A0A087X1D7_HUMAN Loading...

Gametogenetin-binding protein 2

May be involved in spermatogenesis.

AlphaFold DB , UniProt , Accession A0A087X1D7, Species HUMAN (Homo sapiens, Human), Gene GGNBP2, Length 158 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
1M69.6Low87.7Confident214 Ų21494 Ų94100%1.05451%0.509SS*.  0151.70-74.2-179.5173.700108.2P37M1-P37 WeakPolarHBondContact O-CD 3.33Å
2A84.6Confident87.3Confident41 Ų4195.7 Ų95.734%0.33951%0.511SS..  trans-65.5147.7176.800000110.9M34 E35 F36A2-M34 HydrophobicContact CB-CE 4.01Å; A2-E35 CarbonylContact C-O 3.26Å; A2-E35 WeakPolarHBondContact CA-O 3.5Å; A2-E35 WeakPolarHBondContact CB-O 3.19Å; A2-F36 HydrophobicContact CB-CD1 3.91Å; A2-F36 HydrophobicContact CB-CE1 4.16Å
3R91.8Very high86.7Confident158 Ų158102.8 Ų102.860%0.59654%0.539SS*.EExtended strand (participates in β ladder)trans-112.8137.7-178.8179.4177.564160.50.1110.1V5 M34 E35R3-V5 HydrophobicContact CG-CG1 4.39Å; R3-V5 PolarHBondContact O-N 3.19Å; R3-M34 CarbonylContact O-C 3.56Å; R3-M34 WeakPolarHBondContact O-CA 3.4Å; R3-E35 IonicContact CZ-OE2 3.59Å; R3-E35 PolarHBondContact N-O 2.74Å; R3-E35 IonicContact NE-OE2 3.61Å; R3-E35 IonicContact NH2-OE2 2.74Å; R3-E35 PolarHBondContact NH2-OE2 3.04Å; R3-E35 PolarHBondContact O-N 3.25Å
4L94.1Very high86.2Confident77 Ų77108.6 Ų108.640%0.40356%0.562SS.*EExtended strand (participates in β ladder)trans-70.2120.3168.1179.864.1000109.2A6 V7 M32 M34L4-A6 VanDerWaalsContact CD1-O 3.23Å; L4-A6 WeakPolarHBondContact CD1-O 3.42Å; L4-V7 HydrophobicContact CD1-CG2 4.22Å; L4-V7 HydrophobicContact CD2-CG2 4.07Å; L4-V7 HydrophobicContact CG-CG2 4.44Å; L4-M32 HydrophobicContact CD1-CB 3.74Å; L4-M32 HydrophobicContact CD1-CE 3.51Å; L4-M32 HydrophobicContact CD1-CG 4.19Å; L4-M32 HydrophobicContact CD2-CE 3.52Å; L4-M32 HydrophobicContact CG-CE 4.09Å; L4-M34 HydrophobicContact CB-SD 4.11Å; L4-M34 HydrophobicContact CD1-SD 3.98Å
5V94.6Very high86.1Confident51 Ų51105.2 Ų105.231%0.30954%0.541SS..EExtended strand (participates in β ladder)trans-112.9-23.1-178.1-66.50000113.6R3 Q21 V33 E35R3-V5 HydrophobicContact CG-CG1 4.39Å; R3-V5 PolarHBondContact O-N 3.19Å; V5-Q21 HydrophobicContact CG2-CG 4.32Å; V5-V33 HydrophobicContact CG2-CB 3.99Å; V5-V33 HydrophobicContact CG2-CG1 3.69Å; V5-V33 WeakPolarHBondContact CG2-O 3.42Å; V5-V33 PolarHBondContact N-O 3.48Å; V5-E35 HydrophobicContact CB-CB 4.47Å; V5-E35 HydrophobicContact CG1-CB 3.55Å; V5-E35 HydrophobicContact CG1-CG 4.35Å; V5-E35 HydrophobicContact CG2-CB 4.06Å
6A93.4Very high86.1Confident21 Ų21105.1 Ų105.117%0.17455%0.549CS..EExtended strand (participates in β ladder)trans-152.6160.5173.700000111.8L4 F15 V33L4-A6 VanDerWaalsContact CD1-O 3.23Å; L4-A6 WeakPolarHBondContact CD1-O 3.42Å; A6-F15 HydrophobicContact CB-CD2 3.99Å; A6-F15 HydrophobicContact CB-CE2 3.36Å; A6-F15 HydrophobicContact CB-CZ 3.84Å; A6-V33 HydrophobicContact CB-CB 3.96Å; A6-V33 HydrophobicContact CB-CG2 3.92Å; A6-V33 PolarHBondContact O-N 3.45Å
7V92.9Very high86.2Confident71 Ų71101.6 Ų101.643%0.4353%0.529SS..EExtended strand (participates in β ladder)trans-131.8117.9171.7-179.70000106.5L4 L30L4-V7 HydrophobicContact CD1-CG2 4.22Å; L4-V7 HydrophobicContact CD2-CG2 4.07Å; L4-V7 HydrophobicContact CG-CG2 4.44Å; V7-L30 HydrophobicContact CG1-CD1 3.39Å
8C90.7Very high86.3Confident23 Ų23103.1 Ų103.116%0.15553%0.533CS..EExtended strand (participates in β ladder)trans-108.5134.7-176.7-53.20000109.3E12 T31C8-E12 WeakPolarHBondContact CA-OE2 3.35Å; C8-T31 PolarHBondContact N-O 3.38Å; C8-T31 PolarHBondContact O-N 3.05Å
9R91.9Very high86.3Confident171 Ų171106.1 Ų106.165%0.64554%0.537SS*.EExtended strand (participates in β ladder)trans-110.8158.6177.5-65.7-178.4178.4170.80.8111.9G11 E12 T29 L30R9-G11 PolarHBondContact O-N 3.22Å; R9-E12 HydrophobicContact CB-CG 4.41Å; R9-E12 PolarHBondContact N-OE2 3.22Å; R9-E12 WeakPolarHBondContact O-CB 3.42Å; R9-E12 PolarHBondContact O-N 3.36Å; R9-T29 CarbonylContact C-O 3.57Å; R9-T29 VanDerWaalsContact CA-O 3.26Å; R9-T29 WeakPolarHBondContact CA-O 3.46Å; R9-L30 HydrophobicContact CG-CD1 4.45Å
10D83.5Confident86.3Confident130 Ų130101.9 Ų101.970%0.69551%0.514SS*.THydrogen-bonded Turntrans-55.8137.5175-166.521.9000111.8E12 T29D10-E12 VanDerWaalsContact C-N 3.33Å; D10-T29 HydrophobicContact CB-CG2 4.25Å; D10-T29 PolarHBondContact N-O 3.17Å
11G77.8Confident86.6Confident77 Ų7797.5 Ų97.579%0.79449%0.492SS*.THydrogen-bonded Turntrans81.2-0.8-175.800000116.1R9R9-G11 PolarHBondContact O-N 3.22Å
12E82.3Confident87.5Confident114 Ų11488.2 Ų88.253%0.53345%0.446SS..SBendtrans-82.3158.9169.3-64.1178.9165.900111.4C8 R9 D10C8-E12 WeakPolarHBondContact CA-OE2 3.35Å; R9-E12 HydrophobicContact CB-CG 4.41Å; R9-E12 PolarHBondContact N-OE2 3.22Å; R9-E12 WeakPolarHBondContact O-CB 3.42Å; R9-E12 PolarHBondContact O-N 3.36Å; D10-E12 VanDerWaalsContact C-N 3.33Å
13E79.4Confident87.7Confident189 Ų18986.7 Ų86.788%0.88343%0.433SS*.PPolyproline II helixtrans-60.1150.3175.4-71.6-175.4167.200111.7F15E13-F15 PolarHBondContact O-N 2.98Å
14E80.9Confident87.5Confident184 Ų18482.4 Ų82.486%0.8642%0.421SS*.PPolyproline II helixtrans-59.7125.6179.7-170.9171.2-15100110.7P16E14-P16 WeakPolarHBondContact O-CD 3.35Å
15F84.1Confident87Confident57 Ų5783.1 Ų83.125%0.2542%0.419CS..PPolyproline II helixtrans-70.3122.4-176.9-174.9-89.2000110.8A6 E13 F17 V33A6-F15 HydrophobicContact CB-CD2 3.99Å; A6-F15 HydrophobicContact CB-CE2 3.36Å; A6-F15 HydrophobicContact CB-CZ 3.84Å; E13-F15 PolarHBondContact O-N 2.98Å; F15-F17 AromaticContact CD1-CD1 3.89Å; F15-F17 HydrophobicContact CD1-CD1 3.89Å; F15-F17 HydrophobicContact CD1-CE1 4Å; F15-F17 HydrophobicContact CD1-CG 4.2Å; F15-F17 HydrophobicContact CD1-CZ 4.4Å; F15-F17 HydrophobicContact CE1-CD1 4.28Å; F15-F17 WeakPolarHBondContact O-CD2 3.21Å; F15-F17 PolarHBondContact O-N 3.36Å; F15-V33 HydrophobicContact CD1-CG1 4.27Å; F15-V33 HydrophobicContact CD1-CG2 3.82Å; F15-V33 HydrophobicContact CD2-CG2 4.35Å; F15-V33 HydrophobicContact CE1-CB 4.31Å; F15-V33 HydrophobicContact CE1-CG1 3.76Å; F15-V33 HydrophobicContact CE1-CG2 3.96Å; F15-V33 HydrophobicContact CE2-CG2 4.47Å; F15-V33 HydrophobicContact CG-CG2 4.02Å; F15-V33 HydrophobicContact CZ-CG1 4.25Å; F15-V33 HydrophobicContact CZ-CG2 4.29Å
16P86.8Confident86.6Confident103 Ų10385 Ų8567%0.66943%0.427SS*.  trans-76.695.4178.830.9-33.3000110E14 E18E14-P16 WeakPolarHBondContact O-CD 3.35Å; P16-E18 PolarHBondContact O-N 3.4Å
17F86.7Confident86.3Confident47 Ų4787.5 Ų87.521%0.20644%0.437CS..  trans-61.3126.2-179.9-64.2-81.1000111.9F15 Q21 P23 V33 N108F15-F17 AromaticContact CD1-CD1 3.89Å; F15-F17 HydrophobicContact CD1-CD1 3.89Å; F15-F17 HydrophobicContact CD1-CE1 4Å; F15-F17 HydrophobicContact CD1-CG 4.2Å; F15-F17 HydrophobicContact CD1-CZ 4.4Å; F15-F17 HydrophobicContact CE1-CD1 4.28Å; F15-F17 WeakPolarHBondContact O-CD2 3.21Å; F15-F17 PolarHBondContact O-N 3.36Å; F17-Q21 HydrophobicContact CD1-CB 4.4Å; F17-P23 HydrophobicContact CE1-CB 3.8Å; F17-P23 HydrophobicContact CE1-CG 4.08Å; F17-P23 HydrophobicContact CZ-CB 3.7Å; F17-P23 HydrophobicContact CZ-CG 3.95Å; F17-V33 HydrophobicContact CD1-CG1 4.12Å; F17-V33 HydrophobicContact CE1-CG1 4.08Å; F17-V33 HydrophobicContact CE1-CG2 4.04Å; F17-N108 WeakPolarHBondContact CD2-ND2 3.41Å
18E88Confident85.9Confident128 Ų12892.1 Ų92.160%0.59846%0.459SS*.  trans-84.5-179.6168.7-56.4-169.6156.400111.2P16 Q21P16-E18 PolarHBondContact O-N 3.4Å; E18-Q21 HydrophobicContact CB-CG 4.41Å; E18-Q21 PolarHBondContact O-N 3.1Å
19R85.8Confident85.8Confident159 Ų15994.7 Ų94.760%0.648%0.475SS*.THydrogen-bonded Turntrans-59.4147.9172.7-64.8172.7-174.3-152.614.9109.5Q21 P109 E112R19-Q21 PolarHBondContact O-N 3.39Å; R19-P109 HydrophobicContact CG-CG 4.21Å; R19-E112 VanDerWaalsContact CD-OE2 3.27Å; R19-E112 WeakPolarHBondContact CD-OE2 3.41Å; R19-E112 IonicContact CZ-OE2 3.74Å; R19-E112 IonicContact NE-OE2 3.3Å; R19-E112 IonicContact NH1-OE1 2.81Å; R19-E112 PolarHBondContact NH1-OE1 2.96Å; R19-E112 IonicContact NH1-OE2 3.55Å; R19-E112 PolarHBondContact NH1-OE2 3.18Å
20R88.1Confident85.7Confident22 Ų2288.8 Ų88.88%0.08346%0.456CS..THydrogen-bonded Turntrans63.47.8176-52-75.4-72.7-178.10.2114.6E35 F36 P37 A110 E112R20-E35 CarbonylContact O-C 3.59Å; R20-E35 WeakPolarHBondContact O-CA 3.27Å; R20-F36 HydrophobicContact CB-CB 4.26Å; R20-F36 WeakPolarHBondContact CB-O 3.45Å; R20-F36 WeakPolarHBondContact O-CD2 3.34Å; R20-F36 PolarHBondContact O-N 3.09Å; R20-P37 PolarHBondContact NH2-O 2.93Å; R20-A110 WeakPolarHBondContact CA-O 3.46Å; R20-E112 PolarHBondContact NH1-O 3.36Å
21Q90.9Very high86Confident10 Ų1083.8 Ų83.85%0.04743%0.43CS..EExtended strand (participates in β ladder)trans-99.9133.2175.5-67176-3.200110.5V5 F17 E18 R19 V33 M34 E35 A110V5-Q21 HydrophobicContact CG2-CG 4.32Å; F17-Q21 HydrophobicContact CD1-CB 4.4Å; E18-Q21 HydrophobicContact CB-CG 4.41Å; E18-Q21 PolarHBondContact O-N 3.1Å; R19-Q21 PolarHBondContact O-N 3.39Å; Q21-V33 HydrophobicContact CB-CG1 3.93Å; Q21-V33 HydrophobicContact CG-CG1 4.36Å; Q21-M34 CarbonylContact C-O 3.46Å; Q21-M34 VanDerWaalsContact CA-O 3.31Å; Q21-M34 WeakPolarHBondContact CA-O 3.5Å; Q21-E35 HydrophobicContact CG-CB 4.02Å; Q21-E35 HydrophobicContact CG-CG 4.08Å; Q21-E35 PolarHBondContact NE2-OE1 2.95Å; Q21-A110 WeakPolarHBondContact O-CB 3.22Å
22I89.4Confident86.8Confident20 Ų2082.5 Ų82.510%0.10340%0.404CS..EExtended strand (participates in β ladder)trans-124.2142.8175.260.5170.4000110.6M34 F36 L99 A110I22-M34 HydrophobicContact CG1-CB 3.96Å; I22-M34 PolarHBondContact N-O 3.21Å; I22-M34 PolarHBondContact O-N 3.04Å; I22-F36 HydrophobicContact CD1-CE2 3.76Å; I22-F36 HydrophobicContact CD1-CZ 3.51Å; I22-F36 HydrophobicContact CG1-CE2 4.01Å; I22-F36 HydrophobicContact CG1-CZ 4.19Å; I22-F36 HydrophobicContact CG2-CE2 3.76Å; I22-L99 HydrophobicContact CB-CD1 4.04Å; I22-L99 HydrophobicContact CD1-CD1 4.2Å; I22-L99 HydrophobicContact CD1-CD2 4.14Å; I22-L99 HydrophobicContact CG2-CD1 3.95Å; I22-A110 HydrophobicContact CG2-CB 3.38Å
23P88.8Confident87.2Confident9 Ų977.1 Ų77.16%0.05838%0.378CS..EExtended strand (participates in β ladder)trans-73.9138.4166.629.7-31.9000110.7F17 Y25 T31 M32F17-P23 HydrophobicContact CE1-CB 3.8Å; F17-P23 HydrophobicContact CE1-CG 4.08Å; F17-P23 HydrophobicContact CZ-CB 3.7Å; F17-P23 HydrophobicContact CZ-CG 3.95Å; P23-Y25 HydrophobicContact CB-CD2 4.21Å; P23-Y25 HydrophobicContact CB-CE2 3.54Å; P23-Y25 HydrophobicContact CG-CE2 3.61Å; P23-T31 HydrophobicContact CB-CG2 3.77Å; P23-M32 CarbonylContact C-O 3.56Å
24L87.3Confident87.8Confident68 Ų6870 Ų7036%0.35635%0.346SS..EExtended strand (participates in β ladder)trans-118.297.8167.7-178.270.2000107.8I26 M32 M34L24-I26 HydrophobicContact CD2-CD1 3.97Å; L24-I26 HydrophobicContact CG-CD1 4Å; L24-I26 PolarHBondContact O-N 3.08Å; L24-M32 WeakPolarHBondContact CA-O 3.45Å; L24-M32 HydrophobicContact CB-CB 4.26Å; L24-M32 WeakPolarHBondContact CB-O 3.19Å; L24-M32 PolarHBondContact N-O 2.82Å; L24-M32 PolarHBondContact O-N 3.13Å; L24-M34 HydrophobicContact CB-CG 4.15Å; L24-M34 HydrophobicContact CD2-CG 4.4Å
25Y84.1Confident88.3Confident92 Ų9263.2 Ų63.236%0.36131%0.314SS..EExtended strand (participates in β ladder)trans-73.2115.4177.1-58.2-89000109.7P23 T31 Q102P23-Y25 HydrophobicContact CB-CD2 4.21Å; P23-Y25 HydrophobicContact CB-CE2 3.54Å; P23-Y25 HydrophobicContact CG-CE2 3.61Å; Y25-T31 HydrophobicContact CD1-CG2 4.15Å; Y25-T31 VanDerWaalsContact CD1-OG1 3.29Å; Y25-T31 WeakPolarHBondContact CD1-OG1 3.36Å; Y25-T31 HydrophobicContact CE1-CG2 4.15Å; Y25-Q102 VanDerWaalsContact CE2-CD 3.45Å; Y25-Q102 HydrophobicContact CE2-CG 4.47Å
26I86Confident88.4Confident90 Ų9063.4 Ų63.446%0.46232%0.315SS..EExtended strand (participates in β ladder)trans-88.8-50.1177.9-55.5-58.1000109.3L24 L30 M32L24-I26 HydrophobicContact CD2-CD1 3.97Å; L24-I26 HydrophobicContact CG-CD1 4Å; L24-I26 PolarHBondContact O-N 3.08Å; I26-L30 HydrophobicContact CB-CB 4.41Å; I26-L30 HydrophobicContact CB-CD2 4.15Å; I26-L30 HydrophobicContact CB-CG 4.3Å; I26-L30 HydrophobicContact CG1-CD2 4.31Å; I26-L30 HydrophobicContact CG1-CG 4.41Å; I26-L30 HydrophobicContact CG2-CD2 4.22Å; I26-L30 PolarHBondContact N-O 3.26Å; I26-M32 HydrophobicContact CD1-CG 4.43Å; I26-M32 HydrophobicContact CD1-SD 3.8Å; I26-M32 HydrophobicContact CG1-CG 3.95Å; I26-M32 HydrophobicContact CG1-SD 3.77Å
27D86.3Confident88.2Confident74 Ų7460.3 Ų60.340%0.39630%0.295SS..EExtended strand (participates in β ladder)trans-148.9-176.5172.660.156.1000110.1T29 L30D27-T29 PolarHBondContact O-N 2.73Å; D27-T29 VanDerWaalsContact O-N 3.15Å; D27-T29 VanDerWaalsContact OD1-CA 3.31Å; D27-T29 WeakPolarHBondContact OD1-CA 3.46Å; D27-T29 WeakPolarHBondContact OD1-CB 3.37Å; D27-T29 PolarHBondContact OD1-N 3.16Å; D27-T29 PolarHBondContact OD1-OG1 3.05Å; D27-L30 PolarHBondContact N-O 2.73Å; D27-L30 PolarHBondContact O-N 3.45Å; D27-L30 WeakPolarHBondContact OD1-CB 3.35Å; D27-L30 PolarHBondContact OD1-N 3.41Å
28D84.2Confident87.6Confident167 Ų16764.4 Ų64.489%0.89332%0.319SS*.THydrogen-bonded Turntrans-63.9-17.5-177.6-60.2-29.5000113.2
29T88.9Confident86.6Confident78 Ų7864 Ų6448%0.47932%0.321SS..THydrogen-bonded Turntrans-112.3-6.6-175.367.20000114.3R9 D10 D27R9-T29 CarbonylContact C-O 3.57Å; R9-T29 VanDerWaalsContact CA-O 3.26Å; R9-T29 WeakPolarHBondContact CA-O 3.46Å; D10-T29 HydrophobicContact CB-CG2 4.25Å; D10-T29 PolarHBondContact N-O 3.17Å; D27-T29 PolarHBondContact O-N 2.73Å; D27-T29 VanDerWaalsContact O-N 3.15Å; D27-T29 VanDerWaalsContact OD1-CA 3.31Å; D27-T29 WeakPolarHBondContact OD1-CA 3.46Å; D27-T29 WeakPolarHBondContact OD1-CB 3.37Å; D27-T29 PolarHBondContact OD1-N 3.16Å; D27-T29 PolarHBondContact OD1-OG1 3.05Å
30L90.8Very high85.5Confident47 Ų4760 Ų6025%0.24631%0.314CS..EExtended strand (participates in β ladder)trans-138.6115.8-171.8-175.866000111.8V7 R9 I26 D27V7-L30 HydrophobicContact CG1-CD1 3.39Å; R9-L30 HydrophobicContact CG-CD1 4.45Å; I26-L30 HydrophobicContact CB-CB 4.41Å; I26-L30 HydrophobicContact CB-CD2 4.15Å; I26-L30 HydrophobicContact CB-CG 4.3Å; I26-L30 HydrophobicContact CG1-CD2 4.31Å; I26-L30 HydrophobicContact CG1-CG 4.41Å; I26-L30 HydrophobicContact CG2-CD2 4.22Å; I26-L30 PolarHBondContact N-O 3.26Å; D27-L30 PolarHBondContact N-O 2.73Å; D27-L30 PolarHBondContact O-N 3.45Å; D27-L30 WeakPolarHBondContact OD1-CB 3.35Å; D27-L30 PolarHBondContact OD1-N 3.41Å
31T90.3Very high84.6Confident25 Ų2560.4 Ų60.415%0.15332%0.318CS..EExtended strand (participates in β ladder)trans-118.2130.3172.3-59.90000110.2C8 P23 Y25C8-T31 PolarHBondContact N-O 3.38Å; C8-T31 PolarHBondContact O-N 3.05Å; P23-T31 HydrophobicContact CB-CG2 3.77Å; Y25-T31 HydrophobicContact CD1-CG2 4.15Å; Y25-T31 VanDerWaalsContact CD1-OG1 3.29Å; Y25-T31 WeakPolarHBondContact CD1-OG1 3.36Å; Y25-T31 HydrophobicContact CE1-CG2 4.15Å
32M92.9Very high83.8Confident50 Ų5063.5 Ų63.525%0.24633%0.334CS..EExtended strand (participates in β ladder)trans-101.4132.3173.5-66.8177.672.900109.4L4 P23 L24 I26L4-M32 HydrophobicContact CD1-CB 3.74Å; L4-M32 HydrophobicContact CD1-CE 3.51Å; L4-M32 HydrophobicContact CD1-CG 4.19Å; L4-M32 HydrophobicContact CD2-CE 3.52Å; L4-M32 HydrophobicContact CG-CE 4.09Å; P23-M32 CarbonylContact C-O 3.56Å; L24-M32 WeakPolarHBondContact CA-O 3.45Å; L24-M32 HydrophobicContact CB-CB 4.26Å; L24-M32 WeakPolarHBondContact CB-O 3.19Å; L24-M32 PolarHBondContact N-O 2.82Å; L24-M32 PolarHBondContact O-N 3.13Å; I26-M32 HydrophobicContact CD1-CG 4.43Å; I26-M32 HydrophobicContact CD1-SD 3.8Å; I26-M32 HydrophobicContact CG1-CG 3.95Å; I26-M32 HydrophobicContact CG1-SD 3.77Å
33V92.1Very high83Confident0 Ų063.5 Ų63.50%033%0.334CS..EExtended strand (participates in β ladder)trans-96.8118.3176.3-1730000109.2V5 A6 F15 F17 Q21V5-V33 HydrophobicContact CG2-CB 3.99Å; V5-V33 HydrophobicContact CG2-CG1 3.69Å; V5-V33 WeakPolarHBondContact CG2-O 3.42Å; V5-V33 PolarHBondContact N-O 3.48Å; A6-V33 HydrophobicContact CB-CB 3.96Å; A6-V33 HydrophobicContact CB-CG2 3.92Å; A6-V33 PolarHBondContact O-N 3.45Å; F15-V33 HydrophobicContact CD1-CG1 4.27Å; F15-V33 HydrophobicContact CD1-CG2 3.82Å; F15-V33 HydrophobicContact CD2-CG2 4.35Å; F15-V33 HydrophobicContact CE1-CB 4.31Å; F15-V33 HydrophobicContact CE1-CG1 3.76Å; F15-V33 HydrophobicContact CE1-CG2 3.96Å; F15-V33 HydrophobicContact CE2-CG2 4.47Å; F15-V33 HydrophobicContact CG-CG2 4.02Å; F15-V33 HydrophobicContact CZ-CG1 4.25Å; F15-V33 HydrophobicContact CZ-CG2 4.29Å; F17-V33 HydrophobicContact CD1-CG1 4.12Å; F17-V33 HydrophobicContact CE1-CG1 4.08Å; F17-V33 HydrophobicContact CE1-CG2 4.04Å; Q21-V33 HydrophobicContact CB-CG1 3.93Å; Q21-V33 HydrophobicContact CG-CG1 4.36Å
34M92.4Very high82.1Confident40 Ų4069.3 Ų69.320%0.19737%0.365CS..EExtended strand (participates in β ladder)trans-106.7129.7-178.7-60.6-62.9-64.800110.1A2 R3 L4 Q21 I22 L24A2-M34 HydrophobicContact CB-CE 4.01Å; R3-M34 CarbonylContact O-C 3.56Å; R3-M34 WeakPolarHBondContact O-CA 3.4Å; L4-M34 HydrophobicContact CB-SD 4.11Å; L4-M34 HydrophobicContact CD1-SD 3.98Å; Q21-M34 CarbonylContact C-O 3.46Å; Q21-M34 VanDerWaalsContact CA-O 3.31Å; Q21-M34 WeakPolarHBondContact CA-O 3.5Å; I22-M34 HydrophobicContact CG1-CB 3.96Å; I22-M34 PolarHBondContact N-O 3.21Å; I22-M34 PolarHBondContact O-N 3.04Å; L24-M34 HydrophobicContact CB-CG 4.15Å; L24-M34 HydrophobicContact CD2-CG 4.4Å
35E91.1Very high80.9Confident41 Ų4168.2 Ų68.219%0.19237%0.37CS..EExtended strand (participates in β ladder)trans-107.4126.3179.2-177.5175.7-9600111.3A2 R3 V5 R20 Q21A2-E35 CarbonylContact C-O 3.26Å; A2-E35 WeakPolarHBondContact CA-O 3.5Å; A2-E35 WeakPolarHBondContact CB-O 3.19Å; R3-E35 IonicContact CZ-OE2 3.59Å; R3-E35 PolarHBondContact N-O 2.74Å; R3-E35 IonicContact NE-OE2 3.61Å; R3-E35 IonicContact NH2-OE2 2.74Å; R3-E35 PolarHBondContact NH2-OE2 3.04Å; R3-E35 PolarHBondContact O-N 3.25Å; V5-E35 HydrophobicContact CB-CB 4.47Å; V5-E35 HydrophobicContact CG1-CB 3.55Å; V5-E35 HydrophobicContact CG1-CG 4.35Å; V5-E35 HydrophobicContact CG2-CB 4.06Å; R20-E35 CarbonylContact O-C 3.59Å; R20-E35 WeakPolarHBondContact O-CA 3.27Å; Q21-E35 HydrophobicContact CG-CB 4.02Å; Q21-E35 HydrophobicContact CG-CG 4.08Å; Q21-E35 PolarHBondContact NE2-OE1 2.95Å
36F86.3Confident79.7Confident61 Ų6167.5 Ų67.527%0.26837%0.37SS..  trans-81.6132.8171.8-61.3-67.7000110.9A2 R20 I22A2-F36 HydrophobicContact CB-CD1 3.91Å; A2-F36 HydrophobicContact CB-CE1 4.16Å; R20-F36 HydrophobicContact CB-CB 4.26Å; R20-F36 WeakPolarHBondContact CB-O 3.45Å; R20-F36 WeakPolarHBondContact O-CD2 3.34Å; R20-F36 PolarHBondContact O-N 3.09Å; I22-F36 HydrophobicContact CD1-CE2 3.76Å; I22-F36 HydrophobicContact CD1-CZ 3.51Å; I22-F36 HydrophobicContact CG1-CE2 4.01Å; I22-F36 HydrophobicContact CG1-CZ 4.19Å; I22-F36 HydrophobicContact CG2-CE2 3.76Å
37P82.2Confident78.4Confident39 Ų3972.8 Ų72.825%0.25339%0.393SS..  trans-67.1147.2177.325.2-28.9000111.1M1 R20 N39 V40M1-P37 WeakPolarHBondContact O-CD 3.33Å; R20-P37 PolarHBondContact NH2-O 2.93Å; P37-N39 WeakPolarHBondContact CB-OD1 3.28Å; P37-N39 PolarHBondContact O-N 3.28Å; P37-V40 HydrophobicContact CG-CG2 3.86Å
38D74.1Confident77.3Confident133 Ų13371.3 Ų71.371%0.71139%0.385SS*.G310 helixtrans-65.5-23-178-71.3-33.1000113.4V40D38-V40 VanDerWaalsContact C-N 3.27Å; D38-V40 PolarHBondContact O-N 2.79Å
39N66.6Low76.4Confident118 Ų11868.4 Ų68.463%0.63137%0.37SS*.G310 helixtrans-72.1-14.5-175.468-6.5000114.7P37 L41P37-N39 WeakPolarHBondContact CB-OD1 3.28Å; P37-N39 PolarHBondContact O-N 3.28Å; N39-L41 PolarHBondContact O-N 2.77Å
40V62.7Low75.9Confident75 Ų7566.6 Ų66.646%0.45537%0.366SS..G310 helixtrans-65.8-28.9-176.3-178.30000111.6P37 D38P37-V40 HydrophobicContact CG-CG2 3.86Å; D38-V40 VanDerWaalsContact C-N 3.27Å; D38-V40 PolarHBondContact O-N 2.79Å
41L68.9Low75.8Confident32 Ų3267.9 Ų67.917%0.16838%0.384CS..G310 helixtrans-131.250.8179.3-64.6173000110.5N39 L43 P113 L138 H142N39-L41 PolarHBondContact O-N 2.77Å; L41-L43 WeakPolarHBondContact O-CG 3.17Å; L41-L43 PolarHBondContact O-N 3.01Å; L41-P113 HydrophobicContact CD1-CG 4.48Å; L41-L138 HydrophobicContact CD2-CD1 4.48Å; L41-H142 HydrophobicContact CD2-CB 4.16Å
42N74.1Confident75.7Confident74 Ų7471.8 Ų71.840%0.39640%0.4SS..  trans-65.8104.6172.9-174-25.2000109.5D44 G45 H142N42-D44 PolarHBondContact OD1-N 3.03Å; N42-G45 PolarHBondContact OD1-N 3.41Å; N42-G45 VanDerWaalsContact OD1-N 3.16Å; N42-H142 PolarHBondContact O-NE2 3.43Å
43L73.3Confident75.6Confident20 Ų2070.9 Ų70.911%0.10540%0.396CS..SBendtrans-85-15.1-178.1-62.7177.4000113.3L41 P113 K134 T137 L138L41-L43 WeakPolarHBondContact O-CG 3.17Å; L41-L43 PolarHBondContact O-N 3.01Å; L43-P113 HydrophobicContact CD1-CB 4.07Å; L43-P113 HydrophobicContact CD1-CG 3.88Å; L43-K134 HydrophobicContact CB-CB 4.31Å; L43-K134 HydrophobicContact CB-CD 4.49Å; L43-K134 HydrophobicContact CB-CG 3.96Å; L43-K134 HydrophobicContact CD1-CB 4.07Å; L43-K134 HydrophobicContact CD1-CD 4.38Å; L43-K134 HydrophobicContact CD1-CG 4.29Å; L43-T137 HydrophobicContact CD2-CG2 4.19Å; L43-L138 HydrophobicContact CD2-CB 4.03Å; L43-L138 HydrophobicContact CD2-CD1 4.46Å
44D70.1Confident75.6Confident132 Ų13278.3 Ų78.371%0.70643%0.428SS*.SBendtrans-93.1-11.6-172.4-59-45.2000112.7N42 K134N42-D44 PolarHBondContact OD1-N 3.03Å; D44-K134 VanDerWaalsContact OD1-CE 3.22Å; D44-K134 WeakPolarHBondContact OD1-CE 3.33Å; D44-K134 IonicContact OD1-NZ 3.88Å
45G61.1Low75.7Confident45 Ų4580.9 Ų80.946%0.46444%0.44SS..  trans-107.713.2-159.300000119N42N42-G45 PolarHBondContact OD1-N 3.41Å; N42-G45 VanDerWaalsContact OD1-N 3.16Å
46H58.9Low75.8Confident76 Ų7680.7 Ų80.735%0.35244%0.439SS..  trans-119.7114.6-172.8-71.5-13000114.1N48 V141 H142 K145H46-N48 PolarHBondContact O-N 3.2Å; H46-N48 VanDerWaalsContact O-N 3.08Å; H46-V141 HydrophobicContact CB-CG1 4.47Å; H46-V141 WeakPolarHBondContact CD2-CG1 3.41Å; H46-H142 AromaticContact CD2-CE1 3.93Å; H46-H142 AromaticContact NE2-CE1 3.74Å; H46-K145 PolarHBondContact NE2-NZ 2.71Å; H46-K145 VanDerWaalsContact NE2-NZ 3.19Å
47Q59.9Low76.2Confident201 Ų20180.8 Ų80.894%0.93944%0.441SS*.  trans-66.599170.3-70-71.2-17.500108.6
48N62Low76.9Confident44 Ų4485.4 Ų85.424%0.23546%0.46CS..  trans-103.4143.6-174.9-110.2-33.8000112.4H46 G50 L53 Y136 V141H46-N48 PolarHBondContact O-N 3.2Å; H46-N48 VanDerWaalsContact O-N 3.08Å; N48-G50 PolarHBondContact O-N 2.9Å; N48-L53 HydrophobicContact CB-CD2 4.39Å; N48-Y136 HydrophobicContact CB-CD1 4.41Å; N48-Y136 HydrophobicContact CB-CE1 3.87Å; N48-Y136 VanDerWaalsContact CG-CE1 3.48Å; N48-Y136 WeakPolarHBondContact ND2-CD1 3.31Å; N48-Y136 WeakPolarHBondContact ND2-CE1 3.45Å; N48-V141 WeakPolarHBondContact ND2-CG2 3.36Å
49N65.1Low77.8Confident106 Ų10686.1 Ų86.157%0.56745%0.452SS*.  trans-39107.4178.2-161.20.8000111.9A51 Q52 L53N49-A51 PolarHBondContact O-N 3.28Å; N49-Q52 PolarHBondContact O-N 3.03Å; N49-L53 PolarHBondContact O-N 2.99Å
50G78.8Confident79.2Confident40 Ų4081.6 Ų81.641%0.41243%0.427SS..Hα-helixtrans-60.5-25.6-16000000115.2N48 K54N48-G50 PolarHBondContact O-N 2.9Å; G50-K54 WeakPolarHBondContact O-CB 3.41Å; G50-K54 VanDerWaalsContact O-CD 3.27Å; G50-K54 WeakPolarHBondContact O-CD 3.27Å; G50-K54 WeakPolarHBondContact O-CG 3.49Å; G50-K54 PolarHBondContact O-N 3.45Å
51A88.3Confident80.7Confident74 Ų7481.1 Ų81.161%0.61244%0.437SS*.Hα-helixtrans-76.5-47.6-179.600000113N49 K54 Q55N49-A51 PolarHBondContact O-N 3.28Å; A51-K54 PolarHBondContact O-N 3.39Å; A51-Q55 PolarHBondContact O-N 3.41Å
52Q89.1Confident81.9Confident107 Ų10786.7 Ų86.750%0.546%0.464SS..Hα-helixtrans-67.2-41.7-178.7-71.4-180-12.200111.4N49 K54 Q55 F56 Y136N49-Q52 PolarHBondContact O-N 3.03Å; Q52-K54 PolarHBondContact O-N 3.04Å; Q52-Q55 PolarHBondContact O-N 3.25Å; Q52-F56 WeakPolarHBondContact O-CB 3.08Å; Q52-F56 PolarHBondContact O-N 3.44Å; Q52-Y136 WeakPolarHBondContact CB-OH 3.35Å; Q52-Y136 PolarHBondContact OE1-OH 2.89Å
53L90.4Very high82.9Confident31 Ų3187.5 Ų87.516%0.16247%0.468CS..Hα-helixtrans-62.4-44.2176.2176.861000111.6N48 N49 Q55 F56 I57 K133 Y136N48-L53 HydrophobicContact CB-CD2 4.39Å; N49-L53 PolarHBondContact O-N 2.99Å; L53-Q55 VanDerWaalsContact C-N 3.33Å; L53-Q55 PolarHBondContact O-N 2.87Å; L53-F56 PolarHBondContact O-N 3.42Å; L53-I57 HydrophobicContact CD1-CD1 3.9Å; L53-I57 HydrophobicContact CD1-CG1 4.06Å; L53-I57 HydrophobicContact CG-CD1 3.84Å; L53-I57 HydrophobicContact CG-CG1 4.42Å; L53-I57 VanDerWaalsContact O-CG1 3.28Å; L53-I57 WeakPolarHBondContact O-CG1 3.36Å; L53-I57 PolarHBondContact O-N 2.91Å; L53-K133 HydrophobicContact CD1-CG 4.39Å; L53-Y136 HydrophobicContact CB-CD1 4.48Å; L53-Y136 HydrophobicContact CB-CE1 4.23Å; L53-Y136 HydrophobicContact CD1-CD1 3.63Å; L53-Y136 HydrophobicContact CD1-CD2 4.39Å; L53-Y136 HydrophobicContact CD1-CE1 4.23Å; L53-Y136 HydrophobicContact CD1-CG 3.71Å
54K92.7Very high83.8Confident155 Ų15593.4 Ų93.467%0.67449%0.493SS*.Hα-helixtrans-59.1-45176.1-78.8173.4-173.7-177.10111.7G50 A51 Q52 I57 Q58G50-K54 WeakPolarHBondContact O-CB 3.41Å; G50-K54 VanDerWaalsContact O-CD 3.27Å; G50-K54 WeakPolarHBondContact O-CD 3.27Å; G50-K54 WeakPolarHBondContact O-CG 3.49Å; G50-K54 PolarHBondContact O-N 3.45Å; A51-K54 PolarHBondContact O-N 3.39Å; Q52-K54 PolarHBondContact O-N 3.04Å; K54-I57 PolarHBondContact O-N 2.92Å; K54-Q58 WeakPolarHBondContact O-CB 3.41Å; K54-Q58 PolarHBondContact O-N 2.9Å
55Q94.3Very high84.7Confident94 Ų9492 Ų9244%0.43948%0.482SS..Hα-helixtrans-63.9-40.8177.5-174.3176.854.900111.9A51 Q52 L53 Q58 R59A51-Q55 PolarHBondContact O-N 3.41Å; Q52-Q55 PolarHBondContact O-N 3.25Å; L53-Q55 VanDerWaalsContact C-N 3.33Å; L53-Q55 PolarHBondContact O-N 2.87Å; Q55-Q58 PolarHBondContact O-N 3.25Å; Q55-R59 WeakPolarHBondContact O-CG 3.34Å; Q55-R59 PolarHBondContact O-N 2.91Å
56F94Very high86.2Confident38 Ų3897 Ų9717%0.16749%0.493CS..Hα-helixtrans-62.9-48.1176.1-174.8-88.1000111.7Q52 L53 Q58 R59 H60 A132 L135 Y136 F139 Y140Q52-F56 WeakPolarHBondContact O-CB 3.08Å; Q52-F56 PolarHBondContact O-N 3.44Å; L53-F56 PolarHBondContact O-N 3.42Å; F56-Q58 VanDerWaalsContact C-N 3.3Å; F56-Q58 PolarHBondContact O-N 3.42Å; F56-R59 PolarHBondContact O-N 3.44Å; F56-H60 HydrophobicContact CE1-CB 4.37Å; F56-H60 WeakPolarHBondContact O-CB 3.27Å; F56-H60 PolarHBondContact O-N 3.07Å; F56-A132 HydrophobicContact CD1-CB 4.44Å; F56-A132 HydrophobicContact CE1-CB 4.41Å; F56-A132 VanDerWaalsContact CE1-O 3.24Å; F56-A132 WeakPolarHBondContact CE1-O 3.31Å; F56-L135 HydrophobicContact CE1-CB 4.16Å; F56-L135 HydrophobicContact CZ-CB 4.18Å; F56-Y136 HydrophobicContact CB-CD2 3.62Å; F56-Y136 HydrophobicContact CB-CE2 4.05Å; F56-Y136 AromaticContact CD1-CD2 3.94Å; F56-Y136 HydrophobicContact CD1-CD2 3.94Å; F56-Y136 HydrophobicContact CD1-CG 4.29Å; F56-Y136 AromaticContact CD2-CD2 3.77Å; F56-Y136 HydrophobicContact CD2-CD2 3.77Å; F56-Y136 HydrophobicContact CD2-CE2 4.47Å; F56-Y136 HydrophobicContact CE2-CD2 4.41Å; F56-Y136 AromaticContact CG-CD2 3.49Å; F56-Y136 HydrophobicContact CG-CD2 3.49Å; F56-Y136 VanDerWaalsContact CG-CD2 3.49Å; F56-Y136 HydrophobicContact CG-CE2 4.31Å; F56-Y136 HydrophobicContact CG-CG 4.29Å; F56-F139 HydrophobicContact CZ-CD2 4.45Å; F56-Y140 AromaticContact CD2-CE2 3.9Å; F56-Y140 HydrophobicContact CD2-CE2 3.9Å; F56-Y140 AromaticContact CE2-CE2 3.81Å; F56-Y140 HydrophobicContact CE2-CE2 3.81Å
57I94.3Very high87.8Confident63 Ų6397.3 Ų97.332%0.32350%0.498SS..Hα-helixtrans-58.2-44.8177.7-68.2167.7000110.6L53 K54 R59 H60 G61 A132 K133L53-I57 HydrophobicContact CD1-CD1 3.9Å; L53-I57 HydrophobicContact CD1-CG1 4.06Å; L53-I57 HydrophobicContact CG-CD1 3.84Å; L53-I57 HydrophobicContact CG-CG1 4.42Å; L53-I57 VanDerWaalsContact O-CG1 3.28Å; L53-I57 WeakPolarHBondContact O-CG1 3.36Å; L53-I57 PolarHBondContact O-N 2.91Å; K54-I57 PolarHBondContact O-N 2.92Å; I57-R59 PolarHBondContact O-N 3.31Å; I57-H60 PolarHBondContact O-N 3.5Å; I57-G61 PolarHBondContact O-N 3.4Å; I57-A132 HydrophobicContact CB-CB 4.39Å; I57-A132 HydrophobicContact CG1-CB 3.91Å; I57-K133 HydrophobicContact CD1-CG 4.04Å
58Q95.4Very high89.3Confident136 Ų13688.2 Ų88.264%0.63646%0.456SS*.Hα-helixtrans-59.2-48.4177.7-175-176.99.200111.5K54 Q55 F56 G61 M62K54-Q58 WeakPolarHBondContact O-CB 3.41Å; K54-Q58 PolarHBondContact O-N 2.9Å; Q55-Q58 PolarHBondContact O-N 3.25Å; F56-Q58 VanDerWaalsContact C-N 3.3Å; F56-Q58 PolarHBondContact O-N 3.42Å; Q58-G61 PolarHBondContact O-N 3.32Å; Q58-M62 WeakPolarHBondContact O-CG 3.48Å; Q58-M62 PolarHBondContact O-N 3.25Å
59R94.3Very high90.7Very high148 Ų14888.6 Ų88.656%0.55846%0.462SS*.Hα-helixtrans-68.1-40.2-179.4-70.6174.6-179.3179.50.2112.5Q55 F56 I57 G61 M62Q55-R59 WeakPolarHBondContact O-CG 3.34Å; Q55-R59 PolarHBondContact O-N 2.91Å; F56-R59 PolarHBondContact O-N 3.44Å; I57-R59 PolarHBondContact O-N 3.31Å; R59-G61 VanDerWaalsContact C-N 3.28Å; R59-G61 PolarHBondContact O-N 2.69Å; R59-M62 WeakPolarHBondContact O-CB 3.37Å; R59-M62 PolarHBondContact O-N 3.36Å
60H95.2Very high92Very high23 Ų2389.5 Ų89.511%0.10647%0.465CS..Hα-helixtrans-57.4-43.8174.9174.5-84.4000110.9F56 I57 M62 L63 L68 M129 A132F56-H60 HydrophobicContact CE1-CB 4.37Å; F56-H60 WeakPolarHBondContact O-CB 3.27Å; F56-H60 PolarHBondContact O-N 3.07Å; I57-H60 PolarHBondContact O-N 3.5Å; H60-M62 PolarHBondContact O-N 3.29Å; H60-M62 VanDerWaalsContact O-N 3.16Å; H60-L63 WeakPolarHBondContact O-CB 3.37Å; H60-L63 PolarHBondContact O-N 3.12Å; H60-L63 VanDerWaalsContact O-N 3.08Å; H60-L68 WeakPolarHBondContact NE2-CD2 3.43Å; H60-M129 PolarHBondContact NE2-O 3.47Å; H60-A132 HydrophobicContact CB-CB 3.93Å
61G94.2Very high92.7Very high64 Ų6491.3 Ų91.366%0.6648%0.476SS*.THydrogen-bonded Turntrans-64.6-15.7176.300000115.2I57 Q58 R59I57-G61 PolarHBondContact O-N 3.4Å; Q58-G61 PolarHBondContact O-N 3.32Å; R59-G61 VanDerWaalsContact C-N 3.28Å; R59-G61 PolarHBondContact O-N 2.69Å
62M95.3Very high92.9Very high149 Ų14989.1 Ų89.173%0.73445%0.454SS*.THydrogen-bonded Turntrans-87.1-14.4175.6-62.5173.369.900113Q58 R59 H60Q58-M62 WeakPolarHBondContact O-CG 3.48Å; Q58-M62 PolarHBondContact O-N 3.25Å; R59-M62 WeakPolarHBondContact O-CB 3.37Å; R59-M62 PolarHBondContact O-N 3.36Å; H60-M62 PolarHBondContact O-N 3.29Å; H60-M62 VanDerWaalsContact O-N 3.16Å
63L93.8Very high93.2Very high91 Ų9187 Ų8748%0.47645%0.448SS..SBendtrans-82.5139.4-178.3-62.6173.2000110.8H60 L68H60-L63 WeakPolarHBondContact O-CB 3.37Å; H60-L63 PolarHBondContact O-N 3.12Å; H60-L63 VanDerWaalsContact O-N 3.08Å; L63-L68 HydrophobicContact CD1-CD1 4.03Å
64K93.7Very high93.5Very high144 Ų14488.1 Ų88.163%0.62646%0.456SS*.  trans-70.9145.8167.7-61.8175.5-178.9171.60109Q66 D67 L68K64-Q66 PolarHBondContact O-N 3.29Å; K64-D67 HydrophobicContact CB-CB 4.41Å; K64-D67 WeakPolarHBondContact CB-OD2 3.34Å; K64-D67 PolarHBondContact O-N 3.31Å; K64-D67 VanDerWaalsContact O-N 3.13Å; K64-L68 PolarHBondContact O-N 2.88Å
65Q88.6Confident93.7Very high104 Ų10483.4 Ų83.449%0.48644%0.44SS..Hα-helixtrans-59.3-32178.5-68.1-65.7-9.600113S69Q65-S69 WeakPolarHBondContact O-CB 3.31Å; Q65-S69 PolarHBondContact O-N 3.27Å
66Q91.6Very high93.7Very high149 Ų14980.5 Ų80.570%0.69643%0.43SS*.Hα-helixtrans-67.6-48.4175.3-70.8178.5-13.300111.7K64 L68 S69 I70K64-Q66 PolarHBondContact O-N 3.29Å; Q66-L68 VanDerWaalsContact C-N 3.28Å; Q66-L68 PolarHBondContact O-N 3.37Å; Q66-S69 PolarHBondContact O-N 3.02Å; Q66-I70 WeakPolarHBondContact O-CG1 3.41Å; Q66-I70 PolarHBondContact O-N 2.87Å
67D92.3Very high93.8Very high83 Ų8388.7 Ų88.744%0.44446%0.46SS..Hα-helixtrans-61-41.6178.4-58.3-25.4000110.6K64 I70 A71K64-D67 HydrophobicContact CB-CB 4.41Å; K64-D67 WeakPolarHBondContact CB-OD2 3.34Å; K64-D67 PolarHBondContact O-N 3.31Å; K64-D67 VanDerWaalsContact O-N 3.13Å; D67-I70 PolarHBondContact O-N 2.87Å; D67-A71 WeakPolarHBondContact O-CB 3.41Å; D67-A71 PolarHBondContact O-N 2.82Å
68L92.2Very high93.9Very high10 Ų1090.5 Ų90.55%0.05247%0.467CS..Hα-helixtrans-62.7-47175.2-172.964.8000111.3H60 L63 K64 Q66 I70 A71 M72 M129 L135H60-L68 WeakPolarHBondContact NE2-CD2 3.43Å; L63-L68 HydrophobicContact CD1-CD1 4.03Å; K64-L68 PolarHBondContact O-N 2.88Å; Q66-L68 VanDerWaalsContact C-N 3.28Å; Q66-L68 PolarHBondContact O-N 3.37Å; L68-I70 VanDerWaalsContact C-N 3.29Å; L68-I70 PolarHBondContact O-N 2.9Å; L68-A71 PolarHBondContact O-N 3.43Å; L68-M72 HydrophobicContact CD1-CE 3.53Å; L68-M72 HydrophobicContact CG-CE 4.35Å; L68-M72 WeakPolarHBondContact O-CG 3.36Å; L68-M72 PolarHBondContact O-N 3.33Å; L68-M72 VanDerWaalsContact O-N 3.1Å; L68-M129 HydrophobicContact CD2-CG 3.57Å; L68-M129 HydrophobicContact CD2-SD 4.4Å; L68-M129 HydrophobicContact CG-CG 3.84Å; L68-M129 HydrophobicContact CG-SD 4.17Å; L68-L135 HydrophobicContact CD2-CD1 4.48Å
69S91.2Very high93.8Very high52 Ų5285 Ų8536%0.36444%0.443SS..Hα-helixtrans-59.9-39.8178.2-174.20000112.3Q65 Q66 M72Q65-S69 WeakPolarHBondContact O-CB 3.31Å; Q65-S69 PolarHBondContact O-N 3.27Å; Q66-S69 PolarHBondContact O-N 3.02Å; S69-M72 PolarHBondContact O-N 2.78Å
70I92.8Very high93.8Very high124 Ų12481.2 Ų81.264%0.63643%0.433SS*.Hα-helixtrans-67.5-42.8177.9-68.4163.4000110.3Q66 D67 L68 M72 V73Q66-I70 WeakPolarHBondContact O-CG1 3.41Å; Q66-I70 PolarHBondContact O-N 2.87Å; D67-I70 PolarHBondContact O-N 2.87Å; L68-I70 VanDerWaalsContact C-N 3.29Å; L68-I70 PolarHBondContact O-N 2.9Å; I70-M72 PolarHBondContact O-N 3.08Å; I70-V73 PolarHBondContact O-N 3.28Å
71A92.8Very high93.9Very high79 Ų7982.7 Ų82.765%0.65345%0.446SS*.Hα-helixtrans-64.4-20.9177.600000113.5D67 L68D67-A71 WeakPolarHBondContact O-CB 3.41Å; D67-A71 PolarHBondContact O-N 2.82Å; L68-A71 PolarHBondContact O-N 3.43Å
72M93.1Very high93.8Very high27 Ų2781.3 Ų81.313%0.13343%0.429CS..THydrogen-bonded Turntrans-92.24.4178.5-63.9-60.6164.100113.7L68 S69 I70 S123 V124 M129 L135 F139L68-M72 HydrophobicContact CD1-CE 3.53Å; L68-M72 HydrophobicContact CG-CE 4.35Å; L68-M72 WeakPolarHBondContact O-CG 3.36Å; L68-M72 PolarHBondContact O-N 3.33Å; L68-M72 VanDerWaalsContact O-N 3.1Å; S69-M72 PolarHBondContact O-N 2.78Å; I70-M72 PolarHBondContact O-N 3.08Å; M72-S123 WeakPolarHBondContact O-CA 3.25Å; M72-S123 WeakPolarHBondContact O-CB 3.39Å; M72-S123 PolarHBondContact O-OG 3.47Å; M72-V124 HydrophobicContact CB-CG2 4.14Å; M72-V124 HydrophobicContact CG-CG2 3.97Å; M72-V124 HydrophobicContact SD-CG2 4.14Å; M72-M129 HydrophobicContact CB-SD 4.46Å; M72-M129 HydrophobicContact CG-CG 4.43Å; M72-M129 HydrophobicContact CG-SD 4.08Å; M72-L135 HydrophobicContact CE-CD1 4.08Å; M72-L135 HydrophobicContact CE-CD2 4.18Å; M72-F139 HydrophobicContact CE-CE2 3.8Å; M72-F139 HydrophobicContact CE-CZ 3.66Å; M72-F139 HydrophobicContact SD-CE2 4.42Å; M72-F139 HydrophobicContact SD-CZ 3.67Å
73V95.1Very high93.6Very high63 Ų6375.4 Ų75.438%0.38240%0.4SS..  trans-87.3124.5177.7166.40000109.4I70 V121I70-V73 PolarHBondContact O-N 3.28Å; V73-V121 HydrophobicContact CB-CG1 4.5Å; V73-V121 HydrophobicContact CG1-CG1 3.91Å; V73-V121 HydrophobicContact CG2-CG1 4.22Å
74V96.3Very high93.5Very high54 Ų5474 Ų7433%0.32740%0.398SS..BIsolated β-bridgetrans-121.3122.6169.1-175.10000108E78 V79 L122V74-E78 HydrophobicContact CG1-CB 3.72Å; V74-V79 HydrophobicContact CG1-CG2 3.81Å; V74-L122 HydrophobicContact CB-CB 4.18Å; V74-L122 PolarHBondContact N-O 3.25Å; V74-L122 PolarHBondContact O-N 3.03Å
75T96.3Very high93.4Very high57 Ų5774.2 Ų74.235%0.3540%0.401SS..  trans-76158.3-179.964.40000111.4R77 E78 V79T75-R77 PolarHBondContact O-N 3.44Å; T75-E78 WeakPolarHBondContact CB-OE2 3.36Å; T75-E78 WeakPolarHBondContact CG2-OE2 3.32Å; T75-E78 PolarHBondContact N-OE2 3.01Å; T75-E78 PolarHBondContact O-N 3.46Å; T75-E78 WeakPolarHBondContact OG1-CG 3.38Å; T75-E78 PolarHBondContact OG1-N 3.31Å; T75-E78 PolarHBondContact OG1-OE2 3.01Å; T75-V79 PolarHBondContact O-N 3.06Å
76S95.4Very high93.3Very high32 Ų3273.9 Ų73.922%0.22440%0.402CS..Hα-helixtrans-56.1-38.1174-42.10000111.6E78 V79 L80 K119 G120S76-E78 VanDerWaalsContact C-N 3.32Å; S76-E78 PolarHBondContact O-N 2.85Å; S76-V79 PolarHBondContact O-N 3.25Å; S76-L80 WeakPolarHBondContact O-CB 3.35Å; S76-L80 WeakPolarHBondContact O-CG 3.5Å; S76-L80 PolarHBondContact O-N 3.09Å; S76-K119 PolarHBondContact OG-O 3.09Å; S76-G120 PolarHBondContact N-O 3.32Å; S76-G120 VanDerWaalsContact OG-C 3.26Å; S76-G120 WeakPolarHBondContact OG-CA 3.28Å; S76-G120 PolarHBondContact OG-O 3.42Å
77R95.8Very high93.2Very high210 Ų21067.4 Ų67.479%0.79237%0.373SS*.Hα-helixtrans-59.2-43.7177.1-177.5-179.4176-173.3-1.2111.7T75 S81T75-R77 PolarHBondContact O-N 3.44Å; R77-S81 WeakPolarHBondContact O-CB 3.28Å; R77-S81 PolarHBondContact O-N 3.21Å
78E96.4Very high92.9Very high102 Ų10265.9 Ų65.948%0.47737%0.367SS..Hα-helixtrans-67.4-41.9178.1-72160.813800111.5V74 T75 S76 S81 A82V74-E78 HydrophobicContact CG1-CB 3.72Å; T75-E78 WeakPolarHBondContact CB-OE2 3.36Å; T75-E78 WeakPolarHBondContact CG2-OE2 3.32Å; T75-E78 PolarHBondContact N-OE2 3.01Å; T75-E78 PolarHBondContact O-N 3.46Å; T75-E78 WeakPolarHBondContact OG1-CG 3.38Å; T75-E78 PolarHBondContact OG1-N 3.31Å; T75-E78 PolarHBondContact OG1-OE2 3.01Å; S76-E78 VanDerWaalsContact C-N 3.32Å; S76-E78 PolarHBondContact O-N 2.85Å; E78-S81 PolarHBondContact O-N 3.07Å; E78-A82 WeakPolarHBondContact O-CB 3.44Å; E78-A82 PolarHBondContact O-N 3.16Å
79V94Very high92.7Very high20 Ų2067.7 Ų67.712%0.12138%0.38CS..Hα-helixtrans-58.5-53.2175175.90000110.9V74 T75 S76 S81 A82 L83 F100 L122V74-V79 HydrophobicContact CG1-CG2 3.81Å; T75-V79 PolarHBondContact O-N 3.06Å; S76-V79 PolarHBondContact O-N 3.25Å; V79-S81 VanDerWaalsContact C-N 3.34Å; V79-S81 PolarHBondContact O-N 2.91Å; V79-A82 PolarHBondContact O-N 2.97Å; V79-L83 HydrophobicContact CG1-CD1 4.07Å; V79-L83 WeakPolarHBondContact O-CG 3.24Å; V79-L83 PolarHBondContact O-N 2.9Å; V79-F100 HydrophobicContact CG1-CD2 4.34Å; V79-F100 HydrophobicContact CG1-CE2 4.36Å; V79-F100 HydrophobicContact CG2-CE2 4.3Å; V79-F100 HydrophobicContact CG2-CZ 4.32Å; V79-L122 HydrophobicContact CG2-CB 4.19Å; V79-L122 HydrophobicContact CG2-CD2 3.91Å
80L94.4Very high92.7Very high68 Ų6869 Ų6936%0.35639%0.386SS..Hα-helixtrans-63.7-40-178.8-63.1176.9000111.6S76 L83 S84 E97S76-L80 WeakPolarHBondContact O-CB 3.35Å; S76-L80 WeakPolarHBondContact O-CG 3.5Å; S76-L80 PolarHBondContact O-N 3.09Å; L80-L83 PolarHBondContact O-N 3.35Å; L80-S84 PolarHBondContact O-N 3.49Å; L80-E97 HydrophobicContact CD2-CB 4.15Å; L80-E97 HydrophobicContact CD2-CG 3.56Å
81S95.9Very high92.5Very high54 Ų5465 Ų6538%0.37838%0.376SS..Hα-helixtrans-60.8-47.8174.5-1740000111.3R77 E78 V79 S84 Q85R77-S81 WeakPolarHBondContact O-CB 3.28Å; R77-S81 PolarHBondContact O-N 3.21Å; E78-S81 PolarHBondContact O-N 3.07Å; V79-S81 VanDerWaalsContact C-N 3.34Å; V79-S81 PolarHBondContact O-N 2.91Å; S81-S84 PolarHBondContact O-N 2.94Å; S81-S84 PolarHBondContact O-OG 3.49Å; S81-Q85 WeakPolarHBondContact O-CG 3.18Å; S81-Q85 PolarHBondContact O-N 2.89Å
82A93.1Very high92.3Very high36 Ų3664 Ų6430%0.29836%0.363SS..Hα-helixtrans-62.1-44178.100000111.5E78 V79 S84 Q85 L86E78-A82 WeakPolarHBondContact O-CB 3.44Å; E78-A82 PolarHBondContact O-N 3.16Å; V79-A82 PolarHBondContact O-N 2.97Å; A82-S84 VanDerWaalsContact C-N 3.31Å; A82-S84 PolarHBondContact O-N 3.47Å; A82-Q85 PolarHBondContact O-N 2.89Å; A82-Q85 VanDerWaalsContact O-N 3.12Å; A82-L86 HydrophobicContact CB-CD1 4.26Å; A82-L86 WeakPolarHBondContact O-CB 3.38Å; A82-L86 VanDerWaalsContact O-CG 3.27Å; A82-L86 WeakPolarHBondContact O-CG 3.47Å; A82-L86 PolarHBondContact O-N 3.41Å
83L91.9Very high92.2Very high25 Ų2565.5 Ų65.513%0.13137%0.367CS..Hα-helixtrans-57.9-43.3176.3-73171000111.9V79 L80 Q85 V87 R93 V96 E97V79-L83 HydrophobicContact CG1-CD1 4.07Å; V79-L83 WeakPolarHBondContact O-CG 3.24Å; V79-L83 PolarHBondContact O-N 2.9Å; L80-L83 PolarHBondContact O-N 3.35Å; L83-Q85 PolarHBondContact O-N 3.33Å; L83-V87 HydrophobicContact CD2-CG2 4.35Å; L83-V87 PolarHBondContact O-N 2.95Å; L83-R93 VanDerWaalsContact O-CD 3.23Å; L83-R93 WeakPolarHBondContact O-CD 3.42Å; L83-V96 HydrophobicContact CD1-CB 4.17Å; L83-V96 HydrophobicContact CD1-CG1 3.67Å; L83-V96 HydrophobicContact CD2-CB 4.23Å; L83-V96 HydrophobicContact CD2-CG1 3.8Å; L83-V96 HydrophobicContact CG-CG1 4.4Å; L83-E97 HydrophobicContact CD1-CG 4.26Å
84S91.6Very high92.1Very high61 Ų6170.9 Ų70.943%0.42738%0.381SS..Hα-helixtrans-60.9-32.2178.2800000113.6L80 S81 A82 R93L80-S84 PolarHBondContact O-N 3.49Å; S81-S84 PolarHBondContact O-N 2.94Å; S81-S84 PolarHBondContact O-OG 3.49Å; A82-S84 VanDerWaalsContact C-N 3.31Å; A82-S84 PolarHBondContact O-N 3.47Å; S84-R93 PolarHBondContact O-NH1 3.31Å
85Q90.1Very high91.7Very high149 Ų14971.6 Ų71.670%0.69639%0.388SS*.Hα-helixtrans-88.9-38.7-176.5-68.6174.1-11.400112.6S81 A82 L83S81-Q85 WeakPolarHBondContact O-CG 3.18Å; S81-Q85 PolarHBondContact O-N 2.89Å; A82-Q85 PolarHBondContact O-N 2.89Å; A82-Q85 VanDerWaalsContact O-N 3.12Å; L83-Q85 PolarHBondContact O-N 3.33Å
86L88.3Confident91.5Very high96 Ų9672 Ų7250%0.50339%0.39SS..Hα-helixtrans-90.5-32.9-171.1-62.9175.6000113A82 I150A82-L86 HydrophobicContact CB-CD1 4.26Å; A82-L86 WeakPolarHBondContact O-CB 3.38Å; A82-L86 VanDerWaalsContact O-CG 3.27Å; A82-L86 WeakPolarHBondContact O-CG 3.47Å; A82-L86 PolarHBondContact O-N 3.41Å; L86-I150 HydrophobicContact CB-CG2 4.18Å
87V88.8Confident91.4Very high14 Ų1473.5 Ų73.59%0.08539%0.394CS..  trans-107.5110.7-175.2-177.70000109.7L83 C92 R93 I153L83-V87 HydrophobicContact CD2-CG2 4.35Å; L83-V87 PolarHBondContact O-N 2.95Å; V87-C92 HydrophobicContact CG1-CB 3.8Å; V87-R93 HydrophobicContact CB-CG 3.76Å; V87-R93 HydrophobicContact CG1-CG 3.87Å; V87-R93 WeakPolarHBondContact O-CD 3.47Å; V87-R93 WeakPolarHBondContact O-CG 3.23Å; V87-R93 PolarHBondContact O-NH1 3.06Å; V87-I153 HydrophobicContact CG2-CD1 4.46Å
88P86.4Confident91.2Very high50 Ų5069.1 Ų69.133%0.32538%0.377SS..  trans-76.6-27.3-176.128.3-33.4000113V90 K155P88-V90 PolarHBondContact O-N 3.01Å; P88-K155 HydrophobicContact CG-CB 4.24Å; P88-K155 HydrophobicContact CG-CG 3.97Å
89C88.3Confident90.9Very high49 Ų4965.9 Ų65.933%0.33136%0.363SS..  trans-73.4113.7-179.6179.20000111G91 C92 R93C89-G91 VanDerWaalsContact C-N 3.27Å; C89-G91 PolarHBondContact O-N 3.47Å; C89-C92 HydrophobicContact CB-CB 3.9Å; C89-C92 PolarHBondContact O-N 3.18Å; C89-C92 PolarHBondContact SG-N 3Å; C89-C92 PolarHBondContact SG-SG 3.32Å; C89-R93 PolarHBondContact O-N 3.46Å
90V89.9Confident90.9Very high79 Ų7965.7 Ų65.748%0.47936%0.361SS..Hα-helixtrans-56.6-41.5178.2-179.70000111.6P88 R93 R94P88-V90 PolarHBondContact O-N 3.01Å; V90-R93 PolarHBondContact O-N 3.06Å; V90-R94 WeakPolarHBondContact O-CG 3.14Å; V90-R94 PolarHBondContact O-N 2.8Å
91G89.3Confident90.7Very high41 Ų4165.3 Ų65.342%0.42336%0.363SS..Hα-helixtrans-63.2-47.9178.600000112.2C89 R93 R94 S95C89-G91 VanDerWaalsContact C-N 3.27Å; C89-G91 PolarHBondContact O-N 3.47Å; G91-R93 VanDerWaalsContact C-N 3.33Å; G91-R93 PolarHBondContact O-N 3.23Å; G91-R94 PolarHBondContact O-N 3.27Å; G91-S95 PolarHBondContact O-N 3.3Å; G91-S95 PolarHBondContact O-OG 2.99Å; G91-S95 VanDerWaalsContact O-OG 3.1Å
92C88.1Confident90.4Very high58 Ų5864.4 Ų64.439%0.39235%0.353SS..Hα-helixtrans-60.1-42.8176.7-640000111.7V87 C89 S95 V96V87-C92 HydrophobicContact CG1-CB 3.8Å; C89-C92 HydrophobicContact CB-CB 3.9Å; C89-C92 PolarHBondContact O-N 3.18Å; C89-C92 PolarHBondContact SG-N 3Å; C89-C92 PolarHBondContact SG-SG 3.32Å; C92-S95 PolarHBondContact O-N 2.9Å; C92-V96 WeakPolarHBondContact O-CG2 2.9Å; C92-V96 PolarHBondContact O-N 3.29Å
93R91.4Very high90.2Very high57 Ų5762.9 Ų62.922%0.21534%0.34CS..Hα-helixtrans-57.1-56.5175.5-72.1-166.8-62.8-127.510.7111.4L83 S84 V87 C89 V90 G91 S95 V96 E97L83-R93 VanDerWaalsContact O-CD 3.23Å; L83-R93 WeakPolarHBondContact O-CD 3.42Å; S84-R93 PolarHBondContact O-NH1 3.31Å; V87-R93 HydrophobicContact CB-CG 3.76Å; V87-R93 HydrophobicContact CG1-CG 3.87Å; V87-R93 WeakPolarHBondContact O-CD 3.47Å; V87-R93 WeakPolarHBondContact O-CG 3.23Å; V87-R93 PolarHBondContact O-NH1 3.06Å; C89-R93 PolarHBondContact O-N 3.46Å; V90-R93 PolarHBondContact O-N 3.06Å; G91-R93 VanDerWaalsContact C-N 3.33Å; G91-R93 PolarHBondContact O-N 3.23Å; R93-S95 PolarHBondContact O-N 3.12Å; R93-V96 PolarHBondContact O-N 2.89Å; R93-E97 VanDerWaalsContact O-CG 3.28Å; R93-E97 WeakPolarHBondContact O-CG 3.48Å; R93-E97 PolarHBondContact O-N 3.39Å
94R92.1Very high90.3Very high177 Ų17763.7 Ų63.767%0.66835%0.346SS*.Hα-helixtrans-56.9-38.1-179.6-72.2-173.1177.6-151.10.2112.5V90 G91 E97 R98V90-R94 WeakPolarHBondContact O-CG 3.14Å; V90-R94 PolarHBondContact O-N 2.8Å; G91-R94 PolarHBondContact O-N 3.27Å; R94-E97 PolarHBondContact O-N 3.06Å; R94-R98 WeakPolarHBondContact O-CB 3.48Å; R94-R98 PolarHBondContact O-N 3.04Å
95S89.5Confident90.2Very high69 Ų6968.6 Ų68.648%0.48336%0.362SS..Hα-helixtrans-62.9-42.9175.2-64.60000112.5G91 C92 R93 L99G91-S95 PolarHBondContact O-N 3.3Å; G91-S95 PolarHBondContact O-OG 2.99Å; G91-S95 VanDerWaalsContact O-OG 3.1Å; C92-S95 PolarHBondContact O-N 2.9Å; R93-S95 PolarHBondContact O-N 3.12Å; S95-L99 WeakPolarHBondContact O-CB 3.42Å; S95-L99 PolarHBondContact O-N 3.18Å
96V91.2Very high89.9Confident64 Ų6464.3 Ų64.339%0.38835%0.348SS..Hα-helixtrans-70-39.8177179.90000111.4L83 C92 R93 R98 L99 F100L83-V96 HydrophobicContact CD1-CB 4.17Å; L83-V96 HydrophobicContact CD1-CG1 3.67Å; L83-V96 HydrophobicContact CD2-CB 4.23Å; L83-V96 HydrophobicContact CD2-CG1 3.8Å; L83-V96 HydrophobicContact CG-CG1 4.4Å; C92-V96 WeakPolarHBondContact O-CG2 2.9Å; C92-V96 PolarHBondContact O-N 3.29Å; R93-V96 PolarHBondContact O-N 2.89Å; V96-R98 VanDerWaalsContact C-N 3.35Å; V96-R98 PolarHBondContact O-N 3.27Å; V96-L99 PolarHBondContact O-N 3.45Å; V96-F100 WeakPolarHBondContact O-CB 3.32Å; V96-F100 PolarHBondContact O-N 3.01Å
97E93.8Very high89.8Confident64 Ų6462.1 Ų62.130%0.29935%0.349SS..Hα-helixtrans-61.3-43.1176.1-64.4174.8167.700111.8L80 L83 R93 R94 F100 S101L80-E97 HydrophobicContact CD2-CB 4.15Å; L80-E97 HydrophobicContact CD2-CG 3.56Å; L83-E97 HydrophobicContact CD1-CG 4.26Å; R93-E97 VanDerWaalsContact O-CG 3.28Å; R93-E97 WeakPolarHBondContact O-CG 3.48Å; R93-E97 PolarHBondContact O-N 3.39Å; R94-E97 PolarHBondContact O-N 3.06Å; E97-F100 PolarHBondContact O-N 3.36Å; E97-S101 PolarHBondContact O-N 3.13Å; E97-S101 PolarHBondContact O-OG 3.31Å
98R91.4Very high89.7Confident118 Ų11863.1 Ų63.145%0.44535%0.354SS..Hα-helixtrans-62.5-49.2175.2-174.3174.770.5158.55110.9R94 V96 F100 S101 Q102R94-R98 WeakPolarHBondContact O-CB 3.48Å; R94-R98 PolarHBondContact O-N 3.04Å; V96-R98 VanDerWaalsContact C-N 3.35Å; V96-R98 PolarHBondContact O-N 3.27Å; R98-F100 VanDerWaalsContact C-N 3.32Å; R98-F100 PolarHBondContact O-N 3.36Å; R98-S101 PolarHBondContact O-N 2.97Å; R98-Q102 VanDerWaalsContact O-CG 3.31Å; R98-Q102 WeakPolarHBondContact O-CG 3.48Å; R98-Q102 PolarHBondContact O-N 3.29Å
99L89.8Confident89.6Confident35 Ų3563.9 Ų63.918%0.18336%0.359CS..Hα-helixtrans-58.3-45.2176.5175.962000111.3I22 S95 V96 S101 Q102 L103I22-L99 HydrophobicContact CB-CD1 4.04Å; I22-L99 HydrophobicContact CD1-CD1 4.2Å; I22-L99 HydrophobicContact CD1-CD2 4.14Å; I22-L99 HydrophobicContact CG2-CD1 3.95Å; S95-L99 WeakPolarHBondContact O-CB 3.42Å; S95-L99 PolarHBondContact O-N 3.18Å; V96-L99 PolarHBondContact O-N 3.45Å; L99-S101 PolarHBondContact O-N 2.68Å; L99-Q102 PolarHBondContact O-N 2.97Å; L99-L103 HydrophobicContact CD1-CD1 4.3Å; L99-L103 HydrophobicContact CD1-CG 4.27Å; L99-L103 HydrophobicContact CG-CD1 4.12Å; L99-L103 WeakPolarHBondContact O-CG 3.31Å; L99-L103 PolarHBondContact O-N 3.34Å
100F92.9Very high89.6Confident16 Ų1661.6 Ų61.67%0.0734%0.343CS..Hα-helixtrans-60-47178.6-174.6-98.8000111.4V79 V96 E97 R98 Q102 L103 V104 V116 G120 L122V79-F100 HydrophobicContact CG1-CD2 4.34Å; V79-F100 HydrophobicContact CG1-CE2 4.36Å; V79-F100 HydrophobicContact CG2-CE2 4.3Å; V79-F100 HydrophobicContact CG2-CZ 4.32Å; V96-F100 WeakPolarHBondContact O-CB 3.32Å; V96-F100 PolarHBondContact O-N 3.01Å; E97-F100 PolarHBondContact O-N 3.36Å; R98-F100 VanDerWaalsContact C-N 3.32Å; R98-F100 PolarHBondContact O-N 3.36Å; F100-Q102 VanDerWaalsContact C-N 3.29Å; F100-Q102 PolarHBondContact O-N 3.47Å; F100-L103 PolarHBondContact O-N 3.42Å; F100-L103 VanDerWaalsContact O-N 3.13Å; F100-V104 HydrophobicContact CD1-CG2 4.18Å; F100-V104 HydrophobicContact CE1-CG2 3.89Å; F100-V104 HydrophobicContact CZ-CG2 4.29Å; F100-V104 WeakPolarHBondContact O-CG2 3.41Å; F100-V104 PolarHBondContact O-N 2.95Å; F100-V116 HydrophobicContact CD2-CG1 4.43Å; F100-V116 HydrophobicContact CD2-CG2 4.27Å; F100-V116 HydrophobicContact CE2-CG1 3.92Å; F100-V116 HydrophobicContact CE2-CG2 3.98Å; F100-V116 HydrophobicContact CZ-CG1 4.14Å; F100-G120 WeakPolarHBondContact CZ-O 3.36Å; F100-L122 HydrophobicContact CE2-CB 4.38Å
101S91.9Very high89.5Confident59 Ų5960 Ų6041%0.41333%0.332SS..Hα-helixtrans-58.5-42.4177.7-54.10000111.6E97 R98 L99 L103 V104 E105E97-S101 PolarHBondContact O-N 3.13Å; E97-S101 PolarHBondContact O-OG 3.31Å; R98-S101 PolarHBondContact O-N 2.97Å; L99-S101 PolarHBondContact O-N 2.68Å; S101-L103 PolarHBondContact O-N 2.86Å; S101-V104 WeakPolarHBondContact O-CB 3.43Å; S101-V104 PolarHBondContact O-N 3.44Å; S101-E105 WeakPolarHBondContact O-CG 3.34Å; S101-E105 PolarHBondContact O-N 3.49Å
102Q87.9Confident89.4Confident36 Ų3660.7 Ų60.717%0.16832%0.324CS..Hα-helixtrans-64.7-37.6176.6-70.4172.1-21.200112.9Y25 R98 L99 F100 V104 E105 S106Y25-Q102 VanDerWaalsContact CE2-CD 3.45Å; Y25-Q102 HydrophobicContact CE2-CG 4.47Å; R98-Q102 VanDerWaalsContact O-CG 3.31Å; R98-Q102 WeakPolarHBondContact O-CG 3.48Å; R98-Q102 PolarHBondContact O-N 3.29Å; L99-Q102 PolarHBondContact O-N 2.97Å; F100-Q102 VanDerWaalsContact C-N 3.29Å; F100-Q102 PolarHBondContact O-N 3.47Å; Q102-V104 VanDerWaalsContact C-N 3.31Å; Q102-E105 PolarHBondContact O-N 3.41Å; Q102-S106 WeakPolarHBondContact O-CB 3.46Å; Q102-S106 PolarHBondContact O-N 2.82Å; Q102-S106 PolarHBondContact O-OG 3.03Å
103L90.7Very high89.4Confident4 Ų458.4 Ų58.42%0.02131%0.309CS..Hα-helixtrans-67.8-33175-67.8171.2000112L99 F100 S101 G107 N108 A110 L111 V116L99-L103 HydrophobicContact CD1-CD1 4.3Å; L99-L103 HydrophobicContact CD1-CG 4.27Å; L99-L103 HydrophobicContact CG-CD1 4.12Å; L99-L103 WeakPolarHBondContact O-CG 3.31Å; L99-L103 PolarHBondContact O-N 3.34Å; F100-L103 PolarHBondContact O-N 3.42Å; F100-L103 VanDerWaalsContact O-N 3.13Å; S101-L103 PolarHBondContact O-N 2.86Å; L103-G107 WeakPolarHBondContact O-CA 3.32Å; L103-G107 PolarHBondContact O-N 3.46Å; L103-N108 HydrophobicContact CD2-CB 4.31Å; L103-A110 HydrophobicContact CD2-CB 3.76Å; L103-L111 HydrophobicContact CD1-CD1 3.47Å; L103-L111 VanDerWaalsContact CD1-CD1 3.47Å; L103-L111 HydrophobicContact CD1-CD2 4.27Å; L103-L111 HydrophobicContact CD1-CG 3.69Å; L103-V116 HydrophobicContact CB-CB 4.12Å; L103-V116 HydrophobicContact CB-CG1 4.17Å; L103-V116 HydrophobicContact CB-CG2 4.18Å; L103-V116 HydrophobicContact CD1-CG2 4.29Å
104V92.3Very high89.4Confident42 Ų4258.4 Ų58.426%0.25531%0.313SS..Hα-helixtrans-65.3-42.5172.9177.90000111.6F100 S101 Q102 V116F100-V104 HydrophobicContact CD1-CG2 4.18Å; F100-V104 HydrophobicContact CE1-CG2 3.89Å; F100-V104 HydrophobicContact CZ-CG2 4.29Å; F100-V104 WeakPolarHBondContact O-CG2 3.41Å; F100-V104 PolarHBondContact O-N 2.95Å; S101-V104 WeakPolarHBondContact O-CB 3.43Å; S101-V104 PolarHBondContact O-N 3.44Å; Q102-V104 VanDerWaalsContact C-N 3.31Å; V104-V116 HydrophobicContact CB-CG1 4.4Å; V104-V116 HydrophobicContact CG2-CG1 3.48Å; V104-V116 VanDerWaalsContact CG2-CG1 3.48Å
105E89.6Confident89.5Confident164 Ų16452.5 Ų52.577%0.76630%0.297SS*.Hα-helixtrans-73.7-45.5-177.8-71.2171.3-175.700112.4S101 Q102S101-E105 WeakPolarHBondContact O-CG 3.34Å; S101-E105 PolarHBondContact O-N 3.49Å; Q102-E105 PolarHBondContact O-N 3.41Å
106S85.5Confident89.7Confident58 Ų5850.3 Ų50.341%0.40628%0.28SS..Hα-helixtrans-81.3-28.2-176.660.50000114Q102 N108Q102-S106 WeakPolarHBondContact O-CB 3.46Å; Q102-S106 PolarHBondContact O-N 2.82Å; Q102-S106 PolarHBondContact O-OG 3.03Å; S106-N108 WeakPolarHBondContact CB-ND2 3.5Å; S106-N108 PolarHBondContact O-N 2.81Å; S106-N108 PolarHBondContact OG-N 2.88Å; S106-N108 PolarHBondContact OG-ND2 3.05Å
107G85.9Confident89.7Confident50 Ų5048.2 Ų48.252%0.51527%0.272SS..  trans68.511.1-171.700000114.4L103L103-G107 WeakPolarHBondContact O-CA 3.32Å; L103-G107 PolarHBondContact O-N 3.46Å
108N86.2Confident89.3Confident35 Ų3550.4 Ų50.419%0.18729%0.292CS..  trans-62.7131.5-176.5-74-25000111.9F17 L103 S106 A110F17-N108 WeakPolarHBondContact CD2-ND2 3.41Å; L103-N108 HydrophobicContact CD2-CB 4.31Å; S106-N108 WeakPolarHBondContact CB-ND2 3.5Å; S106-N108 PolarHBondContact O-N 2.81Å; S106-N108 PolarHBondContact OG-N 2.88Å; S106-N108 PolarHBondContact OG-ND2 3.05Å; N108-A110 PolarHBondContact O-N 2.99Å
109P85.1Confident89.2Confident66 Ų6654.2 Ų54.243%0.42931%0.311SS..  trans-80.646.8-177.834.9-37000112.5R19 L111R19-P109 HydrophobicContact CG-CG 4.21Å; P109-L111 VanDerWaalsContact C-N 3.26Å; P109-L111 PolarHBondContact O-N 3.22Å
110A87.7Confident89.3Confident1 Ų152.5 Ų52.51%0.00830%0.302CS..THydrogen-bonded Turntrans-72.7-18.4-173.100000114R20 Q21 I22 L103 N108R20-A110 WeakPolarHBondContact CA-O 3.46Å; Q21-A110 WeakPolarHBondContact O-CB 3.22Å; I22-A110 HydrophobicContact CG2-CB 3.38Å; L103-A110 HydrophobicContact CD2-CB 3.76Å; N108-A110 PolarHBondContact O-N 2.99Å
111L87.9Confident89.4Confident46 Ų4654.2 Ų54.224%0.24131%0.314CS..THydrogen-bonded Turntrans-106.314.6-172.9-57.3-174.8000114L103 P109 L114 V116L103-L111 HydrophobicContact CD1-CD1 3.47Å; L103-L111 VanDerWaalsContact CD1-CD1 3.47Å; L103-L111 HydrophobicContact CD1-CD2 4.27Å; L103-L111 HydrophobicContact CD1-CG 3.69Å; P109-L111 VanDerWaalsContact C-N 3.26Å; P109-L111 PolarHBondContact O-N 3.22Å; L111-L114 CarbonylContact C-O 3.56Å; L111-L114 VanDerWaalsContact C-O 3.26Å; L111-L114 HydrophobicContact CB-CB 4.04Å; L111-L114 WeakPolarHBondContact O-CA 3.38Å; L111-L114 VanDerWaalsContact O-CB 3.32Å; L111-L114 WeakPolarHBondContact O-CB 3.36Å; L111-L114 PolarHBondContact O-N 2.98Å; L111-V116 HydrophobicContact CD1-CG2 4.07Å
112E86.2Confident89.6Confident56 Ų5653 Ų5326%0.26230%0.303SS..THydrogen-bonded Turntrans-47.5130.2-178.3-166.8173.2179.300111R19 R20 L114 T125R19-E112 VanDerWaalsContact CD-OE2 3.27Å; R19-E112 WeakPolarHBondContact CD-OE2 3.41Å; R19-E112 IonicContact CZ-OE2 3.74Å; R19-E112 IonicContact NE-OE2 3.3Å; R19-E112 IonicContact NH1-OE1 2.81Å; R19-E112 PolarHBondContact NH1-OE1 2.96Å; R19-E112 IonicContact NH1-OE2 3.55Å; R19-E112 PolarHBondContact NH1-OE2 3.18Å; R20-E112 PolarHBondContact NH1-O 3.36Å; E112-L114 PolarHBondContact N-O 3.34Å; E112-T125 HydrophobicContact CG-CG2 4.14Å
113P89.3Confident89.9Confident10 Ų1052.3 Ų52.37%0.06530%0.302CS..THydrogen-bonded Turncis-84.33.812.238.3-38.5000115.9L41 L43 V124 T125 C128 L138L41-P113 HydrophobicContact CD1-CG 4.48Å; L43-P113 HydrophobicContact CD1-CB 4.07Å; L43-P113 HydrophobicContact CD1-CG 3.88Å; P113-V124 CarbonylContact O-C 3.53Å; P113-V124 WeakPolarHBondContact O-CA 3.28Å; P113-T125 WeakPolarHBondContact O-CG2 3.33Å; P113-T125 PolarHBondContact O-N 3.26Å; P113-C128 HydrophobicContact CB-CB 4.13Å; P113-L138 HydrophobicContact CG-CD1 4.4Å
114L91.4Very high90.1Very high57 Ų5752.8 Ų52.830%0.29831%0.305SS..EExtended strand (participates in β ladder)trans-80.9146.5172.6-56.6177.1000110.5L111 E112 L122 S123 V124L111-L114 CarbonylContact C-O 3.56Å; L111-L114 VanDerWaalsContact C-O 3.26Å; L111-L114 HydrophobicContact CB-CB 4.04Å; L111-L114 WeakPolarHBondContact O-CA 3.38Å; L111-L114 VanDerWaalsContact O-CB 3.32Å; L111-L114 WeakPolarHBondContact O-CB 3.36Å; L111-L114 PolarHBondContact O-N 2.98Å; E112-L114 PolarHBondContact N-O 3.34Å; L114-L122 HydrophobicContact CB-CD1 4.22Å; L114-S123 CarbonylContact C-O 3.6Å; L114-S123 WeakPolarHBondContact CA-O 3.39Å; L114-V124 HydrophobicContact CD2-CG1 3.9Å
115T92.6Very high90Very high53 Ų5352 Ų5233%0.32530%0.3SS..EExtended strand (participates in β ladder)trans-123.2136.5177.7560000110L122 S123 T125T115-L122 CarbonylContact O-C 3.58Å; T115-L122 WeakPolarHBondContact O-CA 3.5Å; T115-S123 PolarHBondContact N-O 3.04Å; T115-S123 PolarHBondContact O-N 2.87Å; T115-T125 HydrophobicContact CG2-CG2 3.57Å
116V94Very high90.1Very high22 Ų2253.8 Ų53.813%0.13330%0.3CS..EExtended strand (participates in β ladder)trans-108.3107.6171.1-178.10000106.8F100 L103 V104 L111 L122F100-V116 HydrophobicContact CD2-CG1 4.43Å; F100-V116 HydrophobicContact CD2-CG2 4.27Å; F100-V116 HydrophobicContact CE2-CG1 3.92Å; F100-V116 HydrophobicContact CE2-CG2 3.98Å; F100-V116 HydrophobicContact CZ-CG1 4.14Å; L103-V116 HydrophobicContact CB-CB 4.12Å; L103-V116 HydrophobicContact CB-CG1 4.17Å; L103-V116 HydrophobicContact CB-CG2 4.18Å; L103-V116 HydrophobicContact CD1-CG2 4.29Å; V104-V116 HydrophobicContact CB-CG1 4.4Å; V104-V116 HydrophobicContact CG2-CG1 3.48Å; V104-V116 VanDerWaalsContact CG2-CG1 3.48Å; L111-V116 HydrophobicContact CD1-CG2 4.07Å; V116-L122 HydrophobicContact CG2-CD1 3.9Å
117G91.3Very high90.3Very high21 Ų2154.3 Ų54.322%0.21630%0.303CS..EExtended strand (participates in β ladder)trans-87.9175-18000000113.1G120 V121G117-G120 PolarHBondContact O-N 3.08Å; G117-G120 VanDerWaalsContact O-N 3.09Å; G117-V121 PolarHBondContact N-O 3.41Å
118P85.8Confident90.6Very high110 Ų11052 Ų5271%0.71428%0.279SS*.G310 helixtrans-54.1147.3174.1-23.433.3000111.5G120P118-G120 PolarHBondContact O-N 2.94Å
119K88.8Confident90.9Very high197 Ų19751.2 Ų51.286%0.85728%0.275SS*.G310 helixtrans62.717.8-174.9-49.1175.5178.1178.10113.8S76S76-K119 PolarHBondContact OG-O 3.09Å
120G92.1Very high91.2Very high0 Ų051.4 Ų51.40%028%0.275CS..G310 helixtrans64.840.3175.600000114.5S76 F100 G117 P118S76-G120 PolarHBondContact N-O 3.32Å; S76-G120 VanDerWaalsContact OG-C 3.26Å; S76-G120 WeakPolarHBondContact OG-CA 3.28Å; S76-G120 PolarHBondContact OG-O 3.42Å; F100-G120 WeakPolarHBondContact CZ-O 3.36Å; G117-G120 PolarHBondContact O-N 3.08Å; G117-G120 VanDerWaalsContact O-N 3.09Å; P118-G120 PolarHBondContact O-N 2.94Å
121V95.4Very high91.4Very high51 Ų5153.9 Ų53.931%0.30929%0.288SS..EExtended strand (participates in β ladder)trans-81112.9166.9173.10000108.7V73 G117V73-V121 HydrophobicContact CB-CG1 4.5Å; V73-V121 HydrophobicContact CG1-CG1 3.91Å; V73-V121 HydrophobicContact CG2-CG1 4.22Å; G117-V121 PolarHBondContact N-O 3.41Å
122L95.8Very high91.6Very high34 Ų3452.1 Ų52.118%0.17828%0.28CS..EExtended strand (participates in β ladder)trans-85.1134.4171.1-179.874000109.4V74 V79 F100 L114 T115 V116V74-L122 HydrophobicContact CB-CB 4.18Å; V74-L122 PolarHBondContact N-O 3.25Å; V74-L122 PolarHBondContact O-N 3.03Å; V79-L122 HydrophobicContact CG2-CB 4.19Å; V79-L122 HydrophobicContact CG2-CD2 3.91Å; F100-L122 HydrophobicContact CE2-CB 4.38Å; L114-L122 HydrophobicContact CB-CD1 4.22Å; T115-L122 CarbonylContact O-C 3.58Å; T115-L122 WeakPolarHBondContact O-CA 3.5Å; V116-L122 HydrophobicContact CG2-CD1 3.9Å
123S95.1Very high91.9Very high22 Ų2255.3 Ų55.315%0.15429%0.293CS..EExtended strand (participates in β ladder)trans-150.9-164.7174.1-156.20000111.7M72 L114 T115M72-S123 WeakPolarHBondContact O-CA 3.25Å; M72-S123 WeakPolarHBondContact O-CB 3.39Å; M72-S123 PolarHBondContact O-OG 3.47Å; L114-S123 CarbonylContact C-O 3.6Å; L114-S123 WeakPolarHBondContact CA-O 3.39Å; T115-S123 PolarHBondContact N-O 3.04Å; T115-S123 PolarHBondContact O-N 2.87Å
124V93.6Very high92Very high14 Ų1457.3 Ų57.39%0.08530%0.301CS..EExtended strand (participates in β ladder)trans-112.3152174.2-720000110.7M72 P113 L114 M129 L135 L138M72-V124 HydrophobicContact CB-CG2 4.14Å; M72-V124 HydrophobicContact CG-CG2 3.97Å; M72-V124 HydrophobicContact SD-CG2 4.14Å; P113-V124 CarbonylContact O-C 3.53Å; P113-V124 WeakPolarHBondContact O-CA 3.28Å; L114-V124 HydrophobicContact CD2-CG1 3.9Å; V124-M129 HydrophobicContact CG2-CB 3.96Å; V124-M129 HydrophobicContact CG2-CG 4.36Å; V124-L135 HydrophobicContact CG2-CD2 4.31Å; V124-L138 HydrophobicContact CG1-CD2 3.77Å
125T91.9Very high92Very high24 Ų2454.7 Ų54.715%0.14729%0.287CS..  trans-58.2148.5173.656.80000111.1E112 P113 T115 S127 C128 M129E112-T125 HydrophobicContact CG-CG2 4.14Å; P113-T125 WeakPolarHBondContact O-CG2 3.33Å; P113-T125 PolarHBondContact O-N 3.26Å; T115-T125 HydrophobicContact CG2-CG2 3.57Å; T125-S127 VanDerWaalsContact C-N 3.26Å; T125-S127 PolarHBondContact O-N 2.96Å; T125-S127 PolarHBondContact OG1-OG 3.23Å; T125-C128 WeakPolarHBondContact O-CB 3.29Å; T125-C128 PolarHBondContact O-N 3.34Å; T125-C128 VanDerWaalsContact O-N 3.08Å; T125-C128 VanDerWaalsContact OG1-CB 3.31Å; T125-C128 WeakPolarHBondContact OG1-CB 3.35Å; T125-C128 PolarHBondContact OG1-N 3.1Å; T125-M129 PolarHBondContact O-N 2.85Å
126R90.8Very high91.9Very high202 Ų20252.5 Ų52.576%0.76227%0.273SS*.Hα-helixtrans-57.5-40.9179.2-166.2178.1-155.9-179.76.4112.3C128 M129 T130R126-C128 VanDerWaalsContact C-N 3.3Å; R126-C128 PolarHBondContact O-N 3.1Å; R126-M129 PolarHBondContact O-N 3.45Å; R126-T130 HydrophobicContact CG-CG2 4.46Å; R126-T130 WeakPolarHBondContact O-CG2 3.48Å; R126-T130 PolarHBondContact O-N 3.39Å; R126-T130 PolarHBondContact O-OG1 3.04Å; R126-T130 VanDerWaalsContact O-OG1 3.06Å
127S89.9Confident91.7Very high69 Ų6951.9 Ų51.948%0.48327%0.269SS..Hα-helixtrans-61.6-37.4177.652.70000112.4T125 T130T125-S127 VanDerWaalsContact C-N 3.26Å; T125-S127 PolarHBondContact O-N 2.96Å; T125-S127 PolarHBondContact OG1-OG 3.23Å; S127-T130 PolarHBondContact O-OG1 2.99Å
128C91.7Very high91.6Very high2 Ų251.7 Ų51.71%0.01426%0.263CS..Hα-helixtrans-69.9-47.9173-1720000110.7P113 T125 R126 T130 D131P113-C128 HydrophobicContact CB-CB 4.13Å; T125-C128 WeakPolarHBondContact O-CB 3.29Å; T125-C128 PolarHBondContact O-N 3.34Å; T125-C128 VanDerWaalsContact O-N 3.08Å; T125-C128 VanDerWaalsContact OG1-CB 3.31Å; T125-C128 WeakPolarHBondContact OG1-CB 3.35Å; T125-C128 PolarHBondContact OG1-N 3.1Å; R126-C128 VanDerWaalsContact C-N 3.3Å; R126-C128 PolarHBondContact O-N 3.1Å; C128-T130 VanDerWaalsContact C-N 3.33Å; C128-T130 PolarHBondContact O-N 3.35Å; C128-D131 PolarHBondContact O-N 3.4Å; C128-D131 VanDerWaalsContact O-N 3.09Å; C128-D131 VanDerWaalsContact O-O 3.12Å
129M92.3Very high91.7Very high18 Ų1850.6 Ų50.69%0.08925%0.247CC..Hα-helixtrans-60.6-37.9-176.1-170.5171.562.600113.7H60 L68 M72 V124 T125 R126 D131 L135H60-M129 PolarHBondContact NE2-O 3.47Å; L68-M129 HydrophobicContact CD2-CG 3.57Å; L68-M129 HydrophobicContact CD2-SD 4.4Å; L68-M129 HydrophobicContact CG-CG 3.84Å; L68-M129 HydrophobicContact CG-SD 4.17Å; M72-M129 HydrophobicContact CB-SD 4.46Å; M72-M129 HydrophobicContact CG-CG 4.43Å; M72-M129 HydrophobicContact CG-SD 4.08Å; V124-M129 HydrophobicContact CG2-CB 3.96Å; V124-M129 HydrophobicContact CG2-CG 4.36Å; T125-M129 PolarHBondContact O-N 2.85Å; R126-M129 PolarHBondContact O-N 3.45Å; M129-D131 VanDerWaalsContact C-N 3.3Å; M129-L135 VanDerWaalsContact O-CD1 3.27Å; M129-L135 WeakPolarHBondContact O-CD1 3.34Å
130T91.6Very high91.6Very high71 Ų7147.8 Ų47.844%0.43623%0.232SC..THydrogen-bonded Turntrans-77.5-15.8179.153.30000113.6R126 S127 C128R126-T130 HydrophobicContact CG-CG2 4.46Å; R126-T130 WeakPolarHBondContact O-CG2 3.48Å; R126-T130 PolarHBondContact O-N 3.39Å; R126-T130 PolarHBondContact O-OG1 3.04Å; R126-T130 VanDerWaalsContact O-OG1 3.06Å; S127-T130 PolarHBondContact O-OG1 2.99Å; C128-T130 VanDerWaalsContact C-N 3.33Å; C128-T130 PolarHBondContact O-N 3.35Å
131D92.6Very high91.3Very high52 Ų5248.7 Ų48.728%0.27824%0.238SC..  trans-101.1101.7179.8-174.2-24.5000110.1C128 M129 K133 K134 L135C128-D131 PolarHBondContact O-N 3.4Å; C128-D131 VanDerWaalsContact O-N 3.09Å; C128-D131 VanDerWaalsContact O-O 3.12Å; M129-D131 VanDerWaalsContact C-N 3.3Å; D131-K133 PolarHBondContact O-N 3.01Å; D131-K133 VanDerWaalsContact O-N 3.16Å; D131-K133 WeakPolarHBondContact OD1-CA 3.27Å; D131-K133 WeakPolarHBondContact OD1-CB 3.33Å; D131-K133 PolarHBondContact OD1-N 3.07Å; D131-K134 HydrophobicContact CB-CB 3.92Å; D131-K134 HydrophobicContact CB-CD 3.88Å; D131-K134 HydrophobicContact CB-CG 3.91Å; D131-K134 PolarHBondContact O-N 2.96Å; D131-K134 PolarHBondContact OD1-N 3.3Å; D131-K134 WeakPolarHBondContact OD2-CD 3.2Å; D131-K134 VanDerWaalsContact OD2-CE 3.31Å; D131-K134 WeakPolarHBondContact OD2-CE 3.32Å; D131-K134 WeakPolarHBondContact OD2-CG 3.41Å; D131-L135 PolarHBondContact O-N 2.89Å
132A92.6Very high90.9Very high10 Ų1046.8 Ų46.88%0.08323%0.226CC..Hα-helixtrans-55.7-32.8179.600000113.1F56 I57 H60 Y136F56-A132 HydrophobicContact CD1-CB 4.44Å; F56-A132 HydrophobicContact CE1-CB 4.41Å; F56-A132 VanDerWaalsContact CE1-O 3.24Å; F56-A132 WeakPolarHBondContact CE1-O 3.31Å; I57-A132 HydrophobicContact CB-CB 4.39Å; I57-A132 HydrophobicContact CG1-CB 3.91Å; H60-A132 HydrophobicContact CB-CB 3.93Å; A132-Y136 VanDerWaalsContact O-CB 3.28Å; A132-Y136 WeakPolarHBondContact O-CB 3.19Å; A132-Y136 PolarHBondContact O-N 3.41Å
133K91.4Very high90.3Very high123 Ų12346 Ų4654%0.53523%0.226SC..Hα-helixtrans-71-42.3178.6-64.6178.9-179.9175.80110.4L53 I57 D131 Y136 T137L53-K133 HydrophobicContact CD1-CG 4.39Å; I57-K133 HydrophobicContact CD1-CG 4.04Å; D131-K133 PolarHBondContact O-N 3.01Å; D131-K133 VanDerWaalsContact O-N 3.16Å; D131-K133 WeakPolarHBondContact OD1-CA 3.27Å; D131-K133 WeakPolarHBondContact OD1-CB 3.33Å; D131-K133 PolarHBondContact OD1-N 3.07Å; K133-Y136 PolarHBondContact O-N 2.85Å; K133-T137 WeakPolarHBondContact O-CB 3.39Å; K133-T137 PolarHBondContact O-N 3.27Å; K133-T137 PolarHBondContact O-OG1 3.04Å
134K91.2Very high89.7Confident52 Ų5247.6 Ų47.623%0.22624%0.237CC..Hα-helixtrans-62.7-46176.7-71.3-175.4-177.3-174.60111.9L43 D44 D131 Y136 T137 L138L43-K134 HydrophobicContact CB-CB 4.31Å; L43-K134 HydrophobicContact CB-CD 4.49Å; L43-K134 HydrophobicContact CB-CG 3.96Å; L43-K134 HydrophobicContact CD1-CB 4.07Å; L43-K134 HydrophobicContact CD1-CD 4.38Å; L43-K134 HydrophobicContact CD1-CG 4.29Å; D44-K134 VanDerWaalsContact OD1-CE 3.22Å; D44-K134 WeakPolarHBondContact OD1-CE 3.33Å; D44-K134 IonicContact OD1-NZ 3.88Å; D131-K134 HydrophobicContact CB-CB 3.92Å; D131-K134 HydrophobicContact CB-CD 3.88Å; D131-K134 HydrophobicContact CB-CG 3.91Å; D131-K134 PolarHBondContact O-N 2.96Å; D131-K134 PolarHBondContact OD1-N 3.3Å; D131-K134 WeakPolarHBondContact OD2-CD 3.2Å; D131-K134 VanDerWaalsContact OD2-CE 3.31Å; D131-K134 WeakPolarHBondContact OD2-CE 3.32Å; D131-K134 WeakPolarHBondContact OD2-CG 3.41Å; K134-Y136 PolarHBondContact O-N 2.81Å; K134-T137 PolarHBondContact O-N 3.3Å; K134-L138 WeakPolarHBondContact O-CB 3.4Å; K134-L138 PolarHBondContact O-N 3.31Å
135L91.4Very high89.2Confident1 Ų151.3 Ų51.31%0.00525%0.252CS..Hα-helixtrans-60.9-43.9174.1-77.7-179.8000112.4F56 L68 M72 V124 M129 D131 T137 L138 F139F56-L135 HydrophobicContact CE1-CB 4.16Å; F56-L135 HydrophobicContact CZ-CB 4.18Å; L68-L135 HydrophobicContact CD2-CD1 4.48Å; M72-L135 HydrophobicContact CE-CD1 4.08Å; M72-L135 HydrophobicContact CE-CD2 4.18Å; V124-L135 HydrophobicContact CG2-CD2 4.31Å; M129-L135 VanDerWaalsContact O-CD1 3.27Å; M129-L135 WeakPolarHBondContact O-CD1 3.34Å; D131-L135 PolarHBondContact O-N 2.89Å; L135-T137 PolarHBondContact O-N 3.02Å; L135-L138 PolarHBondContact O-N 3.16Å; L135-F139 HydrophobicContact CB-CE2 4.28Å; L135-F139 HydrophobicContact CD2-CE2 4.08Å; L135-F139 HydrophobicContact CD2-CZ 3.83Å; L135-F139 WeakPolarHBondContact O-CD2 3.15Å; L135-F139 WeakPolarHBondContact O-CG 3.5Å; L135-F139 PolarHBondContact O-N 3.01Å
136Y91.1Very high88.8Confident8 Ų853.6 Ų53.63%0.03126%0.263CS..Hα-helixtrans-60.7-46.8177.2-175.9-97.7000111.6N48 Q52 L53 F56 A132 K133 K134 L138 F139 Y140N48-Y136 HydrophobicContact CB-CD1 4.41Å; N48-Y136 HydrophobicContact CB-CE1 3.87Å; N48-Y136 VanDerWaalsContact CG-CE1 3.48Å; N48-Y136 WeakPolarHBondContact ND2-CD1 3.31Å; N48-Y136 WeakPolarHBondContact ND2-CE1 3.45Å; Q52-Y136 WeakPolarHBondContact CB-OH 3.35Å; Q52-Y136 PolarHBondContact OE1-OH 2.89Å; L53-Y136 HydrophobicContact CB-CD1 4.48Å; L53-Y136 HydrophobicContact CB-CE1 4.23Å; L53-Y136 HydrophobicContact CD1-CD1 3.63Å; L53-Y136 HydrophobicContact CD1-CD2 4.39Å; L53-Y136 HydrophobicContact CD1-CE1 4.23Å; L53-Y136 HydrophobicContact CD1-CG 3.71Å; F56-Y136 HydrophobicContact CB-CD2 3.62Å; F56-Y136 HydrophobicContact CB-CE2 4.05Å; F56-Y136 AromaticContact CD1-CD2 3.94Å; F56-Y136 HydrophobicContact CD1-CD2 3.94Å; F56-Y136 HydrophobicContact CD1-CG 4.29Å; F56-Y136 AromaticContact CD2-CD2 3.77Å; F56-Y136 HydrophobicContact CD2-CD2 3.77Å; F56-Y136 HydrophobicContact CD2-CE2 4.47Å; F56-Y136 HydrophobicContact CE2-CD2 4.41Å; F56-Y136 AromaticContact CG-CD2 3.49Å; F56-Y136 HydrophobicContact CG-CD2 3.49Å; F56-Y136 VanDerWaalsContact CG-CD2 3.49Å; F56-Y136 HydrophobicContact CG-CE2 4.31Å; F56-Y136 HydrophobicContact CG-CG 4.29Å; A132-Y136 VanDerWaalsContact O-CB 3.28Å; A132-Y136 WeakPolarHBondContact O-CB 3.19Å; A132-Y136 PolarHBondContact O-N 3.41Å; K133-Y136 PolarHBondContact O-N 2.85Å; K134-Y136 PolarHBondContact O-N 2.81Å; Y136-L138 VanDerWaalsContact C-N 3.34Å; Y136-L138 PolarHBondContact O-N 3.49Å; Y136-F139 PolarHBondContact O-N 3.27Å; Y136-Y140 AromaticContact CD2-CD2 3.44Å; Y136-Y140 HydrophobicContact CD2-CD2 3.44Å; Y136-Y140 VanDerWaalsContact CD2-CD2 3.44Å; Y136-Y140 AromaticContact CD2-CE2 3.95Å; Y136-Y140 HydrophobicContact CD2-CE2 3.95Å; Y136-Y140 HydrophobicContact CD2-CG 4.21Å; Y136-Y140 AromaticContact CE2-CD2 3.56Å; Y136-Y140 HydrophobicContact CE2-CD2 3.56Å; Y136-Y140 HydrophobicContact CE2-CE2 4.09Å; Y136-Y140 AromaticContact CE2-CG 3.93Å; Y136-Y140 HydrophobicContact CE2-CG 3.93Å; Y136-Y140 HydrophobicContact CG-CD2 4.16Å; Y136-Y140 WeakPolarHBondContact O-CB 3.29Å; Y136-Y140 PolarHBondContact O-N 2.97Å
137T89.6Confident88.5Confident8 Ų848.4 Ų48.45%0.04925%0.25CC..Iπ-helixtrans-60.8-43.7177.2-60.50000111.2L43 K133 K134 L135 V141 H142L43-T137 HydrophobicContact CD2-CG2 4.19Å; K133-T137 WeakPolarHBondContact O-CB 3.39Å; K133-T137 PolarHBondContact O-N 3.27Å; K133-T137 PolarHBondContact O-OG1 3.04Å; K134-T137 PolarHBondContact O-N 3.3Å; L135-T137 PolarHBondContact O-N 3.02Å; T137-V141 HydrophobicContact CG2-CB 4.27Å; T137-V141 HydrophobicContact CG2-CG2 4.36Å; T137-V141 WeakPolarHBondContact O-CA 3.49Å; T137-V141 WeakPolarHBondContact O-CB 3.43Å; T137-V141 PolarHBondContact O-N 3.1Å; T137-V141 VanDerWaalsContact O-N 3.09Å; T137-H142 PolarHBondContact O-N 3.31Å
138L88.9Confident88.3Confident17 Ų1750.3 Ų50.39%0.08926%0.255CS..Iπ-helixtrans-59.7-50.7177.6-177.363000111.6L41 L43 P113 V124 K134 L135 Y136 G143L41-L138 HydrophobicContact CD2-CD1 4.48Å; L43-L138 HydrophobicContact CD2-CB 4.03Å; L43-L138 HydrophobicContact CD2-CD1 4.46Å; P113-L138 HydrophobicContact CG-CD1 4.4Å; V124-L138 HydrophobicContact CG1-CD2 3.77Å; K134-L138 WeakPolarHBondContact O-CB 3.4Å; K134-L138 PolarHBondContact O-N 3.31Å; L135-L138 PolarHBondContact O-N 3.16Å; Y136-L138 VanDerWaalsContact C-N 3.34Å; Y136-L138 PolarHBondContact O-N 3.49Å; L138-G143 PolarHBondContact O-N 3.19Å
139F89Confident87.9Confident88 Ų8856.2 Ų56.239%0.38628%0.284SS..Iπ-helixtrans-77.7-42.8-174-61.3-25.9000114F56 M72 L135 Y136 G143F56-F139 HydrophobicContact CZ-CD2 4.45Å; M72-F139 HydrophobicContact CE-CE2 3.8Å; M72-F139 HydrophobicContact CE-CZ 3.66Å; M72-F139 HydrophobicContact SD-CE2 4.42Å; M72-F139 HydrophobicContact SD-CZ 3.67Å; L135-F139 HydrophobicContact CB-CE2 4.28Å; L135-F139 HydrophobicContact CD2-CE2 4.08Å; L135-F139 HydrophobicContact CD2-CZ 3.83Å; L135-F139 WeakPolarHBondContact O-CD2 3.15Å; L135-F139 WeakPolarHBondContact O-CG 3.5Å; L135-F139 PolarHBondContact O-N 3.01Å; Y136-F139 PolarHBondContact O-N 3.27Å; F139-G143 WeakPolarHBondContact O-CA 3.44Å
140Y86.8Confident87.5Confident138 Ų13857.8 Ų57.854%0.54129%0.292SS..Iπ-helixtrans-101.7-25-168.6-67.8-81.6000113.9F56 Y136 S144F56-Y140 AromaticContact CD2-CE2 3.9Å; F56-Y140 HydrophobicContact CD2-CE2 3.9Å; F56-Y140 AromaticContact CE2-CE2 3.81Å; F56-Y140 HydrophobicContact CE2-CE2 3.81Å; Y136-Y140 AromaticContact CD2-CD2 3.44Å; Y136-Y140 HydrophobicContact CD2-CD2 3.44Å; Y136-Y140 VanDerWaalsContact CD2-CD2 3.44Å; Y136-Y140 AromaticContact CD2-CE2 3.95Å; Y136-Y140 HydrophobicContact CD2-CE2 3.95Å; Y136-Y140 HydrophobicContact CD2-CG 4.21Å; Y136-Y140 AromaticContact CE2-CD2 3.56Å; Y136-Y140 HydrophobicContact CE2-CD2 3.56Å; Y136-Y140 HydrophobicContact CE2-CE2 4.09Å; Y136-Y140 AromaticContact CE2-CG 3.93Å; Y136-Y140 HydrophobicContact CE2-CG 3.93Å; Y136-Y140 HydrophobicContact CG-CD2 4.16Å; Y136-Y140 WeakPolarHBondContact O-CB 3.29Å; Y136-Y140 PolarHBondContact O-N 2.97Å; Y140-S144 PolarHBondContact O-OG 3.3Å
141V85.4Confident87.2Confident19 Ų1959.3 Ų59.312%0.11530%0.298CS..Iπ-helixtrans-101.6-48.8179.7-166.40000112.2H46 N48 T137 S144 K145H46-V141 HydrophobicContact CB-CG1 4.47Å; H46-V141 WeakPolarHBondContact CD2-CG1 3.41Å; N48-V141 WeakPolarHBondContact ND2-CG2 3.36Å; T137-V141 HydrophobicContact CG2-CB 4.27Å; T137-V141 HydrophobicContact CG2-CG2 4.36Å; T137-V141 WeakPolarHBondContact O-CA 3.49Å; T137-V141 WeakPolarHBondContact O-CB 3.43Å; T137-V141 PolarHBondContact O-N 3.1Å; T137-V141 VanDerWaalsContact O-N 3.09Å; V141-S144 PolarHBondContact O-OG 3.41Å; V141-S144 VanDerWaalsContact O-OG 3.1Å; V141-K145 WeakPolarHBondContact O-CG 3.41Å
142H85.8Confident86.9Confident11 Ų1160.5 Ų60.55%0.05132%0.315CS..Iπ-helixtrans-81.3-37.6178.1-65-45000110.9L41 N42 H46 T137 S144 K145 L146L41-H142 HydrophobicContact CD2-CB 4.16Å; N42-H142 PolarHBondContact O-NE2 3.43Å; H46-H142 AromaticContact CD2-CE1 3.93Å; H46-H142 AromaticContact NE2-CE1 3.74Å; T137-H142 PolarHBondContact O-N 3.31Å; H142-S144 VanDerWaalsContact C-N 3.32Å; H142-S144 PolarHBondContact O-N 3.34Å; H142-K145 PolarHBondContact O-N 3.03Å; H142-L146 WeakPolarHBondContact O-CB 3.4Å; H142-L146 VanDerWaalsContact O-CG 3.25Å; H142-L146 WeakPolarHBondContact O-CG 3.37Å; H142-L146 PolarHBondContact O-N 2.9Å
143G84.3Confident86.3Confident18 Ų1862.3 Ų62.319%0.18632%0.323CS..Hα-helixtrans-55.4-42.4177.200000113.9L138 F139 L146 N147L138-G143 PolarHBondContact O-N 3.19Å; F139-G143 WeakPolarHBondContact O-CA 3.44Å; G143-L146 PolarHBondContact O-N 3.02Å; G143-N147 VanDerWaalsContact O-CG 3.32Å; G143-N147 PolarHBondContact O-N 2.78Å; G143-N147 PolarHBondContact O-ND2 3.04Å
144S81.6Confident85.7Confident55 Ų5561.9 Ų61.939%0.38533%0.332SS..Hα-helixtrans-64.7-49.2176.252.50000112.2Y140 V141 H142 L146 N147 D148Y140-S144 PolarHBondContact O-OG 3.3Å; V141-S144 PolarHBondContact O-OG 3.41Å; V141-S144 VanDerWaalsContact O-OG 3.1Å; H142-S144 VanDerWaalsContact C-N 3.32Å; H142-S144 PolarHBondContact O-N 3.34Å; S144-L146 VanDerWaalsContact C-N 3.29Å; S144-L146 PolarHBondContact O-N 2.88Å; S144-N147 WeakPolarHBondContact O-CB 3.49Å; S144-N147 PolarHBondContact O-N 2.82Å; S144-D148 PolarHBondContact O-N 2.69Å
145K83.6Confident84.8Confident91 Ų9165.2 Ų65.240%0.39635%0.347SS..Hα-helixtrans-59.3-39.7176.7-65174.5-172.8174.60112.4H46 V141 H142 D148 M149H46-K145 PolarHBondContact NE2-NZ 2.71Å; H46-K145 VanDerWaalsContact NE2-NZ 3.19Å; V141-K145 WeakPolarHBondContact O-CG 3.41Å; H142-K145 PolarHBondContact O-N 3.03Å; K145-D148 PolarHBondContact O-N 2.77Å; K145-M149 WeakPolarHBondContact O-CG 3.44Å; K145-M149 PolarHBondContact O-N 2.95Å
146L83.8Confident83.3Confident72 Ų7270.2 Ų70.238%0.37738%0.382SS..Hα-helixtrans-68.5-38.7178.6-71.9171.5000111.4H142 G143 S144 M149 I150H142-L146 WeakPolarHBondContact O-CB 3.4Å; H142-L146 VanDerWaalsContact O-CG 3.25Å; H142-L146 WeakPolarHBondContact O-CG 3.37Å; H142-L146 PolarHBondContact O-N 2.9Å; G143-L146 PolarHBondContact O-N 3.02Å; S144-L146 VanDerWaalsContact C-N 3.29Å; S144-L146 PolarHBondContact O-N 2.88Å; L146-M149 HydrophobicContact CD2-SD 4.38Å; L146-M149 PolarHBondContact O-N 2.84Å; L146-I150 WeakPolarHBondContact O-CG1 3.26Å; L146-I150 PolarHBondContact O-N 2.84Å
147N84.1Confident81.7Confident93 Ų9379.8 Ų79.850%0.49742%0.423SS..Hα-helixtrans-61.2-45.6172.6-75.1-18.5000111.1G143 S144 M149 I150 D151G143-N147 VanDerWaalsContact O-CG 3.32Å; G143-N147 PolarHBondContact O-N 2.78Å; G143-N147 PolarHBondContact O-ND2 3.04Å; S144-N147 WeakPolarHBondContact O-CB 3.49Å; S144-N147 PolarHBondContact O-N 2.82Å; N147-M149 VanDerWaalsContact C-N 3.26Å; N147-M149 PolarHBondContact O-N 3.25Å; N147-I150 PolarHBondContact O-N 3.18Å; N147-I150 VanDerWaalsContact O-N 3.12Å; N147-D151 PolarHBondContact O-N 3.48Å
148D85.7Confident79.7Confident110 Ų11092.5 Ų92.559%0.58848%0.478SS*.Hα-helixtrans-58.7-39.1176.4-62.4-25.3000111.6S144 K145 D151 A152S144-D148 PolarHBondContact O-N 2.69Å; K145-D148 PolarHBondContact O-N 2.77Å; D148-D151 PolarHBondContact O-N 2.81Å; D148-A152 WeakPolarHBondContact O-CB 3.31Å; D148-A152 PolarHBondContact O-N 3.15Å
149M84.1Confident79.2Confident126 Ų12696.3 Ų96.362%0.62150%0.498SS*.Hα-helixtrans-66.4-41.3175.7-71.8180-16900112.8K145 L146 N147 D151 A152 I153K145-M149 WeakPolarHBondContact O-CG 3.44Å; K145-M149 PolarHBondContact O-N 2.95Å; L146-M149 HydrophobicContact CD2-SD 4.38Å; L146-M149 PolarHBondContact O-N 2.84Å; N147-M149 VanDerWaalsContact C-N 3.26Å; N147-M149 PolarHBondContact O-N 3.25Å; M149-D151 VanDerWaalsContact C-N 3.34Å; M149-A152 PolarHBondContact O-N 3.39Å; M149-I153 PolarHBondContact O-N 3Å
150I83.6Confident78.7Confident50 Ų5096.7 Ų96.726%0.25650%0.503SS..Hα-helixtrans-63.9-43.3176.4-69.8169.4000109.9L86 L146 N147 A152 I153L86-I150 HydrophobicContact CB-CG2 4.18Å; L146-I150 WeakPolarHBondContact O-CG1 3.26Å; L146-I150 PolarHBondContact O-N 2.84Å; N147-I150 PolarHBondContact O-N 3.18Å; N147-I150 VanDerWaalsContact O-N 3.12Å; I150-A152 VanDerWaalsContact C-N 3.26Å; I150-A152 PolarHBondContact O-N 2.93Å; I150-I153 VanDerWaalsContact O-CB 3.29Å; I150-I153 WeakPolarHBondContact O-CB 3.38Å; I150-I153 WeakPolarHBondContact O-CG1 3.44Å; I150-I153 PolarHBondContact O-N 2.89Å; I150-I153 VanDerWaalsContact O-N 3.1Å
151D83.9Confident78.3Confident104 Ų10494.4 Ų94.456%0.55650%0.501SS*.Hα-helixtrans-66.9-28.8178.5-80.1-35.7000113.1N147 D148 M149 I153 K155N147-D151 PolarHBondContact O-N 3.48Å; D148-D151 PolarHBondContact O-N 2.81Å; M149-D151 VanDerWaalsContact C-N 3.34Å; D151-I153 VanDerWaalsContact C-N 3.27Å; D151-I153 PolarHBondContact O-N 2.86Å; D151-K155 IonicContact OD1-NZ 3.65Å
152A86.3Confident77.8Confident77 Ų7798.9 Ų98.964%0.63652%0.524SS*.THydrogen-bonded Turntrans-74.8-10.1173.700000114D148 M149 I150 P154D148-A152 WeakPolarHBondContact O-CB 3.31Å; D148-A152 PolarHBondContact O-N 3.15Å; M149-A152 PolarHBondContact O-N 3.39Å; I150-A152 VanDerWaalsContact C-N 3.26Å; I150-A152 PolarHBondContact O-N 2.93Å; A152-P154 WeakPolarHBondContact O-CD 3.23Å
153I81.6Confident77.3Confident48 Ų48104.4 Ų104.425%0.24655%0.554CS.*SBendtrans-60.3123.8175.6-64.6172.4000108.4V87 M149 I150 D151 K155V87-I153 HydrophobicContact CG2-CD1 4.46Å; M149-I153 PolarHBondContact O-N 3Å; I150-I153 VanDerWaalsContact O-CB 3.29Å; I150-I153 WeakPolarHBondContact O-CB 3.38Å; I150-I153 WeakPolarHBondContact O-CG1 3.44Å; I150-I153 PolarHBondContact O-N 2.89Å; I150-I153 VanDerWaalsContact O-N 3.1Å; D151-I153 VanDerWaalsContact C-N 3.27Å; D151-I153 PolarHBondContact O-N 2.86Å; I153-K155 WeakPolarHBondContact O-CG 3.43Å; I153-K155 PolarHBondContact O-N 3.4Å
154P77.4Confident76.9Confident114 Ų114110.1 Ų110.174%0.7458%0.578SS**  trans-54.5113.5-178.7-26.133.8000111.2A152A152-P154 WeakPolarHBondContact O-CD 3.23Å
155K73.6Confident76.5Confident122 Ų122114.1 Ų114.153%0.5359%0.592SS.*PPolyproline II helixtrans-80.5123.9172.1-44.4-163.6173.7169.60105.9P88 D151 I153 K157P88-K155 HydrophobicContact CG-CB 4.24Å; P88-K155 HydrophobicContact CG-CG 3.97Å; D151-K155 IonicContact OD1-NZ 3.65Å; I153-K155 WeakPolarHBondContact O-CG 3.43Å; I153-K155 PolarHBondContact O-N 3.4Å; K155-K157 PolarHBondContact O-N 2.74Å
156S59.4Low76Confident105 Ų105115.8 Ų115.873%0.73461%0.607SS**PPolyproline II helixtrans-53.5120.617660.60000108.1K158S156-K158 PolarHBondContact O-N 2.88Å; S156-K158 VanDerWaalsContact O-N 3.07Å
157K56.8Low75.4Confident209 Ų209119.5 Ų119.591%0.90963%0.626SS**PPolyproline II helixtrans-61.2116.2168-68.3-174.9179.4-178.20106K155K155-K157 PolarHBondContact O-N 2.74Å
158K47.8Very low74.6Confident276 Ų276121.9 Ų121.9100%1.264%0.638SS**  trans-620166.1-109.4-174.7176.9-1770109.2S156S156-K158 PolarHBondContact O-N 2.88Å; S156-K158 VanDerWaalsContact O-N 3.07Å

Retrieved 158 of 158 residues in 71.6 ms (Link to these results)

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