A0A077YZM5_TRITR Loading...

Globin domain containing protein

AlphaFold DB , UniProt , Accession A0A077YZM5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 218 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
1M35.4Very low53.6Low245 Ų245142.8 Ų142.8100%1.20767%0.672SS**  097.40-83.4172.2143.900109.7
2K33.8Very low57.1Low214 Ų214132.5 Ų132.593%0.9363%0.625SS**  trans-86.4105.1166-84.6179.3175.11770106.9S4K2-S4 PolarHBondContact O-N 3.19Å
3R34.1Very low60.1Low241 Ų241130.2 Ų130.291%0.90961%0.613SS**  trans-64.3114.3168.8-88179167.9174-3.8107.1R5R3-R5 PolarHBondContact O-N 3.16Å; R3-R5 VanDerWaalsContact O-N 3.16Å
4S42.2Very low62.7Low74 Ų74120.9 Ų120.952%0.51757%0.57SS.*  trans-46.8120165172.30000107.9K2 N6K2-S4 PolarHBondContact O-N 3.19Å; S4-N6 PolarHBondContact O-N 2.9Å
5R43.3Very low64.9Low212 Ų212120.4 Ų120.480%0.856%0.561SS**  trans-69.988169.2-82.7178.4175173.8-1.9105.6R3 N7R3-R5 PolarHBondContact O-N 3.16Å; R3-R5 VanDerWaalsContact O-N 3.16Å; R5-N7 PolarHBondContact O-N 2.91Å
6N47Very low66.9Low106 Ų106112.9 Ų112.957%0.56753%0.527SS*.  trans-53.2109.4166.4-88.8-9.7000107S4 E8S4-N6 PolarHBondContact O-N 2.9Å; N6-E8 PolarHBondContact O-N 3.19Å
7N52.8Low68.6Low65 Ų65115.9 Ų115.935%0.34854%0.541SS..G310 helixtrans-62.4-5.3175.9-126.35.2000111.9R5 D9R5-N7 PolarHBondContact O-N 2.91Å; N7-D9 VanDerWaalsContact C-N 3.32Å; N7-D9 PolarHBondContact O-N 2.91Å
8E54.7Low70.1Confident61 Ų61117.6 Ų117.629%0.28555%0.546SS..G310 helixtrans-72.1-14.6-177.5-61.8-168.3154.400114.4N6 R38N6-E8 PolarHBondContact O-N 3.19Å; E8-R38 IonicContact OE1-CZ 2.66Å; E8-R38 IonicContact OE1-NH1 3.65Å; E8-R38 PolarHBondContact OE1-NH1 3.42Å; E8-R38 IonicContact OE1-NH2 2.9Å; E8-R38 PolarHBondContact OE1-NH2 2.97Å
9D67.4Low71.5Confident130 Ų130113.1 Ų113.170%0.69553%0.529SS*.G310 helixtrans-99.414.3-177.2-94.1-13.8000114.8N7 A27N7-D9 VanDerWaalsContact C-N 3.32Å; N7-D9 PolarHBondContact O-N 2.91Å; D9-A27 WeakPolarHBondContact O-CB 3.31Å
10R85.3Confident72.7Confident134 Ų134109.9 Ų109.951%0.50653%0.527SS..  trans-98.7131.9-178.6-66.2-176.7179.6-179.7-0.1111.6
11S93.1Very high73.9Confident89 Ų89108.3 Ų108.362%0.62252%0.516SS*.  trans-63.7148.6158.5540000109.7L25S11-L25 CarbonylContact C-O 3.47Å; S11-L25 WeakPolarHBondContact CA-O 3.43Å; S11-L25 WeakPolarHBondContact CB-O 3.26Å
12V95.6Very high76.8Confident19 Ų1999.6 Ų99.612%0.11548%0.479CS..EExtended strand (participates in β ladder)trans-123.8124.5-175.4172.90000108.2I14 L25 V30 V99 P103V12-I14 HydrophobicContact CG1-CD1 4.21Å; V12-I14 HydrophobicContact CG1-CG1 3.75Å; V12-L25 HydrophobicContact CB-CB 4.39Å; V12-L25 PolarHBondContact N-O 3.42Å; V12-L25 PolarHBondContact O-N 3.35Å; V12-V30 HydrophobicContact CB-CG2 4.08Å; V12-V30 HydrophobicContact CG2-CG2 3.69Å; V12-V99 VanDerWaalsContact CG2-O 3.22Å; V12-V99 WeakPolarHBondContact CG2-O 3.32Å; V12-P103 HydrophobicContact CG1-CB 3.62Å; V12-P103 HydrophobicContact CG1-CG 3.58Å
13H96.1Very high79.9Confident102 Ų10289.9 Ų89.947%0.47244%0.437SS..EExtended strand (participates in β ladder)trans-102.6129.3168.4-177.477.4000108S22 D24H13-S22 VanDerWaalsContact CE1-CB 3.47Å; H13-S22 WeakPolarHBondContact CE1-CB 3.25Å; H13-D24 IonicContact CE1-OD1 3.84Å; H13-D24 IonicContact CG-OD1 3.42Å; H13-D24 IonicContact ND1-OD1 3.2Å; H13-D24 PolarHBondContact ND1-OD1 2.66Å; H13-D24 IonicContact ND1-OD2 3.8Å
14I96.4Very high82.9Confident0 Ų082.8 Ų82.80%042%0.418CS..EExtended strand (participates in β ladder)trans-121.3127173.9-45.8-176.3000107.5V12 S22 I23 P103 L106 V107 F163V12-I14 HydrophobicContact CG1-CD1 4.21Å; V12-I14 HydrophobicContact CG1-CG1 3.75Å; I14-S22 CarbonylContact O-C 3.49Å; I14-S22 WeakPolarHBondContact O-CA 3.46Å; I14-S22 WeakPolarHBondContact O-CB 3.41Å; I14-I23 HydrophobicContact CB-CG2 3.7Å; I14-I23 HydrophobicContact CD1-CG2 4.24Å; I14-I23 HydrophobicContact CG1-CG2 4.09Å; I14-I23 PolarHBondContact N-O 3Å; I14-I23 PolarHBondContact O-N 3.36Å; I14-P103 HydrophobicContact CD1-CB 3.79Å; I14-P103 HydrophobicContact CG1-CB 3.67Å; I14-P103 WeakPolarHBondContact CG2-O 3.19Å; I14-L106 HydrophobicContact CD1-CD2 4.07Å; I14-V107 HydrophobicContact CG2-CG2 3.5Å; I14-V107 VanDerWaalsContact CG2-CG2 3.5Å; I14-F163 HydrophobicContact CB-CE1 4.26Å; I14-F163 HydrophobicContact CB-CZ 4.39Å; I14-F163 HydrophobicContact CG2-CE1 3.77Å; I14-F163 HydrophobicContact CG2-CZ 3.98Å
15Y97Very high85.5Confident114 Ų11479.4 Ų79.445%0.44739%0.394SS..EExtended strand (participates in β ladder)trans-123.9137.5180177.3-116.7000111.2E17 R21Y15-E17 HydrophobicContact CD1-CG 4.06Å; Y15-E17 HydrophobicContact CE1-CB 4.29Å; Y15-E17 HydrophobicContact CE1-CG 3.64Å; Y15-R21 WeakPolarHBondContact CD2-O 3.47Å
16S97Very high88.1Confident1 Ų172.8 Ų72.81%0.00738%0.377CS..EExtended strand (participates in β ladder)trans-110.1104.6172.7179.60000109.9K18 S19 G20 R21 V107 E167S16-K18 PolarHBondContact O-N 3.21Å; S16-K18 VanDerWaalsContact O-N 3.16Å; S16-S19 WeakPolarHBondContact CB-OG 3.29Å; S16-S19 PolarHBondContact O-N 3.27Å; S16-S19 PolarHBondContact OG-OG 3.28Å; S16-G20 WeakPolarHBondContact O-CA 3.32Å; S16-G20 PolarHBondContact O-N 3.37Å; S16-R21 PolarHBondContact N-O 3.31Å; S16-V107 WeakPolarHBondContact OG-CG1 3.34Å; S16-E167 VanDerWaalsContact CB-CD 3.45Å; S16-E167 VanDerWaalsContact CB-OE2 3.29Å; S16-E167 WeakPolarHBondContact CB-OE2 3.31Å; S16-E167 VanDerWaalsContact OG-CD 3.3Å; S16-E167 PolarHBondContact OG-OE2 2.85Å
17E95.5Very high90.4Very high163 Ų16369 Ų6976%0.76236%0.361SS*.THydrogen-bonded Turntrans-56.3-30.7173.3-69-179.7173.200112.8Y15Y15-E17 HydrophobicContact CD1-CG 4.06Å; Y15-E17 HydrophobicContact CE1-CB 4.29Å; Y15-E17 HydrophobicContact CE1-CG 3.64Å
18K95.2Very high92.5Very high147 Ų14769.3 Ų69.364%0.63937%0.368SS*.THydrogen-bonded Turntrans-74.5-29.7-175.8-64-64.6-176.2-172.50113.1S16 R111S16-K18 PolarHBondContact O-N 3.21Å; S16-K18 VanDerWaalsContact O-N 3.16Å; K18-R111 VanDerWaalsContact CB-NH1 3.27Å
19S96.1Very high94.5Very high32 Ų3267.1 Ų67.122%0.22436%0.358CS..THydrogen-bonded Turntrans-111.3-12.1-179.872.30000113.4S16 R21 E167S16-S19 WeakPolarHBondContact CB-OG 3.29Å; S16-S19 PolarHBondContact O-N 3.27Å; S16-S19 PolarHBondContact OG-OG 3.28Å; S19-R21 PolarHBondContact O-N 3.17Å; S19-R21 WeakPolarHBondContact OG-CB 3.31Å; S19-R21 PolarHBondContact OG-N 3.27Å; S19-R21 PolarHBondContact OG-NE 3.27Å; S19-E167 WeakPolarHBondContact CB-OE1 3.33Å; S19-E167 PolarHBondContact OG-OE1 3.15Å; S19-E167 PolarHBondContact OG-OE2 2.86Å
20G96.7Very high96Very high48 Ų4861 Ų6150%0.49533%0.325SS..THydrogen-bonded Turntrans69.76.7-171.200000114S16S16-G20 WeakPolarHBondContact O-CA 3.32Å; S16-G20 PolarHBondContact O-N 3.37Å
21R97.3Very high96.4Very high78 Ų7859 Ų5929%0.29432%0.32SS..EExtended strand (participates in β ladder)trans-89.8148-178.5-66.5178.4-65.7-147.1-5.9111.2Y15 S16 S19 F163 S166 E167Y15-R21 WeakPolarHBondContact CD2-O 3.47Å; S16-R21 PolarHBondContact N-O 3.31Å; S19-R21 PolarHBondContact O-N 3.17Å; S19-R21 WeakPolarHBondContact OG-CB 3.31Å; S19-R21 PolarHBondContact OG-N 3.27Å; S19-R21 PolarHBondContact OG-NE 3.27Å; R21-F163 HydrophobicContact CB-CE2 4.16Å; R21-S166 VanDerWaalsContact CZ-C 3.45Å; R21-S166 VanDerWaalsContact CZ-O 3.23Å; R21-S166 VanDerWaalsContact NH1-CB 3.32Å; R21-S166 PolarHBondContact NH1-O 3.23Å; R21-S166 VanDerWaalsContact NH1-O 3.08Å; R21-S166 PolarHBondContact NH2-O 3.21Å; R21-E167 IonicContact CZ-OE1 3.56Å; R21-E167 IonicContact NE-OE1 3.81Å; R21-E167 PolarHBondContact NE-OE1 2.76Å; R21-E167 IonicContact NH2-OE1 2.69Å; R21-E167 PolarHBondContact NH2-OE1 3.36Å; R21-E167 IonicContact NH2-OE2 3.48Å
22S97.2Very high96.6Very high61 Ų6155.9 Ų55.943%0.42730%0.296SS..EExtended strand (participates in β ladder)trans-128.7165.5169.456.90000111.8H13 I14H13-S22 VanDerWaalsContact CE1-CB 3.47Å; H13-S22 WeakPolarHBondContact CE1-CB 3.25Å; I14-S22 CarbonylContact O-C 3.49Å; I14-S22 WeakPolarHBondContact O-CA 3.46Å; I14-S22 WeakPolarHBondContact O-CB 3.41Å
23I97.7Very high96.7Very high10 Ų1055 Ų555%0.05129%0.29CS..EExtended strand (participates in β ladder)trans-139.2134.9166.5178.1174.1000108.8I14 L25 K159 F163I14-I23 HydrophobicContact CB-CG2 3.7Å; I14-I23 HydrophobicContact CD1-CG2 4.24Å; I14-I23 HydrophobicContact CG1-CG2 4.09Å; I14-I23 PolarHBondContact N-O 3Å; I14-I23 PolarHBondContact O-N 3.36Å; I23-L25 HydrophobicContact CD1-CD2 3.86Å; I23-L25 HydrophobicContact CD1-CG 4.24Å; I23-L25 HydrophobicContact CG1-CD2 4.22Å; I23-L25 HydrophobicContact CG1-CG 4.3Å; I23-K159 HydrophobicContact CD1-CB 4.38Å; I23-K159 HydrophobicContact CD1-CG 3.82Å; I23-K159 WeakPolarHBondContact CD1-O 3.32Å; I23-K159 HydrophobicContact CG1-CG 4.3Å; I23-F163 HydrophobicContact CB-CB 4.07Å; I23-F163 HydrophobicContact CB-CD2 3.84Å; I23-F163 HydrophobicContact CB-CE2 4.42Å; I23-F163 HydrophobicContact CB-CG 3.89Å; I23-F163 HydrophobicContact CD1-CB 3.85Å; I23-F163 HydrophobicContact CD1-CG 4.47Å; I23-F163 HydrophobicContact CG2-CB 3.99Å; I23-F163 HydrophobicContact CG2-CD1 3.59Å; I23-F163 HydrophobicContact CG2-CD2 3.64Å; I23-F163 HydrophobicContact CG2-CE1 3.9Å; I23-F163 HydrophobicContact CG2-CE2 3.96Å; I23-F163 HydrophobicContact CG2-CG 3.45Å; I23-F163 VanDerWaalsContact CG2-CG 3.45Å; I23-F163 HydrophobicContact CG2-CZ 4.07Å
24D97.2Very high96.7Very high93 Ų9351 Ų5150%0.49727%0.272SS..EExtended strand (participates in β ladder)trans-105.4121170.1-65.1-67.6000109.5H13 K159H13-D24 IonicContact CE1-OD1 3.84Å; H13-D24 IonicContact CG-OD1 3.42Å; H13-D24 IonicContact ND1-OD1 3.2Å; H13-D24 PolarHBondContact ND1-OD1 2.66Å; H13-D24 IonicContact ND1-OD2 3.8Å; D24-K159 WeakPolarHBondContact O-CE 3.24Å; D24-K159 PolarHBondContact O-NZ 2.87Å
25L97.7Very high96.6Very high2 Ų254.8 Ų54.81%0.0129%0.29CS..EExtended strand (participates in β ladder)trans-105.7124.5170.2-62.7174.4000108.8S11 V12 I23 E29 V30 I33 V99 K159 L160S11-L25 CarbonylContact C-O 3.47Å; S11-L25 WeakPolarHBondContact CA-O 3.43Å; S11-L25 WeakPolarHBondContact CB-O 3.26Å; V12-L25 HydrophobicContact CB-CB 4.39Å; V12-L25 PolarHBondContact N-O 3.42Å; V12-L25 PolarHBondContact O-N 3.35Å; I23-L25 HydrophobicContact CD1-CD2 3.86Å; I23-L25 HydrophobicContact CD1-CG 4.24Å; I23-L25 HydrophobicContact CG1-CD2 4.22Å; I23-L25 HydrophobicContact CG1-CG 4.3Å; L25-E29 WeakPolarHBondContact CA-OE2 3.48Å; L25-E29 HydrophobicContact CB-CB 4.43Å; L25-E29 HydrophobicContact CD2-CB 4.28Å; L25-V30 HydrophobicContact CB-CG2 3.77Å; L25-V30 HydrophobicContact CD1-CG2 4.45Å; L25-I33 HydrophobicContact CD1-CD1 4.09Å; L25-I33 HydrophobicContact CD2-CD1 4.45Å; L25-V99 HydrophobicContact CD1-CB 4.4Å; L25-V99 HydrophobicContact CD1-CG1 3.77Å; L25-K159 HydrophobicContact CD2-CD 4.05Å; L25-K159 HydrophobicContact CD2-CG 4.44Å; L25-L160 HydrophobicContact CD1-CD1 4.37Å
26T97.3Very high96.6Very high73 Ų7349.4 Ų49.445%0.44827%0.269SS..  trans-65.4158.4170.562.60000110.5S28 E29 V30T26-S28 PolarHBondContact O-N 3.18Å; T26-E29 PolarHBondContact N-OE2 2.89Å; T26-E29 PolarHBondContact O-N 3.31Å; T26-E29 VanDerWaalsContact OG1-CG 3.31Å; T26-E29 WeakPolarHBondContact OG1-CG 3.37Å; T26-E29 PolarHBondContact OG1-N 2.82Å; T26-E29 PolarHBondContact OG1-OE2 3.19Å; T26-V30 WeakPolarHBondContact O-CG2 3.33Å; T26-V30 PolarHBondContact O-N 3.38Å
27A96.1Very high96.5Very high28 Ų2850.2 Ų50.223%0.23127%0.272CS..Hα-helixtrans-54.5-36.5174.700000112.3D9 V30 K31D9-A27 WeakPolarHBondContact O-CB 3.31Å; A27-V30 PolarHBondContact O-N 2.84Å; A27-K31 WeakPolarHBondContact O-CB 3.29Å; A27-K31 PolarHBondContact O-N 2.82Å
28S96.2Very high96.5Very high70 Ų7048.7 Ų48.749%0.4926%0.259SS..Hα-helixtrans-63.3-47.2175.2-1720000112.1T26 V30 K31 L32T26-S28 PolarHBondContact O-N 3.18Å; S28-V30 PolarHBondContact O-N 2.85Å; S28-K31 PolarHBondContact O-N 2.81Å; S28-L32 WeakPolarHBondContact O-CB 3.5Å; S28-L32 VanDerWaalsContact O-CG 3.29Å; S28-L32 WeakPolarHBondContact O-CG 3.4Å; S28-L32 PolarHBondContact O-N 2.97Å
29E97.5Very high96.4Very high16 Ų1645.9 Ų45.98%0.07525%0.251CS..Hα-helixtrans-62.6-42.7177.7-71.8166.2129.600111.9L25 T26 K31 L32 I33 H155 A156 K159L25-E29 WeakPolarHBondContact CA-OE2 3.48Å; L25-E29 HydrophobicContact CB-CB 4.43Å; L25-E29 HydrophobicContact CD2-CB 4.28Å; T26-E29 PolarHBondContact N-OE2 2.89Å; T26-E29 PolarHBondContact O-N 3.31Å; T26-E29 VanDerWaalsContact OG1-CG 3.31Å; T26-E29 WeakPolarHBondContact OG1-CG 3.37Å; T26-E29 PolarHBondContact OG1-N 2.82Å; T26-E29 PolarHBondContact OG1-OE2 3.19Å; E29-K31 VanDerWaalsContact C-N 3.34Å; E29-K31 PolarHBondContact O-N 3.18Å; E29-L32 PolarHBondContact O-N 3.08Å; E29-I33 WeakPolarHBondContact O-CD1 3.42Å; E29-I33 WeakPolarHBondContact O-CG1 3.22Å; E29-I33 PolarHBondContact O-N 3.39Å; E29-H155 IonicContact OE1-CD2 2.9Å; E29-H155 IonicContact OE1-NE2 2.69Å; E29-A156 HydrophobicContact CB-CB 3.99Å; E29-A156 HydrophobicContact CG-CB 4.08Å; E29-K159 WeakPolarHBondContact OE1-CD 3.43Å; E29-K159 IonicContact OE1-NZ 2.87Å; E29-K159 PolarHBondContact OE1-NZ 3.02Å; E29-K159 IonicContact OE2-NZ 3.53Å; E29-K159 PolarHBondContact OE2-NZ 3.11Å
30V97.1Very high96.4Very high2 Ų244.5 Ų44.51%0.01224%0.241CC..Hα-helixtrans-59.2-46.9175.6174.70000110.6V12 L25 T26 A27 S28 I33 Q34 V99 T100V12-V30 HydrophobicContact CB-CG2 4.08Å; V12-V30 HydrophobicContact CG2-CG2 3.69Å; L25-V30 HydrophobicContact CB-CG2 3.77Å; L25-V30 HydrophobicContact CD1-CG2 4.45Å; T26-V30 WeakPolarHBondContact O-CG2 3.33Å; T26-V30 PolarHBondContact O-N 3.38Å; A27-V30 PolarHBondContact O-N 2.84Å; S28-V30 PolarHBondContact O-N 2.85Å; V30-I33 PolarHBondContact O-N 2.89Å; V30-Q34 WeakPolarHBondContact O-CG 3.33Å; V30-Q34 PolarHBondContact O-N 3.28Å; V30-V99 HydrophobicContact CG1-CG2 4.21Å; V30-T100 HydrophobicContact CG1-CG2 3.53Å
31K95.4Very high96.1Very high92 Ų9251.8 Ų51.840%0.426%0.259SS..Hα-helixtrans-61.4-44.6177.1-177177.6-180177.50111.9A27 S28 E29 I33 Q34 Q35A27-K31 WeakPolarHBondContact O-CB 3.29Å; A27-K31 PolarHBondContact O-N 2.82Å; S28-K31 PolarHBondContact O-N 2.81Å; E29-K31 VanDerWaalsContact C-N 3.34Å; E29-K31 PolarHBondContact O-N 3.18Å; K31-I33 PolarHBondContact O-N 3.47Å; K31-Q34 PolarHBondContact O-N 3.49Å; K31-Q35 HydrophobicContact CG-CG 4.17Å; K31-Q35 WeakPolarHBondContact O-CB 3.32Å; K31-Q35 VanDerWaalsContact O-CG 3.29Å; K31-Q35 WeakPolarHBondContact O-CG 3.15Å; K31-Q35 PolarHBondContact O-N 3.47Å
32L96.5Very high95.9Very high22 Ų2255.8 Ų55.812%0.11528%0.279CS..Hα-helixtrans-61.2-43.6177.5-72.5169.3000111.6S28 E29 S36 Q152 I153 A156S28-L32 WeakPolarHBondContact O-CB 3.5Å; S28-L32 VanDerWaalsContact O-CG 3.29Å; S28-L32 WeakPolarHBondContact O-CG 3.4Å; S28-L32 PolarHBondContact O-N 2.97Å; E29-L32 PolarHBondContact O-N 3.08Å; L32-S36 WeakPolarHBondContact O-CB 3.37Å; L32-S36 PolarHBondContact O-N 3.21Å; L32-S36 PolarHBondContact O-OG 2.77Å; L32-Q152 HydrophobicContact CD1-CB 3.72Å; L32-I153 HydrophobicContact CB-CG1 4.39Å; L32-I153 HydrophobicContact CD2-CG1 3.91Å; L32-A156 HydrophobicContact CB-CB 4.31Å
33I97.6Very high95.7Very high0 Ų055.6 Ų55.60%027%0.27CS..Hα-helixtrans-60.9-48.5176.6-71.2158.5000110.8L25 E29 V30 K31 S36 W37 A96 V99 A156 W157 L160L25-I33 HydrophobicContact CD1-CD1 4.09Å; L25-I33 HydrophobicContact CD2-CD1 4.45Å; E29-I33 WeakPolarHBondContact O-CD1 3.42Å; E29-I33 WeakPolarHBondContact O-CG1 3.22Å; E29-I33 PolarHBondContact O-N 3.39Å; V30-I33 PolarHBondContact O-N 2.89Å; K31-I33 PolarHBondContact O-N 3.47Å; I33-S36 PolarHBondContact O-OG 3.44Å; I33-S36 VanDerWaalsContact O-OG 3.12Å; I33-W37 WeakPolarHBondContact O-CB 3.26Å; I33-W37 PolarHBondContact O-N 2.97Å; I33-A96 HydrophobicContact CG2-CB 4.44Å; I33-V99 HydrophobicContact CG2-CG2 4.03Å; I33-A156 HydrophobicContact CD1-CB 4.18Å; I33-A156 HydrophobicContact CG1-CB 3.95Å; I33-W157 HydrophobicContact CG1-CD2 4.46Å; I33-W157 HydrophobicContact CG1-CG 4.46Å; I33-W157 HydrophobicContact CG2-CH2 4.27Å; I33-W157 HydrophobicContact CG2-CZ2 3.81Å; I33-L160 HydrophobicContact CD1-CB 4.19Å; I33-L160 HydrophobicContact CD1-CD2 4.06Å; I33-L160 HydrophobicContact CG2-CD2 4.16Å
34Q95.4Very high95.5Very high20 Ų2062 Ų629%0.09330%0.3CS..Hα-helixtrans-62-52.2179.2-73.8-71.8-33.200112.3V30 K31 W37 R38 A96 T100V30-Q34 WeakPolarHBondContact O-CG 3.33Å; V30-Q34 PolarHBondContact O-N 3.28Å; K31-Q34 PolarHBondContact O-N 3.49Å; Q34-W37 PolarHBondContact O-N 2.99Å; Q34-R38 VanDerWaalsContact O-CG 3.27Å; Q34-R38 WeakPolarHBondContact O-CG 3.44Å; Q34-R38 PolarHBondContact O-N 3.09Å; Q34-A96 PolarHBondContact NE2-O 3Å; Q34-T100 HydrophobicContact CG-CG2 3.71Å; Q34-T100 PolarHBondContact NE2-OG1 2.84Å
35Q94.6Very high95.4Very high78 Ų7860.7 Ų60.736%0.36429%0.291SS..Hα-helixtrans-67.8-43.7-175.1-70.1-175.6-18.400111.5K31 W37 R38 N39K31-Q35 HydrophobicContact CG-CG 4.17Å; K31-Q35 WeakPolarHBondContact O-CB 3.32Å; K31-Q35 VanDerWaalsContact O-CG 3.29Å; K31-Q35 WeakPolarHBondContact O-CG 3.15Å; K31-Q35 PolarHBondContact O-N 3.47Å; Q35-W37 VanDerWaalsContact C-N 3.33Å; Q35-W37 PolarHBondContact O-N 2.96Å; Q35-R38 WeakPolarHBondContact O-CB 3.4Å; Q35-R38 PolarHBondContact O-N 3.26Å; Q35-R38 VanDerWaalsContact O-N 3.15Å; Q35-N39 PolarHBondContact O-N 3.29Å; Q35-N39 PolarHBondContact O-ND2 3.06Å; Q35-N39 PolarHBondContact O-OD1 2.88Å
36S96.8Very high95.3Very high1 Ų160.8 Ų60.81%0.00729%0.292CS..Hα-helixtrans-61-41.117858.50000112.2L32 I33 N39 V40 Q145 W157L32-S36 WeakPolarHBondContact O-CB 3.37Å; L32-S36 PolarHBondContact O-N 3.21Å; L32-S36 PolarHBondContact O-OG 2.77Å; I33-S36 PolarHBondContact O-OG 3.44Å; I33-S36 VanDerWaalsContact O-OG 3.12Å; S36-N39 WeakPolarHBondContact O-CB 3.39Å; S36-N39 PolarHBondContact O-N 3.02Å; S36-V40 PolarHBondContact O-N 3.09Å; S36-Q145 PolarHBondContact O-NE2 3.44Å; S36-W157 PolarHBondContact OG-NE1 2.91Å
37W96.3Very high95.3Very high18 Ų1857.3 Ų57.37%0.06827%0.271CS..Hα-helixtrans-68-37.5174-173.4-116.6000113.5I33 Q34 Q35 N39 V40 K43 L92 R93 A96 W157I33-W37 WeakPolarHBondContact O-CB 3.26Å; I33-W37 PolarHBondContact O-N 2.97Å; Q34-W37 PolarHBondContact O-N 2.99Å; Q35-W37 VanDerWaalsContact C-N 3.33Å; Q35-W37 PolarHBondContact O-N 2.96Å; W37-N39 VanDerWaalsContact C-N 3.26Å; W37-N39 PolarHBondContact O-N 3.34Å; W37-V40 HydrophobicContact CE3-CB 4.44Å; W37-V40 HydrophobicContact CE3-CG2 3.98Å; W37-V40 HydrophobicContact CZ3-CG2 4.28Å; W37-V40 WeakPolarHBondContact O-CB 3.27Å; W37-V40 PolarHBondContact O-N 3.08Å; W37-K43 HydrophobicContact CH2-CG 4.43Å; W37-K43 HydrophobicContact CZ2-CB 4.34Å; W37-K43 HydrophobicContact CZ2-CD 3.87Å; W37-K43 HydrophobicContact CZ2-CG 4.02Å; W37-K43 PolarHBondContact O-NZ 3.49Å; W37-L92 HydrophobicContact CH2-CB 3.85Å; W37-L92 HydrophobicContact CZ3-CB 3.86Å; W37-L92 HydrophobicContact CZ3-CD1 4.28Å; W37-R93 HydrophobicContact CZ2-CB 3.7Å; W37-R93 HydrophobicContact CZ2-CG 4.14Å; W37-A96 HydrophobicContact CB-CB 3.71Å; W37-A96 HydrophobicContact CD2-CB 4.27Å; W37-A96 HydrophobicContact CG-CB 3.55Å; W37-W157 HydrophobicContact CB-CZ2 4.15Å
38R93.8Very high95.4Very high131 Ų13158.3 Ų58.349%0.49427%0.27SS..Hα-helixtrans-61-38173.8-73.9175.5-165170.98.8111.1E8 Q34 Q35 V40E8-R38 IonicContact OE1-CZ 2.66Å; E8-R38 IonicContact OE1-NH1 3.65Å; E8-R38 PolarHBondContact OE1-NH1 3.42Å; E8-R38 IonicContact OE1-NH2 2.9Å; E8-R38 PolarHBondContact OE1-NH2 2.97Å; Q34-R38 VanDerWaalsContact O-CG 3.27Å; Q34-R38 WeakPolarHBondContact O-CG 3.44Å; Q34-R38 PolarHBondContact O-N 3.09Å; Q35-R38 WeakPolarHBondContact O-CB 3.4Å; Q35-R38 PolarHBondContact O-N 3.26Å; Q35-R38 VanDerWaalsContact O-N 3.15Å; R38-V40 PolarHBondContact O-N 3.25Å
39N94.4Very high95.4Very high88 Ų8858.3 Ų58.347%0.47126%0.263SS..Hα-helixtrans-67.3-19.9178.6-66.8-17.3000113.8Q35 S36 W37 K41 Q145Q35-N39 PolarHBondContact O-N 3.29Å; Q35-N39 PolarHBondContact O-ND2 3.06Å; Q35-N39 PolarHBondContact O-OD1 2.88Å; S36-N39 WeakPolarHBondContact O-CB 3.39Å; S36-N39 PolarHBondContact O-N 3.02Å; W37-N39 VanDerWaalsContact C-N 3.26Å; W37-N39 PolarHBondContact O-N 3.34Å; N39-K41 PolarHBondContact O-N 2.86Å; N39-Q145 PolarHBondContact ND2-OE1 3.35Å
40V94.9Very high95.4Very high4 Ų457.5 Ų57.52%0.02426%0.259CS..  trans-6895.4171.1-176.30000109.2S36 W37 R38 K43 A46 T144S36-V40 PolarHBondContact O-N 3.09Å; W37-V40 HydrophobicContact CE3-CB 4.44Å; W37-V40 HydrophobicContact CE3-CG2 3.98Å; W37-V40 HydrophobicContact CZ3-CG2 4.28Å; W37-V40 WeakPolarHBondContact O-CB 3.27Å; W37-V40 PolarHBondContact O-N 3.08Å; R38-V40 PolarHBondContact O-N 3.25Å; V40-K43 HydrophobicContact CB-CG 4.43Å; V40-K43 HydrophobicContact CG1-CG 4.12Å; V40-K43 WeakPolarHBondContact O-CG 3.5Å; V40-K43 PolarHBondContact O-NZ 2.61Å; V40-A46 HydrophobicContact CG1-CB 3.8Å; V40-T144 HydrophobicContact CG2-CG2 4.45Å
41K91.1Very high95.5Very high200 Ų20057.4 Ų57.487%0.8726%0.259SS*.SBendtrans-65.5-48.9-177.1-64.5-176.2-179.31790112.5N39N39-K41 PolarHBondContact O-N 2.86Å
42K93Very high95.6Very high162 Ų16256.3 Ų56.370%0.70425%0.254SS*.  trans-103.780.8179.8-63.8-175-178.9-178.20110E44 E45 A46K42-E44 VanDerWaalsContact C-N 3.34Å; K42-E44 PolarHBondContact O-N 2.93Å; K42-E45 HydrophobicContact CB-CB 3.93Å; K42-E45 HydrophobicContact CB-CG 3.87Å; K42-E45 HydrophobicContact CD-CG 4.1Å; K42-E45 WeakPolarHBondContact O-CB 3.48Å; K42-E45 PolarHBondContact O-N 2.83Å; K42-E45 VanDerWaalsContact O-N 3.14Å; K42-A46 PolarHBondContact O-N 3.15Å
43K93.3Very high95.6Very high57 Ų5757.9 Ų57.925%0.24826%0.261CS..Hα-helixtrans-60.2-41-174.5-68.6179.117055.20113W37 V40 E45 A46 G47 E89W37-K43 HydrophobicContact CH2-CG 4.43Å; W37-K43 HydrophobicContact CZ2-CB 4.34Å; W37-K43 HydrophobicContact CZ2-CD 3.87Å; W37-K43 HydrophobicContact CZ2-CG 4.02Å; W37-K43 PolarHBondContact O-NZ 3.49Å; V40-K43 HydrophobicContact CB-CG 4.43Å; V40-K43 HydrophobicContact CG1-CG 4.12Å; V40-K43 WeakPolarHBondContact O-CG 3.5Å; V40-K43 PolarHBondContact O-NZ 2.61Å; K43-E45 VanDerWaalsContact C-N 3.25Å; K43-E45 PolarHBondContact O-N 3.49Å; K43-A46 VanDerWaalsContact O-CB 3.28Å; K43-A46 WeakPolarHBondContact O-CB 3.01Å; K43-A46 PolarHBondContact O-N 2.98Å; K43-G47 PolarHBondContact O-N 2.91Å; K43-E89 HydrophobicContact CB-CG 4.23Å; K43-E89 WeakPolarHBondContact CB-OE1 3.37Å; K43-E89 WeakPolarHBondContact O-CG 3.27Å
44E92.8Very high95.6Very high145 Ų14558.1 Ų58.168%0.67826%0.262SS*.Hα-helixtrans-57.4-39.1176.2-64.5179.2177.500112.4K42 A46 G47 K48K42-E44 VanDerWaalsContact C-N 3.34Å; K42-E44 PolarHBondContact O-N 2.93Å; E44-A46 VanDerWaalsContact C-N 3.32Å; E44-A46 PolarHBondContact O-N 3.39Å; E44-G47 PolarHBondContact O-N 3.46Å; E44-K48 PolarHBondContact O-N 3.49Å
45E95.2Very high95.7Very high65 Ų6557.2 Ų57.230%0.30426%0.257SS..Hα-helixtrans-69-30.2176.4-63.8-56132.700112.2K42 K43 G47 K48 M49K42-E45 HydrophobicContact CB-CB 3.93Å; K42-E45 HydrophobicContact CB-CG 3.87Å; K42-E45 HydrophobicContact CD-CG 4.1Å; K42-E45 WeakPolarHBondContact O-CB 3.48Å; K42-E45 PolarHBondContact O-N 2.83Å; K42-E45 VanDerWaalsContact O-N 3.14Å; K43-E45 VanDerWaalsContact C-N 3.25Å; K43-E45 PolarHBondContact O-N 3.49Å; E45-G47 PolarHBondContact O-N 3.02Å; E45-K48 PolarHBondContact O-N 3.23Å; E45-K48 IonicContact OE1-NZ 3.93Å; E45-K48 PolarHBondContact OE1-NZ 2.64Å; E45-K48 IonicContact OE2-NZ 3.74Å; E45-M49 WeakPolarHBondContact O-CB 3.47Å; E45-M49 VanDerWaalsContact O-CG 3.24Å; E45-M49 WeakPolarHBondContact O-CG 3.36Å; E45-M49 PolarHBondContact O-N 2.94Å
46A96.2Very high95.8Very high4 Ų457.4 Ų57.43%0.03326%0.261CS..Hα-helixtrans-62.4-43.1175.100000111.6V40 K42 K43 E44 K48 M49 V50 V140V40-A46 HydrophobicContact CG1-CB 3.8Å; K42-A46 PolarHBondContact O-N 3.15Å; K43-A46 VanDerWaalsContact O-CB 3.28Å; K43-A46 WeakPolarHBondContact O-CB 3.01Å; K43-A46 PolarHBondContact O-N 2.98Å; E44-A46 VanDerWaalsContact C-N 3.32Å; E44-A46 PolarHBondContact O-N 3.39Å; A46-K48 PolarHBondContact O-N 3.39Å; A46-M49 PolarHBondContact O-N 3.37Å; A46-V50 WeakPolarHBondContact O-CG2 3.47Å; A46-V50 PolarHBondContact O-N 3.42Å; A46-V140 HydrophobicContact CB-CG1 4.11Å
47G96.7Very high95.7Very high0 Ų060.6 Ų60.60%028%0.28CS..Hα-helixtrans-61-42.8175.100000113K43 E44 E45 V50 F51 A85K43-G47 PolarHBondContact O-N 2.91Å; E44-G47 PolarHBondContact O-N 3.46Å; E45-G47 PolarHBondContact O-N 3.02Å; G47-V50 PolarHBondContact O-N 2.87Å; G47-F51 PolarHBondContact O-N 3.27Å; G47-A85 WeakPolarHBondContact CA-O 3.49Å
48K97.6Very high95.7Very high50 Ų5060.9 Ų60.922%0.21728%0.283CS..Hα-helixtrans-64.2-44.3175.3-66.1178.9-175.4170.60111.8E44 E45 A46 F51 K52 F81 A85E44-K48 PolarHBondContact O-N 3.49Å; E45-K48 PolarHBondContact O-N 3.23Å; E45-K48 IonicContact OE1-NZ 3.93Å; E45-K48 PolarHBondContact OE1-NZ 2.64Å; E45-K48 IonicContact OE2-NZ 3.74Å; A46-K48 PolarHBondContact O-N 3.39Å; K48-F51 PolarHBondContact O-N 2.97Å; K48-K52 WeakPolarHBondContact O-CB 3.44Å; K48-K52 PolarHBondContact O-N 3.31Å; K48-F81 HydrophobicContact CB-CE1 4.13Å; K48-F81 HydrophobicContact CB-CZ 4.21Å; K48-F81 HydrophobicContact CG-CE1 4.07Å; K48-A85 HydrophobicContact CB-CB 4.46Å; K48-A85 HydrophobicContact CG-CB 3.99Å
49M97.2Very high95.7Very high69 Ų6958.4 Ų58.434%0.3428%0.277SS..Hα-helixtrans-60.8-45.1177.6-75.3176.466.400111.3E45 A46 F51 Q53 V140 L143E45-M49 WeakPolarHBondContact O-CB 3.47Å; E45-M49 VanDerWaalsContact O-CG 3.24Å; E45-M49 WeakPolarHBondContact O-CG 3.36Å; E45-M49 PolarHBondContact O-N 2.94Å; A46-M49 PolarHBondContact O-N 3.37Å; M49-F51 PolarHBondContact O-N 3.21Å; M49-Q53 WeakPolarHBondContact O-CB 3.5Å; M49-Q53 WeakPolarHBondContact O-CG 3.43Å; M49-Q53 PolarHBondContact O-N 3.31Å; M49-V140 HydrophobicContact CB-CG1 4.03Å; M49-V140 HydrophobicContact CB-CG2 3.96Å; M49-V140 HydrophobicContact CE-CG1 4.47Å; M49-L143 HydrophobicContact CE-CD1 3.92Å
50V98.1Very high95.6Very high0 Ų055.6 Ų55.60%027%0.269CS..Hα-helixtrans-57.9-51.2175.6169.80000110A46 G47 Q53 L54 L88 L92 V136 M137 V140A46-V50 WeakPolarHBondContact O-CG2 3.47Å; A46-V50 PolarHBondContact O-N 3.42Å; G47-V50 PolarHBondContact O-N 2.87Å; V50-Q53 PolarHBondContact O-N 2.98Å; V50-L54 WeakPolarHBondContact O-CB 3.49Å; V50-L54 PolarHBondContact O-N 3.36Å; V50-L88 HydrophobicContact CG1-CD1 4.11Å; V50-L92 HydrophobicContact CG2-CD1 4.27Å; V50-V136 HydrophobicContact CB-CG1 4.38Å; V50-V136 HydrophobicContact CG1-CG1 4.15Å; V50-V136 VanDerWaalsContact O-CG1 3.26Å; V50-V136 WeakPolarHBondContact O-CG1 3.25Å; V50-M137 HydrophobicContact CG1-CG 3.75Å; V50-M137 HydrophobicContact CG2-CG 4.31Å; V50-V140 HydrophobicContact CB-CG2 4.5Å; V50-V140 HydrophobicContact CG2-CB 3.73Å; V50-V140 HydrophobicContact CG2-CG1 3.94Å; V50-V140 HydrophobicContact CG2-CG2 3.72Å
51F97.9Very high95.6Very high0 Ų055.9 Ų55.90%027%0.27CS..Hα-helixtrans-69.1-41-174.8-161-150.5000112.4G47 K48 M49 L54 L55 F65 L67 F81 H84 A85 L88G47-F51 PolarHBondContact O-N 3.27Å; K48-F51 PolarHBondContact O-N 2.97Å; M49-F51 PolarHBondContact O-N 3.21Å; F51-L54 HydrophobicContact CD2-CD2 4.44Å; F51-L54 PolarHBondContact O-N 3.41Å; F51-L55 HydrophobicContact CD1-CD1 4.04Å; F51-L55 HydrophobicContact CD2-CD1 4.18Å; F51-L55 HydrophobicContact CD2-CD2 4.46Å; F51-L55 HydrophobicContact CD2-CG 4.03Å; F51-L55 HydrophobicContact CE1-CD1 3.95Å; F51-L55 HydrophobicContact CE2-CD1 4.09Å; F51-L55 HydrophobicContact CE2-CD2 3.81Å; F51-L55 HydrophobicContact CE2-CG 3.86Å; F51-L55 HydrophobicContact CG-CD1 4.14Å; F51-L55 HydrophobicContact CG-CG 4.45Å; F51-L55 HydrophobicContact CZ-CD1 3.97Å; F51-L55 HydrophobicContact CZ-CD2 3.96Å; F51-L55 HydrophobicContact CZ-CG 4.17Å; F51-L55 WeakPolarHBondContact O-CB 2.96Å; F51-L55 WeakPolarHBondContact O-CG 3.1Å; F51-L55 PolarHBondContact O-N 3.24Å; F51-F65 HydrophobicContact CE1-CD1 4.48Å; F51-F65 AromaticContact CE2-CD2 3.89Å; F51-F65 HydrophobicContact CE2-CD2 3.89Å; F51-F65 HydrophobicContact CE2-CE1 4.48Å; F51-F65 AromaticContact CE2-CE2 3.84Å; F51-F65 HydrophobicContact CE2-CE2 3.84Å; F51-F65 HydrophobicContact CE2-CG 4.27Å; F51-F65 HydrophobicContact CE2-CZ 4.14Å; F51-F65 HydrophobicContact CZ-CB 4.24Å; F51-F65 AromaticContact CZ-CD1 3.69Å; F51-F65 HydrophobicContact CZ-CD1 3.69Å; F51-F65 AromaticContact CZ-CD2 3.72Å; F51-F65 HydrophobicContact CZ-CD2 3.72Å; F51-F65 AromaticContact CZ-CE1 3.88Å; F51-F65 HydrophobicContact CZ-CE1 3.88Å; F51-F65 AromaticContact CZ-CE2 3.92Å; F51-F65 HydrophobicContact CZ-CE2 3.92Å; F51-F65 AromaticContact CZ-CG 3.61Å; F51-F65 HydrophobicContact CZ-CG 3.61Å; F51-F65 HydrophobicContact CZ-CZ 4Å; F51-L67 HydrophobicContact CE1-CD1 4.1Å; F51-L67 HydrophobicContact CZ-CD1 4.3Å; F51-F81 HydrophobicContact CB-CE2 4Å; F51-F81 HydrophobicContact CB-CZ 4.44Å; F51-F81 AromaticContact CD1-CD2 3.44Å; F51-F81 HydrophobicContact CD1-CD2 3.44Å; F51-F81 VanDerWaalsContact CD1-CD2 3.44Å; F51-F81 AromaticContact CD1-CE2 3.76Å; F51-F81 HydrophobicContact CD1-CE2 3.76Å; F51-F81 HydrophobicContact CD1-CG 4.08Å; F51-F81 HydrophobicContact CE1-CB 4.48Å; F51-F81 AromaticContact CE1-CD2 3.95Å; F51-F81 HydrophobicContact CE1-CD2 3.95Å; F51-F81 HydrophobicContact CE1-CG 4.49Å; F51-F81 HydrophobicContact CG-CD2 4.26Å; F51-F81 HydrophobicContact CG-CE2 4.16Å; F51-H84 HydrophobicContact CD1-CB 4.02Å; F51-H84 AromaticContact CD2-CD2 3.65Å; F51-H84 HydrophobicContact CE1-CB 3.6Å; F51-H84 AromaticContact CE1-CD2 3.83Å; F51-H84 AromaticContact CE2-CD2 3.41Å; F51-H84 VanDerWaalsContact CE2-CD2 3.41Å; F51-H84 WeakPolarHBondContact CE2-CD2 3.41Å; F51-H84 AromaticContact CG-CD2 4Å; F51-H84 HydrophobicContact CZ-CB 4.01Å; F51-H84 AromaticContact CZ-CD2 3.51Å; F51-H84 AromaticContact CZ-CG 3.97Å; F51-A85 HydrophobicContact CB-CB 4.43Å; F51-L88 HydrophobicContact CB-CD1 3.72Å; F51-L88 HydrophobicContact CD2-CD1 4Å; F51-L88 HydrophobicContact CG-CD1 3.99Å
52K97.8Very high95.8Very high68 Ų6848.5 Ų48.530%0.29624%0.237SC..Hα-helixtrans-59.2-50.5176.2-174.6170-172.9173.10111.4K48 L54 L55 L56 F75 E76 F81K48-K52 WeakPolarHBondContact O-CB 3.44Å; K48-K52 PolarHBondContact O-N 3.31Å; K52-L54 VanDerWaalsContact C-N 3.32Å; K52-L54 PolarHBondContact O-N 3.33Å; K52-L55 PolarHBondContact O-N 2.86Å; K52-L56 HydrophobicContact CG-CD1 4Å; K52-L56 WeakPolarHBondContact O-CB 3.49Å; K52-L56 VanDerWaalsContact O-CG 3.25Å; K52-L56 WeakPolarHBondContact O-CG 3.3Å; K52-L56 PolarHBondContact O-N 3.42Å; K52-F75 HydrophobicContact CG-CD2 4.27Å; K52-E76 IonicContact NZ-OE1 3.17Å; K52-F81 HydrophobicContact CB-CE2 4.11Å; K52-F81 HydrophobicContact CB-CZ 4.06Å
53Q97.5Very high95.9Very high56 Ų5647.3 Ų47.326%0.26223%0.228SC..Hα-helixtrans-63.7-37.9178.7-73.4-176.91400112.2M49 V50 L56 T57 V136M49-Q53 WeakPolarHBondContact O-CB 3.5Å; M49-Q53 WeakPolarHBondContact O-CG 3.43Å; M49-Q53 PolarHBondContact O-N 3.31Å; V50-Q53 PolarHBondContact O-N 2.98Å; Q53-L56 PolarHBondContact O-N 2.88Å; Q53-T57 WeakPolarHBondContact O-CB 3.18Å; Q53-T57 WeakPolarHBondContact O-CG2 3.48Å; Q53-T57 PolarHBondContact O-N 2.93Å; Q53-T57 VanDerWaalsContact O-N 3.1Å; Q53-T57 PolarHBondContact O-OG1 2.7Å; Q53-V136 HydrophobicContact CB-CG1 3.57Å; Q53-V136 HydrophobicContact CB-CG2 4.37Å
54L97.6Very high95.8Very high4 Ų446.4 Ų46.42%0.02123%0.225CC..Hα-helixtrans-62.1-48.7175.3-179.659.2000111.4V50 F51 K52 L56 T57 N58 V61 R132 M133V50-L54 WeakPolarHBondContact O-CB 3.49Å; V50-L54 PolarHBondContact O-N 3.36Å; F51-L54 HydrophobicContact CD2-CD2 4.44Å; F51-L54 PolarHBondContact O-N 3.41Å; K52-L54 VanDerWaalsContact C-N 3.32Å; K52-L54 PolarHBondContact O-N 3.33Å; L54-L56 VanDerWaalsContact C-N 3.32Å; L54-L56 PolarHBondContact O-N 2.72Å; L54-T57 PolarHBondContact O-N 2.91Å; L54-N58 HydrophobicContact CD1-CB 4.09Å; L54-N58 WeakPolarHBondContact O-CB 3.49Å; L54-N58 PolarHBondContact O-N 3.03Å; L54-V61 HydrophobicContact CD1-CG2 4.41Å; L54-V61 HydrophobicContact CD2-CG1 3.98Å; L54-V61 HydrophobicContact CG-CB 4.47Å; L54-V61 HydrophobicContact CG-CG1 4.05Å; L54-R132 HydrophobicContact CD1-CB 4.21Å; L54-R132 HydrophobicContact CD1-CG 3.85Å; L54-M133 HydrophobicContact CD1-CB 4.22Å; L54-M133 HydrophobicContact CD2-CB 3.93Å; L54-M133 HydrophobicContact CD2-CG 3.96Å; L54-M133 HydrophobicContact CD2-SD 4.33Å
55L97.3Very high95.8Very high1 Ų141.5 Ų41.51%0.00520%0.202CC..Hα-helixtrans-63.8-36.1179.6-66.8168.9000112.7F51 K52 T57 V61 R62 L67 F75 F81F51-L55 HydrophobicContact CD1-CD1 4.04Å; F51-L55 HydrophobicContact CD2-CD1 4.18Å; F51-L55 HydrophobicContact CD2-CD2 4.46Å; F51-L55 HydrophobicContact CD2-CG 4.03Å; F51-L55 HydrophobicContact CE1-CD1 3.95Å; F51-L55 HydrophobicContact CE2-CD1 4.09Å; F51-L55 HydrophobicContact CE2-CD2 3.81Å; F51-L55 HydrophobicContact CE2-CG 3.86Å; F51-L55 HydrophobicContact CG-CD1 4.14Å; F51-L55 HydrophobicContact CG-CG 4.45Å; F51-L55 HydrophobicContact CZ-CD1 3.97Å; F51-L55 HydrophobicContact CZ-CD2 3.96Å; F51-L55 HydrophobicContact CZ-CG 4.17Å; F51-L55 WeakPolarHBondContact O-CB 2.96Å; F51-L55 WeakPolarHBondContact O-CG 3.1Å; F51-L55 PolarHBondContact O-N 3.24Å; K52-L55 PolarHBondContact O-N 2.86Å; L55-T57 VanDerWaalsContact C-N 3.34Å; L55-V61 HydrophobicContact CD2-CG1 4.26Å; L55-R62 HydrophobicContact CB-CG 4.41Å; L55-R62 HydrophobicContact CD2-CB 4.03Å; L55-R62 HydrophobicContact CD2-CG 4.08Å; L55-L67 HydrophobicContact CD1-CD1 3.55Å; L55-L67 HydrophobicContact CD2-CD1 4.18Å; L55-F75 HydrophobicContact CB-CE2 4.07Å; L55-F75 HydrophobicContact CB-CZ 4.31Å; L55-F75 HydrophobicContact CD1-CD2 4.3Å; L55-F75 HydrophobicContact CD1-CE2 4.1Å; L55-F75 HydrophobicContact CD1-CZ 4.32Å; L55-F81 HydrophobicContact CD1-CD2 3.72Å; L55-F81 HydrophobicContact CD1-CE2 3.97Å
56L96.2Very high95.7Very high82 Ų8243.9 Ų43.943%0.42921%0.213SC..Hα-helixtrans-74.9-22.7178.7-68.9175.1000113.4K52 Q53 L54 Q72 F75K52-L56 HydrophobicContact CG-CD1 4Å; K52-L56 WeakPolarHBondContact O-CB 3.49Å; K52-L56 VanDerWaalsContact O-CG 3.25Å; K52-L56 WeakPolarHBondContact O-CG 3.3Å; K52-L56 PolarHBondContact O-N 3.42Å; Q53-L56 PolarHBondContact O-N 2.88Å; L54-L56 VanDerWaalsContact C-N 3.32Å; L54-L56 PolarHBondContact O-N 2.72Å; L56-Q72 HydrophobicContact CD2-CB 4.11Å; L56-F75 HydrophobicContact CD2-CE2 4.33Å
57T95.6Very high95.7Very high69 Ų6943.8 Ų43.842%0.42321%0.212SC..Hα-helixtrans-112.33.3-176.661.70000113.1Q53 L54 L55 R132Q53-T57 WeakPolarHBondContact O-CB 3.18Å; Q53-T57 WeakPolarHBondContact O-CG2 3.48Å; Q53-T57 PolarHBondContact O-N 2.93Å; Q53-T57 VanDerWaalsContact O-N 3.1Å; Q53-T57 PolarHBondContact O-OG1 2.7Å; L54-T57 PolarHBondContact O-N 2.91Å; L55-T57 VanDerWaalsContact C-N 3.34Å; T57-R132 VanDerWaalsContact CB-NH2 3.34Å; T57-R132 PolarHBondContact OG1-NE 3.03Å; T57-R132 PolarHBondContact OG1-NH2 3.28Å; T57-R132 VanDerWaalsContact OG1-NH2 3.11Å
58N95.1Very high95.5Very high23 Ų2346.8 Ų46.812%0.12323%0.226CC..  trans-147.992.1-179.2-161.5-50.5000111.7L54 G60 V61 R62 H129 R132L54-N58 HydrophobicContact CD1-CB 4.09Å; L54-N58 WeakPolarHBondContact O-CB 3.49Å; L54-N58 PolarHBondContact O-N 3.03Å; N58-G60 VanDerWaalsContact C-N 3.25Å; N58-G60 PolarHBondContact O-N 3.49Å; N58-G60 PolarHBondContact OD1-N 2.98Å; N58-V61 HydrophobicContact CB-CB 4.18Å; N58-V61 HydrophobicContact CB-CG2 4.15Å; N58-V61 PolarHBondContact O-N 3.28Å; N58-V61 WeakPolarHBondContact OD1-CG2 3.33Å; N58-V61 PolarHBondContact OD1-N 3.3Å; N58-R62 PolarHBondContact O-N 3.15Å; N58-H129 PolarHBondContact ND2-CD2 2.88Å; N58-H129 PolarHBondContact OD1-CD2 2.7Å; N58-R132 HydrophobicContact CB-CG 4.39Å
59E93.4Very high95.3Very high80 Ų8052.8 Ų52.837%0.37425%0.252SS..Hα-helixtrans-63.7-30.2-179.8-179.160.7-168.200112.6R62 R63E59-R62 PolarHBondContact O-N 3.16Å; E59-R63 WeakPolarHBondContact O-CG 3.42Å; E59-R63 PolarHBondContact O-N 2.98Å; E59-R63 IonicContact OE1-CZ 3.32Å; E59-R63 VanDerWaalsContact OE1-CZ 3.32Å; E59-R63 IonicContact OE1-NE 3.17Å; E59-R63 PolarHBondContact OE1-NE 2.86Å; E59-R63 VanDerWaalsContact OE1-NE 3.09Å; E59-R63 IonicContact OE1-NH2 3.02Å; E59-R63 PolarHBondContact OE1-NH2 3.12Å
60G93.8Very high95.2Very high28 Ų2850.2 Ų50.229%0.28924%0.241SC..Hα-helixtrans-61.3-50.6174.700000111.6N58 R62 R63 I64N58-G60 VanDerWaalsContact C-N 3.25Å; N58-G60 PolarHBondContact O-N 3.49Å; N58-G60 PolarHBondContact OD1-N 2.98Å; G60-R62 VanDerWaalsContact C-N 3.31Å; G60-R62 PolarHBondContact O-N 3.31Å; G60-R63 PolarHBondContact O-N 3.36Å; G60-I64 WeakPolarHBondContact O-CG1 3.28Å; G60-I64 PolarHBondContact O-N 3.18Å
61V94.8Very high95Very high10 Ų1052.8 Ų52.86%0.06126%0.257CS..Hα-helixtrans-60.4-42.3173.6176.50000110.8L54 L55 N58 R63 I64 F65 H129L54-V61 HydrophobicContact CD1-CG2 4.41Å; L54-V61 HydrophobicContact CD2-CG1 3.98Å; L54-V61 HydrophobicContact CG-CB 4.47Å; L54-V61 HydrophobicContact CG-CG1 4.05Å; L55-V61 HydrophobicContact CD2-CG1 4.26Å; N58-V61 HydrophobicContact CB-CB 4.18Å; N58-V61 HydrophobicContact CB-CG2 4.15Å; N58-V61 PolarHBondContact O-N 3.28Å; N58-V61 WeakPolarHBondContact OD1-CG2 3.33Å; N58-V61 PolarHBondContact OD1-N 3.3Å; V61-R63 PolarHBondContact O-N 3.32Å; V61-I64 WeakPolarHBondContact O-CB 3.49Å; V61-I64 PolarHBondContact O-N 3.05Å; V61-I64 VanDerWaalsContact O-N 3.09Å; V61-F65 HydrophobicContact CG1-CD2 3.71Å; V61-F65 HydrophobicContact CG1-CE2 3.77Å; V61-F65 WeakPolarHBondContact O-CD2 3.24Å; V61-F65 PolarHBondContact O-N 3.1Å; V61-F65 VanDerWaalsContact O-N 3.09Å; V61-H129 HydrophobicContact CG2-CB 3.88Å
62R95.1Very high94.8Very high45 Ų4557 Ų5717%0.1728%0.277CS..Hα-helixtrans-59.1-34.3178.2-161.9-176.8176.1-176-0.5113L55 N58 E59 G60 E66 L67 H68 C70L55-R62 HydrophobicContact CB-CG 4.41Å; L55-R62 HydrophobicContact CD2-CB 4.03Å; L55-R62 HydrophobicContact CD2-CG 4.08Å; N58-R62 PolarHBondContact O-N 3.15Å; E59-R62 PolarHBondContact O-N 3.16Å; G60-R62 VanDerWaalsContact C-N 3.31Å; G60-R62 PolarHBondContact O-N 3.31Å; R62-E66 PolarHBondContact O-N 3.06Å; R62-L67 HydrophobicContact CG-CB 4.14Å; R62-L67 PolarHBondContact NE-O 3.22Å; R62-L67 PolarHBondContact O-N 3.31Å; R62-H68 HydrophobicContact CG-CB 4.26Å; R62-H68 PolarHBondContact O-N 3.41Å; R62-C70 PolarHBondContact NH2-O 3.12Å
63R94.2Very high94.7Very high138 Ų13860 Ų6052%0.52129%0.292SS..Hα-helixtrans-74.7-38.6173.2-71175.7-169.2-96.7-11.6113.3E59 G60 V61 F65 E66 H68E59-R63 WeakPolarHBondContact O-CG 3.42Å; E59-R63 PolarHBondContact O-N 2.98Å; E59-R63 IonicContact OE1-CZ 3.32Å; E59-R63 VanDerWaalsContact OE1-CZ 3.32Å; E59-R63 IonicContact OE1-NE 3.17Å; E59-R63 PolarHBondContact OE1-NE 2.86Å; E59-R63 VanDerWaalsContact OE1-NE 3.09Å; E59-R63 IonicContact OE1-NH2 3.02Å; E59-R63 PolarHBondContact OE1-NH2 3.12Å; G60-R63 PolarHBondContact O-N 3.36Å; V61-R63 PolarHBondContact O-N 3.32Å; R63-F65 PolarHBondContact O-N 3.18Å; R63-E66 PolarHBondContact O-N 2.82Å; R63-H68 HydrophobicContact CG-CB 3.92Å
64I92.7Very high94.7Very high37 Ų3762.2 Ų62.219%0.1930%0.303CS..Hα-helixtrans-55.9-42.8175.7-70.3170000110.6G60 V61 E66 K122 V123G60-I64 WeakPolarHBondContact O-CG1 3.28Å; G60-I64 PolarHBondContact O-N 3.18Å; V61-I64 WeakPolarHBondContact O-CB 3.49Å; V61-I64 PolarHBondContact O-N 3.05Å; V61-I64 VanDerWaalsContact O-N 3.09Å; I64-E66 VanDerWaalsContact C-N 3.32Å; I64-K122 HydrophobicContact CG2-CB 4.12Å; I64-V123 HydrophobicContact CG2-CG2 3.91Å
65F92.8Very high94.6Very high43 Ų4362 Ų6219%0.18930%0.302CS..THydrogen-bonded Turntrans-85.83.2177.3-73.8-84.6000114.5F51 V61 R63 L67 I80 H84F51-F65 HydrophobicContact CE1-CD1 4.48Å; F51-F65 AromaticContact CE2-CD2 3.89Å; F51-F65 HydrophobicContact CE2-CD2 3.89Å; F51-F65 HydrophobicContact CE2-CE1 4.48Å; F51-F65 AromaticContact CE2-CE2 3.84Å; F51-F65 HydrophobicContact CE2-CE2 3.84Å; F51-F65 HydrophobicContact CE2-CG 4.27Å; F51-F65 HydrophobicContact CE2-CZ 4.14Å; F51-F65 HydrophobicContact CZ-CB 4.24Å; F51-F65 AromaticContact CZ-CD1 3.69Å; F51-F65 HydrophobicContact CZ-CD1 3.69Å; F51-F65 AromaticContact CZ-CD2 3.72Å; F51-F65 HydrophobicContact CZ-CD2 3.72Å; F51-F65 AromaticContact CZ-CE1 3.88Å; F51-F65 HydrophobicContact CZ-CE1 3.88Å; F51-F65 AromaticContact CZ-CE2 3.92Å; F51-F65 HydrophobicContact CZ-CE2 3.92Å; F51-F65 AromaticContact CZ-CG 3.61Å; F51-F65 HydrophobicContact CZ-CG 3.61Å; F51-F65 HydrophobicContact CZ-CZ 4Å; V61-F65 HydrophobicContact CG1-CD2 3.71Å; V61-F65 HydrophobicContact CG1-CE2 3.77Å; V61-F65 WeakPolarHBondContact O-CD2 3.24Å; V61-F65 PolarHBondContact O-N 3.1Å; V61-F65 VanDerWaalsContact O-N 3.09Å; R63-F65 PolarHBondContact O-N 3.18Å; F65-L67 HydrophobicContact CB-CD1 4.12Å; F65-L67 HydrophobicContact CB-CG 4.13Å; F65-L67 PolarHBondContact O-N 2.7Å; F65-L67 VanDerWaalsContact O-N 3.13Å; F65-I80 HydrophobicContact CB-CG2 4.4Å; F65-I80 HydrophobicContact CD1-CG2 3.88Å; F65-H84 HydrophobicContact CE1-CB 4.09Å; F65-H84 AromaticContact CE1-CD2 3.81Å; F65-H84 AromaticContact CE1-CE1 3.84Å; F65-H84 AromaticContact CE1-CG 3.53Å; F65-H84 AromaticContact CE1-ND1 3.56Å; F65-H84 AromaticContact CE1-NE2 4Å; F65-H84 AromaticContact CZ-CD2 3.58Å; F65-H84 AromaticContact CZ-CE1 3.45Å; F65-H84 VanDerWaalsContact CZ-CE1 3.45Å; F65-H84 WeakPolarHBondContact CZ-CE1 3.5Å; F65-H84 AromaticContact CZ-CG 3.76Å; F65-H84 AromaticContact CZ-ND1 3.68Å; F65-H84 AromaticContact CZ-NE2 3.38Å; F65-H84 WeakPolarHBondContact CZ-NE2 3.34Å
66E93Very high94.6Very high115 Ų11566.1 Ų66.154%0.53732%0.32SS..THydrogen-bonded Turntrans59.719-178.3-56.6-178.2-178.700114.8R62 R63 I64 H68 K122R62-E66 PolarHBondContact O-N 3.06Å; R63-E66 PolarHBondContact O-N 2.82Å; I64-E66 VanDerWaalsContact C-N 3.32Å; E66-H68 VanDerWaalsContact C-N 3.35Å; E66-K122 IonicContact OE1-NZ 2.67Å; E66-K122 PolarHBondContact OE1-NZ 3.34Å
67L95.4Very high94.5Very high1 Ų170.6 Ų70.61%0.00534%0.337CS..G310 helixtrans-90.44.8-179.4-64176.4000113.5F51 L55 R62 F65 K69 C70 F75 N78 F81F51-L67 HydrophobicContact CE1-CD1 4.1Å; F51-L67 HydrophobicContact CZ-CD1 4.3Å; L55-L67 HydrophobicContact CD1-CD1 3.55Å; L55-L67 HydrophobicContact CD2-CD1 4.18Å; R62-L67 HydrophobicContact CG-CB 4.14Å; R62-L67 PolarHBondContact NE-O 3.22Å; R62-L67 PolarHBondContact O-N 3.31Å; F65-L67 HydrophobicContact CB-CD1 4.12Å; F65-L67 HydrophobicContact CB-CG 4.13Å; F65-L67 PolarHBondContact O-N 2.7Å; F65-L67 VanDerWaalsContact O-N 3.13Å; L67-K69 PolarHBondContact O-N 3.49Å; L67-C70 HydrophobicContact CB-CB 4.46Å; L67-C70 HydrophobicContact CD2-CB 4.14Å; L67-C70 PolarHBondContact O-N 3.19Å; L67-C70 VanDerWaalsContact O-N 3.12Å; L67-F75 HydrophobicContact CB-CE1 4.24Å; L67-N78 HydrophobicContact CD2-CB 4.37Å; L67-N78 WeakPolarHBondContact CD2-OD1 3.38Å; L67-F81 HydrophobicContact CD1-CB 4.23Å; L67-F81 HydrophobicContact CD1-CD2 4.44Å
68H93.5Very high94.6Very high64 Ų6469.4 Ų69.430%0.29633%0.328SS..G310 helixtrans-65.9-25.2-179.765-73.5000113.1R62 R63 E66R62-H68 HydrophobicContact CG-CB 4.26Å; R62-H68 PolarHBondContact O-N 3.41Å; R63-H68 HydrophobicContact CG-CB 3.92Å; E66-H68 VanDerWaalsContact C-N 3.35Å
69K92.9Very high94.6Very high176 Ų17675.4 Ų75.477%0.76536%0.355SS*.G310 helixtrans-93.6-9.8173.8-61.5-178.2-178.5-1790113.6L67 P71L67-K69 PolarHBondContact O-N 3.49Å; K69-P71 WeakPolarHBondContact O-CD 3.32Å
70C94.2Very high94.6Very high15 Ų1574.3 Ų74.310%0.10135%0.351CS..SBendtrans-85.2122.6179.5-175.10000109.1R62 L67 F75R62-C70 PolarHBondContact NH2-O 3.12Å; L67-C70 HydrophobicContact CB-CB 4.46Å; L67-C70 HydrophobicContact CD2-CB 4.14Å; L67-C70 PolarHBondContact O-N 3.19Å; L67-C70 VanDerWaalsContact O-N 3.12Å; C70-F75 HydrophobicContact CB-CD1 4.28Å; C70-F75 HydrophobicContact CB-CE1 4.12Å; C70-F75 VanDerWaalsContact O-CE1 3.3Å; C70-F75 WeakPolarHBondContact O-CE1 3.44Å
71P94.9Very high94.8Very high54 Ų5473 Ų7335%0.35134%0.337SS..  trans-58.7145172.5-23.634.7000111.5K69 E73 Q74 F75K69-P71 WeakPolarHBondContact O-CD 3.32Å; P71-E73 WeakPolarHBondContact CB-OE2 3.43Å; P71-E73 PolarHBondContact O-N 2.9Å; P71-Q74 HydrophobicContact CB-CG 4.3Å; P71-Q74 HydrophobicContact CG-CG 4.48Å; P71-Q74 WeakPolarHBondContact O-CB 3.49Å; P71-Q74 PolarHBondContact O-N 2.91Å; P71-F75 PolarHBondContact O-N 3.42Å
72Q93.8Very high94.8Very high88 Ų8874.8 Ų74.841%0.41135%0.346SS..G310 helixtrans-61.6-28.3-175.163.8-178.6-1200113L56 Q74 F75L56-Q72 HydrophobicContact CD2-CB 4.11Å; Q72-Q74 PolarHBondContact O-N 3.32Å; Q72-F75 HydrophobicContact CB-CD2 4.35Å; Q72-F75 HydrophobicContact CB-CE2 4.07Å; Q72-F75 HydrophobicContact CB-CZ 4.36Å; Q72-F75 PolarHBondContact O-N 2.91Å
73E95.3Very high94.8Very high130 Ų13077.1 Ų77.161%0.60736%0.359SS*.G310 helixtrans-70.8-17.2177.6-56.473.5-157.100111.8P71P71-E73 WeakPolarHBondContact CB-OE2 3.43Å; P71-E73 PolarHBondContact O-N 2.9Å
74Q96.4Very high94.8Very high104 Ų10472.4 Ų72.449%0.48634%0.343SS..G310 helixtrans-102.6-6.3-178.9-61.1-17813.300113.2P71 Q72 E76 K77 N78P71-Q74 HydrophobicContact CB-CG 4.3Å; P71-Q74 HydrophobicContact CG-CG 4.48Å; P71-Q74 WeakPolarHBondContact O-CB 3.49Å; P71-Q74 PolarHBondContact O-N 2.91Å; Q72-Q74 PolarHBondContact O-N 3.32Å; Q74-E76 VanDerWaalsContact C-N 3.28Å; Q74-E76 PolarHBondContact O-N 2.74Å; Q74-K77 PolarHBondContact O-N 2.76Å; Q74-N78 PolarHBondContact O-N 2.67Å
75F97.3Very high95.1Very high0 Ų070.8 Ų70.80%034%0.335CS..G310 helixtrans-52.1-47.2179.5-75.1-10.1000112K52 L55 L56 L67 C70 P71 Q72 K77 N78 F81K52-F75 HydrophobicContact CG-CD2 4.27Å; L55-F75 HydrophobicContact CB-CE2 4.07Å; L55-F75 HydrophobicContact CB-CZ 4.31Å; L55-F75 HydrophobicContact CD1-CD2 4.3Å; L55-F75 HydrophobicContact CD1-CE2 4.1Å; L55-F75 HydrophobicContact CD1-CZ 4.32Å; L56-F75 HydrophobicContact CD2-CE2 4.33Å; L67-F75 HydrophobicContact CB-CE1 4.24Å; C70-F75 HydrophobicContact CB-CD1 4.28Å; C70-F75 HydrophobicContact CB-CE1 4.12Å; C70-F75 VanDerWaalsContact O-CE1 3.3Å; C70-F75 WeakPolarHBondContact O-CE1 3.44Å; P71-F75 PolarHBondContact O-N 3.42Å; Q72-F75 HydrophobicContact CB-CD2 4.35Å; Q72-F75 HydrophobicContact CB-CE2 4.07Å; Q72-F75 HydrophobicContact CB-CZ 4.36Å; Q72-F75 PolarHBondContact O-N 2.91Å; F75-K77 PolarHBondContact O-N 3.15Å; F75-K77 VanDerWaalsContact O-N 3.09Å; F75-N78 WeakPolarHBondContact O-CB 3.42Å; F75-N78 PolarHBondContact O-N 2.97Å; F75-F81 HydrophobicContact CB-CD1 4.28Å; F75-F81 HydrophobicContact CB-CD2 3.74Å; F75-F81 HydrophobicContact CB-CE1 4.43Å; F75-F81 HydrophobicContact CB-CE2 3.89Å; F75-F81 HydrophobicContact CB-CG 3.94Å; F75-F81 HydrophobicContact CB-CZ 4.24Å; F75-F81 HydrophobicContact CD2-CD2 4.4Å; F75-F81 HydrophobicContact CD2-CE2 4.2Å; F75-F81 HydrophobicContact CG-CD2 4.14Å; F75-F81 HydrophobicContact CG-CE2 4.31Å; F75-F81 WeakPolarHBondContact O-CB 3.49Å; F75-F81 WeakPolarHBondContact O-CD1 3.43Å; F75-F81 WeakPolarHBondContact O-CG 3.38Å
76E95.4Very high95.2Very high86 Ų8674.6 Ų74.640%0.40235%0.351SS..G310 helixtrans-70.4-8.3-177.3-65.8-178.7-142.100114.4K52 Q74 F81 I82K52-E76 IonicContact NZ-OE1 3.17Å; Q74-E76 VanDerWaalsContact C-N 3.28Å; Q74-E76 PolarHBondContact O-N 2.74Å; E76-F81 HydrophobicContact CG-CE1 3.93Å; E76-I82 WeakPolarHBondContact O-CD1 3.13Å
77K95.8Very high95.4Very high177 Ų17770.4 Ų70.477%0.7734%0.335SS*.G310 helixtrans-99.6-10172-60.3-179.3-178.5178.80112.5Q74 F75Q74-K77 PolarHBondContact O-N 2.76Å; F75-K77 PolarHBondContact O-N 3.15Å; F75-K77 VanDerWaalsContact O-N 3.09Å
78N96.8Very high95.4Very high44 Ų4470.8 Ų70.824%0.23534%0.337CS..  trans-86.5127.4-178.1-176.3-73.5000110.6L67 Q74 F75 I80 F81 I82L67-N78 HydrophobicContact CD2-CB 4.37Å; L67-N78 WeakPolarHBondContact CD2-OD1 3.38Å; Q74-N78 PolarHBondContact O-N 2.67Å; F75-N78 WeakPolarHBondContact O-CB 3.42Å; F75-N78 PolarHBondContact O-N 2.97Å; N78-I80 PolarHBondContact O-N 2.97Å; N78-I80 VanDerWaalsContact OD1-CB 3.29Å; N78-I80 WeakPolarHBondContact OD1-CB 3.5Å; N78-I80 PolarHBondContact OD1-N 3.49Å; N78-F81 HydrophobicContact CB-CB 4.11Å; N78-F81 WeakPolarHBondContact O-CB 3.48Å; N78-F81 PolarHBondContact O-N 2.92Å; N78-F81 VanDerWaalsContact O-N 3.15Å; N78-F81 PolarHBondContact OD1-N 3.35Å; N78-I82 WeakPolarHBondContact O-CG1 3.44Å; N78-I82 PolarHBondContact O-N 2.94Å
79E95Very high95.6Very high148 Ų14868.3 Ų68.369%0.69233%0.325SS*.Hα-helixtrans-61.6-41.7-176.3-66.2-178165.500113F81 I82 E83E79-F81 PolarHBondContact O-N 3.17Å; E79-I82 PolarHBondContact O-N 3.23Å; E79-E83 WeakPolarHBondContact O-CB 3.29Å; E79-E83 VanDerWaalsContact O-CG 3.31Å; E79-E83 WeakPolarHBondContact O-CG 3.33Å; E79-E83 PolarHBondContact O-N 3.24Å
80I93.8Very high95.7Very high57 Ų5760.4 Ų60.429%0.29229%0.292SS..Hα-helixtrans-59.1-41.7177.2-60.9169.2000110.1F65 N78 H84F65-I80 HydrophobicContact CB-CG2 4.4Å; F65-I80 HydrophobicContact CD1-CG2 3.88Å; N78-I80 PolarHBondContact O-N 2.97Å; N78-I80 VanDerWaalsContact OD1-CB 3.29Å; N78-I80 WeakPolarHBondContact OD1-CB 3.5Å; N78-I80 PolarHBondContact OD1-N 3.49Å; I80-H84 WeakPolarHBondContact O-CB 3.36Å; I80-H84 PolarHBondContact O-N 3.07Å; I80-H84 VanDerWaalsContact O-N 3.11Å
81F96.8Very high95.9Very high0 Ų060.5 Ų60.50%029%0.29CS..Hα-helixtrans-63.6-50.7175.9179.6-87.4000112K48 F51 K52 L55 L67 F75 E76 N78 E79 E83 H84 A85K48-F81 HydrophobicContact CB-CE1 4.13Å; K48-F81 HydrophobicContact CB-CZ 4.21Å; K48-F81 HydrophobicContact CG-CE1 4.07Å; F51-F81 HydrophobicContact CB-CE2 4Å; F51-F81 HydrophobicContact CB-CZ 4.44Å; F51-F81 AromaticContact CD1-CD2 3.44Å; F51-F81 HydrophobicContact CD1-CD2 3.44Å; F51-F81 VanDerWaalsContact CD1-CD2 3.44Å; F51-F81 AromaticContact CD1-CE2 3.76Å; F51-F81 HydrophobicContact CD1-CE2 3.76Å; F51-F81 HydrophobicContact CD1-CG 4.08Å; F51-F81 HydrophobicContact CE1-CB 4.48Å; F51-F81 AromaticContact CE1-CD2 3.95Å; F51-F81 HydrophobicContact CE1-CD2 3.95Å; F51-F81 HydrophobicContact CE1-CG 4.49Å; F51-F81 HydrophobicContact CG-CD2 4.26Å; F51-F81 HydrophobicContact CG-CE2 4.16Å; K52-F81 HydrophobicContact CB-CE2 4.11Å; K52-F81 HydrophobicContact CB-CZ 4.06Å; L55-F81 HydrophobicContact CD1-CD2 3.72Å; L55-F81 HydrophobicContact CD1-CE2 3.97Å; L67-F81 HydrophobicContact CD1-CB 4.23Å; L67-F81 HydrophobicContact CD1-CD2 4.44Å; F75-F81 HydrophobicContact CB-CD1 4.28Å; F75-F81 HydrophobicContact CB-CD2 3.74Å; F75-F81 HydrophobicContact CB-CE1 4.43Å; F75-F81 HydrophobicContact CB-CE2 3.89Å; F75-F81 HydrophobicContact CB-CG 3.94Å; F75-F81 HydrophobicContact CB-CZ 4.24Å; F75-F81 HydrophobicContact CD2-CD2 4.4Å; F75-F81 HydrophobicContact CD2-CE2 4.2Å; F75-F81 HydrophobicContact CG-CD2 4.14Å; F75-F81 HydrophobicContact CG-CE2 4.31Å; F75-F81 WeakPolarHBondContact O-CB 3.49Å; F75-F81 WeakPolarHBondContact O-CD1 3.43Å; F75-F81 WeakPolarHBondContact O-CG 3.38Å; E76-F81 HydrophobicContact CG-CE1 3.93Å; N78-F81 HydrophobicContact CB-CB 4.11Å; N78-F81 WeakPolarHBondContact O-CB 3.48Å; N78-F81 PolarHBondContact O-N 2.92Å; N78-F81 VanDerWaalsContact O-N 3.15Å; N78-F81 PolarHBondContact OD1-N 3.35Å; E79-F81 PolarHBondContact O-N 3.17Å; F81-E83 VanDerWaalsContact C-N 3.35Å; F81-E83 PolarHBondContact O-N 2.91Å; F81-H84 PolarHBondContact O-N 3.44Å; F81-A85 HydrophobicContact CE1-CB 4.44Å; F81-A85 WeakPolarHBondContact O-CB 3.44Å; F81-A85 PolarHBondContact O-N 2.9Å
82I96.4Very high96Very high49 Ų4957.9 Ų57.925%0.25127%0.273SS..Hα-helixtrans-60-45.7-178.1-66.3163.6000110.8E76 N78 E79 K86E76-I82 WeakPolarHBondContact O-CD1 3.13Å; N78-I82 WeakPolarHBondContact O-CG1 3.44Å; N78-I82 PolarHBondContact O-N 2.94Å; E79-I82 PolarHBondContact O-N 3.23Å; I82-K86 HydrophobicContact CG2-CD 4.23Å; I82-K86 VanDerWaalsContact O-CG 3.28Å; I82-K86 WeakPolarHBondContact O-CG 3.18Å; I82-K86 PolarHBondContact O-N 3.05Å; I82-K86 VanDerWaalsContact O-N 3.08Å
83E94.5Very high96.1Very high93 Ų9356 Ų5644%0.43526%0.263SS..Hα-helixtrans-65.8-45.1-178.8-72.4-178.516700112.6E79 F81 K86 S87E79-E83 WeakPolarHBondContact O-CB 3.29Å; E79-E83 VanDerWaalsContact O-CG 3.31Å; E79-E83 WeakPolarHBondContact O-CG 3.33Å; E79-E83 PolarHBondContact O-N 3.24Å; F81-E83 VanDerWaalsContact C-N 3.35Å; F81-E83 PolarHBondContact O-N 2.91Å; E83-K86 PolarHBondContact O-N 3.48Å; E83-S87 PolarHBondContact O-N 3.07Å; E83-S87 PolarHBondContact O-OG 2.82Å
84H94.7Very high96.2Very high39 Ų3949.9 Ų49.918%0.18123%0.234CC..Hα-helixtrans-72-36.9-179.3-162.268.4000111.7F51 F65 I80 F81 K86 S87 L88F51-H84 HydrophobicContact CD1-CB 4.02Å; F51-H84 AromaticContact CD2-CD2 3.65Å; F51-H84 HydrophobicContact CE1-CB 3.6Å; F51-H84 AromaticContact CE1-CD2 3.83Å; F51-H84 AromaticContact CE2-CD2 3.41Å; F51-H84 VanDerWaalsContact CE2-CD2 3.41Å; F51-H84 WeakPolarHBondContact CE2-CD2 3.41Å; F51-H84 AromaticContact CG-CD2 4Å; F51-H84 HydrophobicContact CZ-CB 4.01Å; F51-H84 AromaticContact CZ-CD2 3.51Å; F51-H84 AromaticContact CZ-CG 3.97Å; F65-H84 HydrophobicContact CE1-CB 4.09Å; F65-H84 AromaticContact CE1-CD2 3.81Å; F65-H84 AromaticContact CE1-CE1 3.84Å; F65-H84 AromaticContact CE1-CG 3.53Å; F65-H84 AromaticContact CE1-ND1 3.56Å; F65-H84 AromaticContact CE1-NE2 4Å; F65-H84 AromaticContact CZ-CD2 3.58Å; F65-H84 AromaticContact CZ-CE1 3.45Å; F65-H84 VanDerWaalsContact CZ-CE1 3.45Å; F65-H84 WeakPolarHBondContact CZ-CE1 3.5Å; F65-H84 AromaticContact CZ-CG 3.76Å; F65-H84 AromaticContact CZ-ND1 3.68Å; F65-H84 AromaticContact CZ-NE2 3.38Å; F65-H84 WeakPolarHBondContact CZ-NE2 3.34Å; I80-H84 WeakPolarHBondContact O-CB 3.36Å; I80-H84 PolarHBondContact O-N 3.07Å; I80-H84 VanDerWaalsContact O-N 3.11Å; F81-H84 PolarHBondContact O-N 3.44Å; H84-K86 VanDerWaalsContact C-N 3.32Å; H84-K86 PolarHBondContact O-N 3.36Å; H84-S87 WeakPolarHBondContact O-CB 3.42Å; H84-S87 PolarHBondContact O-N 2.9Å; H84-S87 VanDerWaalsContact O-N 3.12Å; H84-L88 WeakPolarHBondContact O-CG 3.48Å; H84-L88 PolarHBondContact O-N 2.82Å
85A97.3Very high96.2Very high3 Ų344.9 Ų44.93%0.02521%0.211CC..Hα-helixtrans-58.6-42.6172.100000112.1G47 K48 F51 F81 S87 L88 E89G47-A85 WeakPolarHBondContact CA-O 3.49Å; K48-A85 HydrophobicContact CB-CB 4.46Å; K48-A85 HydrophobicContact CG-CB 3.99Å; F51-A85 HydrophobicContact CB-CB 4.43Å; F81-A85 HydrophobicContact CE1-CB 4.44Å; F81-A85 WeakPolarHBondContact O-CB 3.44Å; F81-A85 PolarHBondContact O-N 2.9Å; A85-S87 VanDerWaalsContact C-N 3.33Å; A85-S87 PolarHBondContact O-N 2.66Å; A85-L88 PolarHBondContact O-N 2.86Å; A85-E89 PolarHBondContact O-N 3.31Å
86K96.8Very high96.2Very high123 Ų12345 Ų4554%0.53521%0.211SC..Hα-helixtrans-61.5-41.2173.3-74.4170.3-178.9175.10112I82 E83 H84 E89 L90 M198I82-K86 HydrophobicContact CG2-CD 4.23Å; I82-K86 VanDerWaalsContact O-CG 3.28Å; I82-K86 WeakPolarHBondContact O-CG 3.18Å; I82-K86 PolarHBondContact O-N 3.05Å; I82-K86 VanDerWaalsContact O-N 3.08Å; E83-K86 PolarHBondContact O-N 3.48Å; H84-K86 VanDerWaalsContact C-N 3.32Å; H84-K86 PolarHBondContact O-N 3.36Å; K86-E89 PolarHBondContact O-N 3.2Å; K86-L90 WeakPolarHBondContact O-CB 3.25Å; K86-L90 PolarHBondContact O-N 3.25Å; K86-M198 HydrophobicContact CB-CE 4.29Å
87S95.5Very high96.2Very high27 Ų2741.1 Ų41.119%0.18919%0.194CC..Hα-helixtrans-63.7-42.1178-57.20000111.9E83 H84 A85 L90 F91E83-S87 PolarHBondContact O-N 3.07Å; E83-S87 PolarHBondContact O-OG 2.82Å; H84-S87 WeakPolarHBondContact O-CB 3.42Å; H84-S87 PolarHBondContact O-N 2.9Å; H84-S87 VanDerWaalsContact O-N 3.12Å; A85-S87 VanDerWaalsContact C-N 3.33Å; A85-S87 PolarHBondContact O-N 2.66Å; S87-L90 PolarHBondContact O-N 2.75Å; S87-F91 VanDerWaalsContact O-CB 3.32Å; S87-F91 WeakPolarHBondContact O-CB 3.36Å; S87-F91 PolarHBondContact O-N 3.44Å
88L96.6Very high96.1Very high9 Ų932.7 Ų32.75%0.04716%0.157CC..Hα-helixtrans-66.5-42.3177.8-70.3167000112.3V50 F51 H84 A85 F91 L92 M133 M137V50-L88 HydrophobicContact CG1-CD1 4.11Å; F51-L88 HydrophobicContact CB-CD1 3.72Å; F51-L88 HydrophobicContact CD2-CD1 4Å; F51-L88 HydrophobicContact CG-CD1 3.99Å; H84-L88 WeakPolarHBondContact O-CG 3.48Å; H84-L88 PolarHBondContact O-N 2.82Å; A85-L88 PolarHBondContact O-N 2.86Å; L88-F91 PolarHBondContact O-N 2.64Å; L88-L92 WeakPolarHBondContact O-CG 3.4Å; L88-L92 PolarHBondContact O-N 3.31Å; L88-M133 HydrophobicContact CD2-SD 4.08Å; L88-M137 HydrophobicContact CD2-CE 3.42Å; L88-M137 VanDerWaalsContact CD2-CE 3.42Å
89E97Very high96Very high13 Ų1330.6 Ų30.66%0.06115%0.146CC..Hα-helixtrans-58.6-49.8174.1-173.5-77.6138.100111.2K43 A85 K86 F91 L92 R93K43-E89 HydrophobicContact CB-CG 4.23Å; K43-E89 WeakPolarHBondContact CB-OE1 3.37Å; K43-E89 WeakPolarHBondContact O-CG 3.27Å; A85-E89 PolarHBondContact O-N 3.31Å; K86-E89 PolarHBondContact O-N 3.2Å; E89-F91 VanDerWaalsContact C-N 3.3Å; E89-F91 PolarHBondContact O-N 2.57Å; E89-L92 PolarHBondContact O-N 3.22Å; E89-R93 WeakPolarHBondContact O-CB 3.35Å; E89-R93 PolarHBondContact O-N 3.22Å; E89-R93 IonicContact OE1-CZ 3.33Å; E89-R93 IonicContact OE1-NE 3.03Å; E89-R93 PolarHBondContact OE1-NE 3.19Å; E89-R93 IonicContact OE1-NH2 3.76Å; E89-R93 PolarHBondContact OE1-NH2 3.42Å; E89-R93 IonicContact OE2-CZ 3.27Å; E89-R93 VanDerWaalsContact OE2-CZ 3.32Å; E89-R93 IonicContact OE2-NE 2.72Å; E89-R93 IonicContact OE2-NH2 3.88Å; E89-R93 PolarHBondContact OE2-NH2 3.1Å
90L96.2Very high95.8Very high10 Ų1025 Ų255%0.05212%0.122CC..Hα-helixtrans-63.4-39.1-179-170.656.8000111.7K86 S87 R93 I94 M198 L201 K202 W205K86-L90 WeakPolarHBondContact O-CB 3.25Å; K86-L90 PolarHBondContact O-N 3.25Å; S87-L90 PolarHBondContact O-N 2.75Å; L90-R93 WeakPolarHBondContact O-CB 3.44Å; L90-R93 PolarHBondContact O-N 3.16Å; L90-I94 HydrophobicContact CG-CD1 4.21Å; L90-I94 WeakPolarHBondContact O-CB 3.34Å; L90-I94 VanDerWaalsContact O-CG1 3.32Å; L90-I94 WeakPolarHBondContact O-CG1 3.33Å; L90-I94 PolarHBondContact O-N 3.43Å; L90-M198 HydrophobicContact CD2-CE 3.95Å; L90-M198 HydrophobicContact CD2-SD 4.46Å; L90-L201 HydrophobicContact CD2-CB 3.54Å; L90-L201 HydrophobicContact CG-CB 4.11Å; L90-K202 HydrophobicContact CD2-CG 4.06Å; L90-W205 HydrophobicContact CD1-CB 3.55Å; L90-W205 HydrophobicContact CD1-CD2 4.42Å; L90-W205 HydrophobicContact CD1-CG 3.66Å; L90-W205 HydrophobicContact CG-CB 4.49Å
91F96.8Very high95.6Very high16 Ų1623.7 Ų23.77%0.0712%0.117CC..Hα-helixtrans-61.5-47.3174.6172.8-108.4000112.4S87 L88 E89 R93 I94 C95 I113 M137 L161 V164 I168S87-F91 VanDerWaalsContact O-CB 3.32Å; S87-F91 WeakPolarHBondContact O-CB 3.36Å; S87-F91 PolarHBondContact O-N 3.44Å; L88-F91 PolarHBondContact O-N 2.64Å; E89-F91 VanDerWaalsContact C-N 3.3Å; E89-F91 PolarHBondContact O-N 2.57Å; F91-R93 VanDerWaalsContact C-N 3.3Å; F91-R93 PolarHBondContact O-N 2.69Å; F91-I94 PolarHBondContact O-N 2.9Å; F91-C95 PolarHBondContact O-N 3.39Å; F91-C95 PolarHBondContact O-SG 3.42Å; F91-I113 HydrophobicContact CD2-CD1 3.48Å; F91-I113 VanDerWaalsContact CD2-CD1 3.48Å; F91-I113 HydrophobicContact CE2-CD1 3.56Å; F91-M137 HydrophobicContact CD1-CE 4.05Å; F91-M137 HydrophobicContact CE1-CE 4.12Å; F91-M137 HydrophobicContact CE1-SD 4.26Å; F91-L161 HydrophobicContact CE1-CD2 4.33Å; F91-V164 HydrophobicContact CE2-CG1 3.85Å; F91-V164 HydrophobicContact CZ-CG1 3.53Å; F91-I168 HydrophobicContact CE2-CD1 4.37Å; F91-I168 HydrophobicContact CZ-CD1 4.16Å
92L97.6Very high95.4Very high0 Ų025.3 Ų25.30%013%0.126CC..Hα-helixtrans-62.9-39.3176-72.3175.5000111.8W37 V50 L88 E89 C95 A96 M137 I141 W157 L161W37-L92 HydrophobicContact CH2-CB 3.85Å; W37-L92 HydrophobicContact CZ3-CB 3.86Å; W37-L92 HydrophobicContact CZ3-CD1 4.28Å; V50-L92 HydrophobicContact CG2-CD1 4.27Å; L88-L92 WeakPolarHBondContact O-CG 3.4Å; L88-L92 PolarHBondContact O-N 3.31Å; E89-L92 PolarHBondContact O-N 3.22Å; L92-C95 PolarHBondContact O-N 2.94Å; L92-A96 WeakPolarHBondContact O-CB 3.46Å; L92-A96 PolarHBondContact O-N 3.27Å; L92-M137 HydrophobicContact CD1-CG 4.39Å; L92-M137 HydrophobicContact CD2-CB 4.14Å; L92-M137 HydrophobicContact CD2-CG 4.12Å; L92-M137 HydrophobicContact CD2-SD 4.05Å; L92-I141 HydrophobicContact CD2-CD1 4.29Å; L92-W157 HydrophobicContact CD2-CZ3 4.05Å; L92-L161 HydrophobicContact CD2-CD1 4.48Å; L92-L161 HydrophobicContact CD2-CD2 4.36Å
93R95.8Very high95.2Very high49 Ų4924.3 Ų24.319%0.18512%0.122CC..Hα-helixtrans-60.8-44.3175.6-166.5-174.2-65.4-179.8-6.7112.1W37 E89 L90 F91 A96 A97 W205W37-R93 HydrophobicContact CZ2-CB 3.7Å; W37-R93 HydrophobicContact CZ2-CG 4.14Å; E89-R93 WeakPolarHBondContact O-CB 3.35Å; E89-R93 PolarHBondContact O-N 3.22Å; E89-R93 IonicContact OE1-CZ 3.33Å; E89-R93 IonicContact OE1-NE 3.03Å; E89-R93 PolarHBondContact OE1-NE 3.19Å; E89-R93 IonicContact OE1-NH2 3.76Å; E89-R93 PolarHBondContact OE1-NH2 3.42Å; E89-R93 IonicContact OE2-CZ 3.27Å; E89-R93 VanDerWaalsContact OE2-CZ 3.32Å; E89-R93 IonicContact OE2-NE 2.72Å; E89-R93 IonicContact OE2-NH2 3.88Å; E89-R93 PolarHBondContact OE2-NH2 3.1Å; L90-R93 WeakPolarHBondContact O-CB 3.44Å; L90-R93 PolarHBondContact O-N 3.16Å; F91-R93 VanDerWaalsContact C-N 3.3Å; F91-R93 PolarHBondContact O-N 2.69Å; R93-A96 PolarHBondContact O-N 2.91Å; R93-A97 WeakPolarHBondContact O-CB 3.27Å; R93-A97 PolarHBondContact O-N 3.35Å; R93-W205 VanDerWaalsContact CD-CE2 3.41Å; R93-W205 VanDerWaalsContact CD-CZ2 3.42Å; R93-W205 HydrophobicContact CG-CD2 4.25Å; R93-W205 HydrophobicContact CG-CE3 3.81Å; R93-W205 HydrophobicContact CG-CH2 3.79Å; R93-W205 HydrophobicContact CG-CZ2 4.21Å; R93-W205 HydrophobicContact CG-CZ3 3.57Å
94I96.8Very high95Very high0 Ų025 Ų250%013%0.129CC..Hα-helixtrans-63.5-47.1175.3-75164.3000110.5L90 F91 A96 A97 S98 I109 L201 D204 W205 F208L90-I94 HydrophobicContact CG-CD1 4.21Å; L90-I94 WeakPolarHBondContact O-CB 3.34Å; L90-I94 VanDerWaalsContact O-CG1 3.32Å; L90-I94 WeakPolarHBondContact O-CG1 3.33Å; L90-I94 PolarHBondContact O-N 3.43Å; F91-I94 PolarHBondContact O-N 2.9Å; I94-A96 VanDerWaalsContact C-N 3.34Å; I94-A96 PolarHBondContact O-N 3.43Å; I94-A97 PolarHBondContact O-N 3.39Å; I94-S98 VanDerWaalsContact O-CB 3.24Å; I94-S98 WeakPolarHBondContact O-CB 3.31Å; I94-S98 PolarHBondContact O-N 2.87Å; I94-S98 PolarHBondContact O-OG 3.31Å; I94-I109 HydrophobicContact CG2-CD1 3.77Å; I94-I109 HydrophobicContact CG2-CG2 4.27Å; I94-L201 HydrophobicContact CD1-CB 4.34Å; I94-L201 HydrophobicContact CD1-CD2 3.88Å; I94-D204 HydrophobicContact CD1-CB 4.09Å; I94-W205 HydrophobicContact CG1-CB 4.37Å; I94-F208 HydrophobicContact CB-CE2 4.49Å; I94-F208 HydrophobicContact CG1-CD2 4.26Å; I94-F208 HydrophobicContact CG1-CE2 4.42Å; I94-F208 HydrophobicContact CG2-CD2 4.31Å; I94-F208 HydrophobicContact CG2-CE2 3.71Å; I94-F208 HydrophobicContact CG2-CZ 4.45Å
95C97.6Very high94.9Very high0 Ų026.4 Ų26.40%013%0.132CC..Hα-helixtrans-56.2-49.7177.2-68.30000110.9F91 L92 A97 S98 W157 L160F91-C95 PolarHBondContact O-N 3.39Å; F91-C95 PolarHBondContact O-SG 3.42Å; L92-C95 PolarHBondContact O-N 2.94Å; C95-A97 PolarHBondContact O-N 2.97Å; C95-S98 PolarHBondContact O-N 3.42Å; C95-S98 PolarHBondContact O-OG 3.29Å; C95-W157 HydrophobicContact CB-CZ3 4.2Å; C95-L160 HydrophobicContact CB-CD2 4.2Å
96A96.6Very high94.9Very high1 Ų126.3 Ų26.31%0.00813%0.132CC..Hα-helixtrans-59.4-48.2176.700000112I33 Q34 W37 L92 R93 I94 V99 W157I33-A96 HydrophobicContact CG2-CB 4.44Å; Q34-A96 PolarHBondContact NE2-O 3Å; W37-A96 HydrophobicContact CB-CB 3.71Å; W37-A96 HydrophobicContact CD2-CB 4.27Å; W37-A96 HydrophobicContact CG-CB 3.55Å; L92-A96 WeakPolarHBondContact O-CB 3.46Å; L92-A96 PolarHBondContact O-N 3.27Å; R93-A96 PolarHBondContact O-N 2.91Å; I94-A96 VanDerWaalsContact C-N 3.34Å; I94-A96 PolarHBondContact O-N 3.43Å; A96-V99 VanDerWaalsContact O-CG2 3.26Å; A96-V99 WeakPolarHBondContact O-CG2 3.44Å; A96-W157 HydrophobicContact CB-CH2 3.87Å; A96-W157 HydrophobicContact CB-CZ2 4.17Å
97A95Very high94.9Very high6 Ų621.1 Ų21.15%0.0511%0.11CC..Hα-helixtrans-68.1-38.3-177.300000113.1R93 I94 C95 V99 T100 V101 W205 F208 I212R93-A97 WeakPolarHBondContact O-CB 3.27Å; R93-A97 PolarHBondContact O-N 3.35Å; I94-A97 PolarHBondContact O-N 3.39Å; C95-A97 PolarHBondContact O-N 2.97Å; A97-V99 VanDerWaalsContact C-N 3.29Å; A97-V99 PolarHBondContact O-N 3.45Å; A97-T100 PolarHBondContact O-N 2.99Å; A97-T100 PolarHBondContact O-OG1 3.41Å; A97-V101 WeakPolarHBondContact O-CG2 3.33Å; A97-V101 PolarHBondContact O-N 3.17Å; A97-W205 HydrophobicContact CB-CZ3 3.97Å; A97-F208 HydrophobicContact CB-CB 4.07Å; A97-F208 HydrophobicContact CB-CD1 4.36Å; A97-F208 HydrophobicContact CB-CG 4.18Å; A97-I212 HydrophobicContact CB-CD1 4.15Å
98S94.8Very high94.9Very high0 Ų022.2 Ų22.20%012%0.118CC..Hα-helixtrans-59.8-36.4-172.964.60000113.4I94 C95 T100 V101 D102 P103 L106I94-S98 VanDerWaalsContact O-CB 3.24Å; I94-S98 WeakPolarHBondContact O-CB 3.31Å; I94-S98 PolarHBondContact O-N 2.87Å; I94-S98 PolarHBondContact O-OG 3.31Å; C95-S98 PolarHBondContact O-N 3.42Å; C95-S98 PolarHBondContact O-OG 3.29Å; S98-T100 PolarHBondContact O-N 2.87Å; S98-T100 VanDerWaalsContact O-N 3.09Å; S98-V101 PolarHBondContact O-N 2.92Å; S98-D102 CarbonylContact O-C 3.14Å; S98-D102 PolarHBondContact O-N 2.92Å; S98-D102 VanDerWaalsContact O-N 3.08Å; S98-P103 WeakPolarHBondContact O-CA 3.4Å; S98-P103 VanDerWaalsContact O-N 3.11Å; S98-L106 WeakPolarHBondContact OG-CD2 3.28Å
99V94Very high94.9Very high0 Ų021.9 Ų21.90%012%0.116CC..Hα-helixtrans-63.5-19.9-176.6-61.60000114V12 L25 V30 I33 A96 A97 L160V12-V99 VanDerWaalsContact CG2-O 3.22Å; V12-V99 WeakPolarHBondContact CG2-O 3.32Å; L25-V99 HydrophobicContact CD1-CB 4.4Å; L25-V99 HydrophobicContact CD1-CG1 3.77Å; V30-V99 HydrophobicContact CG1-CG2 4.21Å; I33-V99 HydrophobicContact CG2-CG2 4.03Å; A96-V99 VanDerWaalsContact O-CG2 3.26Å; A96-V99 WeakPolarHBondContact O-CG2 3.44Å; A97-V99 VanDerWaalsContact C-N 3.29Å; A97-V99 PolarHBondContact O-N 3.45Å; V99-L160 HydrophobicContact CG1-CD1 3.89Å; V99-L160 HydrophobicContact CG1-CD2 3.98Å
100T90.8Very high94.9Very high31 Ų3121.3 Ų21.319%0.1911%0.114CC..Hα-helixtrans-114.3-18177.752.80000114.3V30 Q34 A97 S98V30-T100 HydrophobicContact CG1-CG2 3.53Å; Q34-T100 HydrophobicContact CG-CG2 3.71Å; Q34-T100 PolarHBondContact NE2-OG1 2.84Å; A97-T100 PolarHBondContact O-N 2.99Å; A97-T100 PolarHBondContact O-OG1 3.41Å; S98-T100 PolarHBondContact O-N 2.87Å; S98-T100 VanDerWaalsContact O-N 3.09Å
101V91.1Very high94.9Very high29 Ų2922.2 Ų22.218%0.17612%0.116CC..Hα-helixtrans-99.6-53.2-174.4178.70000111.2A97 S98 F208 N211 I212A97-V101 WeakPolarHBondContact O-CG2 3.33Å; A97-V101 PolarHBondContact O-N 3.17Å; S98-V101 PolarHBondContact O-N 2.92Å; V101-F208 HydrophobicContact CB-CD1 3.83Å; V101-F208 HydrophobicContact CB-CE1 4.33Å; V101-F208 HydrophobicContact CG1-CD1 3.77Å; V101-F208 HydrophobicContact CG1-CE1 4.41Å; V101-F208 HydrophobicContact CG2-CD1 4.47Å; V101-N211 HydrophobicContact CG1-CB 3.43Å; V101-N211 VanDerWaalsContact CG1-CB 3.43Å; V101-I212 HydrophobicContact CG2-CD1 4.31Å; V101-I212 HydrophobicContact CG2-CG1 3.54Å
102D91.9Very high94.9Very high34 Ų3424.4 Ų24.418%0.18212%0.124CC..  trans-159.784-174.3-172.6-16000108.8S98 D104 R105 Y207 F208S98-D102 CarbonylContact O-C 3.14Å; S98-D102 PolarHBondContact O-N 2.92Å; S98-D102 VanDerWaalsContact O-N 3.08Å; D102-D104 VanDerWaalsContact C-N 3.34Å; D102-R105 HydrophobicContact CB-CB 4.08Å; D102-R105 PolarHBondContact O-N 3.02Å; D102-R105 WeakPolarHBondContact OD1-CB 3.47Å; D102-R105 PolarHBondContact OD1-N 3.32Å; D102-R105 VanDerWaalsContact OD1-N 3.09Å; D102-R105 WeakPolarHBondContact OD2-CB 3.32Å; D102-Y207 HydrophobicContact CB-CE1 4.08Å; D102-Y207 WeakPolarHBondContact OD2-CE1 3.45Å; D102-Y207 PolarHBondContact OD2-OH 3.17Å; D102-F208 HydrophobicContact CB-CE1 3.99Å
103P91.6Very high94.8Very high28 Ų2825.4 Ų25.418%0.18213%0.129CC..Hα-helixtrans-66.8-33.7-175.8-21.133.3000112.9V12 I14 S98 R105 L106V12-P103 HydrophobicContact CG1-CB 3.62Å; V12-P103 HydrophobicContact CG1-CG 3.58Å; I14-P103 HydrophobicContact CD1-CB 3.79Å; I14-P103 HydrophobicContact CG1-CB 3.67Å; I14-P103 WeakPolarHBondContact CG2-O 3.19Å; S98-P103 WeakPolarHBondContact O-CA 3.4Å; S98-P103 VanDerWaalsContact O-N 3.11Å; P103-R105 VanDerWaalsContact C-N 3.31Å; P103-R105 PolarHBondContact O-N 2.9Å; P103-L106 WeakPolarHBondContact O-CB 3.32Å; P103-L106 PolarHBondContact O-N 3.28Å; P103-L106 VanDerWaalsContact O-N 3.12Å
104D89.7Confident94.7Very high108 Ų10823.1 Ų23.158%0.57812%0.121SC*.Hα-helixtrans-65.9-37179.4-65.4-31.8000111.3D102 L106 V107D102-D104 VanDerWaalsContact C-N 3.34Å; D104-L106 PolarHBondContact O-N 3.24Å; D104-V107 WeakPolarHBondContact O-CB 3.2Å; D104-V107 PolarHBondContact O-N 3.44Å; D104-V107 VanDerWaalsContact O-N 3.16Å
105R94.2Very high94.6Very high67 Ų6726.2 Ų26.225%0.25314%0.135SC..Hα-helixtrans-61.2-28174.7-170173-177.5137.2-0.4112.8D102 P103 V107 S108 I109 D204 Y207 F208D102-R105 HydrophobicContact CB-CB 4.08Å; D102-R105 PolarHBondContact O-N 3.02Å; D102-R105 WeakPolarHBondContact OD1-CB 3.47Å; D102-R105 PolarHBondContact OD1-N 3.32Å; D102-R105 VanDerWaalsContact OD1-N 3.09Å; D102-R105 WeakPolarHBondContact OD2-CB 3.32Å; P103-R105 VanDerWaalsContact C-N 3.31Å; P103-R105 PolarHBondContact O-N 2.9Å; R105-V107 VanDerWaalsContact C-N 3.26Å; R105-V107 PolarHBondContact O-N 3.18Å; R105-S108 PolarHBondContact O-N 3.41Å; R105-S108 VanDerWaalsContact O-N 3.15Å; R105-S108 PolarHBondContact O-OG 3.49Å; R105-I109 HydrophobicContact CG-CD1 4Å; R105-I109 HydrophobicContact CG-CG1 4.28Å; R105-I109 WeakPolarHBondContact O-CG1 3.24Å; R105-I109 PolarHBondContact O-N 2.93Å; R105-D204 IonicContact CZ-OD1 2.87Å; R105-D204 IonicContact NE-OD1 3.57Å; R105-D204 PolarHBondContact NE-OD1 3.3Å; R105-D204 IonicContact NH2-OD1 2.89Å; R105-D204 PolarHBondContact NH2-OD1 3.22Å; R105-Y207 VanDerWaalsContact NH1-CD1 3.29Å; R105-Y207 VanDerWaalsContact NH1-CZ 3.33Å; R105-F208 HydrophobicContact CB-CZ 4.36Å; R105-F208 HydrophobicContact CG-CZ 4.26Å
106L96.3Very high94.3Very high2 Ų229.4 Ų29.41%0.0115%0.147CC..Hα-helixtrans-57-40.6176.2-177.559.1000112I14 S98 P103 D104 I109 A110 L160 V164I14-L106 HydrophobicContact CD1-CD2 4.07Å; S98-L106 WeakPolarHBondContact OG-CD2 3.28Å; P103-L106 WeakPolarHBondContact O-CB 3.32Å; P103-L106 PolarHBondContact O-N 3.28Å; P103-L106 VanDerWaalsContact O-N 3.12Å; D104-L106 PolarHBondContact O-N 3.24Å; L106-I109 PolarHBondContact O-N 2.96Å; L106-A110 WeakPolarHBondContact O-CB 3.41Å; L106-A110 PolarHBondContact O-N 3.27Å; L106-L160 HydrophobicContact CD2-CD1 3.65Å; L106-V164 HydrophobicContact CD1-CG2 4.04Å; L106-V164 HydrophobicContact CD2-CG2 3.69Å; L106-V164 HydrophobicContact CG-CG2 3.97Å
107V97Very high94.1Very high13 Ų1331.2 Ų31.28%0.07916%0.155CC..Hα-helixtrans-60.8-49.2177.8177.50000109.8I14 S16 D104 R105 I109 A110 R111 F163 E167I14-V107 HydrophobicContact CG2-CG2 3.5Å; I14-V107 VanDerWaalsContact CG2-CG2 3.5Å; S16-V107 WeakPolarHBondContact OG-CG1 3.34Å; D104-V107 WeakPolarHBondContact O-CB 3.2Å; D104-V107 PolarHBondContact O-N 3.44Å; D104-V107 VanDerWaalsContact O-N 3.16Å; R105-V107 VanDerWaalsContact C-N 3.26Å; R105-V107 PolarHBondContact O-N 3.18Å; V107-I109 VanDerWaalsContact C-N 3.26Å; V107-I109 PolarHBondContact O-N 3.41Å; V107-A110 PolarHBondContact O-N 3.01Å; V107-R111 HydrophobicContact CG1-CG 4.33Å; V107-R111 WeakPolarHBondContact O-CB 3.3Å; V107-R111 VanDerWaalsContact O-CG 3.25Å; V107-R111 WeakPolarHBondContact O-CG 3.49Å; V107-R111 PolarHBondContact O-N 3.24Å; V107-F163 HydrophobicContact CG2-CE1 3.92Å; V107-F163 HydrophobicContact CG2-CZ 3.93Å; V107-E167 HydrophobicContact CG1-CG 4.48Å
108S95.9Very high93.9Very high51 Ų5131.3 Ų31.336%0.35716%0.156SC..Hα-helixtrans-58.5-38.8179.478.60000112.5R105 R112R105-S108 PolarHBondContact O-N 3.41Å; R105-S108 VanDerWaalsContact O-N 3.15Å; R105-S108 PolarHBondContact O-OG 3.49Å; S108-R112 WeakPolarHBondContact O-CB 3.43Å; S108-R112 WeakPolarHBondContact O-CG 3.38Å; S108-R112 PolarHBondContact O-N 2.93Å
109I96.4Very high93.5Very high1 Ų133.4 Ų33.41%0.00516%0.164CC..Hα-helixtrans-70.4-49.3179.7-65.1172.5000110.3I94 R105 L106 V107 R111 R112 I113 L201 D204 F208I94-I109 HydrophobicContact CG2-CD1 3.77Å; I94-I109 HydrophobicContact CG2-CG2 4.27Å; R105-I109 HydrophobicContact CG-CD1 4Å; R105-I109 HydrophobicContact CG-CG1 4.28Å; R105-I109 WeakPolarHBondContact O-CG1 3.24Å; R105-I109 PolarHBondContact O-N 2.93Å; L106-I109 PolarHBondContact O-N 2.96Å; V107-I109 VanDerWaalsContact C-N 3.26Å; V107-I109 PolarHBondContact O-N 3.41Å; I109-R111 PolarHBondContact O-N 3.01Å; I109-R112 PolarHBondContact O-N 3.41Å; I109-I113 HydrophobicContact CG2-CD1 4Å; I109-I113 VanDerWaalsContact O-CG1 3.31Å; I109-I113 WeakPolarHBondContact O-CG1 3.1Å; I109-I113 PolarHBondContact O-N 3.18Å; I109-L201 HydrophobicContact CG2-CD2 4.45Å; I109-D204 HydrophobicContact CD1-CB 3.78Å; I109-D204 HydrophobicContact CG1-CB 4.45Å; I109-D204 WeakPolarHBondContact CG1-OD2 3.48Å; I109-F208 HydrophobicContact CD1-CE2 3.55Å; I109-F208 HydrophobicContact CD1-CZ 3.9Å
110A97.1Very high93.2Very high1 Ų135.1 Ų35.11%0.00817%0.171CC..Hα-helixtrans-55.1-44.6176.600000111L106 V107 I113 G114 V164 E167 I168L106-A110 WeakPolarHBondContact O-CB 3.41Å; L106-A110 PolarHBondContact O-N 3.27Å; V107-A110 PolarHBondContact O-N 3.01Å; A110-I113 WeakPolarHBondContact O-CB 3.28Å; A110-I113 PolarHBondContact O-N 3.4Å; A110-G114 PolarHBondContact O-N 3.05Å; A110-G114 VanDerWaalsContact O-N 3.09Å; A110-V164 HydrophobicContact CB-CG1 3.89Å; A110-E167 HydrophobicContact CB-CB 3.76Å; A110-I168 HydrophobicContact CB-CG1 4.07Å; A110-I168 VanDerWaalsContact O-CG1 3.25Å; A110-I168 WeakPolarHBondContact O-CG1 3.28Å
111R96.8Very high92.7Very high30 Ų3043.9 Ų43.911%0.11320%0.201CC..Hα-helixtrans-64.2-47178.7-69.7-174.965.176.76.9112.6K18 V107 I109 I113 G114 E115 E167 N170 S171K18-R111 VanDerWaalsContact CB-NH1 3.27Å; V107-R111 HydrophobicContact CG1-CG 4.33Å; V107-R111 WeakPolarHBondContact O-CB 3.3Å; V107-R111 VanDerWaalsContact O-CG 3.25Å; V107-R111 WeakPolarHBondContact O-CG 3.49Å; V107-R111 PolarHBondContact O-N 3.24Å; I109-R111 PolarHBondContact O-N 3.01Å; R111-I113 VanDerWaalsContact C-N 3.27Å; R111-I113 PolarHBondContact O-N 3.44Å; R111-G114 PolarHBondContact O-N 3.46Å; R111-G114 VanDerWaalsContact O-N 3.07Å; R111-E115 WeakPolarHBondContact O-CG 3.26Å; R111-E115 PolarHBondContact O-N 2.92Å; R111-E167 HydrophobicContact CG-CB 4.44Å; R111-E167 IonicContact NH1-OE2 3.36Å; R111-N170 PolarHBondContact NH1-OD1 2.99Å; R111-S171 VanDerWaalsContact CA-OG 3.27Å; R111-S171 WeakPolarHBondContact CA-OG 3.16Å; R111-S171 VanDerWaalsContact O-CB 3.26Å; R111-S171 WeakPolarHBondContact O-CB 3.34Å; R111-S171 PolarHBondContact O-OG 2.69Å
112R95.3Very high92.3Very high61 Ų6148 Ų4823%0.2322%0.216CC..Hα-helixtrans-58-38.2175-80.7167.240.6-138.2-19.9112.7S108 I109 R116 D204S108-R112 WeakPolarHBondContact O-CB 3.43Å; S108-R112 WeakPolarHBondContact O-CG 3.38Å; S108-R112 PolarHBondContact O-N 2.93Å; I109-R112 PolarHBondContact O-N 3.41Å; R112-R116 WeakPolarHBondContact O-CB 3.47Å; R112-R116 VanDerWaalsContact O-CG 3.25Å; R112-R116 WeakPolarHBondContact O-CG 3.31Å; R112-R116 PolarHBondContact O-N 3.38Å; R112-D204 IonicContact CZ-OD2 2.78Å; R112-D204 IonicContact NH1-OD1 3.62Å; R112-D204 PolarHBondContact NH1-OD1 3.22Å; R112-D204 IonicContact NH1-OD2 3.83Å; R112-D204 PolarHBondContact NH1-OD2 3.34Å; R112-D204 IonicContact NH2-OD2 2.76Å; R112-D204 PolarHBondContact NH2-OD2 3.49Å
113I95.2Very high91.9Very high22 Ų2247.7 Ų47.711%0.11322%0.216CC..Hα-helixtrans-60.7-49.8174.5-70169.7000109.5F91 I109 A110 R111 E115 R116 H117 I168 L201F91-I113 HydrophobicContact CD2-CD1 3.48Å; F91-I113 VanDerWaalsContact CD2-CD1 3.48Å; F91-I113 HydrophobicContact CE2-CD1 3.56Å; I109-I113 HydrophobicContact CG2-CD1 4Å; I109-I113 VanDerWaalsContact O-CG1 3.31Å; I109-I113 WeakPolarHBondContact O-CG1 3.1Å; I109-I113 PolarHBondContact O-N 3.18Å; A110-I113 WeakPolarHBondContact O-CB 3.28Å; A110-I113 PolarHBondContact O-N 3.4Å; R111-I113 VanDerWaalsContact C-N 3.27Å; R111-I113 PolarHBondContact O-N 3.44Å; I113-E115 PolarHBondContact O-N 3.25Å; I113-R116 PolarHBondContact O-N 3.38Å; I113-H117 VanDerWaalsContact CG2-CE1 3.41Å; I113-H117 WeakPolarHBondContact CG2-CE1 3.37Å; I113-H117 WeakPolarHBondContact CG2-ND1 3.13Å; I113-H117 PolarHBondContact O-N 3.01Å; I113-H117 PolarHBondContact O-ND1 3.48Å; I113-I168 HydrophobicContact CB-CG1 4.34Å; I113-I168 HydrophobicContact CG2-CD1 4.03Å; I113-I168 HydrophobicContact CG2-CG1 4.21Å; I113-I168 HydrophobicContact CG2-CG2 4.09Å; I113-L201 HydrophobicContact CD1-CD2 4.15Å; I113-L201 HydrophobicContact CG1-CD2 4.43Å
114G95.3Very high91.6Very high0 Ų050.1 Ų50.10%023%0.23CC..Hα-helixtrans-60.9-43.9179.500000113.2A110 R111 R116 H117 I168 S171 F172A110-G114 PolarHBondContact O-N 3.05Å; A110-G114 VanDerWaalsContact O-N 3.09Å; R111-G114 PolarHBondContact O-N 3.46Å; R111-G114 VanDerWaalsContact O-N 3.07Å; G114-R116 VanDerWaalsContact C-N 3.33Å; G114-R116 PolarHBondContact O-N 3.28Å; G114-H117 PolarHBondContact O-N 3.22Å; G114-H117 VanDerWaalsContact O-N 3.13Å; G114-I168 VanDerWaalsContact CA-CG2 3.45Å; G114-I168 WeakPolarHBondContact CA-O 3.47Å; G114-S171 WeakPolarHBondContact CA-OG 3.35Å; G114-F172 WeakPolarHBondContact O-CA 3.25Å; G114-F172 WeakPolarHBondContact O-CD2 3.22Å
115E93.9Very high91.7Very high66 Ų6646 Ų4631%0.30821%0.207SC..Hα-helixtrans-57.9-45.3175.3-70.1158-16400111.3R111 I113 H117 V118 Y119 E175R111-E115 WeakPolarHBondContact O-CG 3.26Å; R111-E115 PolarHBondContact O-N 2.92Å; I113-E115 PolarHBondContact O-N 3.25Å; E115-H117 VanDerWaalsContact C-N 3.31Å; E115-H117 PolarHBondContact O-N 3.03Å; E115-V118 WeakPolarHBondContact O-CB 3.27Å; E115-V118 PolarHBondContact O-N 3.47Å; E115-Y119 VanDerWaalsContact O-CD2 3.31Å; E115-Y119 WeakPolarHBondContact O-CD2 3.3Å; E115-Y119 WeakPolarHBondContact O-CE2 3.45Å; E115-E175 HydrophobicContact CB-CB 4.28Å; E115-E175 HydrophobicContact CB-CG 4.11Å; E115-E175 HydrophobicContact CG-CB 4.07Å; E115-E175 HydrophobicContact CG-CG 4.35Å
116R91.2Very high91.5Very high66 Ų6646.1 Ų46.125%0.24921%0.213CC..Hα-helixtrans-64.7-35.2177.5-71.5-70.5178.6-153.9-14112.6R112 I113 G114 V118 Y119 S197R112-R116 WeakPolarHBondContact O-CB 3.47Å; R112-R116 VanDerWaalsContact O-CG 3.25Å; R112-R116 WeakPolarHBondContact O-CG 3.31Å; R112-R116 PolarHBondContact O-N 3.38Å; I113-R116 PolarHBondContact O-N 3.38Å; G114-R116 VanDerWaalsContact C-N 3.33Å; G114-R116 PolarHBondContact O-N 3.28Å; R116-V118 PolarHBondContact O-N 2.99Å; R116-Y119 WeakPolarHBondContact O-CB 3.4Å; R116-Y119 PolarHBondContact O-N 3.25Å; R116-Y119 VanDerWaalsContact O-N 3.1Å; R116-S197 WeakPolarHBondContact CD-OG 3.34Å
117H92.1Very high91.2Very high39 Ų3948.7 Ų48.718%0.18124%0.235CC..Hα-helixtrans-65.5-23.6-176.7-80.568.9000113.5I113 G114 E115 Y119 F120 V123 W130 F172I113-H117 VanDerWaalsContact CG2-CE1 3.41Å; I113-H117 WeakPolarHBondContact CG2-CE1 3.37Å; I113-H117 WeakPolarHBondContact CG2-ND1 3.13Å; I113-H117 PolarHBondContact O-N 3.01Å; I113-H117 PolarHBondContact O-ND1 3.48Å; G114-H117 PolarHBondContact O-N 3.22Å; G114-H117 VanDerWaalsContact O-N 3.13Å; E115-H117 VanDerWaalsContact C-N 3.31Å; E115-H117 PolarHBondContact O-N 3.03Å; H117-Y119 PolarHBondContact O-N 2.82Å; H117-Y119 VanDerWaalsContact O-N 3.16Å; H117-F120 HydrophobicContact CB-CD2 4.45Å; H117-F120 PolarHBondContact O-N 3.47Å; H117-V123 HydrophobicContact CB-CG1 4.47Å; H117-W130 AromaticContact CD2-CH2 3.9Å; H117-W130 AromaticContact CD2-CZ2 3.98Å; H117-F172 HydrophobicContact CB-CD2 3.79Å; H117-F172 HydrophobicContact CB-CE2 4.04Å
118V90.6Very high90.9Very high9 Ų951 Ų516%0.05525%0.254CS..THydrogen-bonded Turntrans-60.6-22.9174.3175.20000112.9E115 R116 F172 E175 L176 K179E115-V118 WeakPolarHBondContact O-CB 3.27Å; E115-V118 PolarHBondContact O-N 3.47Å; R116-V118 PolarHBondContact O-N 2.99Å; V118-F172 HydrophobicContact CB-CD2 4.47Å; V118-F172 HydrophobicContact CB-CE2 4.37Å; V118-F172 HydrophobicContact CG2-CB 4.39Å; V118-F172 HydrophobicContact CG2-CD1 4.3Å; V118-F172 HydrophobicContact CG2-CD2 3.53Å; V118-F172 HydrophobicContact CG2-CE1 4.49Å; V118-F172 HydrophobicContact CG2-CE2 3.78Å; V118-F172 HydrophobicContact CG2-CG 3.82Å; V118-F172 HydrophobicContact CG2-CZ 4.25Å; V118-F172 WeakPolarHBondContact CG2-O 3.47Å; V118-E175 HydrophobicContact CB-CG 4.01Å; V118-E175 HydrophobicContact CG1-CG 4.24Å; V118-E175 HydrophobicContact CG2-CB 3.85Å; V118-E175 HydrophobicContact CG2-CG 3.87Å; V118-L176 HydrophobicContact CG1-CB 4.3Å; V118-L176 HydrophobicContact CG1-CD1 4.14Å; V118-L176 HydrophobicContact CG2-CB 4.2Å; V118-K179 HydrophobicContact CG1-CB 4.32Å; V118-K179 HydrophobicContact CG1-CD 3.53Å; V118-K179 PolarHBondContact O-NZ 3.31Å
119Y87.7Confident90.8Very high43 Ų4350.2 Ų50.217%0.16925%0.245CC..THydrogen-bonded Turntrans-87.1-15.4-177.8-63.6-87.4000113.3E115 R116 H117 R121 E175 R178 F188E115-Y119 VanDerWaalsContact O-CD2 3.31Å; E115-Y119 WeakPolarHBondContact O-CD2 3.3Å; E115-Y119 WeakPolarHBondContact O-CE2 3.45Å; R116-Y119 WeakPolarHBondContact O-CB 3.4Å; R116-Y119 PolarHBondContact O-N 3.25Å; R116-Y119 VanDerWaalsContact O-N 3.1Å; H117-Y119 PolarHBondContact O-N 2.82Å; H117-Y119 VanDerWaalsContact O-N 3.16Å; Y119-R121 PolarHBondContact O-N 3.14Å; Y119-E175 HydrophobicContact CE2-CG 4.27Å; Y119-E175 WeakPolarHBondContact CE2-OE1 3.37Å; Y119-E175 PolarHBondContact OH-OE1 3.32Å; Y119-R178 PolarHBondContact OH-NH2 3.13Å; Y119-F188 AromaticContact CD1-CD2 3.98Å; Y119-F188 HydrophobicContact CD1-CD2 3.98Å; Y119-F188 AromaticContact CD1-CE2 3.45Å; Y119-F188 HydrophobicContact CD1-CE2 3.45Å; Y119-F188 VanDerWaalsContact CD1-CE2 3.45Å; Y119-F188 AromaticContact CD1-CZ 3.9Å; Y119-F188 HydrophobicContact CD1-CZ 3.9Å; Y119-F188 HydrophobicContact CE1-CE2 4.3Å; Y119-F188 AromaticContact CG-CE2 3.95Å; Y119-F188 HydrophobicContact CG-CE2 3.95Å; Y119-F188 HydrophobicContact CG-CZ 4.1Å
120F86.9Confident90.7Very high36 Ų3651 Ų5116%0.15825%0.248CC..SBendtrans-83.492.2170.7-54.9-62.4000109.4H117 K122 V123 L190 K194H117-F120 HydrophobicContact CB-CD2 4.45Å; H117-F120 PolarHBondContact O-N 3.47Å; F120-K122 PolarHBondContact O-N 3.29Å; F120-V123 HydrophobicContact CB-CB 4.03Å; F120-V123 HydrophobicContact CB-CG2 3.57Å; F120-V123 HydrophobicContact CG-CG2 4.47Å; F120-V123 WeakPolarHBondContact O-CB 3.43Å; F120-V123 PolarHBondContact O-N 3.3Å; F120-L190 HydrophobicContact CD1-CD1 3.51Å; F120-L190 HydrophobicContact CD1-CG 4.42Å; F120-L190 HydrophobicContact CE1-CD1 3.96Å; F120-K194 HydrophobicContact CD1-CG 4.5Å; F120-K194 HydrophobicContact CE1-CG 3.54Å; F120-K194 HydrophobicContact CZ-CG 4.18Å
121R79.6Confident90.7Very high216 Ų21655.2 Ų55.282%0.81527%0.27SS*.THydrogen-bonded Turntrans-50.2-28.7-170.2-65.5-176.6-177.2175.51.6115.9Y119Y119-R121 PolarHBondContact O-N 3.14Å
122K83.1Confident90.7Very high114 Ų11457.8 Ų57.850%0.49628%0.28SS..THydrogen-bonded Turntrans-84.2-12.5178.9-64.2-174.5176.6-177.20113.7I64 E66 F120I64-K122 HydrophobicContact CG2-CB 4.12Å; E66-K122 IonicContact OE1-NZ 2.67Å; E66-K122 PolarHBondContact OE1-NZ 3.34Å; F120-K122 PolarHBondContact O-N 3.29Å
123V83.7Confident90.7Very high29 Ų2956 Ų5618%0.17628%0.275CS..  trans-88.2119.9-179.3178.80000109.1I64 H117 F120I64-V123 HydrophobicContact CG2-CG2 3.91Å; H117-V123 HydrophobicContact CB-CG1 4.47Å; F120-V123 HydrophobicContact CB-CB 4.03Å; F120-V123 HydrophobicContact CB-CG2 3.57Å; F120-V123 HydrophobicContact CG-CG2 4.47Å; F120-V123 WeakPolarHBondContact O-CB 3.43Å; F120-V123 PolarHBondContact O-N 3.3Å
124T86.6Confident90.9Very high79 Ų7956.3 Ų56.349%0.48528%0.275SS..  trans-108.3161.3165.259.70000109.4D126 W130T124-D126 PolarHBondContact O-N 2.84Å; T124-D126 VanDerWaalsContact O-N 3.11Å; T124-W130 PolarHBondContact O-NE1 2.97Å
125F89.8Confident91Very high22 Ų2258.7 Ų58.710%0.09629%0.29CS..  trans-85.652.2170-140.5-71.3000112A127 W130 I165 I168 K169 F172 M173F125-A127 PolarHBondContact O-N 3.38Å; F125-W130 AromaticContact CD1-CD1 3.74Å; F125-W130 HydrophobicContact CD1-CD2 4.39Å; F125-W130 HydrophobicContact CD1-CG 4.01Å; F125-W130 AromaticContact CD1-NE1 4Å; F125-W130 HydrophobicContact CD2-CD2 4.35Å; F125-W130 AromaticContact CD2-CE2 3.77Å; F125-W130 AromaticContact CD2-CZ2 3.98Å; F125-W130 HydrophobicContact CD2-CZ2 3.98Å; F125-W130 AromaticContact CD2-NE1 3.8Å; F125-W130 HydrophobicContact CE1-CB 3.98Å; F125-W130 AromaticContact CE1-CD1 3.8Å; F125-W130 AromaticContact CE1-CD2 3.78Å; F125-W130 HydrophobicContact CE1-CD2 3.78Å; F125-W130 HydrophobicContact CE1-CE3 4.36Å; F125-W130 AromaticContact CE1-CG 3.57Å; F125-W130 HydrophobicContact CE1-CG 3.57Å; F125-W130 AromaticContact CE2-CD2 3.73Å; F125-W130 HydrophobicContact CE2-CD2 3.73Å; F125-W130 AromaticContact CE2-CE2 3.48Å; F125-W130 VanDerWaalsContact CE2-CE2 3.48Å; F125-W130 HydrophobicContact CE2-CE3 4.04Å; F125-W130 HydrophobicContact CE2-CG 4.33Å; F125-W130 AromaticContact CE2-CH2 3.97Å; F125-W130 HydrophobicContact CE2-CH2 3.97Å; F125-W130 AromaticContact CE2-CZ2 3.62Å; F125-W130 HydrophobicContact CE2-CZ2 3.62Å; F125-W130 HydrophobicContact CE2-CZ3 4.16Å; F125-W130 AromaticContact CE2-NE1 3.94Å; F125-W130 AromaticContact CG-NE1 3.83Å; F125-W130 HydrophobicContact CZ-CB 4.42Å; F125-W130 AromaticContact CZ-CD2 3.42Å; F125-W130 HydrophobicContact CZ-CD2 3.42Å; F125-W130 VanDerWaalsContact CZ-CD2 3.42Å; F125-W130 AromaticContact CZ-CE2 3.71Å; F125-W130 AromaticContact CZ-CE3 3.66Å; F125-W130 HydrophobicContact CZ-CE3 3.66Å; F125-W130 AromaticContact CZ-CG 3.76Å; F125-W130 HydrophobicContact CZ-CG 3.76Å; F125-W130 HydrophobicContact CZ-CH2 4.42Å; F125-W130 HydrophobicContact CZ-CZ2 4.2Å; F125-W130 HydrophobicContact CZ-CZ3 4.16Å; F125-I165 HydrophobicContact CE1-CG2 4.18Å; F125-I165 HydrophobicContact CZ-CG2 4.03Å; F125-I168 HydrophobicContact CE2-CB 4.26Å; F125-I168 HydrophobicContact CE2-CG2 3.72Å; F125-I168 HydrophobicContact CZ-CB 4.43Å; F125-I168 HydrophobicContact CZ-CG2 4.29Å; F125-K169 HydrophobicContact CD1-CB 3.85Å; F125-K169 HydrophobicContact CD1-CD 3.95Å; F125-K169 HydrophobicContact CD1-CG 3.59Å; F125-K169 HydrophobicContact CD2-CB 4.25Å; F125-K169 HydrophobicContact CD2-CG 4.39Å; F125-K169 HydrophobicContact CE1-CB 3.43Å; F125-K169 VanDerWaalsContact CE1-CB 3.43Å; F125-K169 HydrophobicContact CE1-CD 4.02Å; F125-K169 HydrophobicContact CE1-CG 3.7Å; F125-K169 HydrophobicContact CE2-CB 3.87Å; F125-K169 HydrophobicContact CE2-CG 4.48Å; F125-K169 HydrophobicContact CG-CB 4.24Å; F125-K169 HydrophobicContact CG-CG 3.95Å; F125-K169 VanDerWaalsContact CZ-CA 3.44Å; F125-K169 HydrophobicContact CZ-CB 3.43Å; F125-K169 VanDerWaalsContact CZ-CB 3.43Å; F125-K169 HydrophobicContact CZ-CG 4.15Å; F125-F172 HydrophobicContact CB-CD1 3.89Å; F125-F172 HydrophobicContact CB-CE1 3.98Å; F125-F172 HydrophobicContact CB-CG 4.45Å; F125-F172 HydrophobicContact CD2-CB 3.87Å; F125-F172 HydrophobicContact CD2-CD1 4.07Å; F125-F172 HydrophobicContact CD2-CD2 4.24Å; F125-F172 AromaticContact CD2-CG 3.81Å; F125-F172 HydrophobicContact CD2-CG 3.81Å; F125-F172 HydrophobicContact CE2-CB 4.37Å; F125-F172 HydrophobicContact CG-CD1 4.44Å; F125-M173 HydrophobicContact CB-CE 3.73Å
126D90.5Very high91.2Very high68 Ų6855.6 Ų55.636%0.36428%0.275SS..  trans-68.2120.4174.2-174.4-29.9000109.9T124 A128 H129 W130T124-D126 PolarHBondContact O-N 2.84Å; T124-D126 VanDerWaalsContact O-N 3.11Å; D126-A128 PolarHBondContact O-N 2.76Å; D126-A128 WeakPolarHBondContact OD1-CB 3.36Å; D126-A128 PolarHBondContact OD1-N 3.26Å; D126-H129 HydrophobicContact CB-CB 4.48Å; D126-H129 WeakPolarHBondContact CB-ND1 3.33Å; D126-H129 PolarHBondContact O-N 2.78Å; D126-H129 VanDerWaalsContact O-N 3.15Å; D126-H129 IonicContact OD2-CE1 3.32Å; D126-H129 IonicContact OD2-ND1 2.81Å; D126-W130 VanDerWaalsContact O-CD1 3.28Å; D126-W130 PolarHBondContact O-N 3.34Å
127A89.5Confident91.5Very high57 Ų5752.5 Ų52.547%0.47126%0.264SS..Hα-helixtrans-55.1-35.8-178.700000112.5F125 L131F125-A127 PolarHBondContact O-N 3.38Å; A127-L131 HydrophobicContact CB-CD1 4.42Å; A127-L131 WeakPolarHBondContact O-CB 3.25Å; A127-L131 WeakPolarHBondContact O-CG 3.47Å; A127-L131 PolarHBondContact O-N 3.16Å
128A91.9Very high91.8Very high60 Ų6050.8 Ų50.850%0.49626%0.256SS..Hα-helixtrans-63.9-43.7-179.700000111.9D126 R132D126-A128 PolarHBondContact O-N 2.76Å; D126-A128 WeakPolarHBondContact OD1-CB 3.36Å; D126-A128 PolarHBondContact OD1-N 3.26Å; A128-R132 VanDerWaalsContact O-CB 3.24Å; A128-R132 WeakPolarHBondContact O-CB 3.42Å; A128-R132 PolarHBondContact O-N 3.01Å; A128-R132 VanDerWaalsContact O-N 3.1Å
129H93.9Very high92.1Very high35 Ų3553.2 Ų53.216%0.16227%0.269CS..Hα-helixtrans-64.9-49.2178-61.4144.5000111.5N58 V61 D126 R132 M133N58-H129 PolarHBondContact ND2-CD2 2.88Å; N58-H129 PolarHBondContact OD1-CD2 2.7Å; V61-H129 HydrophobicContact CG2-CB 3.88Å; D126-H129 HydrophobicContact CB-CB 4.48Å; D126-H129 WeakPolarHBondContact CB-ND1 3.33Å; D126-H129 PolarHBondContact O-N 2.78Å; D126-H129 VanDerWaalsContact O-N 3.15Å; D126-H129 IonicContact OD2-CE1 3.32Å; D126-H129 IonicContact OD2-ND1 2.81Å; H129-R132 PolarHBondContact O-N 3.35Å; H129-M133 PolarHBondContact O-N 3.35Å
130W94.7Very high92.5Very high17 Ų1751.3 Ų51.36%0.06426%0.261CS..Hα-helixtrans-72.1-38.7-174.8-74.586.4000113H117 T124 F125 D126 M133 K134 I165 I168H117-W130 AromaticContact CD2-CH2 3.9Å; H117-W130 AromaticContact CD2-CZ2 3.98Å; T124-W130 PolarHBondContact O-NE1 2.97Å; F125-W130 AromaticContact CD1-CD1 3.74Å; F125-W130 HydrophobicContact CD1-CD2 4.39Å; F125-W130 HydrophobicContact CD1-CG 4.01Å; F125-W130 AromaticContact CD1-NE1 4Å; F125-W130 HydrophobicContact CD2-CD2 4.35Å; F125-W130 AromaticContact CD2-CE2 3.77Å; F125-W130 AromaticContact CD2-CZ2 3.98Å; F125-W130 HydrophobicContact CD2-CZ2 3.98Å; F125-W130 AromaticContact CD2-NE1 3.8Å; F125-W130 HydrophobicContact CE1-CB 3.98Å; F125-W130 AromaticContact CE1-CD1 3.8Å; F125-W130 AromaticContact CE1-CD2 3.78Å; F125-W130 HydrophobicContact CE1-CD2 3.78Å; F125-W130 HydrophobicContact CE1-CE3 4.36Å; F125-W130 AromaticContact CE1-CG 3.57Å; F125-W130 HydrophobicContact CE1-CG 3.57Å; F125-W130 AromaticContact CE2-CD2 3.73Å; F125-W130 HydrophobicContact CE2-CD2 3.73Å; F125-W130 AromaticContact CE2-CE2 3.48Å; F125-W130 VanDerWaalsContact CE2-CE2 3.48Å; F125-W130 HydrophobicContact CE2-CE3 4.04Å; F125-W130 HydrophobicContact CE2-CG 4.33Å; F125-W130 AromaticContact CE2-CH2 3.97Å; F125-W130 HydrophobicContact CE2-CH2 3.97Å; F125-W130 AromaticContact CE2-CZ2 3.62Å; F125-W130 HydrophobicContact CE2-CZ2 3.62Å; F125-W130 HydrophobicContact CE2-CZ3 4.16Å; F125-W130 AromaticContact CE2-NE1 3.94Å; F125-W130 AromaticContact CG-NE1 3.83Å; F125-W130 HydrophobicContact CZ-CB 4.42Å; F125-W130 AromaticContact CZ-CD2 3.42Å; F125-W130 HydrophobicContact CZ-CD2 3.42Å; F125-W130 VanDerWaalsContact CZ-CD2 3.42Å; F125-W130 AromaticContact CZ-CE2 3.71Å; F125-W130 AromaticContact CZ-CE3 3.66Å; F125-W130 HydrophobicContact CZ-CE3 3.66Å; F125-W130 AromaticContact CZ-CG 3.76Å; F125-W130 HydrophobicContact CZ-CG 3.76Å; F125-W130 HydrophobicContact CZ-CH2 4.42Å; F125-W130 HydrophobicContact CZ-CZ2 4.2Å; F125-W130 HydrophobicContact CZ-CZ3 4.16Å; D126-W130 VanDerWaalsContact O-CD1 3.28Å; D126-W130 PolarHBondContact O-N 3.34Å; W130-M133 HydrophobicContact CD2-CE 4.08Å; W130-M133 HydrophobicContact CE3-CE 3.29Å; W130-M133 HydrophobicContact CH2-CE 4.29Å; W130-M133 HydrophobicContact CZ3-CE 3.41Å; W130-M133 VanDerWaalsContact CZ3-CE 3.41Å; W130-M133 PolarHBondContact O-N 3.08Å; W130-K134 PolarHBondContact O-N 2.69Å; W130-I165 HydrophobicContact CB-CG2 4.32Å; W130-I165 HydrophobicContact CE3-CG1 4.47Å; W130-I165 HydrophobicContact CE3-CG2 4.3Å; W130-I168 HydrophobicContact CH2-CG2 3.7Å; W130-I168 HydrophobicContact CZ3-CD1 4.09Å; W130-I168 HydrophobicContact CZ3-CG2 3.82Å
131L95.5Very high93Very high90 Ų9049.7 Ų49.747%0.47125%0.254SS..Hα-helixtrans-66.3-39.9174-69.1174.4000111.1A127 M133 K134 T135A127-L131 HydrophobicContact CB-CD1 4.42Å; A127-L131 WeakPolarHBondContact O-CB 3.25Å; A127-L131 WeakPolarHBondContact O-CG 3.47Å; A127-L131 PolarHBondContact O-N 3.16Å; L131-M133 PolarHBondContact O-N 3.48Å; L131-K134 WeakPolarHBondContact O-CB 3.41Å; L131-K134 PolarHBondContact O-N 2.59Å; L131-T135 PolarHBondContact O-N 3Å; L131-T135 PolarHBondContact O-OG1 2.9Å
132R97.1Very high93.7Very high84 Ų8442 Ų4232%0.31723%0.228SC..Hα-helixtrans-63.4-43.2176.1-173.165.4-172.4162.99.1111.7L54 T57 N58 A128 H129 K134 T135 V136L54-R132 HydrophobicContact CD1-CB 4.21Å; L54-R132 HydrophobicContact CD1-CG 3.85Å; T57-R132 VanDerWaalsContact CB-NH2 3.34Å; T57-R132 PolarHBondContact OG1-NE 3.03Å; T57-R132 PolarHBondContact OG1-NH2 3.28Å; T57-R132 VanDerWaalsContact OG1-NH2 3.11Å; N58-R132 HydrophobicContact CB-CG 4.39Å; A128-R132 VanDerWaalsContact O-CB 3.24Å; A128-R132 WeakPolarHBondContact O-CB 3.42Å; A128-R132 PolarHBondContact O-N 3.01Å; A128-R132 VanDerWaalsContact O-N 3.1Å; H129-R132 PolarHBondContact O-N 3.35Å; R132-K134 VanDerWaalsContact C-N 3.33Å; R132-K134 PolarHBondContact O-N 3.41Å; R132-T135 PolarHBondContact O-N 3.32Å; R132-V136 WeakPolarHBondContact O-CG2 3.49Å; R132-V136 PolarHBondContact O-N 2.91Å
133M96.7Very high94.2Very high25 Ų2542.1 Ų42.112%0.12323%0.234CC..Hα-helixtrans-58-45.3174.6-179172.467.600111.5L54 L88 H129 W130 L131 V136 M137L54-M133 HydrophobicContact CD1-CB 4.22Å; L54-M133 HydrophobicContact CD2-CB 3.93Å; L54-M133 HydrophobicContact CD2-CG 3.96Å; L54-M133 HydrophobicContact CD2-SD 4.33Å; L88-M133 HydrophobicContact CD2-SD 4.08Å; H129-M133 PolarHBondContact O-N 3.35Å; W130-M133 HydrophobicContact CD2-CE 4.08Å; W130-M133 HydrophobicContact CE3-CE 3.29Å; W130-M133 HydrophobicContact CH2-CE 4.29Å; W130-M133 HydrophobicContact CZ3-CE 3.41Å; W130-M133 VanDerWaalsContact CZ3-CE 3.41Å; W130-M133 PolarHBondContact O-N 3.08Å; L131-M133 PolarHBondContact O-N 3.48Å; M133-V136 PolarHBondContact O-N 3.41Å; M133-M137 HydrophobicContact CE-CE 4.37Å; M133-M137 HydrophobicContact CG-CE 3.56Å; M133-M137 HydrophobicContact CG-SD 4.26Å; M133-M137 VanDerWaalsContact O-CG 3.29Å; M133-M137 WeakPolarHBondContact O-CG 3.47Å; M133-M137 PolarHBondContact O-N 3.08Å; M133-M137 HydrophobicContact SD-CE 3.85Å
134K97.7Very high94.4Very high28 Ų2843.5 Ų43.512%0.12224%0.242CC..Hα-helixtrans-56.7-51.1174.4-167.7-172.271.7177.70112.1W130 L131 R132 V136 M137 V138 N158 L161 S162 I165W130-K134 PolarHBondContact O-N 2.69Å; L131-K134 WeakPolarHBondContact O-CB 3.41Å; L131-K134 PolarHBondContact O-N 2.59Å; R132-K134 VanDerWaalsContact C-N 3.33Å; R132-K134 PolarHBondContact O-N 3.41Å; K134-V136 VanDerWaalsContact C-N 3.34Å; K134-V136 PolarHBondContact O-N 2.91Å; K134-M137 WeakPolarHBondContact O-CB 3.29Å; K134-M137 PolarHBondContact O-N 3.09Å; K134-V138 WeakPolarHBondContact O-CG2 3.35Å; K134-V138 PolarHBondContact O-N 3.35Å; K134-V138 VanDerWaalsContact O-N 3.08Å; K134-N158 WeakPolarHBondContact CE-OD1 3.4Å; K134-L161 HydrophobicContact CD-CB 4.25Å; K134-L161 HydrophobicContact CG-CB 3.83Å; K134-L161 HydrophobicContact CG-CD1 4.41Å; K134-S162 WeakPolarHBondContact CD-OG 3.18Å; K134-S162 PolarHBondContact NZ-OG 3.1Å; K134-I165 HydrophobicContact CB-CD1 3.5Å; K134-I165 HydrophobicContact CD-CD1 4.03Å; K134-I165 HydrophobicContact CG-CD1 3.74Å
135T98Very high94.7Very high50 Ų5040.9 Ų40.931%0.30723%0.225SC..Hα-helixtrans-57.7-48.6-179.1-62.60000110.7L131 R132 M137 V138 D139L131-T135 PolarHBondContact O-N 3Å; L131-T135 PolarHBondContact O-OG1 2.9Å; R132-T135 PolarHBondContact O-N 3.32Å; T135-M137 VanDerWaalsContact C-N 3.34Å; T135-M137 PolarHBondContact O-N 2.84Å; T135-V138 PolarHBondContact O-N 2.86Å; T135-V138 VanDerWaalsContact O-N 3.14Å; T135-D139 PolarHBondContact O-N 3.44Å
136V98.1Very high94.7Very high0 Ų046 Ų460%025%0.249CC..Hα-helixtrans-62.9-38.3179.21710000112.3V50 Q53 R132 M133 K134 V138 D139 V140V50-V136 HydrophobicContact CB-CG1 4.38Å; V50-V136 HydrophobicContact CG1-CG1 4.15Å; V50-V136 VanDerWaalsContact O-CG1 3.26Å; V50-V136 WeakPolarHBondContact O-CG1 3.25Å; Q53-V136 HydrophobicContact CB-CG1 3.57Å; Q53-V136 HydrophobicContact CB-CG2 4.37Å; R132-V136 WeakPolarHBondContact O-CG2 3.49Å; R132-V136 PolarHBondContact O-N 2.91Å; M133-V136 PolarHBondContact O-N 3.41Å; K134-V136 VanDerWaalsContact C-N 3.34Å; K134-V136 PolarHBondContact O-N 2.91Å; V136-V138 VanDerWaalsContact C-N 3.34Å; V136-V138 PolarHBondContact O-N 3.23Å; V136-D139 PolarHBondContact O-N 2.65Å; V136-V140 HydrophobicContact CG1-CG2 4.41Å; V136-V140 WeakPolarHBondContact O-CG2 3.35Å; V136-V140 PolarHBondContact O-N 2.95Å
137M98.3Very high94.7Very high2 Ų248 Ų481%0.0127%0.266CS..Hα-helixtrans-59-45.8173.8-73.9170.517700111.8V50 L88 F91 L92 M133 K134 T135 I141 L161V50-M137 HydrophobicContact CG1-CG 3.75Å; V50-M137 HydrophobicContact CG2-CG 4.31Å; L88-M137 HydrophobicContact CD2-CE 3.42Å; L88-M137 VanDerWaalsContact CD2-CE 3.42Å; F91-M137 HydrophobicContact CD1-CE 4.05Å; F91-M137 HydrophobicContact CE1-CE 4.12Å; F91-M137 HydrophobicContact CE1-SD 4.26Å; L92-M137 HydrophobicContact CD1-CG 4.39Å; L92-M137 HydrophobicContact CD2-CB 4.14Å; L92-M137 HydrophobicContact CD2-CG 4.12Å; L92-M137 HydrophobicContact CD2-SD 4.05Å; M133-M137 HydrophobicContact CE-CE 4.37Å; M133-M137 HydrophobicContact CG-CE 3.56Å; M133-M137 HydrophobicContact CG-SD 4.26Å; M133-M137 VanDerWaalsContact O-CG 3.29Å; M133-M137 WeakPolarHBondContact O-CG 3.47Å; M133-M137 PolarHBondContact O-N 3.08Å; M133-M137 HydrophobicContact SD-CE 3.85Å; K134-M137 WeakPolarHBondContact O-CB 3.29Å; K134-M137 PolarHBondContact O-N 3.09Å; T135-M137 VanDerWaalsContact C-N 3.34Å; T135-M137 PolarHBondContact O-N 2.84Å; M137-I141 WeakPolarHBondContact O-CD1 3.39Å; M137-I141 WeakPolarHBondContact O-CG1 3.33Å; M137-I141 PolarHBondContact O-N 3.46Å; M137-L161 HydrophobicContact CB-CD1 3.95Å; M137-L161 HydrophobicContact SD-CD1 4.32Å
138V98.2Very high94.8Very high3 Ų353.3 Ų53.32%0.01828%0.278CS..Hα-helixtrans-65.1-45.8178.1177.30000110.8K134 T135 V136 V140 I141 M142 A154 W157 L161K134-V138 WeakPolarHBondContact O-CG2 3.35Å; K134-V138 PolarHBondContact O-N 3.35Å; K134-V138 VanDerWaalsContact O-N 3.08Å; T135-V138 PolarHBondContact O-N 2.86Å; T135-V138 VanDerWaalsContact O-N 3.14Å; V136-V138 VanDerWaalsContact C-N 3.34Å; V136-V138 PolarHBondContact O-N 3.23Å; V138-V140 PolarHBondContact O-N 2.87Å; V138-I141 PolarHBondContact O-N 3.14Å; V138-I141 VanDerWaalsContact O-N 3.17Å; V138-M142 HydrophobicContact CG1-CG 4.29Å; V138-M142 HydrophobicContact CG1-SD 3.9Å; V138-M142 WeakPolarHBondContact O-CG 3.37Å; V138-M142 PolarHBondContact O-N 3.38Å; V138-A154 HydrophobicContact CG1-CB 3.95Å; V138-W157 HydrophobicContact CG2-CB 4.07Å; V138-L161 HydrophobicContact CG2-CD1 3.99Å
139D96.8Very high94.8Very high60 Ų6053.1 Ų53.132%0.32127%0.269SS..Hα-helixtrans-58.4-46.1179.5-67.4-17.2000111.2T135 V136 I141 M142 L143T135-D139 PolarHBondContact O-N 3.44Å; V136-D139 PolarHBondContact O-N 2.65Å; D139-I141 VanDerWaalsContact C-N 3.33Å; D139-I141 PolarHBondContact O-N 3.07Å; D139-M142 WeakPolarHBondContact O-CB 3.44Å; D139-M142 PolarHBondContact O-N 3.09Å; D139-L143 WeakPolarHBondContact O-CG 3.34Å; D139-L143 PolarHBondContact O-N 3.32Å
140V96.5Very high94.7Very high3 Ų352.2 Ų52.22%0.01827%0.267CS..Hα-helixtrans-62.9-39.4178170.20000112A46 M49 V50 V136 V138 L143A46-V140 HydrophobicContact CB-CG1 4.11Å; M49-V140 HydrophobicContact CB-CG1 4.03Å; M49-V140 HydrophobicContact CB-CG2 3.96Å; M49-V140 HydrophobicContact CE-CG1 4.47Å; V50-V140 HydrophobicContact CB-CG2 4.5Å; V50-V140 HydrophobicContact CG2-CB 3.73Å; V50-V140 HydrophobicContact CG2-CG1 3.94Å; V50-V140 HydrophobicContact CG2-CG2 3.72Å; V136-V140 HydrophobicContact CG1-CG2 4.41Å; V136-V140 WeakPolarHBondContact O-CG2 3.35Å; V136-V140 PolarHBondContact O-N 2.95Å; V138-V140 PolarHBondContact O-N 2.87Å; V140-L143 PolarHBondContact O-N 3.29Å
141I96.8Very high94.7Very high2 Ų258.3 Ų58.31%0.0130%0.3CS..Hα-helixtrans-63.6-45.7175.3-68.4161.6000109.8L92 M137 V138 D139 L143 T144 Q145 I153 W157L92-I141 HydrophobicContact CD2-CD1 4.29Å; M137-I141 WeakPolarHBondContact O-CD1 3.39Å; M137-I141 WeakPolarHBondContact O-CG1 3.33Å; M137-I141 PolarHBondContact O-N 3.46Å; V138-I141 PolarHBondContact O-N 3.14Å; V138-I141 VanDerWaalsContact O-N 3.17Å; D139-I141 VanDerWaalsContact C-N 3.33Å; D139-I141 PolarHBondContact O-N 3.07Å; I141-L143 VanDerWaalsContact C-N 3.35Å; I141-L143 PolarHBondContact O-N 2.97Å; I141-T144 PolarHBondContact O-N 3.4Å; I141-T144 PolarHBondContact O-OG1 2.99Å; I141-Q145 VanDerWaalsContact O-CG 3.28Å; I141-Q145 WeakPolarHBondContact O-CG 3.4Å; I141-Q145 PolarHBondContact O-NE2 3.02Å; I141-Q145 VanDerWaalsContact O-NE2 3.15Å; I141-I153 HydrophobicContact CG2-CG2 4.02Å; I141-W157 HydrophobicContact CD1-CD2 3.53Å; I141-W157 HydrophobicContact CD1-CE3 3.67Å; I141-W157 HydrophobicContact CD1-CG 4.06Å; I141-W157 HydrophobicContact CD1-CH2 3.94Å; I141-W157 HydrophobicContact CD1-CZ2 3.84Å; I141-W157 HydrophobicContact CD1-CZ3 3.88Å
142M95.2Very high94.8Very high55 Ų5559.2 Ų59.227%0.27130%0.302SS..Hα-helixtrans-61.2-37.4179.5-71.4171.964.100113.6V138 D139 T144 Q145 A150 A154V138-M142 HydrophobicContact CG1-CG 4.29Å; V138-M142 HydrophobicContact CG1-SD 3.9Å; V138-M142 WeakPolarHBondContact O-CG 3.37Å; V138-M142 PolarHBondContact O-N 3.38Å; D139-M142 WeakPolarHBondContact O-CB 3.44Å; D139-M142 PolarHBondContact O-N 3.09Å; M142-T144 PolarHBondContact O-N 3.48Å; M142-Q145 WeakPolarHBondContact O-CB 3.47Å; M142-Q145 PolarHBondContact O-N 3.23Å; M142-A150 HydrophobicContact CE-CB 4.01Å; M142-A154 HydrophobicContact CE-CB 4.13Å; M142-A154 HydrophobicContact CG-CB 4.14Å; M142-A154 HydrophobicContact SD-CB 3.42Å; M142-A154 WeakPolarHBondContact SD-CB 3.18Å
143L92.3Very high94.8Very high116 Ų11655.5 Ų55.561%0.60729%0.289SS*.THydrogen-bonded Turntrans-59-17.9179.3-74.5173.6000113.7M49 D139 V140 I141M49-L143 HydrophobicContact CE-CD1 3.92Å; D139-L143 WeakPolarHBondContact O-CG 3.34Å; D139-L143 PolarHBondContact O-N 3.32Å; V140-L143 PolarHBondContact O-N 3.29Å; I141-L143 VanDerWaalsContact C-N 3.35Å; I141-L143 PolarHBondContact O-N 2.97Å
144T88.2Confident94.8Very high58 Ų5854.9 Ų54.936%0.35629%0.287SS..THydrogen-bonded Turntrans-995.6179.362.30000113.6V40 I141 M142V40-T144 HydrophobicContact CG2-CG2 4.45Å; I141-T144 PolarHBondContact O-N 3.4Å; I141-T144 PolarHBondContact O-OG1 2.99Å; M142-T144 PolarHBondContact O-N 3.48Å
145Q92.1Very high94.8Very high24 Ų2459 Ų5911%0.11231%0.307CS..SBendtrans-112163.9-172.9-46.6-56.9-4000112.4S36 N39 I141 M142 I153S36-Q145 PolarHBondContact O-NE2 3.44Å; N39-Q145 PolarHBondContact ND2-OE1 3.35Å; I141-Q145 VanDerWaalsContact O-CG 3.28Å; I141-Q145 WeakPolarHBondContact O-CG 3.4Å; I141-Q145 PolarHBondContact O-NE2 3.02Å; I141-Q145 VanDerWaalsContact O-NE2 3.15Å; M142-Q145 WeakPolarHBondContact O-CB 3.47Å; M142-Q145 PolarHBondContact O-N 3.23Å; Q145-I153 HydrophobicContact CB-CD1 3.73Å; Q145-I153 HydrophobicContact CG-CD1 3.55Å; Q145-I153 HydrophobicContact CG-CG2 4.32Å
146Q90.3Very high94.9Very high128 Ų12856.6 Ų56.660%0.59829%0.292SS*.  trans-69.7138.8171.4-65.7-66.1-6.500110.3K148 D149 A150Q146-K148 HydrophobicContact CB-CG 4.2Å; Q146-K148 PolarHBondContact O-N 2.98Å; Q146-K148 VanDerWaalsContact O-N 3.1Å; Q146-D149 PolarHBondContact O-N 2.74Å; Q146-A150 PolarHBondContact O-N 3.47Å
147P90.4Very high94.9Very high111 Ų11156.7 Ų56.772%0.72129%0.292SS*.G310 helixtrans-54.3-35.1-176.6-29.535.4000114.5D149 A150P147-D149 VanDerWaalsContact C-N 3.27Å; P147-D149 PolarHBondContact O-N 2.91Å; P147-A150 WeakPolarHBondContact O-CB 3.44Å; P147-A150 PolarHBondContact O-N 2.68Å
148K92.2Very high94.9Very high168 Ų16859 Ų5973%0.7330%0.304SS*.G310 helixtrans-63.5-28.8-179.665.2174.5-172.3175.90114.1Q146Q146-K148 HydrophobicContact CB-CG 4.2Å; Q146-K148 PolarHBondContact O-N 2.98Å; Q146-K148 VanDerWaalsContact O-N 3.1Å
149D92Very high94.9Very high56 Ų5662.1 Ų62.130%0.29932%0.318SS..G310 helixtrans-99.3-10-176.7-55.8-45.3000111.4Q146 P147 L151 Q152 I153Q146-D149 PolarHBondContact O-N 2.74Å; P147-D149 VanDerWaalsContact C-N 3.27Å; P147-D149 PolarHBondContact O-N 2.91Å; D149-L151 PolarHBondContact O-N 3.47Å; D149-Q152 PolarHBondContact O-N 3.31Å; D149-I153 HydrophobicContact CB-CD1 3.77Å; D149-I153 HydrophobicContact CB-CG1 4.36Å; D149-I153 VanDerWaalsContact O-CG1 3.3Å; D149-I153 WeakPolarHBondContact O-CG1 3.18Å; D149-I153 PolarHBondContact O-N 3.4Å
150A92Very high95Very high16 Ų1659.3 Ų59.313%0.13230%0.303CS..Hα-helixtrans-57.4-44.2-168.600000113M142 Q146 P147 I153 A154M142-A150 HydrophobicContact CE-CB 4.01Å; Q146-A150 PolarHBondContact O-N 3.47Å; P147-A150 WeakPolarHBondContact O-CB 3.44Å; P147-A150 PolarHBondContact O-N 2.68Å; A150-I153 PolarHBondContact O-N 2.93Å; A150-A154 VanDerWaalsContact O-CB 3.27Å; A150-A154 WeakPolarHBondContact O-CB 3.16Å; A150-A154 PolarHBondContact O-N 3.37Å
151L94.5Very high95Very high146 Ų14659.1 Ų59.176%0.76430%0.302SS*.Hα-helixtrans-65.9-40.7-179.2-174.264.9000112.4D149 A154 H155D149-L151 PolarHBondContact O-N 3.47Å; L151-A154 WeakPolarHBondContact O-CB 3.31Å; L151-A154 PolarHBondContact O-N 2.99Å; L151-H155 WeakPolarHBondContact O-CB 3.42Å; L151-H155 PolarHBondContact O-N 3.05Å
152Q96.7Very high95.1Very high109 Ų10960.9 Ų60.951%0.50931%0.314SS..Hα-helixtrans-71.1-40.3-179.6-60.9179.78.100111L32 D149 A154 H155 A156L32-Q152 HydrophobicContact CD1-CB 3.72Å; D149-Q152 PolarHBondContact O-N 3.31Å; Q152-A154 VanDerWaalsContact C-N 3.34Å; Q152-H155 PolarHBondContact O-N 3.05Å; Q152-A156 PolarHBondContact O-N 3.16Å
153I97.3Very high95.3Very high6 Ų659 Ų593%0.03130%0.304CS..Hα-helixtrans-62-45.2173.4-66.9169.6000110L32 I141 Q145 D149 A150 H155 A156 W157L32-I153 HydrophobicContact CB-CG1 4.39Å; L32-I153 HydrophobicContact CD2-CG1 3.91Å; I141-I153 HydrophobicContact CG2-CG2 4.02Å; Q145-I153 HydrophobicContact CB-CD1 3.73Å; Q145-I153 HydrophobicContact CG-CD1 3.55Å; Q145-I153 HydrophobicContact CG-CG2 4.32Å; D149-I153 HydrophobicContact CB-CD1 3.77Å; D149-I153 HydrophobicContact CB-CG1 4.36Å; D149-I153 VanDerWaalsContact O-CG1 3.3Å; D149-I153 WeakPolarHBondContact O-CG1 3.18Å; D149-I153 PolarHBondContact O-N 3.4Å; A150-I153 PolarHBondContact O-N 2.93Å; I153-H155 VanDerWaalsContact C-N 3.29Å; I153-H155 PolarHBondContact O-N 3.49Å; I153-A156 PolarHBondContact O-N 3.42Å; I153-W157 PolarHBondContact O-N 3.08Å
154A97.8Very high95.5Very high11 Ų1153.4 Ų53.49%0.09128%0.276CS..Hα-helixtrans-57.9-43.9176.400000111.6V138 M142 A150 L151 Q152 N158V138-A154 HydrophobicContact CG1-CB 3.95Å; M142-A154 HydrophobicContact CE-CB 4.13Å; M142-A154 HydrophobicContact CG-CB 4.14Å; M142-A154 HydrophobicContact SD-CB 3.42Å; M142-A154 WeakPolarHBondContact SD-CB 3.18Å; A150-A154 VanDerWaalsContact O-CB 3.27Å; A150-A154 WeakPolarHBondContact O-CB 3.16Å; A150-A154 PolarHBondContact O-N 3.37Å; L151-A154 WeakPolarHBondContact O-CB 3.31Å; L151-A154 PolarHBondContact O-N 2.99Å; Q152-A154 VanDerWaalsContact C-N 3.34Å; A154-N158 WeakPolarHBondContact O-CB 3.42Å; A154-N158 PolarHBondContact O-N 2.83Å; A154-N158 PolarHBondContact O-ND2 3.12Å
155H98.1Very high96Very high115 Ų11551.4 Ų51.453%0.53226%0.262SS..Hα-helixtrans-62.3-51.9178.2-174.678.8000111.7E29 L151 Q152 I153 W157 N158 K159E29-H155 IonicContact OE1-CD2 2.9Å; E29-H155 IonicContact OE1-NE2 2.69Å; L151-H155 WeakPolarHBondContact O-CB 3.42Å; L151-H155 PolarHBondContact O-N 3.05Å; Q152-H155 PolarHBondContact O-N 3.05Å; I153-H155 VanDerWaalsContact C-N 3.29Å; I153-H155 PolarHBondContact O-N 3.49Å; H155-W157 PolarHBondContact O-N 3.38Å; H155-N158 PolarHBondContact O-N 3.46Å; H155-K159 WeakPolarHBondContact O-CB 3.46Å; H155-K159 PolarHBondContact O-N 2.87Å
156A98.2Very high96.3Very high0 Ų052.2 Ų52.20%027%0.271CS..Hα-helixtrans-59.8-46.4-178.300000112.1E29 L32 I33 Q152 I153 K159 L160E29-A156 HydrophobicContact CB-CB 3.99Å; E29-A156 HydrophobicContact CG-CB 4.08Å; L32-A156 HydrophobicContact CB-CB 4.31Å; I33-A156 HydrophobicContact CD1-CB 4.18Å; I33-A156 HydrophobicContact CG1-CB 3.95Å; Q152-A156 PolarHBondContact O-N 3.16Å; I153-A156 PolarHBondContact O-N 3.42Å; A156-K159 PolarHBondContact O-N 3.47Å; A156-L160 PolarHBondContact O-N 3.44Å; A156-L160 VanDerWaalsContact O-N 3.1Å
157W98.4Very high96.6Very high1 Ų146.1 Ų46.10%0.00424%0.242CC..Hα-helixtrans-68.2-39.5176.9-8498.7000113.2I33 S36 W37 L92 C95 A96 V138 I141 I153 H155 K159 L160 L161I33-W157 HydrophobicContact CG1-CD2 4.46Å; I33-W157 HydrophobicContact CG1-CG 4.46Å; I33-W157 HydrophobicContact CG2-CH2 4.27Å; I33-W157 HydrophobicContact CG2-CZ2 3.81Å; S36-W157 PolarHBondContact OG-NE1 2.91Å; W37-W157 HydrophobicContact CB-CZ2 4.15Å; L92-W157 HydrophobicContact CD2-CZ3 4.05Å; C95-W157 HydrophobicContact CB-CZ3 4.2Å; A96-W157 HydrophobicContact CB-CH2 3.87Å; A96-W157 HydrophobicContact CB-CZ2 4.17Å; V138-W157 HydrophobicContact CG2-CB 4.07Å; I141-W157 HydrophobicContact CD1-CD2 3.53Å; I141-W157 HydrophobicContact CD1-CE3 3.67Å; I141-W157 HydrophobicContact CD1-CG 4.06Å; I141-W157 HydrophobicContact CD1-CH2 3.94Å; I141-W157 HydrophobicContact CD1-CZ2 3.84Å; I141-W157 HydrophobicContact CD1-CZ3 3.88Å; I153-W157 PolarHBondContact O-N 3.08Å; H155-W157 PolarHBondContact O-N 3.38Å; W157-K159 VanDerWaalsContact C-N 3.28Å; W157-K159 PolarHBondContact O-N 2.93Å; W157-L160 HydrophobicContact CE3-CD2 4.36Å; W157-L160 HydrophobicContact CZ3-CD2 4.32Å; W157-L160 PolarHBondContact O-N 2.87Å; W157-L161 HydrophobicContact CE3-CD1 4Å; W157-L161 HydrophobicContact CE3-CD2 4.31Å; W157-L161 HydrophobicContact CE3-CG 4Å; W157-L161 HydrophobicContact CZ3-CD2 4.37Å; W157-L161 WeakPolarHBondContact O-CB 3.19Å; W157-L161 WeakPolarHBondContact O-CG 3.41Å; W157-L161 PolarHBondContact O-N 3.43Å
158N98.2Very high96.9Very high50 Ų5041 Ų4127%0.26721%0.209SC..Hα-helixtrans-60.5-41.7175-91.5-59.7000111.4K134 A154 H155 S162K134-N158 WeakPolarHBondContact CE-OD1 3.4Å; A154-N158 WeakPolarHBondContact O-CB 3.42Å; A154-N158 PolarHBondContact O-N 2.83Å; A154-N158 PolarHBondContact O-ND2 3.12Å; H155-N158 PolarHBondContact O-N 3.46Å; N158-S162 WeakPolarHBondContact O-CB 3.15Å; N158-S162 PolarHBondContact O-N 2.89Å; N158-S162 PolarHBondContact O-OG 3.09Å
159K98.4Very high97.2Very high70 Ų7037.7 Ų37.730%0.30419%0.194SC..Hα-helixtrans-61.4-53178.2-159.9179.7169.8-178.80110.6I23 D24 L25 E29 H155 A156 W157 S162 F163I23-K159 HydrophobicContact CD1-CB 4.38Å; I23-K159 HydrophobicContact CD1-CG 3.82Å; I23-K159 WeakPolarHBondContact CD1-O 3.32Å; I23-K159 HydrophobicContact CG1-CG 4.3Å; D24-K159 WeakPolarHBondContact O-CE 3.24Å; D24-K159 PolarHBondContact O-NZ 2.87Å; L25-K159 HydrophobicContact CD2-CD 4.05Å; L25-K159 HydrophobicContact CD2-CG 4.44Å; E29-K159 WeakPolarHBondContact OE1-CD 3.43Å; E29-K159 IonicContact OE1-NZ 2.87Å; E29-K159 PolarHBondContact OE1-NZ 3.02Å; E29-K159 IonicContact OE2-NZ 3.53Å; E29-K159 PolarHBondContact OE2-NZ 3.11Å; H155-K159 WeakPolarHBondContact O-CB 3.46Å; H155-K159 PolarHBondContact O-N 2.87Å; A156-K159 PolarHBondContact O-N 3.47Å; W157-K159 VanDerWaalsContact C-N 3.28Å; W157-K159 PolarHBondContact O-N 2.93Å; K159-S162 PolarHBondContact O-N 3.08Å; K159-F163 PolarHBondContact O-N 3.41Å
160L98.5Very high97.5Very high0 Ų036.6 Ų36.60%019%0.189CC..Hα-helixtrans-57.7-55.3177177.462.4000112.4L25 I33 C95 V99 L106 A156 W157 S162 F163 V164L25-L160 HydrophobicContact CD1-CD1 4.37Å; I33-L160 HydrophobicContact CD1-CB 4.19Å; I33-L160 HydrophobicContact CD1-CD2 4.06Å; I33-L160 HydrophobicContact CG2-CD2 4.16Å; C95-L160 HydrophobicContact CB-CD2 4.2Å; V99-L160 HydrophobicContact CG1-CD1 3.89Å; V99-L160 HydrophobicContact CG1-CD2 3.98Å; L106-L160 HydrophobicContact CD2-CD1 3.65Å; A156-L160 PolarHBondContact O-N 3.44Å; A156-L160 VanDerWaalsContact O-N 3.1Å; W157-L160 HydrophobicContact CE3-CD2 4.36Å; W157-L160 HydrophobicContact CZ3-CD2 4.32Å; W157-L160 PolarHBondContact O-N 2.87Å; L160-S162 VanDerWaalsContact C-N 3.29Å; L160-S162 PolarHBondContact O-N 3Å; L160-F163 WeakPolarHBondContact O-CB 3.26Å; L160-F163 PolarHBondContact O-N 3.31Å; L160-V164 HydrophobicContact CD1-CG2 4.27Å; L160-V164 WeakPolarHBondContact O-CG2 3.2Å; L160-V164 PolarHBondContact O-N 3.39Å
161L98.4Very high97.7Very high0 Ų035.9 Ų35.90%018%0.182CC..Hα-helixtrans-68.4-28.5-175.2-65.9176000112.3F91 L92 K134 M137 V138 W157 V164 I165F91-L161 HydrophobicContact CE1-CD2 4.33Å; L92-L161 HydrophobicContact CD2-CD1 4.48Å; L92-L161 HydrophobicContact CD2-CD2 4.36Å; K134-L161 HydrophobicContact CD-CB 4.25Å; K134-L161 HydrophobicContact CG-CB 3.83Å; K134-L161 HydrophobicContact CG-CD1 4.41Å; M137-L161 HydrophobicContact CB-CD1 3.95Å; M137-L161 HydrophobicContact SD-CD1 4.32Å; V138-L161 HydrophobicContact CG2-CD1 3.99Å; W157-L161 HydrophobicContact CE3-CD1 4Å; W157-L161 HydrophobicContact CE3-CD2 4.31Å; W157-L161 HydrophobicContact CE3-CG 4Å; W157-L161 HydrophobicContact CZ3-CD2 4.37Å; W157-L161 WeakPolarHBondContact O-CB 3.19Å; W157-L161 WeakPolarHBondContact O-CG 3.41Å; W157-L161 PolarHBondContact O-N 3.43Å; L161-V164 PolarHBondContact O-N 2.91Å; L161-I165 VanDerWaalsContact O-CB 3.3Å; L161-I165 WeakPolarHBondContact O-CB 3.26Å; L161-I165 VanDerWaalsContact O-CG1 3.27Å; L161-I165 WeakPolarHBondContact O-CG1 3.48Å; L161-I165 PolarHBondContact O-N 3.17Å
162S98.2Very high97.8Very high39 Ų3929.3 Ų29.327%0.27315%0.148SC..Hα-helixtrans-66.5-41.1173.8-60.10000111.4K134 N158 K159 L160 S166K134-S162 WeakPolarHBondContact CD-OG 3.18Å; K134-S162 PolarHBondContact NZ-OG 3.1Å; N158-S162 WeakPolarHBondContact O-CB 3.15Å; N158-S162 PolarHBondContact O-N 2.89Å; N158-S162 PolarHBondContact O-OG 3.09Å; K159-S162 PolarHBondContact O-N 3.08Å; L160-S162 VanDerWaalsContact C-N 3.29Å; L160-S162 PolarHBondContact O-N 3Å; S162-S166 WeakPolarHBondContact O-CB 3.39Å; S162-S166 PolarHBondContact O-N 3.49Å; S162-S166 PolarHBondContact O-OG 3.27Å
163F98.2Very high97.8Very high14 Ų1427.5 Ų27.56%0.06114%0.14CC..Hα-helixtrans-63.4-47.9172.7174.8-98.2000111.2I14 R21 I23 V107 K159 L160 I165 S166 E167I14-F163 HydrophobicContact CB-CE1 4.26Å; I14-F163 HydrophobicContact CB-CZ 4.39Å; I14-F163 HydrophobicContact CG2-CE1 3.77Å; I14-F163 HydrophobicContact CG2-CZ 3.98Å; R21-F163 HydrophobicContact CB-CE2 4.16Å; I23-F163 HydrophobicContact CB-CB 4.07Å; I23-F163 HydrophobicContact CB-CD2 3.84Å; I23-F163 HydrophobicContact CB-CE2 4.42Å; I23-F163 HydrophobicContact CB-CG 3.89Å; I23-F163 HydrophobicContact CD1-CB 3.85Å; I23-F163 HydrophobicContact CD1-CG 4.47Å; I23-F163 HydrophobicContact CG2-CB 3.99Å; I23-F163 HydrophobicContact CG2-CD1 3.59Å; I23-F163 HydrophobicContact CG2-CD2 3.64Å; I23-F163 HydrophobicContact CG2-CE1 3.9Å; I23-F163 HydrophobicContact CG2-CE2 3.96Å; I23-F163 HydrophobicContact CG2-CG 3.45Å; I23-F163 VanDerWaalsContact CG2-CG 3.45Å; I23-F163 HydrophobicContact CG2-CZ 4.07Å; V107-F163 HydrophobicContact CG2-CE1 3.92Å; V107-F163 HydrophobicContact CG2-CZ 3.93Å; K159-F163 PolarHBondContact O-N 3.41Å; L160-F163 WeakPolarHBondContact O-CB 3.26Å; L160-F163 PolarHBondContact O-N 3.31Å; F163-I165 PolarHBondContact O-N 3Å; F163-S166 VanDerWaalsContact O-CB 3.28Å; F163-S166 WeakPolarHBondContact O-CB 3.26Å; F163-S166 PolarHBondContact O-N 3.48Å; F163-S166 VanDerWaalsContact O-N 3.16Å; F163-E167 HydrophobicContact CE1-CG 4.11Å; F163-E167 HydrophobicContact CE2-CG 4.4Å; F163-E167 HydrophobicContact CZ-CG 4.03Å; F163-E167 PolarHBondContact O-N 3.49Å
164V98.1Very high97.7Very high0 Ų032.1 Ų32.10%016%0.162CC..Hα-helixtrans-60.4-49.6179.7174.60000111.7F91 L106 A110 L160 L161 S166 E167 I168F91-V164 HydrophobicContact CE2-CG1 3.85Å; F91-V164 HydrophobicContact CZ-CG1 3.53Å; L106-V164 HydrophobicContact CD1-CG2 4.04Å; L106-V164 HydrophobicContact CD2-CG2 3.69Å; L106-V164 HydrophobicContact CG-CG2 3.97Å; A110-V164 HydrophobicContact CB-CG1 3.89Å; L160-V164 HydrophobicContact CD1-CG2 4.27Å; L160-V164 WeakPolarHBondContact O-CG2 3.2Å; L160-V164 PolarHBondContact O-N 3.39Å; L161-V164 PolarHBondContact O-N 2.91Å; V164-S166 PolarHBondContact O-N 3.01Å; V164-E167 PolarHBondContact O-N 3.1Å; V164-E167 VanDerWaalsContact O-N 3.09Å; V164-I168 HydrophobicContact CG1-CD1 3.99Å; V164-I168 HydrophobicContact CG1-CG1 4.39Å; V164-I168 VanDerWaalsContact O-CG1 3.31Å; V164-I168 WeakPolarHBondContact O-CG1 3.29Å; V164-I168 PolarHBondContact O-N 3.4Å
165I97.8Very high97.6Very high15 Ų1532.6 Ų32.68%0.07716%0.162CC..Hα-helixtrans-62.2-34.9177.8-71.8170.7000111.3F125 W130 K134 L161 F163 I168 K169F125-I165 HydrophobicContact CE1-CG2 4.18Å; F125-I165 HydrophobicContact CZ-CG2 4.03Å; W130-I165 HydrophobicContact CB-CG2 4.32Å; W130-I165 HydrophobicContact CE3-CG1 4.47Å; W130-I165 HydrophobicContact CE3-CG2 4.3Å; K134-I165 HydrophobicContact CB-CD1 3.5Å; K134-I165 HydrophobicContact CD-CD1 4.03Å; K134-I165 HydrophobicContact CG-CD1 3.74Å; L161-I165 VanDerWaalsContact O-CB 3.3Å; L161-I165 WeakPolarHBondContact O-CB 3.26Å; L161-I165 VanDerWaalsContact O-CG1 3.27Å; L161-I165 WeakPolarHBondContact O-CG1 3.48Å; L161-I165 PolarHBondContact O-N 3.17Å; F163-I165 PolarHBondContact O-N 3Å; I165-I168 PolarHBondContact O-N 3.38Å; I165-K169 WeakPolarHBondContact O-CB 3.42Å; I165-K169 PolarHBondContact O-N 2.89Å
166S97.7Very high97.3Very high42 Ų4229.8 Ų29.829%0.29415%0.15SC..Hα-helixtrans-61.9-44.2174.2-69.40000111.1R21 S162 F163 V164 K169 N170R21-S166 VanDerWaalsContact CZ-C 3.45Å; R21-S166 VanDerWaalsContact CZ-O 3.23Å; R21-S166 VanDerWaalsContact NH1-CB 3.32Å; R21-S166 PolarHBondContact NH1-O 3.23Å; R21-S166 VanDerWaalsContact NH1-O 3.08Å; R21-S166 PolarHBondContact NH2-O 3.21Å; S162-S166 WeakPolarHBondContact O-CB 3.39Å; S162-S166 PolarHBondContact O-N 3.49Å; S162-S166 PolarHBondContact O-OG 3.27Å; F163-S166 VanDerWaalsContact O-CB 3.28Å; F163-S166 WeakPolarHBondContact O-CB 3.26Å; F163-S166 PolarHBondContact O-N 3.48Å; F163-S166 VanDerWaalsContact O-N 3.16Å; V164-S166 PolarHBondContact O-N 3.01Å; S166-K169 WeakPolarHBondContact O-CB 3.48Å; S166-K169 PolarHBondContact O-N 3.44Å; S166-N170 PolarHBondContact O-N 2.95Å
167E97.8Very high97.1Very high0 Ų033.6 Ų33.60%017%0.171CC..Hα-helixtrans-64.7-43.7174.4-69.7-52116.700112.9S16 S19 R21 V107 A110 R111 F163 V164 K169 N170 S171S16-E167 VanDerWaalsContact CB-CD 3.45Å; S16-E167 VanDerWaalsContact CB-OE2 3.29Å; S16-E167 WeakPolarHBondContact CB-OE2 3.31Å; S16-E167 VanDerWaalsContact OG-CD 3.3Å; S16-E167 PolarHBondContact OG-OE2 2.85Å; S19-E167 WeakPolarHBondContact CB-OE1 3.33Å; S19-E167 PolarHBondContact OG-OE1 3.15Å; S19-E167 PolarHBondContact OG-OE2 2.86Å; R21-E167 IonicContact CZ-OE1 3.56Å; R21-E167 IonicContact NE-OE1 3.81Å; R21-E167 PolarHBondContact NE-OE1 2.76Å; R21-E167 IonicContact NH2-OE1 2.69Å; R21-E167 PolarHBondContact NH2-OE1 3.36Å; R21-E167 IonicContact NH2-OE2 3.48Å; V107-E167 HydrophobicContact CG1-CG 4.48Å; A110-E167 HydrophobicContact CB-CB 3.76Å; R111-E167 HydrophobicContact CG-CB 4.44Å; R111-E167 IonicContact NH1-OE2 3.36Å; F163-E167 HydrophobicContact CE1-CG 4.11Å; F163-E167 HydrophobicContact CE2-CG 4.4Å; F163-E167 HydrophobicContact CZ-CG 4.03Å; F163-E167 PolarHBondContact O-N 3.49Å; V164-E167 PolarHBondContact O-N 3.1Å; V164-E167 VanDerWaalsContact O-N 3.09Å; E167-K169 VanDerWaalsContact C-N 3.3Å; E167-K169 PolarHBondContact O-N 3.41Å; E167-N170 PolarHBondContact O-N 3.26Å; E167-S171 PolarHBondContact O-N 3.05Å; E167-S171 PolarHBondContact O-OG 3.5Å
168I97.3Very high96.8Very high3 Ų338.8 Ų38.82%0.01519%0.191CC..Hα-helixtrans-57.7-45.2173.2-59.7169.1000109.9F91 A110 I113 G114 F125 W130 V164 I165 N170 S171 F172F91-I168 HydrophobicContact CE2-CD1 4.37Å; F91-I168 HydrophobicContact CZ-CD1 4.16Å; A110-I168 HydrophobicContact CB-CG1 4.07Å; A110-I168 VanDerWaalsContact O-CG1 3.25Å; A110-I168 WeakPolarHBondContact O-CG1 3.28Å; I113-I168 HydrophobicContact CB-CG1 4.34Å; I113-I168 HydrophobicContact CG2-CD1 4.03Å; I113-I168 HydrophobicContact CG2-CG1 4.21Å; I113-I168 HydrophobicContact CG2-CG2 4.09Å; G114-I168 VanDerWaalsContact CA-CG2 3.45Å; G114-I168 WeakPolarHBondContact CA-O 3.47Å; F125-I168 HydrophobicContact CE2-CB 4.26Å; F125-I168 HydrophobicContact CE2-CG2 3.72Å; F125-I168 HydrophobicContact CZ-CB 4.43Å; F125-I168 HydrophobicContact CZ-CG2 4.29Å; W130-I168 HydrophobicContact CH2-CG2 3.7Å; W130-I168 HydrophobicContact CZ3-CD1 4.09Å; W130-I168 HydrophobicContact CZ3-CG2 3.82Å; V164-I168 HydrophobicContact CG1-CD1 3.99Å; V164-I168 HydrophobicContact CG1-CG1 4.39Å; V164-I168 VanDerWaalsContact O-CG1 3.31Å; V164-I168 WeakPolarHBondContact O-CG1 3.29Å; V164-I168 PolarHBondContact O-N 3.4Å; I165-I168 PolarHBondContact O-N 3.38Å; I168-N170 PolarHBondContact O-N 3.23Å; I168-S171 PolarHBondContact O-OG 2.92Å; I168-F172 WeakPolarHBondContact O-CB 3.5Å; I168-F172 PolarHBondContact O-N 3.13Å
169K97.4Very high96.4Very high98 Ų9839.6 Ų39.643%0.42619%0.192SC..Hα-helixtrans-59-50.1177.9-175.9177.8174.5-176.70111.6F125 I165 S166 E167 F172 M173F125-K169 HydrophobicContact CD1-CB 3.85Å; F125-K169 HydrophobicContact CD1-CD 3.95Å; F125-K169 HydrophobicContact CD1-CG 3.59Å; F125-K169 HydrophobicContact CD2-CB 4.25Å; F125-K169 HydrophobicContact CD2-CG 4.39Å; F125-K169 HydrophobicContact CE1-CB 3.43Å; F125-K169 VanDerWaalsContact CE1-CB 3.43Å; F125-K169 HydrophobicContact CE1-CD 4.02Å; F125-K169 HydrophobicContact CE1-CG 3.7Å; F125-K169 HydrophobicContact CE2-CB 3.87Å; F125-K169 HydrophobicContact CE2-CG 4.48Å; F125-K169 HydrophobicContact CG-CB 4.24Å; F125-K169 HydrophobicContact CG-CG 3.95Å; F125-K169 VanDerWaalsContact CZ-CA 3.44Å; F125-K169 HydrophobicContact CZ-CB 3.43Å; F125-K169 VanDerWaalsContact CZ-CB 3.43Å; F125-K169 HydrophobicContact CZ-CG 4.15Å; I165-K169 WeakPolarHBondContact O-CB 3.42Å; I165-K169 PolarHBondContact O-N 2.89Å; S166-K169 WeakPolarHBondContact O-CB 3.48Å; S166-K169 PolarHBondContact O-N 3.44Å; E167-K169 VanDerWaalsContact C-N 3.3Å; E167-K169 PolarHBondContact O-N 3.41Å; K169-F172 PolarHBondContact O-N 3.4Å; K169-M173 HydrophobicContact CG-CE 4.45Å; K169-M173 HydrophobicContact CG-CG 4.5Å; K169-M173 VanDerWaalsContact O-CG 3.32Å; K169-M173 WeakPolarHBondContact O-CG 3.38Å; K169-M173 PolarHBondContact O-N 3.29Å
170N97.7Very high95.9Very high34 Ų3441.9 Ų41.918%0.18221%0.207CC..Hα-helixtrans-61.9-48.1-176.1172.3-92.7000110.8R111 S166 E167 I168 M173 H174R111-N170 PolarHBondContact NH1-OD1 2.99Å; S166-N170 PolarHBondContact O-N 2.95Å; E167-N170 PolarHBondContact O-N 3.26Å; I168-N170 PolarHBondContact O-N 3.23Å; N170-M173 PolarHBondContact O-N 3.45Å; N170-H174 PolarHBondContact ND2-NE2 3.42Å; N170-H174 PolarHBondContact O-CD2 3.3Å; N170-H174 PolarHBondContact O-N 3.1Å; N170-H174 VanDerWaalsContact O-N 3.09Å; N170-H174 PolarHBondContact OD1-CD2 2.97Å
171S97.2Very high95.6Very high0 Ų052.1 Ų52.10%025%0.246CC..Hα-helixtrans-67.8-36.2179.169.70000112.8R111 G114 E167 I168 M173 H174 E175R111-S171 VanDerWaalsContact CA-OG 3.27Å; R111-S171 WeakPolarHBondContact CA-OG 3.16Å; R111-S171 VanDerWaalsContact O-CB 3.26Å; R111-S171 WeakPolarHBondContact O-CB 3.34Å; R111-S171 PolarHBondContact O-OG 2.69Å; G114-S171 WeakPolarHBondContact CA-OG 3.35Å; E167-S171 PolarHBondContact O-N 3.05Å; E167-S171 PolarHBondContact O-OG 3.5Å; I168-S171 PolarHBondContact O-OG 2.92Å; S171-M173 PolarHBondContact O-N 2.58Å; S171-H174 PolarHBondContact O-N 3.22Å; S171-E175 VanDerWaalsContact O-CB 3.29Å; S171-E175 WeakPolarHBondContact O-CB 3.45Å; S171-E175 PolarHBondContact O-N 2.97Å
172F96.1Very high94.9Very high8 Ų857 Ų574%0.03527%0.27CS..Hα-helixtrans-57.2-47.9172.4178.7-81.3000111.3G114 H117 V118 F125 I168 K169 E175 L176G114-F172 WeakPolarHBondContact O-CA 3.25Å; G114-F172 WeakPolarHBondContact O-CD2 3.22Å; H117-F172 HydrophobicContact CB-CD2 3.79Å; H117-F172 HydrophobicContact CB-CE2 4.04Å; V118-F172 HydrophobicContact CB-CD2 4.47Å; V118-F172 HydrophobicContact CB-CE2 4.37Å; V118-F172 HydrophobicContact CG2-CB 4.39Å; V118-F172 HydrophobicContact CG2-CD1 4.3Å; V118-F172 HydrophobicContact CG2-CD2 3.53Å; V118-F172 HydrophobicContact CG2-CE1 4.49Å; V118-F172 HydrophobicContact CG2-CE2 3.78Å; V118-F172 HydrophobicContact CG2-CG 3.82Å; V118-F172 HydrophobicContact CG2-CZ 4.25Å; V118-F172 WeakPolarHBondContact CG2-O 3.47Å; F125-F172 HydrophobicContact CB-CD1 3.89Å; F125-F172 HydrophobicContact CB-CE1 3.98Å; F125-F172 HydrophobicContact CB-CG 4.45Å; F125-F172 HydrophobicContact CD2-CB 3.87Å; F125-F172 HydrophobicContact CD2-CD1 4.07Å; F125-F172 HydrophobicContact CD2-CD2 4.24Å; F125-F172 AromaticContact CD2-CG 3.81Å; F125-F172 HydrophobicContact CD2-CG 3.81Å; F125-F172 HydrophobicContact CE2-CB 4.37Å; F125-F172 HydrophobicContact CG-CD1 4.44Å; I168-F172 WeakPolarHBondContact O-CB 3.5Å; I168-F172 PolarHBondContact O-N 3.13Å; K169-F172 PolarHBondContact O-N 3.4Å; F172-E175 PolarHBondContact O-N 3.49Å; F172-L176 HydrophobicContact CE1-CD2 4Å; F172-L176 VanDerWaalsContact O-CB 3.26Å; F172-L176 WeakPolarHBondContact O-CB 3.5Å; F172-L176 PolarHBondContact O-N 3.49Å
173M96Very high94.1Very high72 Ų7260.9 Ų60.936%0.35529%0.294SS..Hα-helixtrans-65.5-43.7-179.4-65.5-55.8-177.400111.9F125 K169 N170 S171 E175 L176 D177F125-M173 HydrophobicContact CB-CE 3.73Å; K169-M173 HydrophobicContact CG-CE 4.45Å; K169-M173 HydrophobicContact CG-CG 4.5Å; K169-M173 VanDerWaalsContact O-CG 3.32Å; K169-M173 WeakPolarHBondContact O-CG 3.38Å; K169-M173 PolarHBondContact O-N 3.29Å; N170-M173 PolarHBondContact O-N 3.45Å; S171-M173 PolarHBondContact O-N 2.58Å; M173-E175 VanDerWaalsContact C-N 3.33Å; M173-E175 PolarHBondContact O-N 3.41Å; M173-L176 PolarHBondContact O-N 3.41Å; M173-D177 PolarHBondContact O-N 3.16Å
174H96Very high93.1Very high103 Ų10369.6 Ų69.648%0.47733%0.332SS..Hα-helixtrans-61.2-41.9176-78.1-65.5000112.6N170 S171 D177 R178N170-H174 PolarHBondContact ND2-NE2 3.42Å; N170-H174 PolarHBondContact O-CD2 3.3Å; N170-H174 PolarHBondContact O-N 3.1Å; N170-H174 VanDerWaalsContact O-N 3.09Å; N170-H174 PolarHBondContact OD1-CD2 2.97Å; S171-H174 PolarHBondContact O-N 3.22Å; H174-D177 PolarHBondContact O-N 3.18Å; H174-R178 WeakPolarHBondContact O-CB 3.33Å; H174-R178 PolarHBondContact O-N 3.43Å
175E94.8Very high92.2Very high21 Ų2174.6 Ų74.610%0.09836%0.359CS..Hα-helixtrans-72.1-34179.4-179.566-178.900112E115 V118 Y119 S171 F172 M173 R178 K179E115-E175 HydrophobicContact CB-CB 4.28Å; E115-E175 HydrophobicContact CB-CG 4.11Å; E115-E175 HydrophobicContact CG-CB 4.07Å; E115-E175 HydrophobicContact CG-CG 4.35Å; V118-E175 HydrophobicContact CB-CG 4.01Å; V118-E175 HydrophobicContact CG1-CG 4.24Å; V118-E175 HydrophobicContact CG2-CB 3.85Å; V118-E175 HydrophobicContact CG2-CG 3.87Å; Y119-E175 HydrophobicContact CE2-CG 4.27Å; Y119-E175 WeakPolarHBondContact CE2-OE1 3.37Å; Y119-E175 PolarHBondContact OH-OE1 3.32Å; S171-E175 VanDerWaalsContact O-CB 3.29Å; S171-E175 WeakPolarHBondContact O-CB 3.45Å; S171-E175 PolarHBondContact O-N 2.97Å; F172-E175 PolarHBondContact O-N 3.49Å; M173-E175 VanDerWaalsContact C-N 3.33Å; M173-E175 PolarHBondContact O-N 3.41Å; E175-R178 PolarHBondContact O-N 2.95Å; E175-R178 IonicContact OE1-CZ 3.71Å; E175-R178 IonicContact OE1-NE 3.82Å; E175-R178 IonicContact OE1-NH2 2.76Å; E175-R178 PolarHBondContact OE1-NH2 3.5Å; E175-R178 IonicContact OE2-CZ 2.57Å; E175-R178 IonicContact OE2-NE 2.88Å; E175-R178 PolarHBondContact OE2-NE 3.18Å; E175-R178 IonicContact OE2-NH2 3.09Å; E175-R178 PolarHBondContact OE2-NH2 2.92Å; E175-K179 VanDerWaalsContact O-CB 3.26Å; E175-K179 WeakPolarHBondContact O-CB 3.41Å; E175-K179 PolarHBondContact O-N 3Å
176L93.1Very high91.2Very high55 Ų5582.8 Ų82.829%0.28840%0.397SS..Hα-helixtrans-62.9-46.8172.9-178.862.1000110.8V118 F172 M173 R178 K179 N180V118-L176 HydrophobicContact CG1-CB 4.3Å; V118-L176 HydrophobicContact CG1-CD1 4.14Å; V118-L176 HydrophobicContact CG2-CB 4.2Å; F172-L176 HydrophobicContact CE1-CD2 4Å; F172-L176 VanDerWaalsContact O-CB 3.26Å; F172-L176 WeakPolarHBondContact O-CB 3.5Å; F172-L176 PolarHBondContact O-N 3.49Å; M173-L176 PolarHBondContact O-N 3.41Å; L176-R178 VanDerWaalsContact C-N 3.33Å; L176-R178 PolarHBondContact O-N 3.03Å; L176-K179 PolarHBondContact O-N 3.42Å; L176-N180 WeakPolarHBondContact O-CB 3.45Å; L176-N180 PolarHBondContact O-N 3.37Å; L176-N180 PolarHBondContact O-ND2 3.3Å
177D93.5Very high90.4Very high81 Ų8187.9 Ų87.943%0.43342%0.42SS..Hα-helixtrans-61-42.4176.1-73.7-17.2000111.8M173 H174 R181M173-D177 PolarHBondContact O-N 3.16Å; H174-D177 PolarHBondContact O-N 3.18Å; D177-R181 WeakPolarHBondContact O-CG 3.42Å; D177-R181 PolarHBondContact O-N 3.4Å
178R92.8Very high89.6Confident110 Ų11090.7 Ų90.742%0.41543%0.433SS..Hα-helixtrans-62.2-49.8176.2-170.2-175.674.986.62.4111Y119 H174 E175 L176 N180 R181 M182Y119-R178 PolarHBondContact OH-NH2 3.13Å; H174-R178 WeakPolarHBondContact O-CB 3.33Å; H174-R178 PolarHBondContact O-N 3.43Å; E175-R178 PolarHBondContact O-N 2.95Å; E175-R178 IonicContact OE1-CZ 3.71Å; E175-R178 IonicContact OE1-NE 3.82Å; E175-R178 IonicContact OE1-NH2 2.76Å; E175-R178 PolarHBondContact OE1-NH2 3.5Å; E175-R178 IonicContact OE2-CZ 2.57Å; E175-R178 IonicContact OE2-NE 2.88Å; E175-R178 PolarHBondContact OE2-NE 3.18Å; E175-R178 IonicContact OE2-NH2 3.09Å; E175-R178 PolarHBondContact OE2-NH2 2.92Å; L176-R178 VanDerWaalsContact C-N 3.33Å; L176-R178 PolarHBondContact O-N 3.03Å; R178-N180 VanDerWaalsContact C-N 3.33Å; R178-N180 PolarHBondContact O-N 3.29Å; R178-R181 PolarHBondContact O-N 2.99Å; R178-R181 VanDerWaalsContact O-N 3.1Å; R178-M182 HydrophobicContact CG-SD 4.38Å; R178-M182 PolarHBondContact NH1-SD 2.98Å; R178-M182 WeakPolarHBondContact O-CG 3.47Å; R178-M182 PolarHBondContact O-N 3.17Å
179K88.5Confident89Confident67 Ų6792.5 Ų92.529%0.29145%0.446SS..Hα-helixtrans-61.5-39.6-179.5-178-179.8176.3-179.80112.1V118 E175 L176 R181 M182V118-K179 HydrophobicContact CG1-CB 4.32Å; V118-K179 HydrophobicContact CG1-CD 3.53Å; V118-K179 PolarHBondContact O-NZ 3.31Å; E175-K179 VanDerWaalsContact O-CB 3.26Å; E175-K179 WeakPolarHBondContact O-CB 3.41Å; E175-K179 PolarHBondContact O-N 3Å; L176-K179 PolarHBondContact O-N 3.42Å; K179-R181 PolarHBondContact O-N 3.41Å; K179-M182 PolarHBondContact O-N 3.31Å; K179-M182 VanDerWaalsContact O-N 3.1Å
180N88.7Confident88.4Confident118 Ų11891.5 Ų91.563%0.63144%0.444SS*.Hα-helixtrans-65.6-18.7177.8-72.7-20.1000113.3L176 R178L176-N180 WeakPolarHBondContact O-CB 3.45Å; L176-N180 PolarHBondContact O-N 3.37Å; L176-N180 PolarHBondContact O-ND2 3.3Å; R178-N180 VanDerWaalsContact C-N 3.33Å; R178-N180 PolarHBondContact O-N 3.29Å
181R91.6Very high87.8Confident214 Ų21494 Ų9481%0.80846%0.455SS*.THydrogen-bonded Turntrans-94.8-6.4175.7-63.6172.8-166.6-1693.7113.4D177 R178 K179D177-R181 WeakPolarHBondContact O-CG 3.42Å; D177-R181 PolarHBondContact O-N 3.4Å; R178-R181 PolarHBondContact O-N 2.99Å; R178-R181 VanDerWaalsContact O-N 3.1Å; K179-R181 PolarHBondContact O-N 3.41Å
182M84.8Confident87.3Confident102 Ų102100 Ų10050%0.50248%0.483SS..SBendtrans-103.2152.8-178.6-70.3-172.473.900111.4R178 K179R178-M182 HydrophobicContact CG-SD 4.38Å; R178-M182 PolarHBondContact NH1-SD 2.98Å; R178-M182 WeakPolarHBondContact O-CG 3.47Å; R178-M182 PolarHBondContact O-N 3.17Å; K179-M182 PolarHBondContact O-N 3.31Å; K179-M182 VanDerWaalsContact O-N 3.1Å
183P80.1Confident86.8Confident121 Ų12199.9 Ų99.979%0.78648%0.484SS*.PPolyproline II helixtrans-55147.3168.5-22.233000110.8D185P183-D185 PolarHBondContact O-N 3.15Å
184K77.6Confident86.4Confident198 Ų19899.9 Ų99.986%0.86148%0.482SS*.PPolyproline II helixtrans-62.9128.5173.1-72-179.5-179172.50108.8E186K184-E186 PolarHBondContact O-N 3.26Å
185D79Confident86.2Confident105 Ų105100.2 Ų100.256%0.56148%0.483SS*.  trans-75.5104.8168.6-177.20.9000108.8P183 N187 F188P183-D185 PolarHBondContact O-N 3.15Å; D185-N187 PolarHBondContact O-N 3.26Å; D185-N187 PolarHBondContact OD1-N 3.09Å; D185-F188 HydrophobicContact CB-CB 4.13Å; D185-F188 WeakPolarHBondContact O-CB 3.43Å; D185-F188 PolarHBondContact O-N 3.23Å; D185-F188 PolarHBondContact OD1-N 2.98Å
186E77.9Confident85.9Confident187 Ų187104.9 Ų104.987%0.87450%0.503SS*.THydrogen-bonded Turntrans-68.9-22.6178.7-64.8-170.3166.600112.4K184 F188K184-E186 PolarHBondContact O-N 3.26Å; E186-F188 VanDerWaalsContact C-N 3.35Å
187N80.3Confident85.8Confident148 Ų148103.3 Ų103.379%0.79150%0.497SS*.THydrogen-bonded Turntrans-92.46.6-179.7-66.6-33.2000112.9D185 S189D185-N187 PolarHBondContact O-N 3.26Å; D185-N187 PolarHBondContact OD1-N 3.09Å; N187-S189 PolarHBondContact O-N 2.96Å
188F81.2Confident85.8Confident60 Ų60101.4 Ų101.426%0.26349%0.486SS..  trans-67.3115.5-176.7176.9-94.9000112.4Y119 D185 E186 L190 A193Y119-F188 AromaticContact CD1-CD2 3.98Å; Y119-F188 HydrophobicContact CD1-CD2 3.98Å; Y119-F188 AromaticContact CD1-CE2 3.45Å; Y119-F188 HydrophobicContact CD1-CE2 3.45Å; Y119-F188 VanDerWaalsContact CD1-CE2 3.45Å; Y119-F188 AromaticContact CD1-CZ 3.9Å; Y119-F188 HydrophobicContact CD1-CZ 3.9Å; Y119-F188 HydrophobicContact CE1-CE2 4.3Å; Y119-F188 AromaticContact CG-CE2 3.95Å; Y119-F188 HydrophobicContact CG-CE2 3.95Å; Y119-F188 HydrophobicContact CG-CZ 4.1Å; D185-F188 HydrophobicContact CB-CB 4.13Å; D185-F188 WeakPolarHBondContact O-CB 3.43Å; D185-F188 PolarHBondContact O-N 3.23Å; D185-F188 PolarHBondContact OD1-N 2.98Å; E186-F188 VanDerWaalsContact C-N 3.35Å; F188-L190 HydrophobicContact CE1-CB 4.33Å; F188-L190 HydrophobicContact CE1-CD1 4.16Å; F188-L190 HydrophobicContact CZ-CD1 4.43Å; F188-A193 HydrophobicContact CE2-CB 3.83Å; F188-A193 HydrophobicContact CZ-CB 3.53Å
189S85Confident85.8Confident40 Ų40100.5 Ų100.528%0.2849%0.487SS..  trans-95122.1170.8175.50000112N187 Q191 E192 A193N187-S189 PolarHBondContact O-N 2.96Å; S189-Q191 VanDerWaalsContact C-N 3.26Å; S189-Q191 PolarHBondContact O-N 2.96Å; S189-Q191 PolarHBondContact OG-N 3.11Å; S189-E192 WeakPolarHBondContact CB-OE2 3.14Å; S189-E192 PolarHBondContact O-N 3.31Å; S189-E192 PolarHBondContact OG-N 3.34Å; S189-A193 PolarHBondContact O-N 3.43Å; S189-A193 VanDerWaalsContact O-N 3.13Å
190L84.3Confident86Confident77 Ų7799.5 Ų99.540%0.40349%0.485SS..Hα-helixtrans-63.9-35174.2-171.263.2000111.9F120 F188 A193 K194F120-L190 HydrophobicContact CD1-CD1 3.51Å; F120-L190 HydrophobicContact CD1-CG 4.42Å; F120-L190 HydrophobicContact CE1-CD1 3.96Å; F188-L190 HydrophobicContact CE1-CB 4.33Å; F188-L190 HydrophobicContact CE1-CD1 4.16Å; F188-L190 HydrophobicContact CZ-CD1 4.43Å; L190-A193 PolarHBondContact O-N 3.17Å; L190-K194 WeakPolarHBondContact O-CG 3.29Å; L190-K194 PolarHBondContact O-N 3.21Å
191Q86.2Confident86.2Confident86 Ų8694.7 Ų94.740%0.40246%0.459SS..Hα-helixtrans-68-46.5-179.2-176.459.320.800110.7S189 A193 K194 E195S189-Q191 VanDerWaalsContact C-N 3.26Å; S189-Q191 PolarHBondContact O-N 2.96Å; S189-Q191 PolarHBondContact OG-N 3.11Å; Q191-A193 PolarHBondContact O-N 2.84Å; Q191-K194 WeakPolarHBondContact O-CB 3.22Å; Q191-K194 PolarHBondContact O-N 3.15Å; Q191-K194 VanDerWaalsContact O-N 3.08Å; Q191-E195 WeakPolarHBondContact CG-OE1 3.32Å; Q191-E195 PolarHBondContact NE2-OE1 3.1Å; Q191-E195 WeakPolarHBondContact O-CG 3.4Å; Q191-E195 PolarHBondContact O-N 3.1Å
192E86.1Confident86.4Confident126 Ų12689 Ų8959%0.58944%0.44SS*.Hα-helixtrans-59.9-38174.4-67.6176.4169.200111.4S189 E195 K196S189-E192 WeakPolarHBondContact CB-OE2 3.14Å; S189-E192 PolarHBondContact O-N 3.31Å; S189-E192 PolarHBondContact OG-N 3.34Å; E192-E195 PolarHBondContact O-N 3.38Å; E192-K196 WeakPolarHBondContact O-CB 3.14Å; E192-K196 PolarHBondContact O-N 3.43Å
193A86.2Confident86.9Confident6 Ų688 Ų885%0.0544%0.436CS..Hα-helixtrans-65-38.5175.600000112.8F188 S189 L190 Q191 S197F188-A193 HydrophobicContact CE2-CB 3.83Å; F188-A193 HydrophobicContact CZ-CB 3.53Å; S189-A193 PolarHBondContact O-N 3.43Å; S189-A193 VanDerWaalsContact O-N 3.13Å; L190-A193 PolarHBondContact O-N 3.17Å; Q191-A193 PolarHBondContact O-N 2.84Å; A193-S197 WeakPolarHBondContact O-CB 3.4Å; A193-S197 PolarHBondContact O-N 3.42Å; A193-S197 PolarHBondContact O-OG 3.46Å
194K87.6Confident87.5Confident72 Ų7282.3 Ų82.331%0.31340%0.399SS..Hα-helixtrans-64.3-50.8173.5-72.2-179.6179.51790111.1F120 L190 Q191 K196 S197 M198F120-K194 HydrophobicContact CD1-CG 4.5Å; F120-K194 HydrophobicContact CE1-CG 3.54Å; F120-K194 HydrophobicContact CZ-CG 4.18Å; L190-K194 WeakPolarHBondContact O-CG 3.29Å; L190-K194 PolarHBondContact O-N 3.21Å; Q191-K194 WeakPolarHBondContact O-CB 3.22Å; Q191-K194 PolarHBondContact O-N 3.15Å; Q191-K194 VanDerWaalsContact O-N 3.08Å; K194-K196 PolarHBondContact O-N 3.23Å; K194-S197 WeakPolarHBondContact O-CB 3.24Å; K194-S197 PolarHBondContact O-N 2.93Å; K194-S197 VanDerWaalsContact O-N 3.16Å; K194-M198 PolarHBondContact O-N 3.3Å
195E90.1Very high88.3Confident110 Ų11075 Ų7551%0.51437%0.367SS..Hα-helixtrans-60.2-46.5-178.9-72.8170.7-170.600111.4Q191 E192 S197 M198 Q199Q191-E195 WeakPolarHBondContact CG-OE1 3.32Å; Q191-E195 PolarHBondContact NE2-OE1 3.1Å; Q191-E195 WeakPolarHBondContact O-CG 3.4Å; Q191-E195 PolarHBondContact O-N 3.1Å; E192-E195 PolarHBondContact O-N 3.38Å; E195-S197 VanDerWaalsContact C-N 3.32Å; E195-S197 PolarHBondContact O-N 3.34Å; E195-M198 PolarHBondContact O-N 3.49Å; E195-Q199 WeakPolarHBondContact O-CB 3.41Å; E195-Q199 PolarHBondContact O-N 3.11Å
196K90Very high89Confident119 Ų11973.4 Ų73.452%0.51736%0.355SS..Hα-helixtrans-61.1-40.3175.6-172168.7-172170.80112.1E192 K194 L200E192-K196 WeakPolarHBondContact O-CB 3.14Å; E192-K196 PolarHBondContact O-N 3.43Å; K194-K196 PolarHBondContact O-N 3.23Å; K196-L200 HydrophobicContact CG-CD1 4.29Å; K196-L200 VanDerWaalsContact O-CB 3.3Å; K196-L200 WeakPolarHBondContact O-CB 3.41Å; K196-L200 WeakPolarHBondContact O-CG 3.36Å; K196-L200 PolarHBondContact O-N 2.95Å
197S90.3Very high89.8Confident23 Ų2368 Ų6816%0.16133%0.327CS..Hα-helixtrans-64.7-43.6177-59.40000111.5R116 A193 K194 E195 L201R116-S197 WeakPolarHBondContact CD-OG 3.34Å; A193-S197 WeakPolarHBondContact O-CB 3.4Å; A193-S197 PolarHBondContact O-N 3.42Å; A193-S197 PolarHBondContact O-OG 3.46Å; K194-S197 WeakPolarHBondContact O-CB 3.24Å; K194-S197 PolarHBondContact O-N 2.93Å; K194-S197 VanDerWaalsContact O-N 3.16Å; E195-S197 VanDerWaalsContact C-N 3.32Å; E195-S197 PolarHBondContact O-N 3.34Å; S197-L201 PolarHBondContact O-N 3.09Å
198M92.6Very high90.3Very high41 Ų4160.9 Ų60.920%0.20229%0.29CS..Hα-helixtrans-67.2-42.2177.9-173.960.4-173.100111.9K86 L90 K194 E195 L200 L201 K202K86-M198 HydrophobicContact CB-CE 4.29Å; L90-M198 HydrophobicContact CD2-CE 3.95Å; L90-M198 HydrophobicContact CD2-SD 4.46Å; K194-M198 PolarHBondContact O-N 3.3Å; E195-M198 PolarHBondContact O-N 3.49Å; M198-L200 VanDerWaalsContact C-N 3.33Å; M198-L200 PolarHBondContact O-N 2.92Å; M198-L201 PolarHBondContact O-N 3.24Å; M198-K202 HydrophobicContact CE-CG 4.37Å; M198-K202 WeakPolarHBondContact O-CG 3.48Å; M198-K202 PolarHBondContact O-N 2.92Å
199Q94.1Very high90.8Very high90 Ų9060.9 Ų60.942%0.42129%0.29SS..Hα-helixtrans-61-44.4177.8-173.256.442.200111.3E195 L201 K202 D203E195-Q199 WeakPolarHBondContact O-CB 3.41Å; E195-Q199 PolarHBondContact O-N 3.11Å; Q199-L201 VanDerWaalsContact C-N 3.33Å; Q199-L201 PolarHBondContact O-N 2.92Å; Q199-K202 WeakPolarHBondContact O-CA 3.21Å; Q199-K202 WeakPolarHBondContact O-CB 3.43Å; Q199-K202 PolarHBondContact O-N 2.69Å; Q199-D203 PolarHBondContact NE2-OD1 3.42Å; Q199-D203 PolarHBondContact O-N 3.31Å
200L92.6Very high91.1Very high47 Ų4767 Ų6725%0.24631%0.307CS..Hα-helixtrans-59-40.3176.6-81.3175.3000113.2K196 M198 D203 D204K196-L200 HydrophobicContact CG-CD1 4.29Å; K196-L200 VanDerWaalsContact O-CB 3.3Å; K196-L200 WeakPolarHBondContact O-CB 3.41Å; K196-L200 WeakPolarHBondContact O-CG 3.36Å; K196-L200 PolarHBondContact O-N 2.95Å; M198-L200 VanDerWaalsContact C-N 3.33Å; M198-L200 PolarHBondContact O-N 2.92Å; L200-D203 PolarHBondContact O-N 2.8Å; L200-D204 PolarHBondContact O-N 3.09Å; L200-D204 VanDerWaalsContact O-N 3.07Å
201L92.6Very high91.2Very high17 Ų1765.7 Ų65.79%0.08930%0.3CS..Hα-helixtrans-65.9-38.4173.8-70174.4000111.9L90 I94 I109 I113 S197 M198 Q199 D203 D204 W205L90-L201 HydrophobicContact CD2-CB 3.54Å; L90-L201 HydrophobicContact CG-CB 4.11Å; I94-L201 HydrophobicContact CD1-CB 4.34Å; I94-L201 HydrophobicContact CD1-CD2 3.88Å; I109-L201 HydrophobicContact CG2-CD2 4.45Å; I113-L201 HydrophobicContact CD1-CD2 4.15Å; I113-L201 HydrophobicContact CG1-CD2 4.43Å; S197-L201 PolarHBondContact O-N 3.09Å; M198-L201 PolarHBondContact O-N 3.24Å; Q199-L201 VanDerWaalsContact C-N 3.33Å; Q199-L201 PolarHBondContact O-N 2.92Å; L201-D203 VanDerWaalsContact C-N 3.35Å; L201-D204 PolarHBondContact O-N 3.47Å; L201-W205 WeakPolarHBondContact O-CB 3.45Å; L201-W205 PolarHBondContact O-N 3.43Å
202K95Very high91.2Very high94 Ų9464.6 Ų64.641%0.40930%0.296SS..Hα-helixtrans-63.5-42.6176-69172.7-178.8172.80111.1L90 M198 Q199 W205 E206L90-K202 HydrophobicContact CD2-CG 4.06Å; M198-K202 HydrophobicContact CE-CG 4.37Å; M198-K202 WeakPolarHBondContact O-CG 3.48Å; M198-K202 PolarHBondContact O-N 2.92Å; Q199-K202 WeakPolarHBondContact O-CA 3.21Å; Q199-K202 WeakPolarHBondContact O-CB 3.43Å; Q199-K202 PolarHBondContact O-N 2.69Å; K202-W205 PolarHBondContact O-N 3Å; K202-E206 PolarHBondContact O-N 3.13Å
203D95.3Very high90.6Very high80 Ų8066.1 Ų66.143%0.42830%0.297SS..Hα-helixtrans-63.9-43.1179.3-62.6-20.8000111.3Q199 L200 L201 W205 E206 Y207Q199-D203 PolarHBondContact NE2-OD1 3.42Å; Q199-D203 PolarHBondContact O-N 3.31Å; L200-D203 PolarHBondContact O-N 2.8Å; L201-D203 VanDerWaalsContact C-N 3.35Å; D203-W205 VanDerWaalsContact C-N 3.34Å; D203-W205 PolarHBondContact O-N 3.45Å; D203-E206 PolarHBondContact O-N 3.25Å; D203-Y207 PolarHBondContact O-N 3.1Å
204D93.6Very high89.6Confident3 Ų369.3 Ų69.32%0.01632%0.315CS..Hα-helixtrans-62.1-42.6173.5-73.2-42.6000111.8I94 R105 I109 R112 L200 L201 Y207 F208I94-D204 HydrophobicContact CD1-CB 4.09Å; R105-D204 IonicContact CZ-OD1 2.87Å; R105-D204 IonicContact NE-OD1 3.57Å; R105-D204 PolarHBondContact NE-OD1 3.3Å; R105-D204 IonicContact NH2-OD1 2.89Å; R105-D204 PolarHBondContact NH2-OD1 3.22Å; I109-D204 HydrophobicContact CD1-CB 3.78Å; I109-D204 HydrophobicContact CG1-CB 4.45Å; I109-D204 WeakPolarHBondContact CG1-OD2 3.48Å; R112-D204 IonicContact CZ-OD2 2.78Å; R112-D204 IonicContact NH1-OD1 3.62Å; R112-D204 PolarHBondContact NH1-OD1 3.22Å; R112-D204 IonicContact NH1-OD2 3.83Å; R112-D204 PolarHBondContact NH1-OD2 3.34Å; R112-D204 IonicContact NH2-OD2 2.76Å; R112-D204 PolarHBondContact NH2-OD2 3.49Å; L200-D204 PolarHBondContact O-N 3.09Å; L200-D204 VanDerWaalsContact O-N 3.07Å; L201-D204 PolarHBondContact O-N 3.47Å; D204-Y207 WeakPolarHBondContact O-CB 3.37Å; D204-Y207 PolarHBondContact O-N 3.25Å; D204-F208 HydrophobicContact CB-CE2 4.38Å; D204-F208 WeakPolarHBondContact O-CD2 3.47Å; D204-F208 PolarHBondContact O-N 3.35Å
205W93.9Very high88.2Confident45 Ų4569.5 Ų69.517%0.1732%0.32CS..Hα-helixtrans-63.3-42.6176.8173.4-117.3000112.5L90 R93 I94 A97 L201 K202 D203 Y207 F208 K209 I212L90-W205 HydrophobicContact CD1-CB 3.55Å; L90-W205 HydrophobicContact CD1-CD2 4.42Å; L90-W205 HydrophobicContact CD1-CG 3.66Å; L90-W205 HydrophobicContact CG-CB 4.49Å; R93-W205 VanDerWaalsContact CD-CE2 3.41Å; R93-W205 VanDerWaalsContact CD-CZ2 3.42Å; R93-W205 HydrophobicContact CG-CD2 4.25Å; R93-W205 HydrophobicContact CG-CE3 3.81Å; R93-W205 HydrophobicContact CG-CH2 3.79Å; R93-W205 HydrophobicContact CG-CZ2 4.21Å; R93-W205 HydrophobicContact CG-CZ3 3.57Å; I94-W205 HydrophobicContact CG1-CB 4.37Å; A97-W205 HydrophobicContact CB-CZ3 3.97Å; L201-W205 WeakPolarHBondContact O-CB 3.45Å; L201-W205 PolarHBondContact O-N 3.43Å; K202-W205 PolarHBondContact O-N 3Å; D203-W205 VanDerWaalsContact C-N 3.34Å; D203-W205 PolarHBondContact O-N 3.45Å; W205-Y207 VanDerWaalsContact C-N 3.27Å; W205-Y207 PolarHBondContact O-N 3.44Å; W205-F208 HydrophobicContact CE3-CB 4.15Å; W205-F208 HydrophobicContact CZ3-CB 4.23Å; W205-F208 PolarHBondContact O-N 3.21Å; W205-K209 HydrophobicContact CZ2-CB 4.17Å; W205-K209 HydrophobicContact CZ2-CD 4.46Å; W205-K209 HydrophobicContact CZ2-CG 4.41Å; W205-K209 VanDerWaalsContact O-CB 3.26Å; W205-K209 WeakPolarHBondContact O-CB 3.44Å; W205-K209 PolarHBondContact O-N 3.01Å; W205-I212 HydrophobicContact CH2-CD1 4.29Å; W205-I212 HydrophobicContact CZ3-CD1 4.4Å
206E94.7Very high86.6Confident70 Ų7068.9 Ų68.933%0.32733%0.328SS..Hα-helixtrans-64.4-34.1176.1-73.7-59.5131.800111.8K202 D203 K209 R210K202-E206 PolarHBondContact O-N 3.13Å; D203-E206 PolarHBondContact O-N 3.25Å; E206-K209 WeakPolarHBondContact OE1-CD 3.43Å; E206-K209 IonicContact OE1-NZ 3Å; E206-K209 PolarHBondContact OE1-NZ 3.26Å; E206-K209 IonicContact OE2-NZ 2.75Å; E206-K209 PolarHBondContact OE2-NZ 3.47Å; E206-R210 VanDerWaalsContact O-CG 3.24Å; E206-R210 WeakPolarHBondContact O-CG 3.5Å; E206-R210 PolarHBondContact O-N 3.03Å; E206-R210 VanDerWaalsContact O-N 3.08Å
207Y94.1Very high84.5Confident73 Ų7370.3 Ų70.329%0.28634%0.34SS..Hα-helixtrans-59.6-53.3168.8171.1-95.1000111.9D102 R105 D203 D204 W205 K209 R210 N211D102-Y207 HydrophobicContact CB-CE1 4.08Å; D102-Y207 WeakPolarHBondContact OD2-CE1 3.45Å; D102-Y207 PolarHBondContact OD2-OH 3.17Å; R105-Y207 VanDerWaalsContact NH1-CD1 3.29Å; R105-Y207 VanDerWaalsContact NH1-CZ 3.33Å; D203-Y207 PolarHBondContact O-N 3.1Å; D204-Y207 WeakPolarHBondContact O-CB 3.37Å; D204-Y207 PolarHBondContact O-N 3.25Å; W205-Y207 VanDerWaalsContact C-N 3.27Å; W205-Y207 PolarHBondContact O-N 3.44Å; Y207-K209 VanDerWaalsContact C-N 3.32Å; Y207-K209 PolarHBondContact O-N 2.93Å; Y207-R210 PolarHBondContact O-N 3.19Å; Y207-N211 WeakPolarHBondContact CD2-ND2 3.45Å; Y207-N211 VanDerWaalsContact CE2-ND2 3.31Å; Y207-N211 WeakPolarHBondContact CE2-ND2 3.3Å; Y207-N211 PolarHBondContact O-N 3.28Å; Y207-N211 PolarHBondContact O-ND2 3.3Å
208F91.5Very high82.2Confident0 Ų076.1 Ų76.10%037%0.374CS..Hα-helixtrans-60.4-43.6-179.9-73.2-65000111.8I94 A97 V101 D102 R105 I109 D204 W205 R210 N211 I212I94-F208 HydrophobicContact CB-CE2 4.49Å; I94-F208 HydrophobicContact CG1-CD2 4.26Å; I94-F208 HydrophobicContact CG1-CE2 4.42Å; I94-F208 HydrophobicContact CG2-CD2 4.31Å; I94-F208 HydrophobicContact CG2-CE2 3.71Å; I94-F208 HydrophobicContact CG2-CZ 4.45Å; A97-F208 HydrophobicContact CB-CB 4.07Å; A97-F208 HydrophobicContact CB-CD1 4.36Å; A97-F208 HydrophobicContact CB-CG 4.18Å; V101-F208 HydrophobicContact CB-CD1 3.83Å; V101-F208 HydrophobicContact CB-CE1 4.33Å; V101-F208 HydrophobicContact CG1-CD1 3.77Å; V101-F208 HydrophobicContact CG1-CE1 4.41Å; V101-F208 HydrophobicContact CG2-CD1 4.47Å; D102-F208 HydrophobicContact CB-CE1 3.99Å; R105-F208 HydrophobicContact CB-CZ 4.36Å; R105-F208 HydrophobicContact CG-CZ 4.26Å; I109-F208 HydrophobicContact CD1-CE2 3.55Å; I109-F208 HydrophobicContact CD1-CZ 3.9Å; D204-F208 HydrophobicContact CB-CE2 4.38Å; D204-F208 WeakPolarHBondContact O-CD2 3.47Å; D204-F208 PolarHBondContact O-N 3.35Å; W205-F208 HydrophobicContact CE3-CB 4.15Å; W205-F208 HydrophobicContact CZ3-CB 4.23Å; W205-F208 PolarHBondContact O-N 3.21Å; F208-R210 VanDerWaalsContact C-N 3.35Å; F208-R210 PolarHBondContact O-N 3.42Å; F208-N211 PolarHBondContact O-N 3.33Å; F208-I212 VanDerWaalsContact O-CG1 3.25Å; F208-I212 WeakPolarHBondContact O-CG1 3.38Å; F208-I212 PolarHBondContact O-N 3.34Å
209K90.2Very high81.6Confident60 Ų6077.9 Ų77.926%0.26138%0.383SS..Hα-helixtrans-60.7-40179.7-177.5-176.5171.1-163.10112.9W205 E206 Y207 R213W205-K209 HydrophobicContact CZ2-CB 4.17Å; W205-K209 HydrophobicContact CZ2-CD 4.46Å; W205-K209 HydrophobicContact CZ2-CG 4.41Å; W205-K209 VanDerWaalsContact O-CB 3.26Å; W205-K209 WeakPolarHBondContact O-CB 3.44Å; W205-K209 PolarHBondContact O-N 3.01Å; E206-K209 WeakPolarHBondContact OE1-CD 3.43Å; E206-K209 IonicContact OE1-NZ 3Å; E206-K209 PolarHBondContact OE1-NZ 3.26Å; E206-K209 IonicContact OE2-NZ 2.75Å; E206-K209 PolarHBondContact OE2-NZ 3.47Å; Y207-K209 VanDerWaalsContact C-N 3.32Å; Y207-K209 PolarHBondContact O-N 2.93Å; K209-R213 WeakPolarHBondContact O-CG 3.36Å; K209-R213 PolarHBondContact O-N 2.76Å
210R91.3Very high81Confident169 Ų16977.2 Ų77.264%0.63838%0.381SS*.Hα-helixtrans-63.2-45.1174.8-72.4170.8-168.1-178.53.9111E206 Y207 F208 R213 T214E206-R210 VanDerWaalsContact O-CG 3.24Å; E206-R210 WeakPolarHBondContact O-CG 3.5Å; E206-R210 PolarHBondContact O-N 3.03Å; E206-R210 VanDerWaalsContact O-N 3.08Å; Y207-R210 PolarHBondContact O-N 3.19Å; F208-R210 VanDerWaalsContact C-N 3.35Å; F208-R210 PolarHBondContact O-N 3.42Å; R210-R213 PolarHBondContact O-N 3.28Å; R210-T214 PolarHBondContact O-N 3.03Å; R210-T214 VanDerWaalsContact O-N 3.17Å
211N88.1Confident80.3Confident48 Ų4878.9 Ų78.926%0.25739%0.388SS..Hα-helixtrans-74.6-26.5-177.9-70.9-73.2000113.8V101 Y207 F208 T214 N215V101-N211 HydrophobicContact CG1-CB 3.43Å; V101-N211 VanDerWaalsContact CG1-CB 3.43Å; Y207-N211 WeakPolarHBondContact CD2-ND2 3.45Å; Y207-N211 VanDerWaalsContact CE2-ND2 3.31Å; Y207-N211 WeakPolarHBondContact CE2-ND2 3.3Å; Y207-N211 PolarHBondContact O-N 3.28Å; Y207-N211 PolarHBondContact O-ND2 3.3Å; F208-N211 PolarHBondContact O-N 3.33Å; N211-T214 VanDerWaalsContact CA-OG1 3.32Å; N211-T214 WeakPolarHBondContact CA-OG1 3.43Å; N211-T214 PolarHBondContact O-OG1 2.99Å; N211-N215 PolarHBondContact O-N 2.57Å; N211-N215 PolarHBondContact O-ND2 2.98Å
212I85.1Confident79.6Confident63 Ų6382.5 Ų82.532%0.32341%0.406SS..Hα-helixtrans-63.3-44.9169.3-70.1164.1000110.1A97 V101 W205 F208 N215 S216A97-I212 HydrophobicContact CB-CD1 4.15Å; V101-I212 HydrophobicContact CG2-CD1 4.31Å; V101-I212 HydrophobicContact CG2-CG1 3.54Å; W205-I212 HydrophobicContact CH2-CD1 4.29Å; W205-I212 HydrophobicContact CZ3-CD1 4.4Å; F208-I212 VanDerWaalsContact O-CG1 3.25Å; F208-I212 WeakPolarHBondContact O-CG1 3.38Å; F208-I212 PolarHBondContact O-N 3.34Å; I212-N215 PolarHBondContact O-N 2.92Å; I212-S216 PolarHBondContact O-N 3.32Å; I212-S216 PolarHBondContact O-OG 2.91Å
213R73.9Confident78.7Confident159 Ų15981.8 Ų81.860%0.641%0.405SS*.Hα-helixtrans-65.3-40.5-178.8-71.6174.4177.3-174.2-3.4112.1K209 R210 N215 S216 I217K209-R213 WeakPolarHBondContact O-CG 3.36Å; K209-R213 PolarHBondContact O-N 2.76Å; R210-R213 PolarHBondContact O-N 3.28Å; R213-N215 VanDerWaalsContact C-N 3.34Å; R213-S216 PolarHBondContact O-N 3.12Å; R213-I217 WeakPolarHBondContact O-CG1 3.47Å
214T64.1Low77.5Confident72 Ų7281.9 Ų81.944%0.44240%0.404SS..Hα-helixtrans-64.6-40.1177.351.70000111.7R210 N211 S216 I217R210-T214 PolarHBondContact O-N 3.03Å; R210-T214 VanDerWaalsContact O-N 3.17Å; N211-T214 VanDerWaalsContact CA-OG1 3.32Å; N211-T214 WeakPolarHBondContact CA-OG1 3.43Å; N211-T214 PolarHBondContact O-OG1 2.99Å; T214-S216 PolarHBondContact O-N 3.09Å; T214-I217 PolarHBondContact O-N 2.81Å
215N58.2Low76.4Confident76 Ų7687.6 Ų87.641%0.40643%0.432SS..Hα-helixtrans-69-17.2178.4-69.6-10.8000113.8N211 I212 R213N211-N215 PolarHBondContact O-N 2.57Å; N211-N215 PolarHBondContact O-ND2 2.98Å; I212-N215 PolarHBondContact O-N 2.92Å; R213-N215 VanDerWaalsContact C-N 3.34Å
216S57.3Low75.1Confident98 Ų9890.8 Ų90.869%0.68545%0.452SS*.THydrogen-bonded Turntrans-88.5-11.9175-58.80000113.9I212 R213 T214I212-S216 PolarHBondContact O-N 3.32Å; I212-S216 PolarHBondContact O-OG 2.91Å; R213-S216 PolarHBondContact O-N 3.12Å; T214-S216 PolarHBondContact O-N 3.09Å
217I45.8Very low73.4Confident149 Ų14992.6 Ų92.676%0.76446%0.462SS*.THydrogen-bonded Turntrans-96.3-22-177.4-64.5168.1000111.8R213 T214R213-I217 WeakPolarHBondContact O-CG1 3.47Å; T214-I217 PolarHBondContact O-N 2.81Å
218T41.2Very low71.5Confident144 Ų14494.4 Ų94.488%0.88348%0.478SS*.  trans-92.30177.551.20000113.4

Retrieved 218 of 218 residues in 180.2 ms (Link to these results)

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