContact O-CG 3.34Å; K289-K293 PolarHBondContact O-N 3.27Å; F290-K293 WeakPolarHBondContact O-CB 3.37Å; F290-K293 PolarHBondContact O-N 3.17Å; L291-K293 VanDerWaalsContact C-N 3.34Å; L291-K293 PolarHBondContact O-N 3.46Å; K293-K295 VanDerWaalsContact C-N 3.25Å
294K97.1Very high95.2Very high104 Ų10462 Ų6245%0.45228%0.283SS..THydrogen-bonded Turntrans-87.410.3173.9-69.1-61.5-171.3176.70113.5L259 I265 F290 L291 I292 A296L259-K294 HydrophobicContact CD1-CB 4.33Å; L259-K294 HydrophobicContact CD1-CG 3.99Å; I265-K294 HydrophobicContact CD1-CB 3.79Å; F290-K294 HydrophobicContact CD2-CG 4.45Å; F290-K294 HydrophobicContact CE1-CG 4.19Å; F290-K294 HydrophobicContact CE2-CD 4.43Å; F290-K294 HydrophobicContact CE2-CG 3.93Å; F290-K294 HydrophobicContact CZ-CD 4.38Å; F290-K294 HydrophobicContact CZ-CG 3.77Å; F290-K294 WeakPolarHBondContact O-CG 3.49Å; F290-K294 PolarHBondContact O-N 3.48Å; L291-K294 CarbonylContact O-C 3.59Å; L291-K294 WeakPolarHBondContact O-CA 3.49Å; L291-K294 WeakPolarHBondContact O-CB 3.45Å; L291-K294 PolarHBondContact O-N 3.09Å; I292-K294 PolarHBondContact O-N 3.3Å; K294-A296 VanDerWaalsContact C-N 3.29Å; K294-A296 PolarHBondContact O-N 2.81Å
295K94.8Very high95Very high192 Ų19260.4 Ų60.484%0.83528%0.278SS*.THydrogen-bonded Turntrans60.535.5178.3-54.9-175.5176.1-174.20113.1L291 I292 K293L291-K295 PolarHBondContact O-N 3.41Å; I292-K295 WeakPolarHBondContact O-CA 3.48Å; I292-K295 PolarHBondContact O-N 3.48Å; K293-K295 VanDerWaalsContact C-N 3.25Å
296A96Very high94.9Very high4 Ų458.2 Ų58.23%0.03327%0.267CS..  trans-56143.3167.200000110.2I265 E266 L276 L291 K294 L298I265-A296 HydrophobicContact CD1-CB 3.79Å; I265-A296 HydrophobicContact CG1-CB 4.01Å; E266-A296 WeakPolarHBondContact OE1-CA 3.49Å; L276-A296 HydrophobicContact CB-CB 4.07Å; L276-A296 HydrophobicContact CD2-CB 4.07Å; L276-A296 HydrophobicContact CG-CB 4.47Å; L291-A296 HydrophobicContact CB-CB 4.13Å; L291-A296 WeakPolarHBondContact O-CB 3.41Å; L291-A296 PolarHBondContact O-N 3.4Å; L291-A296 VanDerWaalsContact O-N 3.11Å; K294-A296 VanDerWaalsContact C-N 3.29Å; K294-A296 PolarHBondContact O-N 2.81Å; A296-L298 PolarHBondContact O-N 3.37Å; A296-L298 VanDerWaalsContact O-N 3.1Å
297N95.2Very high94.8Very high75 Ų7554 Ų5440%0.40125%0.248SC..  trans-68.3108.8-176-176.27.6000111.6E266 N299 A300E266-N297 PolarHBondContact OE1-N 2.93Å; E266-N297 VanDerWaalsContact OE2-CB 3.24Å; E266-N297 WeakPolarHBondContact OE2-CB 3.34Å; N297-N299 PolarHBondContact O-N 3.4Å; N297-N299 WeakPolarHBondContact OD1-CB 3Å; N297-N299 PolarHBondContact OD1-N 3.04Å; N297-A300 HydrophobicContact CB-CB 4.38Å; N297-A300 WeakPolarHBondContact O-CB 3.33Å; N297-A300 PolarHBondContact O-N 2.92Å
298L93.3Very high94.7Very high30 Ų3054 Ų5416%0.15725%0.249CC..THydrogen-bonded Turntrans-69.3-23.2177.9-59.4-179.5000113L276 I292 A296 A300 L324 Q327 V329L276-L298 HydrophobicContact CD2-CD2 3.66Å; I292-L298 HydrophobicContact CD1-CD2 4.46Å; I292-L298 HydrophobicContact CG1-CD2 3.96Å; A296-L298 PolarHBondContact O-N 3.37Å; A296-L298 VanDerWaalsContact O-N 3.1Å; L298-A300 VanDerWaalsContact C-N 3.29Å; L298-L324 HydrophobicContact CD2-CD2 3.84Å; L298-Q327 HydrophobicContact CD1-CB 3.47Å; L298-Q327 VanDerWaalsContact CD1-CB 3.47Å; L298-Q327 HydrophobicContact CD1-CG 4.01Å; L298-V329 HydrophobicContact CB-CG1 4.07Å; L298-V329 HydrophobicContact CD1-CG1 3.62Å; L298-V329 HydrophobicContact CG-CG1 4.41Å
299N91.8Very high94.6Very high103 Ų10354.3 Ų54.355%0.55125%0.25SC*.THydrogen-bonded Turntrans-90.86.7179.6-59.4-28000112.2N297 L301N297-N299 PolarHBondContact O-N 3.4Å; N297-N299 WeakPolarHBondContact OD1-CB 3Å; N297-N299 PolarHBondContact OD1-N 3.04Å; N299-L301 PolarHBondContact O-N 3.34Å
300A93.9Very high94.4Very high5 Ų549.9 Ų49.94%0.04123%0.231CC..  trans-59.6135.4171.900000109.8T274 L277 N297 L298T274-A300 HydrophobicContact CG2-CB 3.88Å; L277-A300 HydrophobicContact CD1-CB 4.22Å; L277-A300 HydrophobicContact CG-CB 4.42Å; N297-A300 HydrophobicContact CB-CB 4.38Å; N297-A300 WeakPolarHBondContact O-CB 3.33Å; N297-A300 PolarHBondContact O-N 2.92Å; L298-A300 VanDerWaalsContact C-N 3.29Å
301L94.3Very high94.1Very high78 Ų7849.1 Ų49.141%0.40823%0.227SC..  trans-106.7137.3179.6-53.8-178.8000110.5K268 N299 R306 T307K268-L301 PolarHBondContact NZ-O 2.84Å; N299-L301 PolarHBondContact O-N 3.34Å; L301-R306 WeakPolarHBondContact CA-O 3.19Å; L301-T307 HydrophobicContact CD2-CG2 3.65Å
302D92.1Very high94Very high11 Ų1149.1 Ų49.16%0.05923%0.227CC..  trans-75.8-177.2168.481.6-9.1000112.1L273 L277 Y304 G305 R306 L311L273-D302 HydrophobicContact CD2-CB 3.77Å; L277-D302 HydrophobicContact CD1-CB 4.14Å; D302-Y304 PolarHBondContact O-N 2.9Å; D302-Y304 VanDerWaalsContact O-N 3.12Å; D302-Y304 WeakPolarHBondContact OD1-CA 3.39Å; D302-Y304 WeakPolarHBondContact OD1-CB 3.45Å; D302-Y304 PolarHBondContact OD1-N 3Å; D302-G305 PolarHBondContact O-N 3.35Å; D302-G305 PolarHBondContact OD1-N 3.03Å; D302-G305 VanDerWaalsContact OD1-N 3.14Å; D302-R306 PolarHBondContact N-O 2.76Å; D302-R306 VanDerWaalsContact N-O 3.14Å; D302-R306 WeakPolarHBondContact OD1-CB 3.46Å; D302-R306 PolarHBondContact OD1-N 3.39Å; D302-R306 IonicContact OD1-NE 3.51Å; D302-R306 IonicContact OD2-CZ 3.55Å; D302-R306 IonicContact OD2-NE 3.04Å; D302-R306 PolarHBondContact OD2-NE 3.26Å; D302-R306 IonicContact OD2-NH2 3.73Å; D302-R306 PolarHBondContact OD2-NH2 3.04Å; D302-L311 HydrophobicContact CB-CD1 4.36Å
303R91.6Very high93.8Very high132 Ų13248.4 Ų48.450%0.49822%0.224SC..THydrogen-bonded Turntrans-62.1-16.1178.969.9-179.4-63-167.1-0.3115.1C271C271-R303 WeakPolarHBondContact O-CB 3.25Å; C271-R303 WeakPolarHBondContact O-CG 3.41Å; C271-R303 PolarHBondContact O-N 3.46Å
304Y90Very high93.5Very high74 Ų7441.7 Ų41.729%0.2920%0.196SC..THydrogen-bonded Turntrans-102.68178.7-56.3-70.6000111.8G121 D302 R306 L336G121-Y304 WeakPolarHBondContact CA-OH 3.39Å; G121-Y304 PolarHBondContact O-OH 2.98Å; D302-Y304 PolarHBondContact O-N 2.9Å; D302-Y304 VanDerWaalsContact O-N 3.12Å; D302-Y304 WeakPolarHBondContact OD1-CA 3.39Å; D302-Y304 WeakPolarHBondContact OD1-CB 3.45Å; D302-Y304 PolarHBondContact OD1-N 3Å; Y304-R306 VanDerWaalsContact C-N 3.26Å; Y304-R306 PolarHBondContact O-N 3.1Å; Y304-L336 WeakPolarHBondContact O-CB 3.26Å; Y304-L336 VanDerWaalsContact O-CG 3.27Å; Y304-L336 WeakPolarHBondContact O-CG 3.49Å; Y304-L336 PolarHBondContact O-N 3.04Å; Y304-L336 VanDerWaalsContact O-N 3.07Å
305G91.6Very high93.1Very high9 Ų937.8 Ų37.89%0.09318%0.182CC..  trans72.916-176.900000113.6D302D302-G305 PolarHBondContact O-N 3.35Å; D302-G305 PolarHBondContact OD1-N 3.03Å; D302-G305 VanDerWaalsContact OD1-N 3.14Å
306R92.5Very high92.9Very high28 Ų2830 Ų3011%0.10616%0.155CC..  trans-83.8133.8-178.3-59.4178.6-61.9178.81.1110.3L301 D302 Y304 I310 L311 D335L301-R306 WeakPolarHBondContact CA-O 3.19Å; D302-R306 PolarHBondContact N-O 2.76Å; D302-R306 VanDerWaalsContact N-O 3.14Å; D302-R306 WeakPolarHBondContact OD1-CB 3.46Å; D302-R306 PolarHBondContact OD1-N 3.39Å; D302-R306 IonicContact OD1-NE 3.51Å; D302-R306 IonicContact OD2-CZ 3.55Å; D302-R306 IonicContact OD2-NE 3.04Å; D302-R306 PolarHBondContact OD2-NE 3.26Å; D302-R306 IonicContact OD2-NH2 3.73Å; D302-R306 PolarHBondContact OD2-NH2 3.04Å; Y304-R306 VanDerWaalsContact C-N 3.26Å; Y304-R306 PolarHBondContact O-N 3.1Å; R306-I310 HydrophobicContact CB-CB 4.14Å; R306-I310 HydrophobicContact CB-CG2 3.94Å; R306-I310 HydrophobicContact CG-CG2 3.87Å; R306-L311 HydrophobicContact CB-CD2 4.32Å; R306-L311 HydrophobicContact CB-CG 3.99Å; R306-L311 VanDerWaalsContact NH2-CD2 3.33Å; R306-D335 HydrophobicContact CG-CB 3.75Å
307T94.3Very high92.7Very high11 Ų1130.4 Ų30.47%0.06716%0.158CC..  trans-75.6169.217164.40000111.2L301 L309 I310 L311L301-T307 HydrophobicContact CD2-CG2 3.65Å; T307-L309 PolarHBondContact O-N 3.41Å; T307-L309 PolarHBondContact OG1-N 3.1Å; T307-I310 PolarHBondContact O-N 3.24Å; T307-I310 PolarHBondContact OG1-N 2.9Å; T307-L311 WeakPolarHBondContact O-CG 3.47Å; T307-L311 PolarHBondContact O-N 3.02Å
308A95.3Very high92.7Very high1 Ų128.1 Ų28.11%0.00815%0.15CC..Hα-helixtrans-54.7-36.9172.100000112.5L277 V280 A312 L324L277-A308 HydrophobicContact CD2-CB 3.77Å; V280-A308 WeakPolarHBondContact CG1-O 3.38Å; V280-A308 HydrophobicContact CG2-CB 4.43Å; A308-A312 WeakPolarHBondContact O-CB 3.3Å; A308-A312 PolarHBondContact O-N 3.3Å; A308-L324 HydrophobicContact CB-CD1 4.04Å; A308-L324 HydrophobicContact CB-CD2 4.13Å; A308-L324 WeakPolarHBondContact O-CD1 3.14Å
309L95.4Very high92.8Very high5 Ų529.6 Ų29.63%0.02616%0.163CC..Hα-helixtrans-67.9-49.2178.9-178.566.4000111.5T307 L311 A312 V313 V321 L324 L325 V329 V331 A341 L357T307-L309 PolarHBondContact O-N 3.41Å; T307-L309 PolarHBondContact OG1-N 3.1Å; L309-L311 VanDerWaalsContact C-N 3.28Å; L309-L311 PolarHBondContact O-N 3.22Å; L309-A312 PolarHBondContact O-N 2.84Å; L309-V313 WeakPolarHBondContact O-CG2 3.44Å; L309-V313 PolarHBondContact O-N 3.22Å; L309-V321 HydrophobicContact CD1-CG1 4.12Å; L309-L324 HydrophobicContact CD1-CB 4.41Å; L309-L325 HydrophobicContact CD1-CD2 4.24Å; L309-L325 HydrophobicContact CD1-CG 4.49Å; L309-L325 HydrophobicContact CD2-CD2 4.46Å; L309-V329 HydrophobicContact CD2-CG2 4.13Å; L309-V331 HydrophobicContact CD2-CB 4.19Å; L309-V331 HydrophobicContact CD2-CG1 3.82Å; L309-A341 HydrophobicContact CD2-CB 3.99Å; L309-A341 HydrophobicContact CG-CB 3.95Å; L309-L357 HydrophobicContact CD2-CD2 4.45Å
310I93.3Very high92.9Very high1 Ų124.7 Ų24.71%0.00514%0.136CC..Hα-helixtrans-58.2-45.7178.5-64.5171.8000109.7R306 T307 A312 V313 C314 D335 A341 Y344R306-I310 HydrophobicContact CB-CB 4.14Å; R306-I310 HydrophobicContact CB-CG2 3.94Å; R306-I310 HydrophobicContact CG-CG2 3.87Å; T307-I310 PolarHBondContact O-N 3.24Å; T307-I310 PolarHBondContact OG1-N 2.9Å; I310-A312 PolarHBondContact O-N 3.17Å; I310-V313 PolarHBondContact O-N 2.99Å; I310-C314 PolarHBondContact O-N 3.32Å; I310-C314 PolarHBondContact O-SG 3.37Å; I310-D335 HydrophobicContact CD1-CB 4.24Å; I310-A341 HydrophobicContact CG1-CB 4.08Å; I310-Y344 HydrophobicContact CG2-CD2 3.71Å; I310-Y344 HydrophobicContact CG2-CE2 3.77Å
311L92.9Very high93Very high0 Ų024.5 Ų24.50%014%0.135CC..Hα-helixtrans-58.9-46.1176.3-76.1167.8000112.8L273 L277 V280 D302 R306 T307 L309 V313 C314 C315L273-L311 HydrophobicContact CD2-CD1 4.43Å; L277-L311 HydrophobicContact CB-CD1 4.09Å; L277-L311 HydrophobicContact CD1-CD1 4.32Å; L277-L311 HydrophobicContact CD2-CD1 3.85Å; L277-L311 HydrophobicContact CG-CD1 4.29Å; V280-L311 HydrophobicContact CG1-CB 3.9Å; D302-L311 HydrophobicContact CB-CD1 4.36Å; R306-L311 HydrophobicContact CB-CD2 4.32Å; R306-L311 HydrophobicContact CB-CG 3.99Å; R306-L311 VanDerWaalsContact NH2-CD2 3.33Å; T307-L311 WeakPolarHBondContact O-CG 3.47Å; T307-L311 PolarHBondContact O-N 3.02Å; L309-L311 VanDerWaalsContact C-N 3.28Å; L309-L311 PolarHBondContact O-N 3.22Å; L311-V313 VanDerWaalsContact C-N 3.27Å; L311-V313 PolarHBondContact O-N 2.85Å; L311-C314 PolarHBondContact O-N 3.02Å; L311-C315 WeakPolarHBondContact O-CB 3.13Å; L311-C315 PolarHBondContact O-N 2.65Å; L311-C315 PolarHBondContact O-SG 3.42Å
312A94.6Very high93.1Very high0 Ų024.2 Ų24.20%013%0.134CC..Hα-helixtrans-60.6-38178.800000112.2V280 A308 L309 I310 G316 S317 I320 V321 L324V280-A312 HydrophobicContact CG1-CB 3.69Å; A308-A312 WeakPolarHBondContact O-CB 3.3Å; A308-A312 PolarHBondContact O-N 3.3Å; L309-A312 PolarHBondContact O-N 2.84Å; I310-A312 PolarHBondContact O-N 3.17Å; A312-G316 PolarHBondContact O-N 3.47Å; A312-S317 PolarHBondContact O-N 2.82Å; A312-I320 HydrophobicContact CB-CB 4.32Å; A312-I320 HydrophobicContact CB-CG2 3.77Å; A312-V321 HydrophobicContact CB-CG2 3.77Å; A312-L324 HydrophobicContact CB-CD1 3.94Å
313V93.8Very high93.2Very high0 Ų024.4 Ų24.40%013%0.134CC..Hα-helixtrans-68.6-46.9175.2174.70000111.6L309 I310 L311 C315 G316 V321 A341 A345 H350 I353 L357L309-V313 WeakPolarHBondContact O-CG2 3.44Å; L309-V313 PolarHBondContact O-N 3.22Å; I310-V313 PolarHBondContact O-N 2.99Å; L311-V313 VanDerWaalsContact C-N 3.27Å; L311-V313 PolarHBondContact O-N 2.85Å; V313-C315 PolarHBondContact O-N 3.41Å; V313-G316 PolarHBondContact O-N 3.42Å; V313-V321 HydrophobicContact CG2-CG2 3.84Å; V313-A341 WeakPolarHBondContact CG1-O 3.27Å; V313-A341 HydrophobicContact CG2-CB 4.06Å; V313-A345 HydrophobicContact CG1-CB 3.66Å; V313-H350 PolarHBondContact O-CD2 2.87Å; V313-I353 HydrophobicContact CB-CG2 4.37Å; V313-I353 HydrophobicContact CG1-CG2 4.04Å; V313-I353 HydrophobicContact CG2-CG2 3.69Å; V313-L357 HydrophobicContact CG2-CD1 4.45Å
314C90.4Very high93.3Very high13 Ų1318.1 Ų18.19%0.08811%0.111CC..Hα-helixtrans-57.1-39.2177.1-63.40000111W120 I310 L311 G316W120-C314 VanDerWaalsContact CH2-C 3.46Å; W120-C314 HydrophobicContact CH2-CB 3.41Å; W120-C314 VanDerWaalsContact CH2-CB 3.41Å; W120-C314 WeakPolarHBondContact CH2-O 3.46Å; W120-C314 HydrophobicContact CZ2-CB 3.93Å; W120-C314 WeakPolarHBondContact CZ2-O 3.37Å; W120-C314 HydrophobicContact CZ3-CB 4.18Å; I310-C314 PolarHBondContact O-N 3.32Å; I310-C314 PolarHBondContact O-SG 3.37Å; L311-C314 PolarHBondContact O-N 3.02Å; C314-G316 PolarHBondContact O-N 2.99Å
315C89Confident93.5Very high22 Ų2214.8 Ų14.815%0.14910%0.098CC..THydrogen-bonded Turntrans-75.9-7177.3-64.60000113.9H281 Q283 L311 V313 S317H281-C315 PolarHBondContact O-SG 3.28Å; H281-C315 VanDerWaalsContact O-SG 3.41Å; Q283-C315 HydrophobicContact CG-CB 4.27Å; Q283-C315 PolarHBondContact NE2-O 3.26Å; L311-C315 WeakPolarHBondContact O-CB 3.13Å; L311-C315 PolarHBondContact O-N 2.65Å; L311-C315 PolarHBondContact O-SG 3.42Å; V313-C315 PolarHBondContact O-N 3.41Å; C315-S317 VanDerWaalsContact C-N 3.31Å; C315-S317 PolarHBondContact O-N 2.97Å
316G89.9Confident93.5Very high27 Ų2720.1 Ų20.128%0.27812%0.121SC..THydrogen-bonded Turntrans71.519.1179.700000114.7A312 V313 C314 A318A312-G316 PolarHBondContact O-N 3.47Å; V313-G316 PolarHBondContact O-N 3.42Å; C314-G316 PolarHBondContact O-N 2.99Å; G316-A318 PolarHBondContact O-N 2.94Å
317S92.3Very high93.4Very high13 Ų1323.1 Ų23.19%0.09114%0.136CC..  trans-90.285.9-174.1-1680000112.2A312 C315 S319 I320 V321A312-S317 PolarHBondContact O-N 2.82Å; C315-S317 VanDerWaalsContact C-N 3.31Å; C315-S317 PolarHBondContact O-N 2.97Å; S317-S319 PolarHBondContact O-N 3.15Å; S317-I320 PolarHBondContact O-N 2.66Å; S317-I320 VanDerWaalsContact O-N 3.1Å; S317-I320 WeakPolarHBondContact OG-CG1 3.06Å; S317-V321 WeakPolarHBondContact O-CG2 3.28Å; S317-V321 PolarHBondContact O-N 3.36Å
318A94.1Very high92.9Very high28 Ų2827.7 Ų27.723%0.23116%0.16CC..Hα-helixtrans-54.4-37.3177.900000112.9G316 I320 V321 N322 V352 I353 L356G316-A318 PolarHBondContact O-N 2.94Å; A318-I320 PolarHBondContact O-N 2.67Å; A318-V321 PolarHBondContact O-N 3.04Å; A318-N322 WeakPolarHBondContact O-CB 3.43Å; A318-N322 PolarHBondContact O-N 3.22Å; A318-V352 HydrophobicContact CB-CG1 4.08Å; A318-I353 HydrophobicContact CB-CG1 4.03Å; A318-L356 HydrophobicContact CB-CD1 4.02Å
319S94.9Very high92.6Very high61 Ų6128.4 Ų28.443%0.42716%0.164SC..Hα-helixtrans-62.1-42.6177.5-59.20000113.1S317 L323S317-S319 PolarHBondContact O-N 3.15Å; S319-L323 WeakPolarHBondContact O-CG 3.05Å; S319-L323 PolarHBondContact O-N 3.3Å
320I95.5Very high92.2Very high0 Ų031.7 Ų31.70%018%0.181CC..Hα-helixtrans-75.6-38.1178.9-67.1175.7000110.5V280 Q283 Q285 V288 A312 S317 A318 N322 L323 L324V280-I320 HydrophobicContact CG1-CG2 4.16Å; V280-I320 HydrophobicContact CG2-CG2 3.98Å; Q283-I320 HydrophobicContact CB-CD1 4.36Å; Q285-I320 HydrophobicContact CB-CG1 4.5Å; Q285-I320 HydrophobicContact CG-CG1 4.47Å; V288-I320 HydrophobicContact CG1-CG2 4.25Å; V288-I320 HydrophobicContact CG2-CD1 4.45Å; A312-I320 HydrophobicContact CB-CB 4.32Å; A312-I320 HydrophobicContact CB-CG2 3.77Å; S317-I320 PolarHBondContact O-N 2.66Å; S317-I320 VanDerWaalsContact O-N 3.1Å; S317-I320 WeakPolarHBondContact OG-CG1 3.06Å; A318-I320 PolarHBondContact O-N 2.67Å; I320-N322 VanDerWaalsContact C-N 3.3Å; I320-N322 PolarHBondContact O-N 3.3Å; I320-L323 WeakPolarHBondContact O-CB 3.4Å; I320-L323 PolarHBondContact O-N 2.96Å; I320-L324 HydrophobicContact CG2-CD1 3.98Å; I320-L324 HydrophobicContact CG2-CG 4.33Å; I320-L324 WeakPolarHBondContact O-CG 3.41Å; I320-L324 PolarHBondContact O-N 3.29Å
321V95.9Very high92Very high0 Ų033.8 Ų33.80%019%0.194CC..Hα-helixtrans-54.3-50171.8170.20000110.1L309 A312 V313 S317 A318 L323 L324 L325 I353L309-V321 HydrophobicContact CD1-CG1 4.12Å; A312-V321 HydrophobicContact CB-CG2 3.77Å; V313-V321 HydrophobicContact CG2-CG2 3.84Å; S317-V321 WeakPolarHBondContact O-CG2 3.28Å; S317-V321 PolarHBondContact O-N 3.36Å; A318-V321 PolarHBondContact O-N 3.04Å; V321-L323 VanDerWaalsContact C-N 3.35Å; V321-L323 PolarHBondContact O-N 3.15Å; V321-L324 PolarHBondContact O-N 3.04Å; V321-L324 VanDerWaalsContact O-N 3.11Å; V321-L325 HydrophobicContact CG1-CD1 3.78Å; V321-L325 HydrophobicContact CG1-CG 4.21Å; V321-L325 VanDerWaalsContact O-CG 3.31Å; V321-L325 WeakPolarHBondContact O-CG 3.3Å; V321-L325 PolarHBondContact O-N 3.33Å; V321-I353 HydrophobicContact CG1-CG2 4.39Å; V321-I353 HydrophobicContact CG2-CD1 4.23Å; V321-I353 HydrophobicContact CG2-CG1 4.47Å; V321-I353 HydrophobicContact CG2-CG2 4.29Å
322N94.6Very high91.8Very high73 Ų7337.7 Ų37.739%0.3922%0.222SC..Hα-helixtrans-61.4-43.4-179.7-142.75.3000111.8A318 I320 L324 L325 E326A318-N322 WeakPolarHBondContact O-CB 3.43Å; A318-N322 PolarHBondContact O-N 3.22Å; I320-N322 VanDerWaalsContact C-N 3.3Å; I320-N322 PolarHBondContact O-N 3.3Å; N322-L324 VanDerWaalsContact C-N 3.28Å; N322-L324 PolarHBondContact O-N 2.9Å; N322-L325 PolarHBondContact O-N 3.03Å; N322-E326 WeakPolarHBondContact O-CG 3.44Å; N322-E326 PolarHBondContact O-N 3.29Å; N322-E326 VanDerWaalsContact O-N 3.1Å
323L95Very high91.7Very high14 Ų1439.2 Ų39.27%0.07323%0.232CC..Hα-helixtrans-59.4-36.1174.8-75.1171.5000113.3Q285 K289 S319 I320 V321Q285-L323 HydrophobicContact CG-CD1 3.78Å; K289-L323 HydrophobicContact CB-CD1 4.25Å; K289-L323 HydrophobicContact CD-CD2 4.05Å; K289-L323 HydrophobicContact CG-CD2 4.29Å; S319-L323 WeakPolarHBondContact O-CG 3.05Å; S319-L323 PolarHBondContact O-N 3.3Å; I320-L323 WeakPolarHBondContact O-CB 3.4Å; I320-L323 PolarHBondContact O-N 2.96Å; V321-L323 VanDerWaalsContact C-N 3.35Å; V321-L323 PolarHBondContact O-N 3.15Å
324L94.5Very high91.6Very high0 Ų044.9 Ų44.90%026%0.259CS..Hα-helixtrans-75.7-41.4178.5-69.7170.7000111.5I292 L298 A308 L309 A312 I320 V321 N322 E326 Q327 V329I292-L324 HydrophobicContact CD1-CD2 3.87Å; L298-L324 HydrophobicContact CD2-CD2 3.84Å; A308-L324 HydrophobicContact CB-CD1 4.04Å; A308-L324 HydrophobicContact CB-CD2 4.13Å; A308-L324 WeakPolarHBondContact O-CD1 3.14Å; L309-L324 HydrophobicContact CD1-CB 4.41Å; A312-L324 HydrophobicContact CB-CD1 3.94Å; I320-L324 HydrophobicContact CG2-CD1 3.98Å; I320-L324 HydrophobicContact CG2-CG 4.33Å; I320-L324 WeakPolarHBondContact O-CG 3.41Å; I320-L324 PolarHBondContact O-N 3.29Å; V321-L324 PolarHBondContact O-N 3.04Å; V321-L324 VanDerWaalsContact O-N 3.11Å; N322-L324 VanDerWaalsContact C-N 3.28Å; N322-L324 PolarHBondContact O-N 2.9Å; L324-E326 VanDerWaalsContact C-N 3.26Å; L324-E326 PolarHBondContact O-N 2.89Å; L324-Q327 WeakPolarHBondContact O-CB 3.39Å; L324-Q327 PolarHBondContact O-N 3.37Å; L324-V329 HydrophobicContact CB-CG2 4.36Å; L324-V329 WeakPolarHBondContact O-CG1 3.11Å; L324-V329 WeakPolarHBondContact O-CG2 3.18Å
325L93Very high91.7Very high5 Ų545 Ų453%0.02626%0.259CS..Hα-helixtrans-61.1-35.2177.2-68.2175.1000112.1L309 V321 N322 Q327 N328 V329 V331 L356 L357 Y360L309-L325 HydrophobicContact CD1-CD2 4.24Å; L309-L325 HydrophobicContact CD1-CG 4.49Å; L309-L325 HydrophobicContact CD2-CD2 4.46Å; V321-L325 HydrophobicContact CG1-CD1 3.78Å; V321-L325 HydrophobicContact CG1-CG 4.21Å; V321-L325 VanDerWaalsContact O-CG 3.31Å; V321-L325 WeakPolarHBondContact O-CG 3.3Å; V321-L325 PolarHBondContact O-N 3.33Å; N322-L325 PolarHBondContact O-N 3.03Å; L325-Q327 PolarHBondContact O-N 3.04Å; L325-Q327 VanDerWaalsContact O-N 3.09Å; L325-N328 PolarHBondContact O-N 3.05Å; L325-V329 HydrophobicContact CD2-CG2 4.3Å; L325-V331 HydrophobicContact CD2-CG1 3.64Å; L325-L356 HydrophobicContact CD1-CB 4.38Å; L325-L357 HydrophobicContact CD1-CD2 4.26Å; L325-L357 HydrophobicContact CD2-CD2 4.07Å; L325-Y360 HydrophobicContact CB-CD2 3.83Å; L325-Y360 HydrophobicContact CB-CE2 4.09Å; L325-Y360 HydrophobicContact CB-CG 4.32Å; L325-Y360 HydrophobicContact CD1-CG 4.35Å; L325-Y360 HydrophobicContact CD2-CD1 3.86Å; L325-Y360 HydrophobicContact CD2-CD2 4.14Å; L325-Y360 HydrophobicContact CD2-CE1 4.19Å; L325-Y360 HydrophobicContact CD2-CE2 4.46Å; L325-Y360 HydrophobicContact CD2-CG 3.83Å; L325-Y360 HydrophobicContact CG-CD2 4.38Å; L325-Y360 HydrophobicContact CG-CG 4.38Å; L325-Y360 WeakPolarHBondContact O-CE2 3.4Å
326E91.8Very high91.8Very high121 Ų12150.8 Ų50.857%0.56529%0.287SS*.THydrogen-bonded Turntrans-58.1-19.4171.5-74.1173.7-17400113.7N322 L324N322-E326 WeakPolarHBondContact O-CG 3.44Å; N322-E326 PolarHBondContact O-N 3.29Å; N322-E326 VanDerWaalsContact O-N 3.1Å; L324-E326 VanDerWaalsContact C-N 3.26Å; L324-E326 PolarHBondContact O-N 2.89Å
327Q91.3Very high91.8Very high90 Ų9053 Ų5342%0.42130%0.298SS..THydrogen-bonded Turntrans-95.711.5-178.8-55.6-56.1-65.800114.3I292 L298 L324 L325 V329I292-Q327 HydrophobicContact CG2-CG 3.59Å; L298-Q327 HydrophobicContact CD1-CB 3.47Å; L298-Q327 VanDerWaalsContact CD1-CB 3.47Å; L298-Q327 HydrophobicContact CD1-CG 4.01Å; L324-Q327 WeakPolarHBondContact O-CB 3.39Å; L324-Q327 PolarHBondContact O-N 3.37Å; L325-Q327 PolarHBondContact O-N 3.04Å; L325-Q327 VanDerWaalsContact O-N 3.09Å; Q327-V329 VanDerWaalsContact C-N 3.31Å; Q327-V329 HydrophobicContact CB-CG1 4.43Å; Q327-V329 PolarHBondContact O-N 2.91Å
328N84.2Confident91.8Very high108 Ų10853.7 Ų53.758%0.57831%0.308SS*.THydrogen-bonded Turntrans56.440.2-177.5-59.9-48.5000114.4L325 Y360L325-N328 PolarHBondContact O-N 3.05Å; N328-Y360 WeakPolarHBondContact CA-OH 3.33Å; N328-Y360 PolarHBondContact OD1-OH 3.36Å
329V88Confident91.6Very high15 Ų1555.7 Ų55.79%0.09131%0.312CS..  trans-66.1147.4174.2-65.60000111.4L298 L309 L324 L325 Q327 V331L298-V329 HydrophobicContact CB-CG1 4.07Å; L298-V329 HydrophobicContact CD1-CG1 3.62Å; L298-V329 HydrophobicContact CG-CG1 4.41Å; L309-V329 HydrophobicContact CD2-CG2 4.13Å; L324-V329 HydrophobicContact CB-CG2 4.36Å; L324-V329 WeakPolarHBondContact O-CG1 3.11Å; L324-V329 WeakPolarHBondContact O-CG2 3.18Å; L325-V329 HydrophobicContact CD2-CG2 4.3Å; Q327-V329 VanDerWaalsContact C-N 3.31Å; Q327-V329 HydrophobicContact CB-CG1 4.43Å; Q327-V329 PolarHBondContact O-N 2.91Å; V329-V331 PolarHBondContact O-N 3.16Å
330D87.8Confident91.5Very high74 Ų7453.9 Ų53.940%0.39630%0.299SS..  trans-68.7118171.7174.729.6000110.5S332 S333D330-S332 WeakPolarHBondContact OD1-CB 3.2Å; D330-S332 PolarHBondContact OD1-N 3.09Å; D330-S332 PolarHBondContact OD1-OG 3.15Å; D330-S332 PolarHBondContact OD2-OG 2.82Å; D330-S333 PolarHBondContact OD2-N 3.14Å; D330-S333 VanDerWaalsContact OD2-N 3.12Å; D330-S333 PolarHBondContact OD2-OG 2.95Å
331V88.8Confident91.4Very high46 Ų4654 Ų5428%0.27930%0.299SS..SBendtrans-87.3-11.4178.8-60.90000113L309 L325 V329 L357 Y360L309-V331 HydrophobicContact CD2-CB 4.19Å; L309-V331 HydrophobicContact CD2-CG1 3.82Å; L325-V331 HydrophobicContact CD2-CG1 3.64Å; V329-V331 PolarHBondContact O-N 3.16Å; V331-L357 HydrophobicContact CG1-CD2 4.5Å; V331-Y360 HydrophobicContact CG1-CD1 3.77Å; V331-Y360 HydrophobicContact CG1-CE1 3.75Å
332S89.3Confident91.2Very high82 Ų8259.8 Ų59.857%0.57332%0.321SS*.SBendtrans-91.5-9.1-178.270.60000113.9D330 Q334D330-S332 WeakPolarHBondContact OD1-CB 3.2Å; D330-S332 PolarHBondContact OD1-N 3.09Å; D330-S332 PolarHBondContact OD1-OG 3.15Å; D330-S332 PolarHBondContact OD2-OG 2.82Å; S332-Q334 PolarHBondContact O-N 3.48Å
333S90.8Very high91Very high31 Ų3160.1 Ų60.122%0.21732%0.32CS..  trans-53137.2175.6-72.80000111.9D330D330-S333 PolarHBondContact OD2-N 3.14Å; D330-S333 VanDerWaalsContact OD2-N 3.12Å; D330-S333 PolarHBondContact OD2-OG 2.95Å
334Q92.8Very high90.8Very high120 Ų12060.8 Ų60.856%0.56132%0.322SS*.BIsolated β-bridgetrans-111.8147179-70.8177.9-33.700110.4S332 G338 Q339 T340S332-Q334 PolarHBondContact O-N 3.48Å; Q334-G338 PolarHBondContact NE2-O 2.96Å; Q334-G338 VanDerWaalsContact NE2-O 3.12Å; Q334-Q339 WeakPolarHBondContact CA-O 3.22Å; Q334-T340 HydrophobicContact CG-CG2 3.66Å
335D91.9Very high90.7Very high16 Ų1660.8 Ų60.89%0.08632%0.322CS..  trans-81.7-175.1170.578.8-6.6000112.5R306 I310 S337 G338 Q339 Y344R306-D335 HydrophobicContact CG-CB 3.75Å; I310-D335 HydrophobicContact CD1-CB 4.24Å; D335-S337 VanDerWaalsContact CG-OG 3.28Å; D335-S337 PolarHBondContact O-N 2.71Å; D335-S337 VanDerWaalsContact O-N 3.14Å; D335-S337 VanDerWaalsContact OD1-CA 3.31Å; D335-S337 WeakPolarHBondContact OD1-CA 3.26Å; D335-S337 WeakPolarHBondContact OD1-CB 3.46Å; D335-S337 PolarHBondContact OD1-N 3.29Å; D335-S337 PolarHBondContact OD1-OG 3.38Å; D335-S337 PolarHBondContact OD2-OG 3.02Å; D335-G338 PolarHBondContact O-N 2.69Å; D335-G338 PolarHBondContact OD1-N 3.3Å; D335-G338 VanDerWaalsContact OD1-N 3.15Å; D335-Q339 PolarHBondContact N-O 2.92Å; D335-Q339 PolarHBondContact OD1-N 2.86Å; D335-Y344 PolarHBondContact OD2-OH 3.46Å
336L91.8Very high90.7Very high143 Ų14364.6 Ų64.675%0.74935%0.345SS*.THydrogen-bonded Turntrans-63.9-17.1178.9-67.6177.9000114Y304 G338Y304-L336 WeakPolarHBondContact O-CB 3.26Å; Y304-L336 VanDerWaalsContact O-CG 3.27Å; Y304-L336 WeakPolarHBondContact O-CG 3.49Å; Y304-L336 PolarHBondContact O-N 3.04Å; Y304-L336 VanDerWaalsContact O-N 3.07Å; L336-G338 VanDerWaalsContact C-N 3.34Å
337S89.9Confident90.6Very high73 Ų7360.7 Ų60.751%0.5133%0.331SS..THydrogen-bonded Turntrans-92.13174.672.90000113.2D335 Q339D335-S337 VanDerWaalsContact CG-OG 3.28Å; D335-S337 PolarHBondContact O-N 2.71Å; D335-S337 VanDerWaalsContact O-N 3.14Å; D335-S337 VanDerWaalsContact OD1-CA 3.31Å; D335-S337 WeakPolarHBondContact OD1-CA 3.26Å; D335-S337 WeakPolarHBondContact OD1-CB 3.46Å; D335-S337 PolarHBondContact OD1-N 3.29Å; D335-S337 PolarHBondContact OD1-OG 3.38Å; D335-S337 PolarHBondContact OD2-OG 3.02Å; S337-Q339 PolarHBondContact O-N 3.24Å; S337-Q339 WeakPolarHBondContact OG-CG 3.44Å
338G91.3Very high90.3Very high28 Ų2858.3 Ų58.329%0.28933%0.325SS..SBendtrans76.110.6-176.800000113.5Q334 D335 L336Q334-G338 PolarHBondContact NE2-O 2.96Å; Q334-G338 VanDerWaalsContact NE2-O 3.12Å; D335-G338 PolarHBondContact O-N 2.69Å; D335-G338 PolarHBondContact OD1-N 3.3Å; D335-G338 VanDerWaalsContact OD1-N 3.15Å; L336-G338 VanDerWaalsContact C-N 3.34Å
339Q91.1Very high90.5Very high70 Ų7059.9 Ų59.933%0.32733%0.328SS..  trans-89.8135-176.6-63.3-66-6500111Q334 D335 S337 E343 Y344Q334-Q339 WeakPolarHBondContact CA-O 3.22Å; D335-Q339 PolarHBondContact N-O 2.92Å; D335-Q339 PolarHBondContact OD1-N 2.86Å; S337-Q339 PolarHBondContact O-N 3.24Å; S337-Q339 WeakPolarHBondContact OG-CG 3.44Å; Q339-E343 WeakPolarHBondContact CA-OE2 3.26Å; Q339-Y344 HydrophobicContact CB-CD2 3.99Å; Q339-Y344 HydrophobicContact CB-CE2 3.41Å; Q339-Y344 VanDerWaalsContact CB-CE2 3.41Å; Q339-Y344 HydrophobicContact CG-CE2 4.34Å
340T93.3Very high90.6Very high23 Ų2361.8 Ų61.814%0.14134%0.336CS..BIsolated β-bridgetrans-91.8163.817662.50000111.6Q334 R342 E343 Y344Q334-T340 HydrophobicContact CG-CG2 3.66Å; T340-R342 PolarHBondContact O-N 3.26Å; T340-E343 PolarHBondContact N-OE2 3.1Å; T340-E343 PolarHBondContact O-N 3.23Å; T340-E343 VanDerWaalsContact OG1-CD 3.28Å; T340-E343 WeakPolarHBondContact OG1-CG 3.31Å; T340-E343 PolarHBondContact OG1-N 3.37Å; T340-E343 PolarHBondContact OG1-OE2 3.15Å; T340-Y344 WeakPolarHBondContact O-CD2 3.37Å; T340-Y344 PolarHBondContact O-N 3.37Å
341A91.7Very high90.8Very high2 Ų264.8 Ų64.82%0.01735%0.347CS..Hα-helixtrans-56.1-36.4174.200000112.5L309 I310 V313 A345L309-A341 HydrophobicContact CD2-CB 3.99Å; L309-A341 HydrophobicContact CG-CB 3.95Å; I310-A341 HydrophobicContact CG1-CB 4.08Å; V313-A341 WeakPolarHBondContact CG1-O 3.27Å; V313-A341 HydrophobicContact CG2-CB 4.06Å; A341-A345 PolarHBondContact O-N 3.28Å
342R92.8Very high91Very high121 Ų12166.7 Ų66.746%0.45736%0.359SS..Hα-helixtrans-68-41.8178.8-174.8-179.9177.897.1-0.4112.2T340 Y344 A345 V346 L357 S358T340-R342 PolarHBondContact O-N 3.26Å; R342-Y344 VanDerWaalsContact C-N 3.33Å; R342-Y344 PolarHBondContact O-N 3.45Å; R342-A345 PolarHBondContact O-N 2.99Å; R342-V346 WeakPolarHBondContact O-CG2 3.02Å; R342-V346 PolarHBondContact O-N 3.5Å; R342-L357 HydrophobicContact CB-CD1 4.33Å; R342-S358 PolarHBondContact NH1-OG 3.4Å
343E91.3Very high91.2Very high80 Ų8063 Ų6337%0.37433%0.333SS..Hα-helixtrans-64.6-39.2179.4-71.2159.4159.600111.3Q339 T340 V346 S347Q339-E343 WeakPolarHBondContact CA-OE2 3.26Å; T340-E343 PolarHBondContact N-OE2 3.1Å; T340-E343 PolarHBondContact O-N 3.23Å; T340-E343 VanDerWaalsContact OG1-CD 3.28Å; T340-E343 WeakPolarHBondContact OG1-CG 3.31Å; T340-E343 PolarHBondContact OG1-N 3.37Å; T340-E343 PolarHBondContact OG1-OE2 3.15Å; E343-V346 PolarHBondContact O-N 2.9Å; E343-S347 VanDerWaalsContact O-CB 3.31Å; E343-S347 WeakPolarHBondContact O-CB 3.46Å; E343-S347 PolarHBondContact O-N 3.14Å; E343-S347 PolarHBondContact O-OG 3.26Å
344Y90.8Very high91.2Very high28 Ų2862.6 Ų62.611%0.1133%0.33CS..Hα-helixtrans-62.4-43170.1-82.2-66.3000113.1V117 I310 D335 Q339 T340 R342 V346 S347 S348V117-Y344 HydrophobicContact CG1-CD1 3.86Å; V117-Y344 HydrophobicContact CG1-CE1 3.6Å; I310-Y344 HydrophobicContact CG2-CD2 3.71Å; I310-Y344 HydrophobicContact CG2-CE2 3.77Å; D335-Y344 PolarHBondContact OD2-OH 3.46Å; Q339-Y344 HydrophobicContact CB-CD2 3.99Å; Q339-Y344 HydrophobicContact CB-CE2 3.41Å; Q339-Y344 VanDerWaalsContact CB-CE2 3.41Å; Q339-Y344 HydrophobicContact CG-CE2 4.34Å; T340-Y344 WeakPolarHBondContact O-CD2 3.37Å; T340-Y344 PolarHBondContact O-N 3.37Å; R342-Y344 VanDerWaalsContact C-N 3.33Å; R342-Y344 PolarHBondContact O-N 3.45Å; Y344-V346 VanDerWaalsContact C-N 3.33Å; Y344-V346 PolarHBondContact O-N 3.06Å; Y344-S347 WeakPolarHBondContact CA-OG 3.43Å; Y344-S347 PolarHBondContact O-N 3.47Å; Y344-S347 PolarHBondContact O-OG 3.24Å; Y344-S348 VanDerWaalsContact O-CB 3.31Å; Y344-S348 WeakPolarHBondContact O-CB 3.39Å; Y344-S348 PolarHBondContact O-N 2.76Å; Y344-S348 PolarHBondContact O-OG 2.8Å
345A92.1Very high91.2Very high0 Ų062.6 Ų62.60%033%0.33CS..Hα-helixtrans-62-41.5178.400000112V313 A341 R342 H349 H350 I353 C354 L357V313-A345 HydrophobicContact CG1-CB 3.66Å; A341-A345 PolarHBondContact O-N 3.28Å; R342-A345 PolarHBondContact O-N 2.99Å; A345-H349 PolarHBondContact O-N 3.38Å; A345-H350 PolarHBondContact O-N 3.18Å; A345-I353 HydrophobicContact CB-CB 4.38Å; A345-I353 HydrophobicContact CB-CG2 3.82Å; A345-C354 VanDerWaalsContact C-SG 3.56Å; A345-C354 VanDerWaalsContact CB-SG 3.51Å; A345-L357 HydrophobicContact CB-CD1 4.24Å
346V91.4Very high91.3Very high85 Ų8563.4 Ų63.452%0.51533%0.334SS..Hα-helixtrans-69.3-47.5179.3172.90000111.2R342 E343 Y344 S348 H349R342-V346 WeakPolarHBondContact O-CG2 3.02Å; R342-V346 PolarHBondContact O-N 3.5Å; E343-V346 PolarHBondContact O-N 2.9Å; Y344-V346 VanDerWaalsContact C-N 3.33Å; Y344-V346 PolarHBondContact O-N 3.06Å; V346-S348 VanDerWaalsContact C-N 3.32Å; V346-S348 PolarHBondContact O-N 3.43Å; V346-H349 PolarHBondContact O-N 3.06Å; V346-H349 VanDerWaalsContact O-N 3.15Å
347S89.7Confident91.3Very high39 Ų3957.1 Ų57.127%0.27330%0.301SS..Hα-helixtrans-68.1-29.7-177.660.10000113.6E343 Y344E343-S347 VanDerWaalsContact O-CB 3.31Å; E343-S347 WeakPolarHBondContact O-CB 3.46Å; E343-S347 PolarHBondContact O-N 3.14Å; E343-S347 PolarHBondContact O-OG 3.26Å; Y344-S347 WeakPolarHBondContact CA-OG 3.43Å; Y344-S347 PolarHBondContact O-N 3.47Å; Y344-S347 PolarHBondContact O-OG 3.24Å
348S85.8Confident91.3Very high40 Ų4055 Ų5528%0.2829%0.287SS..THydrogen-bonded Turntrans-89.53.3173.8-62.80000114.1Y344 V346 H350Y344-S348 VanDerWaalsContact O-CB 3.31Å; Y344-S348 WeakPolarHBondContact O-CB 3.39Å; Y344-S348 PolarHBondContact O-N 2.76Å; Y344-S348 PolarHBondContact O-OG 2.8Å; V346-S348 VanDerWaalsContact C-N 3.32Å; V346-S348 PolarHBondContact O-N 3.43Å; S348-H350 VanDerWaalsContact C-N 3.27Å; S348-H350 VanDerWaalsContact CB-CD2 3.42Å; S348-H350 WeakPolarHBondContact CB-CD2 3.22Å; S348-H350 WeakPolarHBondContact CB-NE2 3.27Å; S348-H350 PolarHBondContact O-N 2.94Å
349H88.9Confident91.3Very high141 Ų14157.2 Ų57.265%0.65329%0.292SS*.THydrogen-bonded Turntrans56.234.9-178.1-51-56.6000114.5A345 V346 H351A345-H349 PolarHBondContact O-N 3.38Å; V346-H349 PolarHBondContact O-N 3.06Å; V346-H349 VanDerWaalsContact O-N 3.15Å; H349-H351 VanDerWaalsContact C-N 3.32Å; H349-H351 PolarHBondContact O-CD2 3.37Å; H349-H351 PolarHBondContact O-N 3.03Å
350H90.4Very high91.2Very high55 Ų5555.3 Ų55.326%0.25528%0.282SS..  trans-83.172.7175.9-65.9-44.7000111.3V313 A345 S348 V352 I353 C354V313-H350 PolarHBondContact O-CD2 2.87Å; A345-H350 PolarHBondContact O-N 3.18Å; S348-H350 VanDerWaalsContact C-N 3.27Å; S348-H350 VanDerWaalsContact CB-CD2 3.42Å; S348-H350 WeakPolarHBondContact CB-CD2 3.22Å; S348-H350 WeakPolarHBondContact CB-NE2 3.27Å; S348-H350 PolarHBondContact O-N 2.94Å; H350-V352 VanDerWaalsContact C-N 3.34Å; H350-V352 PolarHBondContact O-N 3.47Å; H350-I353 HydrophobicContact CB-CB 3.95Å; H350-I353 HydrophobicContact CB-CD1 3.97Å; H350-I353 HydrophobicContact CB-CG1 4.19Å; H350-I353 PolarHBondContact O-N 3.01Å; H350-C354 PolarHBondContact O-N 3.49Å
351H90.9Very high90.8Very high137 Ų13760 Ų6063%0.63430%0.3SS*.Hα-helixtrans-50.3-47.8-175.2-63.1-70.1000113.9H349 I353 C354 E355H349-H351 VanDerWaalsContact C-N 3.32Å; H349-H351 PolarHBondContact O-CD2 3.37Å; H349-H351 PolarHBondContact O-N 3.03Å; H351-I353 VanDerWaalsContact C-N 3.28Å; H351-I353 PolarHBondContact O-N 2.88Å; H351-C354 WeakPolarHBondContact O-CB 3.33Å; H351-C354 PolarHBondContact O-N 3.4Å; H351-C354 VanDerWaalsContact O-N 3.14Å; H351-E355 PolarHBondContact O-N 2.66Å
352V93.2Very high90.5Very high87 Ų8765.9 Ų65.953%0.52733%0.327SS..Hα-helixtrans-60.4-38.2178.8179.80000111.9A318 H350 E355 L356A318-V352 HydrophobicContact CB-CG1 4.08Å; H350-V352 VanDerWaalsContact C-N 3.34Å; H350-V352 PolarHBondContact O-N 3.47Å; V352-E355 PolarHBondContact O-N 3.19Å; V352-L356 HydrophobicContact CG1-CD1 4.39Å; V352-L356 VanDerWaalsContact O-CG 3.3Å; V352-L356 WeakPolarHBondContact O-CG 3.32Å; V352-L356 PolarHBondContact O-N 3.32Å
353I93.1Very high90.1Very high3 Ų366.7 Ų66.72%0.01533%0.334CS..Hα-helixtrans-72-37.9178.5-66.5177.9000110.5V313 A318 V321 A345 H350 H351 E355 L356 L357V313-I353 HydrophobicContact CB-CG2 4.37Å; V313-I353 HydrophobicContact CG1-CG2 4.04Å; V313-I353 HydrophobicContact CG2-CG2 3.69Å; A318-I353 HydrophobicContact CB-CG1 4.03Å; V321-I353 HydrophobicContact CG1-CG2 4.39Å; V321-I353 HydrophobicContact CG2-CD1 4.23Å; V321-I353 HydrophobicContact CG2-CG1 4.47Å; V321-I353 HydrophobicContact CG2-CG2 4.29Å; A345-I353 HydrophobicContact CB-CB 4.38Å; A345-I353 HydrophobicContact CB-CG2 3.82Å; H350-I353 HydrophobicContact CB-CB 3.95Å; H350-I353 HydrophobicContact CB-CD1 3.97Å; H350-I353 HydrophobicContact CB-CG1 4.19Å; H350-I353 PolarHBondContact O-N 3.01Å; H351-I353 VanDerWaalsContact C-N 3.28Å; H351-I353 PolarHBondContact O-N 2.88Å; I353-E355 VanDerWaalsContact C-N 3.31Å; I353-E355 PolarHBondContact O-N 3.28Å; I353-L356 PolarHBondContact O-N 3.01Å; I353-L357 HydrophobicContact CG2-CD1 4.05Å; I353-L357 HydrophobicContact CG2-CG 4.37Å; I353-L357 WeakPolarHBondContact O-CB 3.45Å; I353-L357 VanDerWaalsContact O-CG 3.32Å; I353-L357 WeakPolarHBondContact O-CG 3.34Å; I353-L357 PolarHBondContact O-N 3.47Å
354C92.3Very high89.6Confident23 Ų2365.6 Ų65.616%0.15533%0.329CS..Hα-helixtrans-59.5-41.8173.5-67.80000112A345 H350 H351 S358A345-C354 VanDerWaalsContact C-SG 3.56Å; A345-C354 VanDerWaalsContact CB-SG 3.51Å; H350-C354 PolarHBondContact O-N 3.49Å; H351-C354 WeakPolarHBondContact O-CB 3.33Å; H351-C354 PolarHBondContact O-N 3.4Å; H351-C354 VanDerWaalsContact O-N 3.14Å; C354-S358 WeakPolarHBondContact O-CB 3.42Å; C354-S358 PolarHBondContact O-N 2.78Å; C354-S358 PolarHBondContact O-OG 3.17Å
355E92.6Very high88.9Confident120 Ų12069.5 Ų69.556%0.56135%0.35SS*.Hα-helixtrans-62.7-52.5174.3-71.5173.6-179.800110.6H351 V352 I353 L357 S358 D359H351-E355 PolarHBondContact O-N 2.66Å; V352-E355 PolarHBondContact O-N 3.19Å; I353-E355 VanDerWaalsContact C-N 3.31Å; I353-E355 PolarHBondContact O-N 3.28Å; E355-L357 VanDerWaalsContact C-N 3.29Å; E355-L357 PolarHBondContact O-N 2.9Å; E355-S358 WeakPolarHBondContact O-CA 3.46Å; E355-S358 WeakPolarHBondContact O-CB 3.44Å; E355-S358 PolarHBondContact O-N 3.21Å; E355-D359 PolarHBondContact O-N 3.29Å
356L93.4Very high88.2Confident33 Ų3375 Ų7517%0.17338%0.379CS..Hα-helixtrans-54.1-42.9178.1-72.9172.9000113.2A318 L325 V352 I353 Y360A318-L356 HydrophobicContact CB-CD1 4.02Å; L325-L356 HydrophobicContact CD1-CB 4.38Å; V352-L356 HydrophobicContact CG1-CD1 4.39Å; V352-L356 VanDerWaalsContact O-CG 3.3Å; V352-L356 WeakPolarHBondContact O-CG 3.32Å; V352-L356 PolarHBondContact O-N 3.32Å; I353-L356 PolarHBondContact O-N 3.01Å; L356-Y360 VanDerWaalsContact O-CB 3.31Å; L356-Y360 WeakPolarHBondContact O-CB 3.36Å; L356-Y360 PolarHBondContact O-N 2.79Å; L356-Y360 VanDerWaalsContact O-N 3.07Å
357L91.4Very high87.4Confident11 Ų1176 Ų766%0.05838%0.376CS..Hα-helixtrans-69.5-32.8177.4-69.6173.4000112.5L309 V313 L325 V331 R342 A345 I353 E355 K361L309-L357 HydrophobicContact CD2-CD2 4.45Å; V313-L357 HydrophobicContact CG2-CD1 4.45Å; L325-L357 HydrophobicContact CD1-CD2 4.26Å; L325-L357 HydrophobicContact CD2-CD2 4.07Å; V331-L357 HydrophobicContact CG1-CD2 4.5Å; R342-L357 HydrophobicContact CB-CD1 4.33Å; A345-L357 HydrophobicContact CB-CD1 4.24Å; I353-L357 HydrophobicContact CG2-CD1 4.05Å; I353-L357 HydrophobicContact CG2-CG 4.37Å; I353-L357 WeakPolarHBondContact O-CB 3.45Å; I353-L357 VanDerWaalsContact O-CG 3.32Å; I353-L357 WeakPolarHBondContact O-CG 3.34Å; I353-L357 PolarHBondContact O-N 3.47Å; E355-L357 VanDerWaalsContact C-N 3.29Å; E355-L357 PolarHBondContact O-N 2.9Å; L357-K361 PolarHBondContact O-N 3.09Å
358S90.4Very high86.6Confident30 Ų3078.1 Ų78.121%0.2138%0.383CS..Hα-helixtrans-72.1-49.1177.5-55.90000110.7R342 C354 E355 Y360 K361 E362R342-S358 PolarHBondContact NH1-OG 3.4Å; C354-S358 WeakPolarHBondContact O-CB 3.42Å; C354-S358 PolarHBondContact O-N 2.78Å; C354-S358 PolarHBondContact O-OG 3.17Å; E355-S358 WeakPolarHBondContact O-CA 3.46Å; E355-S358 WeakPolarHBondContact O-CB 3.44Å; E355-S358 PolarHBondContact O-N 3.21Å; S358-Y360 VanDerWaalsContact C-N 3.25Å; S358-Y360 PolarHBondContact O-N 3.4Å; S358-K361 WeakPolarHBondContact O-CB 3.24Å; S358-K361 PolarHBondContact O-N 3.13Å; S358-E362 PolarHBondContact O-N 3.48Å
359D90.5Very high85.8Confident74 Ų7479 Ų7940%0.39639%0.389SS..Hα-helixtrans-56.1-41.1175.7-71.24.6000111.8E355 E362 K363E355-D359 PolarHBondContact O-N 3.29Å; D359-E362 PolarHBondContact O-N 2.99Å; D359-K363 WeakPolarHBondContact O-CB 3.5Å; D359-K363 VanDerWaalsContact O-CG 3.26Å; D359-K363 WeakPolarHBondContact O-CG 3.42Å; D359-K363 PolarHBondContact O-N 3.32Å
360Y90Very high84.8Confident30 Ų3075.6 Ų75.612%0.11838%0.381CS..Hα-helixtrans-64.1-43177.5-177.2-98.5000112.2L325 N328 V331 L356 S358 K363 Q364L325-Y360 HydrophobicContact CB-CD2 3.83Å; L325-Y360 HydrophobicContact CB-CE2 4.09Å; L325-Y360 HydrophobicContact CB-CG 4.32Å; L325-Y360 HydrophobicContact CD1-CG 4.35Å; L325-Y360 HydrophobicContact CD2-CD1 3.86Å; L325-Y360 HydrophobicContact CD2-CD2 4.14Å; L325-Y360 HydrophobicContact CD2-CE1 4.19Å; L325-Y360 HydrophobicContact CD2-CE2 4.46Å; L325-Y360 HydrophobicContact CD2-CG 3.83Å; L325-Y360 HydrophobicContact CG-CD2 4.38Å; L325-Y360 HydrophobicContact CG-CG 4.38Å; L325-Y360 WeakPolarHBondContact O-CE2 3.4Å; N328-Y360 WeakPolarHBondContact CA-OH 3.33Å; N328-Y360 PolarHBondContact OD1-OH 3.36Å; V331-Y360 HydrophobicContact CG1-CD1 3.77Å; V331-Y360 HydrophobicContact CG1-CE1 3.75Å; L356-Y360 VanDerWaalsContact O-CB 3.31Å; L356-Y360 WeakPolarHBondContact O-CB 3.36Å; L356-Y360 PolarHBondContact O-N 2.79Å; L356-Y360 VanDerWaalsContact O-N 3.07Å; S358-Y360 VanDerWaalsContact C-N 3.25Å; S358-Y360 PolarHBondContact O-N 3.4Å; Y360-K363 PolarHBondContact O-N 3.35Å; Y360-Q364 HydrophobicContact CD1-CG 4.29Å; Y360-Q364 HydrophobicContact CE1-CG 3.81Å; Y360-Q364 WeakPolarHBondContact O-CG 3.36Å; Y360-Q364 PolarHBondContact O-N 3.01Å; Y360-Q364 PolarHBondContact OH-NE2 3.47Å
361K84.8Confident83.4Confident122 Ų12278.7 Ų78.753%0.5340%0.396SS..Hα-helixtrans-64.4-42.7178-170.7176.7-179.5178.90111.3L357 S358 Q364 M365L357-K361 PolarHBondContact O-N 3.09Å; S358-K361 WeakPolarHBondContact O-CB 3.24Å; S358-K361 PolarHBondContact O-N 3.13Å; K361-Q364 PolarHBondContact O-N 3.47Å; K361-M365 HydrophobicContact CG-CE 4.34Å; K361-M365 VanDerWaalsContact O-CG 3.26Å; K361-M365 WeakPolarHBondContact O-CG 3.44Å; K361-M365 PolarHBondContact O-N 3.05Å
362E85.4Confident81.9Confident124 Ų12478.1 Ų78.158%0.57940%0.398SS*.Hα-helixtrans-61.5-45.2175.9-70.7178.1-172.400111.9S358 D359 Q364 M365 L366S358-E362 PolarHBondContact O-N 3.48Å; D359-E362 PolarHBondContact O-N 2.99Å; E362-Q364 VanDerWaalsContact C-N 3.33Å; E362-Q364 PolarHBondContact O-N 2.82Å; E362-M365 PolarHBondContact O-N 3.5Å; E362-L366 WeakPolarHBondContact O-CG 3.45Å; E362-L366 PolarHBondContact O-N 3.44Å
363K84.4Confident80.1Confident139 Ų13978.1 Ų78.160%0.60440%0.401SS*.Hα-helixtrans-60.3-40.4176-74.1170-175.1170.10112.6D359 Y360 K367D359-K363 WeakPolarHBondContact O-CB 3.5Å; D359-K363 VanDerWaalsContact O-CG 3.26Å; D359-K363 WeakPolarHBondContact O-CG 3.42Å; D359-K363 PolarHBondContact O-N 3.32Å; Y360-K363 PolarHBondContact O-N 3.35Å; K363-K367 PolarHBondContact O-N 2.97Å
364Q80.6Confident78.2Confident57 Ų5785 Ų8527%0.26644%0.439SS..Hα-helixtrans-63.7-43.2174.8-77.3-72.3-0.200111.9Y360 K361 E362 L366 K367 I368Y360-Q364 HydrophobicContact CD1-CG 4.29Å; Y360-Q364 HydrophobicContact CE1-CG 3.81Å; Y360-Q364 WeakPolarHBondContact O-CG 3.36Å; Y360-Q364 PolarHBondContact O-N 3.01Å; Y360-Q364 PolarHBondContact OH-NE2 3.47Å; K361-Q364 PolarHBondContact O-N 3.47Å; E362-Q364 VanDerWaalsContact C-N 3.33Å; E362-Q364 PolarHBondContact O-N 2.82Å; Q364-L366 PolarHBondContact O-N 2.99Å; Q364-K367 WeakPolarHBondContact O-CB 3.4Å; Q364-K367 PolarHBondContact O-N 3.17Å; Q364-I368 WeakPolarHBondContact O-CG1 3.32Å; Q364-I368 PolarHBondContact O-N 3.2Å
365M76.1Confident76.1Confident110 Ų11089.7 Ų89.754%0.54247%0.469SS..Hα-helixtrans-63.3-40.4178.2-66-67.5167.800112.4K361 E362 K367 I368 S369K361-M365 HydrophobicContact CG-CE 4.34Å; K361-M365 VanDerWaalsContact O-CG 3.26Å; K361-M365 WeakPolarHBondContact O-CG 3.44Å; K361-M365 PolarHBondContact O-N 3.05Å; E362-M365 PolarHBondContact O-N 3.5Å; M365-K367 VanDerWaalsContact C-N 3.33Å; M365-I368 PolarHBondContact O-N 3.45Å; M365-S369 PolarHBondContact O-N 3.45Å; M365-S369 VanDerWaalsContact O-N 3.07Å; M365-S369 PolarHBondContact O-OG 3.41Å
366L76.3Confident74Confident116 Ų11687 Ų8761%0.60747%0.473SS*.Hα-helixtrans-67.3-32.9175.2-68.7171000112.7E362 Q364 S369 S370E362-L366 WeakPolarHBondContact O-CG 3.45Å; E362-L366 PolarHBondContact O-N 3.44Å; Q364-L366 PolarHBondContact O-N 2.99Å; L366-S369 WeakPolarHBondContact CA-OG 3.32Å; L366-S369 PolarHBondContact O-OG 3.4Å; L366-S370 PolarHBondContact O-N 3.06Å; L366-S370 VanDerWaalsContact O-N 3.13Å; L366-S370 PolarHBondContact O-OG 3.13Å; L366-S370 VanDerWaalsContact O-OG 3.08Å
367K75.7Confident71.8Confident105 Ų10595.2 Ų95.246%0.45751%0.507SS..Hα-helixtrans-66.8-43.8174.2-164.7175.4178.9-172.90111.6K363 Q364 M365 S369 S370 E371K363-K367 PolarHBondContact O-N 2.97Å; Q364-K367 WeakPolarHBondContact O-CB 3.4Å; Q364-K367 PolarHBondContact O-N 3.17Å; M365-K367 VanDerWaalsContact C-N 3.33Å; K367-S369 PolarHBondContact O-N 3.23Å; K367-S370 PolarHBondContact O-N 3.38Å; K367-S370 PolarHBondContact O-OG 3.3Å; K367-E371 WeakPolarHBondContact CE-OE1 3.35Å; K367-E371 WeakPolarHBondContact O-CG 3.4Å; K367-E371 PolarHBondContact O-N 3.39Å; K367-E371 VanDerWaalsContact O-N 3.08Å
368I72.8Confident69.4Low83 Ų83103.9 Ų103.943%0.42655%0.548SS..Hα-helixtrans-64.7-39.7177.6-64.5162.9000111.3Q364 M365 N372Q364-I368 WeakPolarHBondContact O-CG1 3.32Å; Q364-I368 PolarHBondContact O-N 3.2Å; M365-I368 PolarHBondContact O-N 3.45Å; I368-N372 VanDerWaalsContact O-CG 3.31Å; I368-N372 PolarHBondContact O-N 2.94Å; I368-N372 VanDerWaalsContact O-N 3.14Å; I368-N372 PolarHBondContact O-ND2 2.88Å
369S68.5Low67.2Low59 Ų59106.9 Ų106.941%0.41357%0.574SS.*Hα-helixtrans-69.2-35.2178.664.30000113.1M365 L366 K367 S373M365-S369 PolarHBondContact O-N 3.45Å; M365-S369 VanDerWaalsContact O-N 3.07Å; M365-S369 PolarHBondContact O-OG 3.41Å; L366-S369 WeakPolarHBondContact CA-OG 3.32Å; L366-S369 PolarHBondContact O-OG 3.4Å; K367-S369 PolarHBondContact O-N 3.23Å; S369-S373 PolarHBondContact O-N 3.35Å; S369-S373 PolarHBondContact O-OG 3.14Å
370S68.1Low65Low69 Ų69112.7 Ų112.748%0.48360%0.599SS.*Hα-helixtrans-70.7-37.5174.757.20000113.1L366 K367 S373L366-S370 PolarHBondContact O-N 3.06Å; L366-S370 VanDerWaalsContact O-N 3.13Å; L366-S370 PolarHBondContact O-OG 3.13Å; L366-S370 VanDerWaalsContact O-OG 3.08Å; K367-S370 PolarHBondContact O-N 3.38Å; K367-S370 PolarHBondContact O-OG 3.3Å; S370-S373 PolarHBondContact O-N 3.26Å
371E60.5Low62.9Low120 Ų120124.1 Ų124.156%0.56165%0.653SS**Hα-helixtrans-66.4-37175.7-73.4172.9-177.100112.1K367 S373 N374K367-E371 WeakPolarHBondContact CE-OE1 3.35Å; K367-E371 WeakPolarHBondContact O-CG 3.4Å; K367-E371 PolarHBondContact O-N 3.39Å; K367-E371 VanDerWaalsContact O-N 3.08Å; E371-S373 PolarHBondContact O-N 3.5Å; E371-N374 PolarHBondContact O-N 3.04Å
372N59Low61.8Low126 Ų126124.2 Ų124.267%0.67466%0.659SS**THydrogen-bonded Turntrans-73.9-10.4175.1-70.1-21.8000114.2I368I368-N372 VanDerWaalsContact O-CG 3.31Å; I368-N372 PolarHBondContact O-N 2.94Å; I368-N372 VanDerWaalsContact O-N 3.14Å; I368-N372 PolarHBondContact O-ND2 2.88Å
373S56.8Low60.5Low86 Ų86124.2 Ų124.260%0.60166%0.664SS**THydrogen-bonded Turntrans-91.7-1178.2-56.40000113.4S369 S370 E371 P375S369-S373 PolarHBondContact O-N 3.35Å; S369-S373 PolarHBondContact O-OG 3.14Å; S370-S373 PolarHBondContact O-N 3.26Å; E371-S373 PolarHBondContact O-N 3.5Å; S373-P375 WeakPolarHBondContact O-CD 3.3Å
374N51.8Low59.2Low149 Ų149123.4 Ų123.480%0.79767%0.667SS**  trans-109.973.9173.8-98.2-3.1000112.3E371E371-N374 PolarHBondContact O-N 3.04Å
375P48.7Very low57.9Low121 Ų121127.3 Ų127.379%0.78669%0.691SS**  trans-88.997.2159.733.1-25.1000108.2S373S373-P375 WeakPolarHBondContact O-CD 3.3Å
376G49.8Very low56.8Low64 Ų64128.4 Ų128.466%0.6670%0.7SS**  trans-178.1107.6176.600000116.8
377K46.5Very low55.5Low205 Ų205129.2 Ų129.289%0.89171%0.706SS**  trans84116.6165.7-49.1-177.6-178.2-172.30113
378E40.8Very low54.1Low193 Ų193130.9 Ų130.990%0.90272%0.724SS**  cis-143.3119.739.8-71.7165.9171.200111.8
379A43.8Very low52.6Low93 Ų93134.6 Ų134.677%0.76975%0.747SS**  trans-123.9144.3141.700000105.5
380E43.7Very low51.3Low195 Ų195140.9 Ų140.991%0.91178%0.775SS**  trans81.1114.9-172.1-54.2177.617300112.3
381E46.2Very low49.8Very low270 Ų270147.5 Ų147.5100%1.26280%0.801SS**  cis-146039.7-161.3172.6-160.600113

Retrieved 381 of 381 residues in 67 ms (Link to these results)