A0A087WYB4_HUMAN Loading...

Stomatin-like protein 2, mitochondrial

Mitochondrial protein that probably regulates the biogenesis and the activity of mitochondria. Stimulates cardiolipin biosynthesis, binds cardiolipin-enriched membranes where it recruits and stabilizes some proteins including prohibitin and may therefore act in the organization of functional microdomains in mitochondrial membranes. Through regulation of the mitochondrial function may play a role into several biological processes including cell migration, cell proliferation, T-cell activation, calcium homeostasis and cellular response to stress. May play a role in calcium homeostasis through negative regulation of calcium efflux from mitochondria. Required for mitochondrial hyperfusion a pro-survival cellular response to stress which results in increased ATP production by mitochondria. May also regulate the organization of functional domains at the plasma membrane and play a role in T-cell activation through association with the T-cell receptor signaling complex and its regulation.

AlphaFold DB , UniProt , Accession A0A087WYB4, Species HUMAN (Homo sapiens, Human), Gene STOML2, Length 310 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
1M55.7Low58Low117 Ų11761.9 Ų61.958%0.57634%0.343SS*.  0116.90-174.9166164.800105.1R15 L33M1-R15 HydrophobicContact CE-CB 4.34Å; M1-L33 HydrophobicContact CB-CB 4.41Å; M1-L33 HydrophobicContact CE-CD1 4.15Å; M1-L33 HydrophobicContact CG-CD1 4.15Å; M1-L33 PolarHBondContact O-N 3.42Å
2L58Low58.2Low102 Ų10261.3 Ų61.353%0.53434%0.338SS..EExtended strand (participates in β ladder)trans-112.1132.3-172.4-61.4172.3000108.4V30 Q31L2-V30 HydrophobicContact CB-CG1 4.06Å; L2-V30 HydrophobicContact CD1-CG1 4.02Å; L2-V30 HydrophobicContact CD2-CG1 4.27Å; L2-V30 HydrophobicContact CG-CG1 4.33Å; L2-Q31 CarbonylContact C-O 3.44Å; L2-Q31 WeakPolarHBondContact CA-O 3.49Å
3A59.7Low58.6Low2 Ų258.1 Ų58.12%0.01732%0.32CS..EExtended strand (participates in β ladder)trans-97.2143.1167.200000108.7V30 Q31 L33 P66A3-V30 CarbonylContact O-C 3.25Å; A3-V30 WeakPolarHBondContact O-CA 3.38Å; A3-Q31 PolarHBondContact N-O 3.44Å; A3-Q31 PolarHBondContact O-N 2.91Å; A3-L33 HydrophobicContact CB-CD1 4.32Å; A3-L33 HydrophobicContact CB-CG 4.42Å; A3-P66 HydrophobicContact CB-CB 3.59Å; A3-P66 HydrophobicContact CB-CG 3.5Å
4R64.4Low58.7Low118 Ų11861.4 Ų61.445%0.44534%0.337SS..EExtended strand (participates in β ladder)trans-123140.3179.7-70.3177.4166.3-177.4-1.5110.3L13 I27 Y29 V30R4-L13 HydrophobicContact CB-CB 4.03Å; R4-L13 HydrophobicContact CB-CD1 4.11Å; R4-L13 HydrophobicContact CB-CG 4.5Å; R4-L13 PolarHBondContact N-O 3.33Å; R4-L13 WeakPolarHBondContact O-CA 3.47Å; R4-L13 VanDerWaalsContact O-CB 3.25Å; R4-L13 WeakPolarHBondContact O-CB 3.49Å; R4-L13 PolarHBondContact O-N 2.93Å; R4-I27 HydrophobicContact CB-CG2 4.04Å; R4-I27 HydrophobicContact CG-CG2 4.1Å; R4-Y29 VanDerWaalsContact CA-O 3.31Å; R4-Y29 WeakPolarHBondContact CA-O 3.5Å; R4-V30 HydrophobicContact CG-CG1 4.1Å; R4-V30 HydrophobicContact CG-CG2 4.17Å
5A59.3Low58.6Low1 Ų172 Ų721%0.00837%0.37CS..EExtended strand (participates in β ladder)trans-114.6130.2173.600000110.8R28 Y29 Y71A5-R28 PolarHBondContact O-N 3.12Å; A5-R28 VanDerWaalsContact O-N 3.14Å; A5-Y29 HydrophobicContact CB-CD2 4.31Å; A5-Y29 PolarHBondContact N-O 3.42Å; A5-Y71 HydrophobicContact CB-CE2 4.1Å
6A60.1Low58.9Low1 Ų171.1 Ų71.11%0.00838%0.383CS..EExtended strand (participates in β ladder)trans-94.2129.717600000110.4G10 L13 D25 Y71A6-G10 PolarHBondContact O-N 3.14Å; A6-L13 HydrophobicContact CB-CD1 4.5Å; A6-D25 HydrophobicContact CB-CB 4.23Å; A6-Y71 PolarHBondContact O-OH 3.36Å
7R52.6Low59.1Low133 Ų13376.9 Ų76.950%0.50241%0.413SS..THydrogen-bonded Turntrans-74.1-24.1-175.2-177.3-179.8-86-159.4-11.3113.7R26 R28R7-R26 PolarHBondContact N-O 3.22Å; R7-R28 VanDerWaalsContact CZ-CZ 3.49Å; R7-R28 VanDerWaalsContact CZ-NE 3.27Å
8G54.4Low59.5Low50 Ų5076.3 Ų76.352%0.51541%0.41SS..THydrogen-bonded Turntrans-76.7-45.9-175.300000113.6L24G8-L24 WeakPolarHBondContact CA-O 3.33Å
9T56.4Low60Low87 Ų8780.5 Ų80.553%0.53443%0.43SS..THydrogen-bonded Turntrans-104.6-9.8-17545.70000114.5A11 D25T9-A11 PolarHBondContact O-N 2.99Å; T9-A11 VanDerWaalsContact O-N 3.13Å; T9-D25 WeakPolarHBondContact CB-OD1 3.41Å; T9-D25 WeakPolarHBondContact CG2-OD1 3.37Å; T9-D25 PolarHBondContact N-OD1 3.19Å; T9-D25 PolarHBondContact OG1-OD1 3.29Å
10G59.3Low60.4Low28 Ų2879.1 Ų79.129%0.28942%0.422SS..  trans68.61.1-17300000114.3A6A6-G10 PolarHBondContact O-N 3.14Å
11A58.7Low61Low42 Ų4279.7 Ų79.735%0.34743%0.425SS..  trans-68.4136.7-17400000112.6T9T9-A11 PolarHBondContact O-N 2.99Å; T9-A11 VanDerWaalsContact O-N 3.13Å
12L60.3Low61.5Low54 Ų5479.9 Ų79.928%0.28344%0.435SS..EExtended strand (participates in β ladder)trans-81.3116170.6-128.575.5000110.3L14 P66 Y67L12-L14 HydrophobicContact CD2-CD2 4.23Å; L12-L14 HydrophobicContact CD2-CG 4.5Å; L12-L14 PolarHBondContact O-N 3.32Å; L12-L14 VanDerWaalsContact O-N 3.09Å; L12-P66 HydrophobicContact CD2-CB 4.25Å; L12-P66 HydrophobicContact CD2-CG 4.5Å; L12-Y67 HydrophobicContact CD1-CD2 3.67Å; L12-Y67 HydrophobicContact CD1-CG 4.1Å
13L63.5Low62.1Low20 Ų2081.1 Ų81.111%0.10545%0.446CS..EExtended strand (participates in β ladder)trans-86.685.3175.6-48.8-179.3000108.2R4 A6 N18 L20 I27R4-L13 HydrophobicContact CB-CB 4.03Å; R4-L13 HydrophobicContact CB-CD1 4.11Å; R4-L13 HydrophobicContact CB-CG 4.5Å; R4-L13 PolarHBondContact N-O 3.33Å; R4-L13 WeakPolarHBondContact O-CA 3.47Å; R4-L13 VanDerWaalsContact O-CB 3.25Å; R4-L13 WeakPolarHBondContact O-CB 3.49Å; R4-L13 PolarHBondContact O-N 2.93Å; A6-L13 HydrophobicContact CB-CD1 4.5Å; L13-N18 HydrophobicContact CD2-CB 4.04Å; L13-L20 HydrophobicContact CD1-CD1 3.97Å; L13-L20 HydrophobicContact CD1-CD2 3.94Å; L13-L20 HydrophobicContact CD1-CG 4.22Å; L13-I27 HydrophobicContact CD1-CG1 4.16Å
14L60.1Low62.4Low105 Ų10586.6 Ų86.655%0.5548%0.475SS..  trans-71.6174.3170.3-69.2172000110.7L12 G16 N18L12-L14 HydrophobicContact CD2-CD2 4.23Å; L12-L14 HydrophobicContact CD2-CG 4.5Å; L12-L14 PolarHBondContact O-N 3.32Å; L12-L14 VanDerWaalsContact O-N 3.09Å; L14-G16 PolarHBondContact O-N 3.33Å; L14-N18 PolarHBondContact O-ND2 3.46Å
15R56.1Low62.4Low220 Ų22081.8 Ų81.883%0.8346%0.458SS*.SBendtrans-70.297.3-173.3-161.8-177.7-167.4-149.72.3110.8M1M1-R15 HydrophobicContact CE-CB 4.34Å
16G63.9Low62.7Low57 Ų5790.9 Ų90.959%0.58849%0.492SS*.SBendtrans179.9-173.8-17900000112.7L14 N18L14-G16 PolarHBondContact O-N 3.33Å; G16-N18 PolarHBondContact O-N 3.43Å; G16-N18 PolarHBondContact O-ND2 3.06Å; G16-N18 VanDerWaalsContact O-ND2 3.16Å
17L62.2Low63Low170 Ų17094 Ų9489%0.8951%0.508SS*.  trans-74.4110.8170.9-175.772.2000108.8
18N66.5Low63.7Low67 Ų6794.7 Ų94.736%0.35851%0.51SS..  trans-111.1121.3179.3-67.3-68.4000109.1L13 L14 G16 L20L13-N18 HydrophobicContact CD2-CB 4.04Å; L14-N18 PolarHBondContact O-ND2 3.46Å; G16-N18 PolarHBondContact O-N 3.43Å; G16-N18 PolarHBondContact O-ND2 3.06Å; G16-N18 VanDerWaalsContact O-ND2 3.16Å; N18-L20 HydrophobicContact CB-CD1 3.94Å; N18-L20 WeakPolarHBondContact O-CD1 3.23Å
19I68.6Low64.4Low155 Ų15595.4 Ų95.480%0.79550%0.498SS*.  trans-91.8116.1175.4-58.4175.3000107.6
20L67.9Low65.1Low52 Ų5294.5 Ų94.527%0.27249%0.492SS..  trans-108.3140.9177.2-73.578.3000109.6L13 N18 P22 D25 I27L13-L20 HydrophobicContact CD1-CD1 3.97Å; L13-L20 HydrophobicContact CD1-CD2 3.94Å; L13-L20 HydrophobicContact CD1-CG 4.22Å; N18-L20 HydrophobicContact CB-CD1 3.94Å; N18-L20 WeakPolarHBondContact O-CD1 3.23Å; L20-P22 WeakPolarHBondContact O-CD 3.45Å; L20-D25 HydrophobicContact CB-CB 4.07Å; L20-D25 HydrophobicContact CD2-CB 4.19Å; L20-D25 HydrophobicContact CG-CB 4.27Å; L20-I27 HydrophobicContact CD2-CD1 3.76Å; L20-I27 HydrophobicContact CD2-CG1 3.58Å
21I74.3Confident66Low92 Ų9294.4 Ų94.447%0.47248%0.484SS..  trans-86113.4175-60.3175.2000108.4V23 L24 D25I21-V23 PolarHBondContact O-N 2.92Å; I21-L24 HydrophobicContact CB-CB 4.45Å; I21-L24 HydrophobicContact CG2-CB 4.37Å; I21-L24 HydrophobicContact CG2-CD1 4.28Å; I21-L24 HydrophobicContact CG2-CG 4.36Å; I21-L24 PolarHBondContact O-N 2.89Å; I21-L24 VanDerWaalsContact O-N 3.1Å; I21-D25 PolarHBondContact N-OD2 3.11Å; I21-D25 PolarHBondContact O-N 3.01Å
22P65.8Low66.9Low121 Ų12194 Ų9479%0.78648%0.479SS*.THydrogen-bonded Turntrans-60.4-17.5-165.9-27.335.7000116.7L20L20-P22 WeakPolarHBondContact O-CD 3.45Å
23V69.9Low68.1Low129 Ų12993 Ų9378%0.78247%0.474SS*.THydrogen-bonded Turntrans-95.1-32.2-178.6-177.40000112.3I21I21-V23 PolarHBondContact O-N 2.92Å
24L67Low69.2Low117 Ų11798.7 Ų98.761%0.61350%0.498SS*.THydrogen-bonded Turntrans-99.7-41.7-174.9-65.3173.8000112.2G8 I21G8-L24 WeakPolarHBondContact CA-O 3.33Å; I21-L24 HydrophobicContact CB-CB 4.45Å; I21-L24 HydrophobicContact CG2-CB 4.37Å; I21-L24 HydrophobicContact CG2-CD1 4.28Å; I21-L24 HydrophobicContact CG2-CG 4.36Å; I21-L24 PolarHBondContact O-N 2.89Å; I21-L24 VanDerWaalsContact O-N 3.1Å
25D62.9Low70.6Confident17 Ų1797.7 Ų97.79%0.09149%0.49CS..  trans-95104.8-175.6-68.7-54.6000111.8A6 T9 L20 I21A6-D25 HydrophobicContact CB-CB 4.23Å; T9-D25 WeakPolarHBondContact CB-OD1 3.41Å; T9-D25 WeakPolarHBondContact CG2-OD1 3.37Å; T9-D25 PolarHBondContact N-OD1 3.19Å; T9-D25 PolarHBondContact OG1-OD1 3.29Å; L20-D25 HydrophobicContact CB-CB 4.07Å; L20-D25 HydrophobicContact CD2-CB 4.19Å; L20-D25 HydrophobicContact CG-CB 4.27Å; I21-D25 PolarHBondContact N-OD2 3.11Å; I21-D25 PolarHBondContact O-N 3.01Å
26R66.6Low72.2Confident191 Ų19188.7 Ų88.772%0.72146%0.458SS*.  trans-100.2122.5161.4-59.4-165.5-164.4-159.17.2110.1R7 R28R7-R26 PolarHBondContact N-O 3.22Å; R26-R28 PolarHBondContact O-N 3.46Å
27I65.9Low73.7Confident68 Ų6890 Ų9035%0.34945%0.454SS..EExtended strand (participates in β ladder)trans-62.6125.1164.6-61.9160.4000107.1R4 L13 L20 V30R4-I27 HydrophobicContact CB-CG2 4.04Å; R4-I27 HydrophobicContact CG-CG2 4.1Å; L13-I27 HydrophobicContact CD1-CG1 4.16Å; L20-I27 HydrophobicContact CD2-CD1 3.76Å; L20-I27 HydrophobicContact CD2-CG1 3.58Å; I27-V30 HydrophobicContact CG2-CG2 4.16Å
28R66.4Low75.2Confident146 Ų14683 Ų8355%0.55142%0.418SS*.EExtended strand (participates in β ladder)trans-120.7-44.5175.5179.3166.8-73.4-121.10.5113.1A5 R7 R26A5-R28 PolarHBondContact O-N 3.12Å; A5-R28 VanDerWaalsContact O-N 3.14Å; R7-R28 VanDerWaalsContact CZ-CZ 3.49Å; R7-R28 VanDerWaalsContact CZ-NE 3.27Å; R26-R28 PolarHBondContact O-N 3.46Å
29Y69.8Low76.5Confident66 Ų6685.4 Ų85.426%0.25943%0.431SS..EExtended strand (participates in β ladder)trans-102.2133.9-176.8-52.5-83.8000109.4R4 A5 S70 Y71R4-Y29 VanDerWaalsContact CA-O 3.31Å; R4-Y29 WeakPolarHBondContact CA-O 3.5Å; A5-Y29 HydrophobicContact CB-CD2 4.31Å; A5-Y29 PolarHBondContact N-O 3.42Å; Y29-S70 WeakPolarHBondContact CB-OG 3.36Å; Y29-Y71 HydrophobicContact CE2-CE1 4.43Å
30V71.6Confident77.7Confident68 Ų6878.2 Ų78.241%0.41239%0.394SS..EExtended strand (participates in β ladder)trans-131.495179.1-1710000107.6L2 A3 R4 I27L2-V30 HydrophobicContact CB-CG1 4.06Å; L2-V30 HydrophobicContact CD1-CG1 4.02Å; L2-V30 HydrophobicContact CD2-CG1 4.27Å; L2-V30 HydrophobicContact CG-CG1 4.33Å; A3-V30 CarbonylContact O-C 3.25Å; A3-V30 WeakPolarHBondContact O-CA 3.38Å; R4-V30 HydrophobicContact CG-CG1 4.1Å; R4-V30 HydrophobicContact CG-CG2 4.17Å; I27-V30 HydrophobicContact CG2-CG2 4.16Å
31Q77.5Confident78.8Confident25 Ų2578.8 Ų78.812%0.11740%0.401CS..EExtended strand (participates in β ladder)trans-96.8137.4-174-65.3-61.4-100111.6L2 A3 I63 P66 A69L2-Q31 CarbonylContact C-O 3.44Å; L2-Q31 WeakPolarHBondContact CA-O 3.49Å; A3-Q31 PolarHBondContact N-O 3.44Å; A3-Q31 PolarHBondContact O-N 2.91Å; Q31-I63 HydrophobicContact CB-CD1 3.85Å; Q31-I63 HydrophobicContact CG-CD1 4.21Å; Q31-I63 VanDerWaalsContact OE1-CD1 3.23Å; Q31-P66 HydrophobicContact CB-CB 4.34Å; Q31-A69 PolarHBondContact NE2-O 2.91Å
32S79.1Confident79.7Confident35 Ų3578.4 Ų78.425%0.24540%0.397CS..EExtended strand (participates in β ladder)trans-85.2125.6175.2-174.30000110.9K34S32-K34 VanDerWaalsContact C-N 3.27Å; S32-K34 PolarHBondContact OG-N 3.27Å
33L83.9Confident80.8Confident33 Ų3374.6 Ų74.617%0.17337%0.369CS..  trans-86.44.1174.3-70.4173.7000113.4M1 A3 R62 I63 P66M1-L33 HydrophobicContact CB-CB 4.41Å; M1-L33 HydrophobicContact CE-CD1 4.15Å; M1-L33 HydrophobicContact CG-CD1 4.15Å; M1-L33 PolarHBondContact O-N 3.42Å; A3-L33 HydrophobicContact CB-CD1 4.32Å; A3-L33 HydrophobicContact CB-CG 4.42Å; L33-R62 PolarHBondContact O-NE 2.85Å; L33-I63 WeakPolarHBondContact CD2-O 3.25Å; L33-P66 HydrophobicContact CD2-CG 3.61Å; L33-P66 HydrophobicContact CG-CG 4.4Å
34K87.5Confident81.9Confident138 Ų13871.9 Ų71.960%0.636%0.356SS*.SBendtrans-79.4162.9173.1-67.6-172.6171.8-171.40110.1S32 I36S32-K34 VanDerWaalsContact C-N 3.27Å; S32-K34 PolarHBondContact OG-N 3.27Å; K34-I36 PolarHBondContact O-N 3.5Å
35E89.4Confident83.1Confident85 Ų8566.6 Ų66.640%0.39733%0.329SS..EExtended strand (participates in β ladder)trans-59.8131.1161.6-171.2166.9179.600108.7Y60 L61 L127 R128E35-Y60 WeakPolarHBondContact OE1-CD1 3.33Å; E35-L61 CarbonylContact C-O 3.5Å; E35-L61 WeakPolarHBondContact CA-O 3.37Å; E35-L127 HydrophobicContact CB-CD1 4.49Å; E35-L127 HydrophobicContact CG-CD1 3.91Å; E35-R128 IonicContact OE1-CZ 3.86Å; E35-R128 IonicContact OE1-NE 3.77Å; E35-R128 IonicContact OE1-NH2 3.03Å; E35-R128 PolarHBondContact OE1-NH2 3.1Å
36I90.4Very high84.6Confident30 Ų3068.9 Ų68.915%0.15434%0.343CS..EExtended strand (participates in β ladder)trans-116.7147.8174.664.5176.8000108.4K34 I38 L61 E77K34-I36 PolarHBondContact O-N 3.5Å; I36-I38 HydrophobicContact CD1-CD1 4.2Å; I36-L61 HydrophobicContact CD1-CB 4.22Å; I36-L61 HydrophobicContact CD1-CD1 4.5Å; I36-L61 HydrophobicContact CG1-CB 3.76Å; I36-L61 PolarHBondContact N-O 3.27Å; I36-L61 PolarHBondContact O-N 2.82Å; I36-E77 HydrophobicContact CD1-CG 3.96Å
37V94.1Very high85.9Confident84 Ų8460.1 Ų60.151%0.50931%0.311SS..EExtended strand (participates in β ladder)trans-118.4121.4-176.7-175.10000107.6V58 Y60V37-V58 HydrophobicContact CG1-CG1 3.28Å; V37-Y60 HydrophobicContact CG1-CE1 4.23Å; V37-Y60 HydrophobicContact CG2-CD1 3.77Å; V37-Y60 HydrophobicContact CG2-CE1 3.76Å
38I93.5Very high87.2Confident23 Ų2362.4 Ų62.412%0.11832%0.323CS..EExtended strand (participates in β ladder)trans-121.3129.4-178.6-51.8-172.4000108.9I36 L59 L61 E77 T81I36-I38 HydrophobicContact CD1-CD1 4.2Å; I38-L59 PolarHBondContact N-O 3.42Å; I38-L59 PolarHBondContact O-N 3.38Å; I38-L61 HydrophobicContact CD1-CD1 3.65Å; I38-L61 HydrophobicContact CG1-CD1 4.33Å; I38-E77 HydrophobicContact CD1-CB 3.67Å; I38-E77 HydrophobicContact CD1-CG 3.82Å; I38-T81 WeakPolarHBondContact CG2-OG1 3.38Å
39N93.9Very high88.4Confident119 Ų11959.5 Ų59.564%0.63632%0.319SS*.EExtended strand (participates in β ladder)trans-80.8124173.6-60.6-41.3000109.2
40V94Very high89.5Confident3 Ų362.9 Ų62.92%0.01834%0.341CS..EExtended strand (participates in β ladder)trans-82.5121.3170.1-1790000107.3G57 L59 A84 Q85 Y129V40-G57 PolarHBondContact N-O 3.12Å; V40-L59 HydrophobicContact CG2-CB 4.15Å; V40-A84 HydrophobicContact CG2-CB 4.16Å; V40-Q85 HydrophobicContact CG1-CG 3.66Å; V40-Y129 HydrophobicContact CG2-CE2 4.05Å
41P92.3Very high90.4Very high65 Ų6560.8 Ų60.842%0.42233%0.328SS..EExtended strand (participates in β ladder)trans-64.8152.9-17828.8-36000110.9Q43P41-Q43 PolarHBondContact O-N 2.97Å
42E92.8Very high91.1Very high83 Ų8363.2 Ų63.239%0.38835%0.345SS..EExtended strand (participates in β ladder)trans-55.3134.1179.3-172.4172.3-14300111.5Q54 I55 D56 H135E42-Q54 HydrophobicContact CG-CB 3.87Å; E42-Q54 VanDerWaalsContact OE1-CB 3.25Å; E42-Q54 WeakPolarHBondContact OE1-CB 3.29Å; E42-I55 WeakPolarHBondContact CA-O 3.45Å; E42-D56 HydrophobicContact CB-CB 4.12Å; E42-H135 IonicContact OE1-CE1 3.63Å; E42-H135 IonicContact OE1-CG 3.83Å; E42-H135 IonicContact OE1-ND1 2.79Å; E42-H135 PolarHBondContact OE1-ND1 2.94Å
43Q89.2Confident91.7Very high42 Ų4261.6 Ų61.620%0.19633%0.334CS..EExtended strand (participates in β ladder)trans-128.1142.7177.8-64.5-65.6-73.300110.9P41 Q54 I55 Q85 M88P41-Q43 PolarHBondContact O-N 2.97Å; Q43-Q54 WeakPolarHBondContact O-CA 3.43Å; Q43-I55 PolarHBondContact N-O 3.32Å; Q43-I55 PolarHBondContact O-N 3.48Å; Q43-Q85 HydrophobicContact CG-CB 4.17Å; Q43-Q85 HydrophobicContact CG-CG 3.91Å; Q43-M88 HydrophobicContact CB-CE 4.07Å; Q43-M88 HydrophobicContact CG-CE 4.25Å
44S92.4Very high92.2Very high72 Ų7264.5 Ų64.550%0.50335%0.346SS..EExtended strand (participates in β ladder)trans-80.3135.2165.7-171.80000110.6L53 R89S44-L53 WeakPolarHBondContact CA-O 3.46Å; S44-R89 PolarHBondContact O-NE 3.1Å
45A91.7Very high92.4Very high5 Ų558 Ų584%0.04132%0.318CS..EExtended strand (participates in β ladder)trans-144163.9177.500000110.4T52 L53 R89 L92A45-T52 WeakPolarHBondContact O-CA 3.37Å; A45-L53 PolarHBondContact N-O 3.32Å; A45-L53 PolarHBondContact O-N 2.99Å; A45-R89 HydrophobicContact CB-CG 4.21Å; A45-L92 HydrophobicContact CB-CD2 3.48Å; A45-L92 VanDerWaalsContact CB-CD2 3.48Å; A45-L92 HydrophobicContact CB-CG 4.35Å
46V94.1Very high92.6Very high66 Ų6655.1 Ų55.140%0.431%0.305SS..EExtended strand (participates in β ladder)trans-121.7129.7-179.7-174.20000108.1V51 T52 G93V46-V51 WeakPolarHBondContact CA-O 3.18Å; V46-T52 HydrophobicContact CG2-CG2 3.91Å; V46-G93 WeakPolarHBondContact O-CA 3.33Å
47T93.9Very high92.8Very high6 Ų653.7 Ų53.74%0.03730%0.299CS..  trans-80171.1175.762.60000111.8D49 N50 V51 L53 L92 L95 L97T47-D49 PolarHBondContact O-N 3.4Å; T47-D49 VanDerWaalsContact O-N 3.14Å; T47-N50 PolarHBondContact O-N 2.98Å; T47-V51 PolarHBondContact N-O 3.26Å; T47-V51 PolarHBondContact OG1-N 3.48Å; T47-V51 PolarHBondContact OG1-O 3.36Å; T47-L53 HydrophobicContact CG2-CD2 3.58Å; T47-L53 HydrophobicContact CG2-CG 4.41Å; T47-L92 HydrophobicContact CG2-CD1 4.23Å; T47-L95 WeakPolarHBondContact CB-O 3.49Å; T47-L97 HydrophobicContact CG2-CB 4.48Å; T47-L97 HydrophobicContact CG2-CD1 4.27Å
48L94.1Very high92.8Very high117 Ų11750.6 Ų50.661%0.61328%0.28SS*.THydrogen-bonded Turntrans-54.3-31.5174.4-17565.4000113.1N50 L95L48-N50 PolarHBondContact O-N 3.1Å; L48-L95 WeakPolarHBondContact CB-O 3.4Å; L48-L95 PolarHBondContact N-O 3.33Å
49D92.4Very high92.9Very high85 Ų8549.5 Ų49.546%0.45527%0.274SS..THydrogen-bonded Turntrans-82.313.1179.3-41.5-55.7000113.4T47 V51 S96 L97T47-D49 PolarHBondContact O-N 3.4Å; T47-D49 VanDerWaalsContact O-N 3.14Å; D49-V51 HydrophobicContact CB-CG2 4.38Å; D49-V51 PolarHBondContact O-N 3.01Å; D49-S96 WeakPolarHBondContact OD1-CB 3.42Å; D49-S96 WeakPolarHBondContact OD2-CA 3.48Å; D49-S96 WeakPolarHBondContact OD2-CB 3.36Å; D49-L97 PolarHBondContact OD2-N 2.97Å
50N91.3Very high93Very high137 Ų13747 Ų4773%0.73326%0.256SS*.SBendtrans59.229.3-176.4-167.156.5000113.9T47 L48T47-N50 PolarHBondContact O-N 2.98Å; L48-N50 PolarHBondContact O-N 3.1Å
51V91.1Very high93Very high23 Ų2346.9 Ų46.914%0.13926%0.255CS..  trans-92.3122.7173.3178.40000109.4V46 T47 D49 L97 V136 V140V46-V51 WeakPolarHBondContact CA-O 3.18Å; T47-V51 PolarHBondContact N-O 3.26Å; T47-V51 PolarHBondContact OG1-N 3.48Å; T47-V51 PolarHBondContact OG1-O 3.36Å; D49-V51 HydrophobicContact CB-CG2 4.38Å; D49-V51 PolarHBondContact O-N 3.01Å; V51-L97 HydrophobicContact CG1-CD1 4.34Å; V51-L97 HydrophobicContact CG1-CD2 4.18Å; V51-L97 HydrophobicContact CG2-CD2 4.38Å; V51-V136 HydrophobicContact CG1-CG1 4.24Å; V51-V140 HydrophobicContact CG1-CG1 4.13Å; V51-V140 HydrophobicContact CG1-CG2 4.41Å; V51-V140 HydrophobicContact CG2-CG1 4.27Å
52T92.6Very high92.9Very high76 Ų7649.3 Ų49.347%0.46626%0.256SS..EExtended strand (participates in β ladder)trans-72.5130.5167.242.20000110.2A45 V46 P137A45-T52 WeakPolarHBondContact O-CA 3.37Å; V46-T52 HydrophobicContact CG2-CG2 3.91Å; T52-P137 WeakPolarHBondContact O-CD 3.3Å; T52-P137 WeakPolarHBondContact O-CG 3.38Å
53L92.4Very high92.8Very high2 Ų245.7 Ų45.71%0.0124%0.239CC..EExtended strand (participates in β ladder)trans-139.2157.4172.471.577.8000110.6S44 A45 T47 I55 L92 L97 I134 H135 V136S44-L53 WeakPolarHBondContact CA-O 3.46Å; A45-L53 PolarHBondContact N-O 3.32Å; A45-L53 PolarHBondContact O-N 2.99Å; T47-L53 HydrophobicContact CG2-CD2 3.58Å; T47-L53 HydrophobicContact CG2-CG 4.41Å; L53-I55 HydrophobicContact CD1-CB 3.78Å; L53-I55 HydrophobicContact CD1-CG2 3.79Å; L53-L92 HydrophobicContact CD1-CD2 3.66Å; L53-L92 HydrophobicContact CD2-CD1 4.38Å; L53-L92 HydrophobicContact CD2-CD2 4.45Å; L53-L92 HydrophobicContact CG-CD2 4.24Å; L53-L97 HydrophobicContact CD2-CD1 3.66Å; L53-I134 HydrophobicContact CD1-CG2 4Å; L53-I134 HydrophobicContact CD2-CG2 4.1Å; L53-I134 HydrophobicContact CG-CG2 4.5Å; L53-H135 WeakPolarHBondContact CA-O 3.47Å; L53-H135 WeakPolarHBondContact CB-O 3.47Å; L53-V136 HydrophobicContact CB-CG2 4.29Å
54Q93.3Very high92.8Very high94 Ų9448.7 Ų48.744%0.43926%0.255SS..EExtended strand (participates in β ladder)trans-110.3138.6173.4-51.8166.4-81.800108.5E42 Q43 I134 H135E42-Q54 HydrophobicContact CG-CB 3.87Å; E42-Q54 VanDerWaalsContact OE1-CB 3.25Å; E42-Q54 WeakPolarHBondContact OE1-CB 3.29Å; Q43-Q54 WeakPolarHBondContact O-CA 3.43Å; Q54-I134 CarbonylContact O-C 3.6Å; Q54-H135 HydrophobicContact CB-CB 4.22Å; Q54-H135 PolarHBondContact N-O 3.29Å; Q54-H135 PolarHBondContact O-N 3.36Å
55I92.4Very high92.6Very high0 Ų047.6 Ų47.60%024%0.243CC..EExtended strand (participates in β ladder)trans-145.4136.8-173.1179.7167.7000109.8E42 Q43 L53 M88 L92 I131 D133 I134E42-I55 WeakPolarHBondContact CA-O 3.45Å; Q43-I55 PolarHBondContact N-O 3.32Å; Q43-I55 PolarHBondContact O-N 3.48Å; L53-I55 HydrophobicContact CD1-CB 3.78Å; L53-I55 HydrophobicContact CD1-CG2 3.79Å; I55-M88 HydrophobicContact CG2-CE 3.76Å; I55-M88 HydrophobicContact CG2-SD 3.4Å; I55-M88 WeakPolarHBondContact CG2-SD 3.35Å; I55-L92 HydrophobicContact CD1-CD2 4.49Å; I55-L92 HydrophobicContact CG2-CD2 3.89Å; I55-I131 HydrophobicContact CD1-CD1 4.26Å; I55-I131 HydrophobicContact CD1-CG1 4.14Å; I55-I131 HydrophobicContact CD1-CG2 3.76Å; I55-I131 HydrophobicContact CG1-CG2 4Å; I55-D133 WeakPolarHBondContact CA-O 3.37Å; I55-I134 HydrophobicContact CD1-CD1 4.31Å; I55-I134 HydrophobicContact CD1-CG1 4.11Å; I55-I134 HydrophobicContact CG1-CG1 4.26Å
56D93.4Very high92.3Very high25 Ų2547.9 Ų47.913%0.13424%0.244CC..EExtended strand (participates in β ladder)trans-123.6169.3171.980.1-23.3000111E42 K132 D133E42-D56 HydrophobicContact CB-CB 4.12Å; D56-K132 PolarHBondContact O-N 3.06Å; D56-K132 WeakPolarHBondContact OD1-CB 3.33Å; D56-K132 IonicContact OD1-NZ 3.55Å; D56-K132 IonicContact OD2-NZ 2.69Å; D56-K132 PolarHBondContact OD2-NZ 3.3Å; D56-D133 PolarHBondContact N-O 3.04Å; D56-D133 WeakPolarHBondContact OD1-CB 3.17Å; D56-D133 PolarHBondContact OD1-N 2.84Å
57G93.9Very high91.8Very high1 Ų150.3 Ų50.31%0.0125%0.247CC..EExtended strand (participates in β ladder)trans-166171.8-174.300000113.6V40 E130V40-G57 PolarHBondContact N-O 3.12Å; G57-E130 CarbonylContact C-O 3.56Å; G57-E130 WeakPolarHBondContact CA-O 3.35Å
58V95.3Very high91.5Very high19 Ų1954.6 Ų54.612%0.11527%0.265CS..EExtended strand (participates in β ladder)trans-127.2130.2-178.8-174.30000108.9V37 Y60 E130V37-V58 HydrophobicContact CG1-CG1 3.28Å; V58-Y60 HydrophobicContact CB-CE2 4.15Å; V58-Y60 HydrophobicContact CG1-CD2 4.25Å; V58-Y60 HydrophobicContact CG1-CE2 3.67Å; V58-E130 PolarHBondContact N-O 2.89Å; V58-E130 PolarHBondContact O-N 3.36Å
59L95.2Very high91.1Very high0 Ų049 Ų490%024%0.236CC..EExtended strand (participates in β ladder)trans-112.4127-175.1-172.667.9000109.6I38 V40 L61 V80 A84 I115 C126 Y129I38-L59 PolarHBondContact N-O 3.42Å; I38-L59 PolarHBondContact O-N 3.38Å; V40-L59 HydrophobicContact CG2-CB 4.15Å; L59-L61 HydrophobicContact CD1-CD2 4.25Å; L59-L61 HydrophobicContact CD2-CD1 4.08Å; L59-L61 HydrophobicContact CD2-CD2 3.81Å; L59-L61 HydrophobicContact CD2-CG 4.07Å; L59-L61 HydrophobicContact CG-CD1 4.43Å; L59-L61 HydrophobicContact CG-CD2 3.72Å; L59-L61 HydrophobicContact CG-CG 3.93Å; L59-V80 HydrophobicContact CD2-CG1 3.55Å; L59-A84 HydrophobicContact CD2-CB 4Å; L59-I115 HydrophobicContact CD1-CD1 3.89Å; L59-C126 HydrophobicContact CD1-CB 4.48Å; L59-C126 WeakPolarHBondContact CD1-SG 3.46Å; L59-Y129 HydrophobicContact CB-CD2 4.43Å; L59-Y129 HydrophobicContact CD1-CD2 3.88Å
60Y95.3Very high90.6Very high65 Ų6545.2 Ų45.226%0.25522%0.217SC..EExtended strand (participates in β ladder)trans-107.9110.5-178.8-66.5-108.2000108.6E35 V37 V58 L127 R128 E130E35-Y60 WeakPolarHBondContact OE1-CD1 3.33Å; V37-Y60 HydrophobicContact CG1-CE1 4.23Å; V37-Y60 HydrophobicContact CG2-CD1 3.77Å; V37-Y60 HydrophobicContact CG2-CE1 3.76Å; V58-Y60 HydrophobicContact CB-CE2 4.15Å; V58-Y60 HydrophobicContact CG1-CD2 4.25Å; V58-Y60 HydrophobicContact CG1-CE2 3.67Å; Y60-L127 PolarHBondContact O-N 2.77Å; Y60-R128 HydrophobicContact CD1-CG 4.44Å; Y60-R128 HydrophobicContact CD2-CG 3.49Å; Y60-R128 VanDerWaalsContact CD2-CG 3.49Å; Y60-R128 HydrophobicContact CE2-CG 4.28Å; Y60-R128 HydrophobicContact CG-CG 3.59Å; Y60-R128 PolarHBondContact N-O 3.12Å; Y60-E130 HydrophobicContact CD2-CG 4.47Å; Y60-E130 HydrophobicContact CE2-CB 4.46Å; Y60-E130 HydrophobicContact CE2-CG 3.9Å
61L93.6Very high90.2Very high1 Ų143.2 Ų43.21%0.00520%0.199CC..EExtended strand (participates in β ladder)trans-114.7155.4-172.6-58.8173.8000111.3E35 I36 I38 L59 V80 I124 R125 C126E35-L61 CarbonylContact C-O 3.5Å; E35-L61 WeakPolarHBondContact CA-O 3.37Å; I36-L61 HydrophobicContact CD1-CB 4.22Å; I36-L61 HydrophobicContact CD1-CD1 4.5Å; I36-L61 HydrophobicContact CG1-CB 3.76Å; I36-L61 PolarHBondContact N-O 3.27Å; I36-L61 PolarHBondContact O-N 2.82Å; I38-L61 HydrophobicContact CD1-CD1 3.65Å; I38-L61 HydrophobicContact CG1-CD1 4.33Å; L59-L61 HydrophobicContact CD1-CD2 4.25Å; L59-L61 HydrophobicContact CD2-CD1 4.08Å; L59-L61 HydrophobicContact CD2-CD2 3.81Å; L59-L61 HydrophobicContact CD2-CG 4.07Å; L59-L61 HydrophobicContact CG-CD1 4.43Å; L59-L61 HydrophobicContact CG-CD2 3.72Å; L59-L61 HydrophobicContact CG-CG 3.93Å; L61-V80 HydrophobicContact CD1-CB 4.22Å; L61-V80 HydrophobicContact CD1-CG1 3.7Å; L61-V80 HydrophobicContact CD2-CG1 3.76Å; L61-V80 HydrophobicContact CG-CG1 4.37Å; L61-I124 HydrophobicContact CB-CG2 4.09Å; L61-I124 HydrophobicContact CD1-CG2 4.34Å; L61-I124 HydrophobicContact CD2-CG2 4.07Å; L61-I124 HydrophobicContact CG-CG2 4.41Å; L61-R125 CarbonylContact C-O 3.53Å; L61-R125 WeakPolarHBondContact CA-O 3.26Å; L61-C126 HydrophobicContact CD2-CB 4.05Å
62R91.8Very high89.8Confident116 Ų11644.2 Ų44.244%0.43821%0.214SC..EExtended strand (participates in β ladder)trans-139.5130.7166.3-175.4173.6178.1-172.7-7.3110.6L33 M64 R125 L127L33-R62 PolarHBondContact O-NE 2.85Å; R62-M64 HydrophobicContact CG-SD 4.38Å; R62-M64 PolarHBondContact O-N 3.02Å; R62-R125 PolarHBondContact N-O 3.38Å; R62-R125 PolarHBondContact O-N 3.42Å; R62-L127 HydrophobicContact CB-CD1 4.12Å; R62-L127 HydrophobicContact CB-CG 4.36Å
63I90.6Very high89.4Confident7 Ų742.4 Ų42.44%0.03620%0.203CC..EExtended strand (participates in β ladder)trans-72.9117.1170.7-58.9177.9000108Q31 L33 P66 A69Q31-I63 HydrophobicContact CB-CD1 3.85Å; Q31-I63 HydrophobicContact CG-CD1 4.21Å; Q31-I63 VanDerWaalsContact OE1-CD1 3.23Å; L33-I63 WeakPolarHBondContact CD2-O 3.25Å; I63-P66 HydrophobicContact CG2-CB 4.5Å; I63-P66 HydrophobicContact CG2-CG 4.2Å; I63-A69 HydrophobicContact CD1-CB 4.39Å; I63-A69 HydrophobicContact CG2-CB 3.72Å
64M89.2Confident89Confident105 Ų10551.5 Ų51.552%0.51725%0.246SC..SBendtrans-94.3-39.4177.5-66.4-61.2-64.400111R62 G123 R125R62-M64 HydrophobicContact CG-SD 4.38Å; R62-M64 PolarHBondContact O-N 3.02Å; M64-G123 PolarHBondContact N-O 3.26Å; M64-R125 HydrophobicContact CG-CB 3.81Å
65D87.8Confident88.7Confident50 Ų5051 Ų5127%0.26725%0.246SC..  trans-124.599.2178.1-176.6-10.8000110.6Y67 K68 A69 G123D65-Y67 PolarHBondContact O-N 3.43Å; D65-Y67 WeakPolarHBondContact OD1-CA 3.49Å; D65-Y67 WeakPolarHBondContact OD1-CB 3.45Å; D65-Y67 PolarHBondContact OD1-N 3.24Å; D65-K68 HydrophobicContact CB-CB 4.31Å; D65-K68 HydrophobicContact CB-CD 4.23Å; D65-K68 HydrophobicContact CB-CG 4.41Å; D65-K68 PolarHBondContact O-N 3.43Å; D65-K68 PolarHBondContact OD1-N 3.32Å; D65-K68 VanDerWaalsContact OD2-CD 3.28Å; D65-K68 WeakPolarHBondContact OD2-CD 3.45Å; D65-K68 WeakPolarHBondContact OD2-CE 3.4Å; D65-K68 VanDerWaalsContact OD2-CG 3.29Å; D65-K68 WeakPolarHBondContact OD2-CG 3.24Å; D65-A69 WeakPolarHBondContact O-CB 3.43Å; D65-A69 PolarHBondContact O-N 2.91Å; D65-G123 PolarHBondContact N-O 3.18Å
66P84.1Confident88.3Confident10 Ų1051.6 Ų51.67%0.06525%0.25CC..Hα-helixtrans-63.3-18177.5-24.135.1000114.8A3 L12 Q31 L33 I63 S70A3-P66 HydrophobicContact CB-CB 3.59Å; A3-P66 HydrophobicContact CB-CG 3.5Å; L12-P66 HydrophobicContact CD2-CB 4.25Å; L12-P66 HydrophobicContact CD2-CG 4.5Å; Q31-P66 HydrophobicContact CB-CB 4.34Å; L33-P66 HydrophobicContact CD2-CG 3.61Å; L33-P66 HydrophobicContact CG-CG 4.4Å; I63-P66 HydrophobicContact CG2-CB 4.5Å; I63-P66 HydrophobicContact CG2-CG 4.2Å; P66-S70 VanDerWaalsContact O-CB 3.25Å; P66-S70 WeakPolarHBondContact O-CB 3.43Å; P66-S70 PolarHBondContact O-N 2.63Å; P66-S70 VanDerWaalsContact O-N 3.12Å; P66-S70 PolarHBondContact O-OG 3.11Å
67Y84.8Confident88Confident118 Ų11854.6 Ų54.646%0.46326%0.263SS..Hα-helixtrans-71.2-56.5176-172.6-106.7000109.5L12 D65 A69 S70 Y71L12-Y67 HydrophobicContact CD1-CD2 3.67Å; L12-Y67 HydrophobicContact CD1-CG 4.1Å; D65-Y67 PolarHBondContact O-N 3.43Å; D65-Y67 WeakPolarHBondContact OD1-CA 3.49Å; D65-Y67 WeakPolarHBondContact OD1-CB 3.45Å; D65-Y67 PolarHBondContact OD1-N 3.24Å; Y67-A69 VanDerWaalsContact C-N 3.27Å; Y67-A69 PolarHBondContact O-N 3.05Å; Y67-S70 PolarHBondContact O-N 2.7Å; Y67-Y71 AromaticContact CD2-CD2 3.73Å; Y67-Y71 HydrophobicContact CD2-CD2 3.73Å; Y67-Y71 AromaticContact CD2-CE2 3.92Å; Y67-Y71 HydrophobicContact CD2-CE2 3.92Å; Y67-Y71 AromaticContact CE2-CD2 3.66Å; Y67-Y71 HydrophobicContact CE2-CD2 3.66Å; Y67-Y71 AromaticContact CE2-CE2 3.75Å; Y67-Y71 HydrophobicContact CE2-CE2 3.75Å; Y67-Y71 HydrophobicContact CG-CD2 4.34Å; Y67-Y71 WeakPolarHBondContact O-CD2 3.32Å; Y67-Y71 PolarHBondContact O-N 3.46Å
68K86.3Confident87.9Confident95 Ų9561.3 Ų61.341%0.41329%0.289SS..Hα-helixtrans-58.7-39.1175.3-68.4177.6-173.5-1750111.8D65 S70 G72 W122D65-K68 HydrophobicContact CB-CB 4.31Å; D65-K68 HydrophobicContact CB-CD 4.23Å; D65-K68 HydrophobicContact CB-CG 4.41Å; D65-K68 PolarHBondContact O-N 3.43Å; D65-K68 PolarHBondContact OD1-N 3.32Å; D65-K68 VanDerWaalsContact OD2-CD 3.28Å; D65-K68 WeakPolarHBondContact OD2-CD 3.45Å; D65-K68 WeakPolarHBondContact OD2-CE 3.4Å; D65-K68 VanDerWaalsContact OD2-CG 3.29Å; D65-K68 WeakPolarHBondContact OD2-CG 3.24Å; K68-S70 VanDerWaalsContact C-N 3.28Å; K68-S70 PolarHBondContact O-N 3.03Å; K68-G72 VanDerWaalsContact O-CA 3.27Å; K68-G72 WeakPolarHBondContact O-CA 3.39Å; K68-G72 PolarHBondContact O-N 2.93Å; K68-W122 CarbonylContact C-O 3.58Å; K68-W122 VanDerWaalsContact C-O 3.25Å
69A85.7Confident87.7Confident0 Ų061.3 Ų61.30%029%0.291CS..Hα-helixtrans-72-17177.200000114Q31 I63 D65 Y67 P76 W122Q31-A69 PolarHBondContact NE2-O 2.91Å; I63-A69 HydrophobicContact CD1-CB 4.39Å; I63-A69 HydrophobicContact CG2-CB 3.72Å; D65-A69 WeakPolarHBondContact O-CB 3.43Å; D65-A69 PolarHBondContact O-N 2.91Å; Y67-A69 VanDerWaalsContact C-N 3.27Å; Y67-A69 PolarHBondContact O-N 3.05Å; A69-P76 WeakPolarHBondContact O-CG 3.23Å; A69-W122 WeakPolarHBondContact CA-O 3.43Å; A69-W122 WeakPolarHBondContact CB-O 3.44Å; A69-W122 PolarHBondContact N-O 3.44Å
70S82.6Confident87.5Confident6 Ų661.3 Ų61.34%0.04229%0.291CS..Hα-helixtrans-99.1-20.2177.8-57.10000113.8Y29 P66 Y67 K68Y29-S70 WeakPolarHBondContact CB-OG 3.36Å; P66-S70 VanDerWaalsContact O-CB 3.25Å; P66-S70 WeakPolarHBondContact O-CB 3.43Å; P66-S70 PolarHBondContact O-N 2.63Å; P66-S70 VanDerWaalsContact O-N 3.12Å; P66-S70 PolarHBondContact O-OG 3.11Å; Y67-S70 PolarHBondContact O-N 2.7Å; K68-S70 VanDerWaalsContact C-N 3.28Å; K68-S70 PolarHBondContact O-N 3.03Å
71Y83Confident87.4Confident95 Ų9558.8 Ų58.837%0.37328%0.282SS..Hα-helixtrans-126.5-17-173.3-68.5-74.4000114.6A5 A6 Y29 Y67A5-Y71 HydrophobicContact CB-CE2 4.1Å; A6-Y71 PolarHBondContact O-OH 3.36Å; Y29-Y71 HydrophobicContact CE2-CE1 4.43Å; Y67-Y71 AromaticContact CD2-CD2 3.73Å; Y67-Y71 HydrophobicContact CD2-CD2 3.73Å; Y67-Y71 AromaticContact CD2-CE2 3.92Å; Y67-Y71 HydrophobicContact CD2-CE2 3.92Å; Y67-Y71 AromaticContact CE2-CD2 3.66Å; Y67-Y71 HydrophobicContact CE2-CD2 3.66Å; Y67-Y71 AromaticContact CE2-CE2 3.75Å; Y67-Y71 HydrophobicContact CE2-CE2 3.75Å; Y67-Y71 HydrophobicContact CG-CD2 4.34Å; Y67-Y71 WeakPolarHBondContact O-CD2 3.32Å; Y67-Y71 PolarHBondContact O-N 3.46Å
72G82.3Confident87.4Confident44 Ų4461.9 Ų61.945%0.45430%0.296SS..SBendtrans-85.2-16.5-178.400000114.8K68K68-G72 VanDerWaalsContact O-CA 3.27Å; K68-G72 WeakPolarHBondContact O-CA 3.39Å; K68-G72 PolarHBondContact O-N 2.93Å
73V84.6Confident87.5Confident37 Ų3758 Ų5822%0.22429%0.285CS..  trans-158.9151.6177.163.30000110P76 A79 W122V73-P76 HydrophobicContact CG1-CB 3.58Å; V73-P76 HydrophobicContact CG1-CG 3.81Å; V73-A79 HydrophobicContact CG2-CB 3.65Å; V73-W122 HydrophobicContact CB-CG 4.28Å; V73-W122 HydrophobicContact CG1-CB 4.14Å; V73-W122 HydrophobicContact CG1-CD2 4.42Å; V73-W122 HydrophobicContact CG1-CG 3.9Å
74E83.6Confident87.6Confident194 Ų19457.7 Ų57.791%0.90728%0.283SS*.SBendtrans-72-50.7-175.9-178.5169.1-159.900112.7
75D86.6Confident87.8Confident83 Ų8353.3 Ų53.344%0.44426%0.261SS..  trans-121.8105.3169.9-173.7-29000108.9E77 Y78 A79D75-E77 PolarHBondContact OD1-N 2.89Å; D75-Y78 VanDerWaalsContact CG-CB 3.41Å; D75-Y78 PolarHBondContact OD1-N 3.28Å; D75-A79 VanDerWaalsContact O-CB 3.27Å; D75-A79 WeakPolarHBondContact O-CB 3.33Å; D75-A79 PolarHBondContact O-N 2.87Å
76P85.8Confident88.1Confident13 Ų1355 Ų558%0.08427%0.274CS..Hα-helixtrans-74.9-27.8-176.8-6.321.2000113.5A69 V73 V80 I124A69-P76 WeakPolarHBondContact O-CG 3.23Å; V73-P76 HydrophobicContact CG1-CB 3.58Å; V73-P76 HydrophobicContact CG1-CG 3.81Å; P76-V80 WeakPolarHBondContact O-CB 3.42Å; P76-V80 WeakPolarHBondContact O-CG2 3.49Å; P76-V80 PolarHBondContact O-N 3.49Å; P76-I124 HydrophobicContact CB-CD1 3.45Å; P76-I124 VanDerWaalsContact CB-CD1 3.45Å
77E87.2Confident88.5Confident88 Ų8855.3 Ų55.341%0.41128%0.275SS..Hα-helixtrans-73.5-45.1179.2-69.6-171.7-164.400110.1I36 I38 D75 T81I36-E77 HydrophobicContact CD1-CG 3.96Å; I38-E77 HydrophobicContact CD1-CB 3.67Å; I38-E77 HydrophobicContact CD1-CG 3.82Å; D75-E77 PolarHBondContact OD1-N 2.89Å; E77-T81 WeakPolarHBondContact O-CB 3.3Å; E77-T81 PolarHBondContact O-N 2.94Å; E77-T81 PolarHBondContact O-OG1 2.89Å
78Y90.5Very high88.9Confident142 Ų14249.8 Ų49.856%0.55725%0.253SS*.Hα-helixtrans-64.2-46.7173.8-179.6-105.5000112.4D75 V80 T81 Q82D75-Y78 VanDerWaalsContact CG-CB 3.41Å; D75-Y78 PolarHBondContact OD1-N 3.28Å; Y78-V80 PolarHBondContact O-N 2.88Å; Y78-T81 WeakPolarHBondContact O-CB 3.21Å; Y78-T81 PolarHBondContact O-N 3.47Å; Y78-T81 VanDerWaalsContact O-N 3.09Å; Y78-Q82 HydrophobicContact CD1-CG 4.29Å; Y78-Q82 HydrophobicContact CD2-CG 4.39Å; Y78-Q82 HydrophobicContact CE1-CG 3.85Å; Y78-Q82 HydrophobicContact CE2-CG 3.95Å; Y78-Q82 WeakPolarHBondContact O-CG 3.36Å; Y78-Q82 PolarHBondContact O-N 3.38Å
79A91.4Very high89.2Confident18 Ų1849.9 Ų49.915%0.14925%0.251CS..Hα-helixtrans-60.6-43.7-178.400000112.6V73 D75 T81 Q82 L83 W122V73-A79 HydrophobicContact CG2-CB 3.65Å; D75-A79 VanDerWaalsContact O-CB 3.27Å; D75-A79 WeakPolarHBondContact O-CB 3.33Å; D75-A79 PolarHBondContact O-N 2.87Å; A79-T81 VanDerWaalsContact C-N 3.34Å; A79-Q82 PolarHBondContact O-N 3.18Å; A79-L83 WeakPolarHBondContact O-CB 3.34Å; A79-L83 PolarHBondContact O-N 2.9Å; A79-W122 HydrophobicContact CB-CH2 4.05Å; A79-W122 HydrophobicContact CB-CZ2 4.31Å; A79-W122 HydrophobicContact CB-CZ3 4.17Å
80V92.1Very high89.5Confident0 Ų053 Ų530%027%0.273CS..Hα-helixtrans-67.4-34.7175172.20000111.7L59 L61 P76 Y78 L83 A84 I115 A119 W122 I124L59-V80 HydrophobicContact CD2-CG1 3.55Å; L61-V80 HydrophobicContact CD1-CB 4.22Å; L61-V80 HydrophobicContact CD1-CG1 3.7Å; L61-V80 HydrophobicContact CD2-CG1 3.76Å; L61-V80 HydrophobicContact CG-CG1 4.37Å; P76-V80 WeakPolarHBondContact O-CB 3.42Å; P76-V80 WeakPolarHBondContact O-CG2 3.49Å; P76-V80 PolarHBondContact O-N 3.49Å; Y78-V80 PolarHBondContact O-N 2.88Å; V80-L83 PolarHBondContact O-N 3.36Å; V80-A84 WeakPolarHBondContact O-CB 3.28Å; V80-A84 PolarHBondContact O-N 3.12Å; V80-I115 HydrophobicContact CG1-CG2 4.33Å; V80-A119 HydrophobicContact CG2-CB 4.48Å; V80-W122 HydrophobicContact CG2-CE3 3.54Å; V80-W122 HydrophobicContact CG2-CZ3 3.67Å; V80-I124 HydrophobicContact CG2-CD1 3.68Å; V80-I124 HydrophobicContact CG2-CG2 4.42Å
81T92.8Very high90Very high12 Ų1254.3 Ų54.37%0.07428%0.278CS..Hα-helixtrans-64.4-42.8175.5-58.10000111.9I38 E77 Y78 A79 A84 Q85I38-T81 WeakPolarHBondContact CG2-OG1 3.38Å; E77-T81 WeakPolarHBondContact O-CB 3.3Å; E77-T81 PolarHBondContact O-N 2.94Å; E77-T81 PolarHBondContact O-OG1 2.89Å; Y78-T81 WeakPolarHBondContact O-CB 3.21Å; Y78-T81 PolarHBondContact O-N 3.47Å; Y78-T81 VanDerWaalsContact O-N 3.09Å; A79-T81 VanDerWaalsContact C-N 3.34Å; T81-A84 PolarHBondContact O-N 3.48Å; T81-Q85 WeakPolarHBondContact O-CG 3.44Å; T81-Q85 PolarHBondContact O-N 2.92Å
82Q93Very high90.4Very high66 Ų6649.8 Ų49.831%0.30826%0.261SS..Hα-helixtrans-68.1-37.2176.3-66.5-55.7107.800112.5Y78 A79 T86Y78-Q82 HydrophobicContact CD1-CG 4.29Å; Y78-Q82 HydrophobicContact CD2-CG 4.39Å; Y78-Q82 HydrophobicContact CE1-CG 3.85Å; Y78-Q82 HydrophobicContact CE2-CG 3.95Å; Y78-Q82 WeakPolarHBondContact O-CG 3.36Å; Y78-Q82 PolarHBondContact O-N 3.38Å; A79-Q82 PolarHBondContact O-N 3.18Å; Q82-T86 PolarHBondContact O-N 2.96Å; Q82-T86 PolarHBondContact O-OG1 3.14Å
83L92.9Very high90.9Very high36 Ų3649.1 Ų49.119%0.18825%0.254CS..Hα-helixtrans-60.2-49.3170.5175.364.6000110.6A79 V80 Q85 T86 T87 I115 A118 W122A79-L83 WeakPolarHBondContact O-CB 3.34Å; A79-L83 PolarHBondContact O-N 2.9Å; V80-L83 PolarHBondContact O-N 3.36Å; L83-Q85 PolarHBondContact O-N 2.97Å; L83-T86 PolarHBondContact O-N 2.97Å; L83-T86 VanDerWaalsContact O-N 3.08Å; L83-T87 WeakPolarHBondContact O-CB 3.35Å; L83-T87 PolarHBondContact O-N 3.35Å; L83-T87 PolarHBondContact O-OG1 3.42Å; L83-I115 HydrophobicContact CD2-CG2 4.21Å; L83-A118 HydrophobicContact CD1-CB 4.2Å; L83-A118 HydrophobicContact CD2-CB 3.76Å; L83-W122 HydrophobicContact CD2-CH2 4.28Å; L83-W122 HydrophobicContact CD2-CZ3 3.92Å
84A93.4Very high91.3Very high0 Ų053 Ų530%027%0.268CS..Hα-helixtrans-58.7-43.7179.900000112.7V40 L59 V80 T81 T86 M88 I115V40-A84 HydrophobicContact CG2-CB 4.16Å; L59-A84 HydrophobicContact CD2-CB 4Å; V80-A84 WeakPolarHBondContact O-CB 3.28Å; V80-A84 PolarHBondContact O-N 3.12Å; T81-A84 PolarHBondContact O-N 3.48Å; A84-T86 VanDerWaalsContact C-N 3.31Å; A84-T86 PolarHBondContact O-N 3.11Å; A84-M88 WeakPolarHBondContact O-CB 3.39Å; A84-M88 PolarHBondContact O-N 3.27Å; A84-I115 HydrophobicContact CB-CD1 3.66Å; A84-I115 HydrophobicContact CB-CG1 4.42Å
85Q93.6Very high91.7Very high13 Ų1345.5 Ų45.56%0.06123%0.234CC..Hα-helixtrans-58.5-41.8173.8-69.216827.700112.5V40 Q43 T81 L83 R89V40-Q85 HydrophobicContact CG1-CG 3.66Å; Q43-Q85 HydrophobicContact CG-CB 4.17Å; Q43-Q85 HydrophobicContact CG-CG 3.91Å; T81-Q85 WeakPolarHBondContact O-CG 3.44Å; T81-Q85 PolarHBondContact O-N 2.92Å; L83-Q85 PolarHBondContact O-N 2.97Å; Q85-R89 WeakPolarHBondContact O-CB 3.34Å; Q85-R89 PolarHBondContact O-N 3.44Å; Q85-R89 VanDerWaalsContact O-N 3.12Å
86T93.3Very high92Very high86 Ų8642.8 Ų42.853%0.52822%0.221SC..Hα-helixtrans-73.3-45.3-176.7-540000111.2Q82 L83 A84 R89 S90Q82-T86 PolarHBondContact O-N 2.96Å; Q82-T86 PolarHBondContact O-OG1 3.14Å; L83-T86 PolarHBondContact O-N 2.97Å; L83-T86 VanDerWaalsContact O-N 3.08Å; A84-T86 VanDerWaalsContact C-N 3.31Å; A84-T86 PolarHBondContact O-N 3.11Å; T86-R89 PolarHBondContact O-N 3.26Å; T86-S90 PolarHBondContact O-N 3.47Å
87T94.1Very high92.3Very high16 Ų1642.7 Ų42.710%0.09822%0.22CC..Hα-helixtrans-61-49.6174.8-62.80000111.2L83 R89 S90 E91 I111 A114 I115L83-T87 WeakPolarHBondContact O-CB 3.35Å; L83-T87 PolarHBondContact O-N 3.35Å; L83-T87 PolarHBondContact O-OG1 3.42Å; T87-R89 VanDerWaalsContact C-N 3.35Å; T87-R89 PolarHBondContact O-N 3.29Å; T87-S90 WeakPolarHBondContact O-CB 3.5Å; T87-S90 PolarHBondContact O-N 2.97Å; T87-E91 HydrophobicContact CG2-CG 4.26Å; T87-E91 PolarHBondContact O-N 2.91Å; T87-I111 HydrophobicContact CG2-CG2 4.36Å; T87-A114 HydrophobicContact CG2-CB 3.48Å; T87-A114 VanDerWaalsContact CG2-CB 3.48Å; T87-I115 HydrophobicContact CG2-CG1 4.32Å
88M92.5Very high92.4Very high1 Ų141.5 Ų41.51%0.00522%0.216CC..Hα-helixtrans-58.9-44.2178.8172.7-90.8-75.800111.8Q43 I55 A84 S90 L92 I111Q43-M88 HydrophobicContact CB-CE 4.07Å; Q43-M88 HydrophobicContact CG-CE 4.25Å; I55-M88 HydrophobicContact CG2-CE 3.76Å; I55-M88 HydrophobicContact CG2-SD 3.4Å; I55-M88 WeakPolarHBondContact CG2-SD 3.35Å; A84-M88 WeakPolarHBondContact O-CB 3.39Å; A84-M88 PolarHBondContact O-N 3.27Å; M88-S90 VanDerWaalsContact C-N 3.29Å; M88-S90 PolarHBondContact O-N 2.92Å; M88-L92 WeakPolarHBondContact O-CB 3.37Å; M88-L92 PolarHBondContact O-N 2.75Å; M88-L92 HydrophobicContact SD-CD2 4.42Å; M88-I111 HydrophobicContact CB-CD1 4.02Å; M88-I111 HydrophobicContact CG-CD1 4.04Å
89R92.4Very high92.4Very high97 Ų9739 Ų3937%0.36621%0.209SC..Hα-helixtrans-59.6-39.2174.2-176.9-177.4-67.8110.80.4112.4S44 A45 Q85 T86 T87 G93S44-R89 PolarHBondContact O-NE 3.1Å; A45-R89 HydrophobicContact CB-CG 4.21Å; Q85-R89 WeakPolarHBondContact O-CB 3.34Å; Q85-R89 PolarHBondContact O-N 3.44Å; Q85-R89 VanDerWaalsContact O-N 3.12Å; T86-R89 PolarHBondContact O-N 3.26Å; T87-R89 VanDerWaalsContact C-N 3.35Å; T87-R89 PolarHBondContact O-N 3.29Å; R89-G93 PolarHBondContact O-N 2.96Å
90S92.8Very high92.3Very high66 Ų6638.2 Ų38.246%0.46220%0.201SC..Hα-helixtrans-70.2-48.8179.9-172.20000112.5T86 T87 M88 G93T86-S90 PolarHBondContact O-N 3.47Å; T87-S90 WeakPolarHBondContact O-CB 3.5Å; T87-S90 PolarHBondContact O-N 2.97Å; M88-S90 VanDerWaalsContact C-N 3.29Å; M88-S90 PolarHBondContact O-N 2.92Å; S90-G93 PolarHBondContact O-N 3.37Å
91E92.6Very high92.1Very high33 Ų3341.8 Ų41.815%0.15422%0.217CC..Hα-helixtrans-65.2-40.1178.5-62.7-46.4129.900111.8T87 G93 K94 L107 I111T87-E91 HydrophobicContact CG2-CG 4.26Å; T87-E91 PolarHBondContact O-N 2.91Å; E91-G93 VanDerWaalsContact C-N 3.3Å; E91-G93 PolarHBondContact O-N 2.88Å; E91-K94 WeakPolarHBondContact O-CB 3.39Å; E91-K94 PolarHBondContact O-N 2.88Å; E91-K94 VanDerWaalsContact O-N 3.15Å; E91-K94 IonicContact OE1-NZ 2.64Å; E91-K94 PolarHBondContact OE1-NZ 3.15Å; E91-K94 WeakPolarHBondContact OE2-CE 3.14Å; E91-K94 IonicContact OE2-NZ 2.69Å; E91-K94 PolarHBondContact OE2-NZ 3.48Å; E91-L107 HydrophobicContact CB-CD1 3.65Å; E91-I111 HydrophobicContact CB-CG1 4.17Å; E91-I111 HydrophobicContact CG-CG1 4.06Å
92L91.8Very high91.9Very high1 Ų149.9 Ų49.91%0.00525%0.247CC..Hα-helixtrans-62.2-36177.2-17857.9000112.8A45 T47 L53 I55 M88 K94 L95 V100A45-L92 HydrophobicContact CB-CD2 3.48Å; A45-L92 VanDerWaalsContact CB-CD2 3.48Å; A45-L92 HydrophobicContact CB-CG 4.35Å; T47-L92 HydrophobicContact CG2-CD1 4.23Å; L53-L92 HydrophobicContact CD1-CD2 3.66Å; L53-L92 HydrophobicContact CD2-CD1 4.38Å; L53-L92 HydrophobicContact CD2-CD2 4.45Å; L53-L92 HydrophobicContact CG-CD2 4.24Å; I55-L92 HydrophobicContact CD1-CD2 4.49Å; I55-L92 HydrophobicContact CG2-CD2 3.89Å; M88-L92 WeakPolarHBondContact O-CB 3.37Å; M88-L92 PolarHBondContact O-N 2.75Å; M88-L92 HydrophobicContact SD-CD2 4.42Å; L92-K94 PolarHBondContact O-N 3.44Å; L92-L95 PolarHBondContact O-N 3.39Å; L92-V100 HydrophobicContact CD1-CB 4.16Å; L92-V100 HydrophobicContact CD1-CG1 3.69Å; L92-V100 HydrophobicContact CD1-CG2 3.33Å
93G91.9Very high91.8Very high30 Ų3050.5 Ų50.531%0.30925%0.249SC..Hα-helixtrans-68-16.7176.800000114.7V46 R89 S90 E91V46-G93 WeakPolarHBondContact O-CA 3.33Å; R89-G93 PolarHBondContact O-N 2.96Å; S90-G93 PolarHBondContact O-N 3.37Å; E91-G93 VanDerWaalsContact C-N 3.3Å; E91-G93 PolarHBondContact O-N 2.88Å
94K92.5Very high91.7Very high118 Ų11852.9 Ų52.951%0.51326%0.256SS..THydrogen-bonded Turntrans-84.9-13.9176.4-57.4172.1-160.2170.40113E91 L92E91-K94 WeakPolarHBondContact O-CB 3.39Å; E91-K94 PolarHBondContact O-N 2.88Å; E91-K94 VanDerWaalsContact O-N 3.15Å; E91-K94 IonicContact OE1-NZ 2.64Å; E91-K94 PolarHBondContact OE1-NZ 3.15Å; E91-K94 WeakPolarHBondContact OE2-CE 3.14Å; E91-K94 IonicContact OE2-NZ 2.69Å; E91-K94 PolarHBondContact OE2-NZ 3.48Å; L92-K94 PolarHBondContact O-N 3.44Å
95L92.6Very high91.6Very high37 Ų3760.9 Ų60.919%0.19429%0.293CS..SBendtrans-110.5149.2-172.9-62.5178.2000111.6T47 L48 L92 K99 V100 L107T47-L95 WeakPolarHBondContact CB-O 3.49Å; L48-L95 WeakPolarHBondContact CB-O 3.4Å; L48-L95 PolarHBondContact N-O 3.33Å; L92-L95 PolarHBondContact O-N 3.39Å; L95-K99 HydrophobicContact CD2-CD 4.45Å; L95-V100 HydrophobicContact CB-CG2 3.75Å; L95-V100 HydrophobicContact CD1-CG2 4.32Å; L95-L107 HydrophobicContact CD1-CB 4.31Å; L95-L107 HydrophobicContact CD1-CD1 4Å; L95-L107 HydrophobicContact CD1-CD2 4.29Å; L95-L107 HydrophobicContact CD1-CG 4.44Å
96S93.6Very high91.5Very high25 Ų2563.4 Ų63.418%0.17531%0.312CS..  trans-76.3154.2167.954.90000110.9D49 D98 K99 V100D49-S96 WeakPolarHBondContact OD1-CB 3.42Å; D49-S96 WeakPolarHBondContact OD2-CA 3.48Å; D49-S96 WeakPolarHBondContact OD2-CB 3.36Å; S96-D98 VanDerWaalsContact C-N 3.3Å; S96-D98 PolarHBondContact O-N 2.88Å; S96-K99 WeakPolarHBondContact O-CB 3.3Å; S96-K99 PolarHBondContact O-N 3.36Å; S96-K99 VanDerWaalsContact O-N 3.08Å; S96-K99 WeakPolarHBondContact OG-CG 3.4Å; S96-V100 WeakPolarHBondContact O-CG2 3.49Å; S96-V100 PolarHBondContact O-N 3.46Å
97L91Very high91.4Very high11 Ų1159.5 Ų59.56%0.05829%0.288CS..Hα-helixtrans-54-45.5-176.8-177.370.4000112T47 D49 V51 L53 K99 V100 F101 V136 V140 M144T47-L97 HydrophobicContact CG2-CB 4.48Å; T47-L97 HydrophobicContact CG2-CD1 4.27Å; D49-L97 PolarHBondContact OD2-N 2.97Å; V51-L97 HydrophobicContact CG1-CD1 4.34Å; V51-L97 HydrophobicContact CG1-CD2 4.18Å; V51-L97 HydrophobicContact CG2-CD2 4.38Å; L53-L97 HydrophobicContact CD2-CD1 3.66Å; L97-K99 PolarHBondContact O-N 3.44Å; L97-V100 WeakPolarHBondContact O-CB 3.44Å; L97-V100 PolarHBondContact O-N 3.35Å; L97-F101 HydrophobicContact CD1-CE2 3.92Å; L97-F101 HydrophobicContact CG-CD2 4.42Å; L97-F101 HydrophobicContact CG-CE2 4.13Å; L97-F101 VanDerWaalsContact O-CD2 3.26Å; L97-F101 WeakPolarHBondContact O-CD2 3.44Å; L97-F101 PolarHBondContact O-N 2.87Å; L97-V136 HydrophobicContact CD1-CG2 4.01Å; L97-V136 HydrophobicContact CD2-CG1 4.27Å; L97-V140 HydrophobicContact CD2-CG1 3.89Å; L97-M144 HydrophobicContact CD2-SD 4.48Å
98D89.4Confident91.4Very high64 Ų6459.8 Ų59.834%0.34229%0.289SS..Hα-helixtrans-63.6-40179177.671.3000112.3S96 V100 F101 R102S96-D98 VanDerWaalsContact C-N 3.3Å; S96-D98 PolarHBondContact O-N 2.88Å; D98-V100 PolarHBondContact O-N 2.94Å; D98-F101 PolarHBondContact O-N 2.9Å; D98-R102 VanDerWaalsContact CG-NH2 3.31Å; D98-R102 WeakPolarHBondContact O-CG 3.47Å; D98-R102 PolarHBondContact O-N 3.37Å; D98-R102 IonicContact OD1-CZ 3.23Å; D98-R102 VanDerWaalsContact OD1-CZ 3.23Å; D98-R102 IonicContact OD1-NE 2.84Å; D98-R102 PolarHBondContact OD1-NE 3.27Å; D98-R102 IonicContact OD1-NH2 2.76Å; D98-R102 PolarHBondContact OD1-NH2 3.49Å; D98-R102 IonicContact OD2-CZ 3.16Å; D98-R102 IonicContact OD2-NE 2.86Å; D98-R102 PolarHBondContact OD2-NE 3.27Å; D98-R102 IonicContact OD2-NH2 3.12Å; D98-R102 PolarHBondContact OD2-NH2 2.92Å; D98-R102 VanDerWaalsContact OD2-NH2 3.12Å
99K90.9Very high91.5Very high90 Ų9062.1 Ų62.139%0.39131%0.308SS..Hα-helixtrans-64.1-38.8174.6-78-170.6169.5-159.30112.5L95 S96 L97 F101 R102 E103L95-K99 HydrophobicContact CD2-CD 4.45Å; S96-K99 WeakPolarHBondContact O-CB 3.3Å; S96-K99 PolarHBondContact O-N 3.36Å; S96-K99 VanDerWaalsContact O-N 3.08Å; S96-K99 WeakPolarHBondContact OG-CG 3.4Å; L97-K99 PolarHBondContact O-N 3.44Å; K99-F101 PolarHBondContact O-N 2.83Å; K99-R102 PolarHBondContact O-N 3.03Å; K99-R102 VanDerWaalsContact O-N 3.14Å; K99-E103 WeakPolarHBondContact O-CB 3.29Å; K99-E103 PolarHBondContact O-N 3.41Å
100V90.2Very high91.5Very high0 Ų059.7 Ų59.70%031%0.307CS..Hα-helixtrans-60.4-32.4176.71760000111.7L92 L95 S96 L97 D98 R104 L107 I134L92-V100 HydrophobicContact CD1-CB 4.16Å; L92-V100 HydrophobicContact CD1-CG1 3.69Å; L92-V100 HydrophobicContact CD1-CG2 3.33Å; L95-V100 HydrophobicContact CB-CG2 3.75Å; L95-V100 HydrophobicContact CD1-CG2 4.32Å; S96-V100 WeakPolarHBondContact O-CG2 3.49Å; S96-V100 PolarHBondContact O-N 3.46Å; L97-V100 WeakPolarHBondContact O-CB 3.44Å; L97-V100 PolarHBondContact O-N 3.35Å; D98-V100 PolarHBondContact O-N 2.94Å; V100-R104 VanDerWaalsContact O-CG 3.23Å; V100-R104 WeakPolarHBondContact O-CG 3.31Å; V100-L107 HydrophobicContact CG1-CD2 4.19Å; V100-I134 HydrophobicContact CG1-CD1 3.83Å
101F87.4Confident91.6Very high76 Ų7656.6 Ų56.633%0.33329%0.285SS..Hα-helixtrans-79.2-35.3173.6-75.9-73.8000113.8L97 D98 K99 I134 V136L97-F101 HydrophobicContact CD1-CE2 3.92Å; L97-F101 HydrophobicContact CG-CD2 4.42Å; L97-F101 HydrophobicContact CG-CE2 4.13Å; L97-F101 VanDerWaalsContact O-CD2 3.26Å; L97-F101 WeakPolarHBondContact O-CD2 3.44Å; L97-F101 PolarHBondContact O-N 2.87Å; D98-F101 PolarHBondContact O-N 2.9Å; K99-F101 PolarHBondContact O-N 2.83Å; F101-I134 HydrophobicContact CE1-CB 4.16Å; F101-I134 HydrophobicContact CE1-CD1 4.27Å; F101-I134 HydrophobicContact CE1-CG2 4.33Å; F101-I134 HydrophobicContact CZ-CB 4.19Å; F101-I134 HydrophobicContact CZ-CG2 3.87Å; F101-V136 HydrophobicContact CE2-CG2 3.98Å; F101-V136 HydrophobicContact CZ-CG2 3.79Å
102R88.5Confident91.7Very high182 Ų18255.9 Ų55.969%0.68728%0.283SS*.Hα-helixtrans-84.4-37.7-176.5-66.3-178.2-163.2-151.712.8114.3D98 K99D98-R102 VanDerWaalsContact CG-NH2 3.31Å; D98-R102 WeakPolarHBondContact O-CG 3.47Å; D98-R102 PolarHBondContact O-N 3.37Å; D98-R102 IonicContact OD1-CZ 3.23Å; D98-R102 VanDerWaalsContact OD1-CZ 3.23Å; D98-R102 IonicContact OD1-NE 2.84Å; D98-R102 PolarHBondContact OD1-NE 3.27Å; D98-R102 IonicContact OD1-NH2 2.76Å; D98-R102 PolarHBondContact OD1-NH2 3.49Å; D98-R102 IonicContact OD2-CZ 3.16Å; D98-R102 IonicContact OD2-NE 2.86Å; D98-R102 PolarHBondContact OD2-NE 3.27Å; D98-R102 IonicContact OD2-NH2 3.12Å; D98-R102 PolarHBondContact OD2-NH2 2.92Å; D98-R102 VanDerWaalsContact OD2-NH2 3.12Å; K99-R102 PolarHBondContact O-N 3.03Å; K99-R102 VanDerWaalsContact O-N 3.14Å
103E91.3Very high91.9Very high78 Ų7860.6 Ų60.636%0.36431%0.308SS..  trans-109.933.4-168.7-60176.5-150.900111.8K99 E105 S106 L107K99-E103 WeakPolarHBondContact O-CB 3.29Å; K99-E103 PolarHBondContact O-N 3.41Å; E103-E105 VanDerWaalsContact C-N 3.26Å; E103-E105 PolarHBondContact O-N 3.47Å; E103-S106 WeakPolarHBondContact O-CB 3.34Å; E103-S106 PolarHBondContact O-N 2.87Å; E103-L107 PolarHBondContact O-N 3.38Å; E103-L107 VanDerWaalsContact O-N 3.09Å
104R89.9Confident92Very high86 Ų8660.3 Ų60.333%0.32530%0.303SS..Hα-helixtrans-51.4-40.9-177.9-75.2-171.7175-153.2-0113.6V100 L107 N108V100-R104 VanDerWaalsContact O-CG 3.23Å; V100-R104 WeakPolarHBondContact O-CG 3.31Å; R104-L107 PolarHBondContact O-N 2.96Å; R104-N108 WeakPolarHBondContact O-CB 3.27Å; R104-N108 VanDerWaalsContact O-CG 3.29Å; R104-N108 PolarHBondContact O-N 2.89Å; R104-N108 PolarHBondContact O-OD1 3.39Å
105E91.2Very high92.1Very high169 Ų16954.7 Ų54.779%0.7928%0.278SS*.Hα-helixtrans-64.5-39.6179.3-172.8173.3-167.700112.3E103 N108 A109E103-E105 VanDerWaalsContact C-N 3.26Å; E103-E105 PolarHBondContact O-N 3.47Å; E105-N108 PolarHBondContact O-N 2.85Å; E105-A109 PolarHBondContact O-N 2.82Å
106S92Very high92.2Very high66 Ų6654.2 Ų54.246%0.46228%0.276SS..Hα-helixtrans-65.3-41.5175.2-174.10000111.7E103 A109 S110E103-S106 WeakPolarHBondContact O-CB 3.34Å; E103-S106 PolarHBondContact O-N 2.87Å; S106-A109 PolarHBondContact O-N 2.94Å; S106-S110 WeakPolarHBondContact O-CB 3.37Å; S106-S110 PolarHBondContact O-N 2.94Å; S106-S110 PolarHBondContact O-OG 3.43Å
107L91.9Very high92.1Very high3 Ų360.3 Ų60.32%0.01630%0.302CS..Hα-helixtrans-65.8-43.6174.7-179.855.9000111.7E91 L95 V100 E103 R104 A109 S110 I111 I131E91-L107 HydrophobicContact CB-CD1 3.65Å; L95-L107 HydrophobicContact CD1-CB 4.31Å; L95-L107 HydrophobicContact CD1-CD1 4Å; L95-L107 HydrophobicContact CD1-CD2 4.29Å; L95-L107 HydrophobicContact CD1-CG 4.44Å; V100-L107 HydrophobicContact CG1-CD2 4.19Å; E103-L107 PolarHBondContact O-N 3.38Å; E103-L107 VanDerWaalsContact O-N 3.09Å; R104-L107 PolarHBondContact O-N 2.96Å; L107-A109 PolarHBondContact O-N 3.22Å; L107-S110 PolarHBondContact O-N 3.5Å; L107-I111 HydrophobicContact CD1-CD1 3.8Å; L107-I111 HydrophobicContact CD1-CG1 4.11Å; L107-I111 HydrophobicContact CG-CD1 3.88Å; L107-I111 WeakPolarHBondContact O-CB 3.24Å; L107-I111 VanDerWaalsContact O-CG1 3.28Å; L107-I111 WeakPolarHBondContact O-CG1 3.31Å; L107-I111 PolarHBondContact O-N 2.9Å; L107-I131 HydrophobicContact CD2-CD1 3.67Å; L107-I131 HydrophobicContact CG-CD1 4.05Å
108N93.4Very high92.1Very high22 Ų2261.4 Ų61.412%0.11831%0.313CS..Hα-helixtrans-57.2-48.8174.6-75-2.7000111.2R104 E105 I111 V112 Y129 E130 I131R104-N108 WeakPolarHBondContact O-CB 3.27Å; R104-N108 VanDerWaalsContact O-CG 3.29Å; R104-N108 PolarHBondContact O-N 2.89Å; R104-N108 PolarHBondContact O-OD1 3.39Å; E105-N108 PolarHBondContact O-N 2.85Å; N108-I111 PolarHBondContact O-N 3.32Å; N108-V112 VanDerWaalsContact O-CG2 3.24Å; N108-V112 WeakPolarHBondContact O-CG2 3.43Å; N108-V112 PolarHBondContact O-N 3.49Å; N108-Y129 WeakPolarHBondContact CB-O 3.49Å; N108-Y129 PolarHBondContact ND2-O 2.91Å; N108-E130 PolarHBondContact ND2-OE2 2.9Å; N108-I131 WeakPolarHBondContact OD1-CD1 3.42Å; N108-I131 WeakPolarHBondContact OD1-CG1 3.35Å
109A93.8Very high92.1Very high50 Ų5058.4 Ų58.441%0.41330%0.296SS..Hα-helixtrans-60.4-47.2177.600000112.2E105 S106 L107 I111 V112 D113E105-A109 PolarHBondContact O-N 2.82Å; S106-A109 PolarHBondContact O-N 2.94Å; L107-A109 PolarHBondContact O-N 3.22Å; A109-I111 VanDerWaalsContact C-N 3.31Å; A109-I111 PolarHBondContact O-N 3.31Å; A109-V112 PolarHBondContact O-N 3.45Å; A109-V112 VanDerWaalsContact O-N 3.14Å; A109-D113 PolarHBondContact O-N 3.31Å
110S93.4Very high92Very high47 Ų4757.9 Ų57.933%0.32930%0.298SS..Hα-helixtrans-59.3-40.8178.4-56.70000112.4S106 L107 A114S106-S110 WeakPolarHBondContact O-CB 3.37Å; S106-S110 PolarHBondContact O-N 2.94Å; S106-S110 PolarHBondContact O-OG 3.43Å; L107-S110 PolarHBondContact O-N 3.5Å; S110-A114 WeakPolarHBondContact O-CB 3.44Å; S110-A114 PolarHBondContact O-N 3.19Å; S110-A114 VanDerWaalsContact O-N 3.1Å
111I94Very high91.9Very high0 Ų062 Ų620%033%0.326CS..Hα-helixtrans-66.6-43.3175.8-69.9167.3000111T87 M88 E91 L107 N108 A109 A114 I115 Y129T87-I111 HydrophobicContact CG2-CG2 4.36Å; M88-I111 HydrophobicContact CB-CD1 4.02Å; M88-I111 HydrophobicContact CG-CD1 4.04Å; E91-I111 HydrophobicContact CB-CG1 4.17Å; E91-I111 HydrophobicContact CG-CG1 4.06Å; L107-I111 HydrophobicContact CD1-CD1 3.8Å; L107-I111 HydrophobicContact CD1-CG1 4.11Å; L107-I111 HydrophobicContact CG-CD1 3.88Å; L107-I111 WeakPolarHBondContact O-CB 3.24Å; L107-I111 VanDerWaalsContact O-CG1 3.28Å; L107-I111 WeakPolarHBondContact O-CG1 3.31Å; L107-I111 PolarHBondContact O-N 2.9Å; N108-I111 PolarHBondContact O-N 3.32Å; A109-I111 VanDerWaalsContact C-N 3.31Å; A109-I111 PolarHBondContact O-N 3.31Å; I111-A114 PolarHBondContact O-N 2.72Å; I111-I115 HydrophobicContact CG2-CD1 3.58Å; I111-I115 HydrophobicContact CG2-CG1 4.31Å; I111-I115 WeakPolarHBondContact O-CB 3.41Å; I111-I115 VanDerWaalsContact O-CG1 3.22Å; I111-I115 WeakPolarHBondContact O-CG1 3.46Å; I111-I115 PolarHBondContact O-N 2.93Å; I111-Y129 HydrophobicContact CB-CD1 4.22Å; I111-Y129 HydrophobicContact CB-CG 4.49Å; I111-Y129 HydrophobicContact CD1-CD1 3.85Å; I111-Y129 HydrophobicContact CD1-CE1 3.71Å; I111-Y129 HydrophobicContact CG2-CD1 3.82Å; I111-Y129 HydrophobicContact CG2-CD2 4.18Å; I111-Y129 HydrophobicContact CG2-CE1 4.29Å; I111-Y129 HydrophobicContact CG2-CG 3.75Å
112V95.6Very high92Very high19 Ų1961 Ų6112%0.11532%0.32CS..Hα-helixtrans-60.5-46.3177.9170.50000111.3N108 A109 I115 N116 C126 Y129N108-V112 VanDerWaalsContact O-CG2 3.24Å; N108-V112 WeakPolarHBondContact O-CG2 3.43Å; N108-V112 PolarHBondContact O-N 3.49Å; A109-V112 PolarHBondContact O-N 3.45Å; A109-V112 VanDerWaalsContact O-N 3.14Å; V112-I115 PolarHBondContact O-N 3.24Å; V112-N116 WeakPolarHBondContact CG1-ND2 3.35Å; V112-N116 WeakPolarHBondContact O-CB 3.39Å; V112-N116 PolarHBondContact O-N 2.78Å; V112-N116 PolarHBondContact O-ND2 2.89Å; V112-C126 HydrophobicContact CG1-CB 4.4Å; V112-Y129 VanDerWaalsContact CG2-N 3.26Å
113D94.9Very high92.1Very high99 Ų9952.6 Ų52.653%0.52929%0.29SS..Hα-helixtrans-65.4-43-179.6-75.6-14.4000112.1A109 N116 Q117A109-D113 PolarHBondContact O-N 3.31Å; D113-N116 PolarHBondContact O-N 3.36Å; D113-Q117 WeakPolarHBondContact O-CG 3.24Å; D113-Q117 PolarHBondContact O-N 3.39Å; D113-Q117 PolarHBondContact O-NE2 3.12Å; D113-Q117 VanDerWaalsContact O-NE2 3.17Å
114A94.4Very high92.1Very high25 Ų2549.1 Ų49.121%0.20727%0.274CS..Hα-helixtrans-69.5-34.1177.300000112.9T87 S110 I111T87-A114 HydrophobicContact CG2-CB 3.48Å; T87-A114 VanDerWaalsContact CG2-CB 3.48Å; S110-A114 WeakPolarHBondContact O-CB 3.44Å; S110-A114 PolarHBondContact O-N 3.19Å; S110-A114 VanDerWaalsContact O-N 3.1Å; I111-A114 PolarHBondContact O-N 2.72Å
115I94.6Very high92.2Very high0 Ų050.4 Ų50.40%028%0.279CS..Hα-helixtrans-66.2-47.1171.5-71.1168000110.5L59 V80 L83 A84 T87 I111 V112 Q117 A118 A119 C126L59-I115 HydrophobicContact CD1-CD1 3.89Å; V80-I115 HydrophobicContact CG1-CG2 4.33Å; L83-I115 HydrophobicContact CD2-CG2 4.21Å; A84-I115 HydrophobicContact CB-CD1 3.66Å; A84-I115 HydrophobicContact CB-CG1 4.42Å; T87-I115 HydrophobicContact CG2-CG1 4.32Å; I111-I115 HydrophobicContact CG2-CD1 3.58Å; I111-I115 HydrophobicContact CG2-CG1 4.31Å; I111-I115 WeakPolarHBondContact O-CB 3.41Å; I111-I115 VanDerWaalsContact O-CG1 3.22Å; I111-I115 WeakPolarHBondContact O-CG1 3.46Å; I111-I115 PolarHBondContact O-N 2.93Å; V112-I115 PolarHBondContact O-N 3.24Å; I115-Q117 VanDerWaalsContact C-N 3.33Å; I115-Q117 PolarHBondContact O-N 2.86Å; I115-A118 PolarHBondContact O-N 2.82Å; I115-A119 HydrophobicContact CG2-CB 4.33Å; I115-A119 VanDerWaalsContact O-CB 3.29Å; I115-A119 WeakPolarHBondContact O-CB 3.3Å; I115-A119 PolarHBondContact O-N 2.87Å; I115-C126 HydrophobicContact CG2-CB 3.93Å
116N94.8Very high92.4Very high27 Ų2742.5 Ų42.514%0.14424%0.242CC..Hα-helixtrans-61.3-38.4-175.9-83.7-39.7000112.9V112 D113 A118 A119 D120 C126V112-N116 WeakPolarHBondContact CG1-ND2 3.35Å; V112-N116 WeakPolarHBondContact O-CB 3.39Å; V112-N116 PolarHBondContact O-N 2.78Å; V112-N116 PolarHBondContact O-ND2 2.89Å; D113-N116 PolarHBondContact O-N 3.36Å; N116-A118 PolarHBondContact O-N 2.94Å; N116-A119 PolarHBondContact O-N 2.82Å; N116-D120 PolarHBondContact O-N 3.38Å; N116-D120 VanDerWaalsContact O-N 3.12Å; N116-C126 PolarHBondContact ND2-O 2.91Å; N116-C126 WeakPolarHBondContact OD1-CB 3.44Å; N116-C126 PolarHBondContact OD1-N 3.46Å; N116-C126 PolarHBondContact OD1-O 3.43Å
117Q92.4Very high92.6Very high152 Ų15242.9 Ų42.971%0.7124%0.239SC*.Hα-helixtrans-54.8-34.1176.6-76.3168.859.200113.8D113 I115D113-Q117 WeakPolarHBondContact O-CG 3.24Å; D113-Q117 PolarHBondContact O-N 3.39Å; D113-Q117 PolarHBondContact O-NE2 3.12Å; D113-Q117 VanDerWaalsContact O-NE2 3.17Å; I115-Q117 VanDerWaalsContact C-N 3.33Å; I115-Q117 PolarHBondContact O-N 2.86Å
118A89.4Confident92.7Very high35 Ų3548 Ų4829%0.28926%0.258SS..Hα-helixtrans-97.7-29.4176.900000113.2L83 I115 N116 D120 C121L83-A118 HydrophobicContact CD1-CB 4.2Å; L83-A118 HydrophobicContact CD2-CB 3.76Å; I115-A118 PolarHBondContact O-N 2.82Å; N116-A118 PolarHBondContact O-N 2.94Å; A118-D120 PolarHBondContact O-N 3.17Å; A118-C121 WeakPolarHBondContact O-CB 3.34Å; A118-C121 PolarHBondContact O-N 3.43Å; A118-C121 PolarHBondContact O-SG 3.15Å; A118-C121 VanDerWaalsContact O-SG 3.38Å
119A89.9Confident92.8Very high0 Ų047 Ų470%025%0.252CS..Hα-helixtrans-72.4-22.9-178.800000114.2V80 I115 N116 C121 W122 G123 I124V80-A119 HydrophobicContact CG2-CB 4.48Å; I115-A119 HydrophobicContact CG2-CB 4.33Å; I115-A119 VanDerWaalsContact O-CB 3.29Å; I115-A119 WeakPolarHBondContact O-CB 3.3Å; I115-A119 PolarHBondContact O-N 2.87Å; N116-A119 PolarHBondContact O-N 2.82Å; A119-C121 PolarHBondContact O-N 2.96Å; A119-W122 HydrophobicContact CB-CE3 4.48Å; A119-W122 PolarHBondContact O-N 3.13Å; A119-G123 PolarHBondContact O-N 3.09Å; A119-I124 CarbonylContact C-O 3.46Å; A119-I124 WeakPolarHBondContact CB-O 3.3Å; A119-I124 PolarHBondContact O-N 2.96Å
120D88.8Confident92.8Very high80 Ų8048.5 Ų48.543%0.42825%0.251SS..G310 helixtrans-58.3-27.6174.7-90.6-19.6000112.6N116 A118 W122 G123 R125N116-D120 PolarHBondContact O-N 3.38Å; N116-D120 VanDerWaalsContact O-N 3.12Å; A118-D120 PolarHBondContact O-N 3.17Å; D120-W122 VanDerWaalsContact C-N 3.25Å; D120-W122 PolarHBondContact O-N 2.9Å; D120-G123 PolarHBondContact O-N 2.82Å; D120-R125 IonicContact OD1-NH2 3.73Å
121C87.9Confident92.8Very high86 Ų8647 Ų4758%0.58124%0.238SC*.G310 helixtrans-57.4-38.4171.3-60.60000112.3A118 A119A118-C121 WeakPolarHBondContact O-CB 3.34Å; A118-C121 PolarHBondContact O-N 3.43Å; A118-C121 PolarHBondContact O-SG 3.15Å; A118-C121 VanDerWaalsContact O-SG 3.38Å; A119-C121 PolarHBondContact O-N 2.96Å
122W90.8Very high92.6Very high55 Ų5551.8 Ų51.821%0.20826%0.259CS..G310 helixtrans-961.3-175.4-51.7-40.3000112.8K68 A69 V73 A79 V80 L83 A119 D120 I124K68-W122 CarbonylContact C-O 3.58Å; K68-W122 VanDerWaalsContact C-O 3.25Å; A69-W122 WeakPolarHBondContact CA-O 3.43Å; A69-W122 WeakPolarHBondContact CB-O 3.44Å; A69-W122 PolarHBondContact N-O 3.44Å; V73-W122 HydrophobicContact CB-CG 4.28Å; V73-W122 HydrophobicContact CG1-CB 4.14Å; V73-W122 HydrophobicContact CG1-CD2 4.42Å; V73-W122 HydrophobicContact CG1-CG 3.9Å; A79-W122 HydrophobicContact CB-CH2 4.05Å; A79-W122 HydrophobicContact CB-CZ2 4.31Å; A79-W122 HydrophobicContact CB-CZ3 4.17Å; V80-W122 HydrophobicContact CG2-CE3 3.54Å; V80-W122 HydrophobicContact CG2-CZ3 3.67Å; L83-W122 HydrophobicContact CD2-CH2 4.28Å; L83-W122 HydrophobicContact CD2-CZ3 3.92Å; A119-W122 HydrophobicContact CB-CE3 4.48Å; A119-W122 PolarHBondContact O-N 3.13Å; D120-W122 VanDerWaalsContact C-N 3.25Å; D120-W122 PolarHBondContact O-N 2.9Å; W122-I124 VanDerWaalsContact C-N 3.28Å; W122-I124 HydrophobicContact CB-CD1 3.98Å; W122-I124 HydrophobicContact CB-CG1 4.33Å; W122-I124 PolarHBondContact O-N 2.89Å
123G89.3Confident92.3Very high6 Ų654.1 Ų54.16%0.06227%0.271CS..THydrogen-bonded Turntrans71.620.8179.800000114.3M64 D65 A119 D120M64-G123 PolarHBondContact N-O 3.26Å; D65-G123 PolarHBondContact N-O 3.18Å; A119-G123 PolarHBondContact O-N 3.09Å; D120-G123 PolarHBondContact O-N 2.82Å
124I91.6Very high92.2Very high5 Ų550.4 Ų50.43%0.02625%0.251CS..EExtended strand (participates in β ladder)trans-111.2138.5-179.3-55.6162.1000108.3L61 P76 V80 A119 W122L61-I124 HydrophobicContact CB-CG2 4.09Å; L61-I124 HydrophobicContact CD1-CG2 4.34Å; L61-I124 HydrophobicContact CD2-CG2 4.07Å; L61-I124 HydrophobicContact CG-CG2 4.41Å; P76-I124 HydrophobicContact CB-CD1 3.45Å; P76-I124 VanDerWaalsContact CB-CD1 3.45Å; V80-I124 HydrophobicContact CG2-CD1 3.68Å; V80-I124 HydrophobicContact CG2-CG2 4.42Å; A119-I124 CarbonylContact C-O 3.46Å; A119-I124 WeakPolarHBondContact CB-O 3.3Å; A119-I124 PolarHBondContact O-N 2.96Å; W122-I124 VanDerWaalsContact C-N 3.28Å; W122-I124 HydrophobicContact CB-CD1 3.98Å; W122-I124 HydrophobicContact CB-CG1 4.33Å; W122-I124 PolarHBondContact O-N 2.89Å
125R93.3Very high92Very high113 Ų11353.4 Ų53.443%0.42626%0.261SS..EExtended strand (participates in β ladder)trans-114.7129172.3-175.6158.6-68.4-166.6-4.4110.5L61 R62 M64 D120 L127L61-R125 CarbonylContact C-O 3.53Å; L61-R125 WeakPolarHBondContact CA-O 3.26Å; R62-R125 PolarHBondContact N-O 3.38Å; R62-R125 PolarHBondContact O-N 3.42Å; M64-R125 HydrophobicContact CG-CB 3.81Å; D120-R125 IonicContact OD1-NH2 3.73Å; R125-L127 HydrophobicContact CG-CD2 4.36Å
126C95.2Very high91.9Very high3 Ų354.7 Ų54.72%0.0227%0.268CS..EExtended strand (participates in β ladder)trans-74.8124.3162.3-177.20000109.3L59 L61 V112 I115 N116L59-C126 HydrophobicContact CD1-CB 4.48Å; L59-C126 WeakPolarHBondContact CD1-SG 3.46Å; L61-C126 HydrophobicContact CD2-CB 4.05Å; V112-C126 HydrophobicContact CG1-CB 4.4Å; I115-C126 HydrophobicContact CG2-CB 3.93Å; N116-C126 PolarHBondContact ND2-O 2.91Å; N116-C126 WeakPolarHBondContact OD1-CB 3.44Å; N116-C126 PolarHBondContact OD1-N 3.46Å; N116-C126 PolarHBondContact OD1-O 3.43Å
127L94.4Very high91.7Very high74 Ų7455.7 Ų55.739%0.38728%0.276SS..EExtended strand (participates in β ladder)trans-90.5-37.7176.4-58.4-179.3000111.4E35 Y60 R62 R125E35-L127 HydrophobicContact CB-CD1 4.49Å; E35-L127 HydrophobicContact CG-CD1 3.91Å; Y60-L127 PolarHBondContact O-N 2.77Å; R62-L127 HydrophobicContact CB-CD1 4.12Å; R62-L127 HydrophobicContact CB-CG 4.36Å; R125-L127 HydrophobicContact CG-CD2 4.36Å
128R95.2Very high91.7Very high111 Ų11152.6 Ų52.642%0.41927%0.27SS..EExtended strand (participates in β ladder)trans-162.9154.6175.358.7-178.3131.9-128.5-14.8110.5E35 Y60E35-R128 IonicContact OE1-CZ 3.86Å; E35-R128 IonicContact OE1-NE 3.77Å; E35-R128 IonicContact OE1-NH2 3.03Å; E35-R128 PolarHBondContact OE1-NH2 3.1Å; Y60-R128 HydrophobicContact CD1-CG 4.44Å; Y60-R128 HydrophobicContact CD2-CG 3.49Å; Y60-R128 VanDerWaalsContact CD2-CG 3.49Å; Y60-R128 HydrophobicContact CE2-CG 4.28Å; Y60-R128 HydrophobicContact CG-CG 3.59Å; Y60-R128 PolarHBondContact N-O 3.12Å
129Y94.9Very high91.8Very high1 Ų161.1 Ų61.10%0.00429%0.294CS..EExtended strand (participates in β ladder)trans-119131.8165.8179.7-100.2000107.4V40 L59 N108 I111 V112 I131V40-Y129 HydrophobicContact CG2-CE2 4.05Å; L59-Y129 HydrophobicContact CB-CD2 4.43Å; L59-Y129 HydrophobicContact CD1-CD2 3.88Å; N108-Y129 WeakPolarHBondContact CB-O 3.49Å; N108-Y129 PolarHBondContact ND2-O 2.91Å; I111-Y129 HydrophobicContact CB-CD1 4.22Å; I111-Y129 HydrophobicContact CB-CG 4.49Å; I111-Y129 HydrophobicContact CD1-CD1 3.85Å; I111-Y129 HydrophobicContact CD1-CE1 3.71Å; I111-Y129 HydrophobicContact CG2-CD1 3.82Å; I111-Y129 HydrophobicContact CG2-CD2 4.18Å; I111-Y129 HydrophobicContact CG2-CE1 4.29Å; I111-Y129 HydrophobicContact CG2-CG 3.75Å; V112-Y129 VanDerWaalsContact CG2-N 3.26Å; Y129-I131 HydrophobicContact CD1-CG1 4.29Å; Y129-I131 HydrophobicContact CE1-CG1 3.69Å
130E94.1Very high91.7Very high81 Ų8163.4 Ų63.438%0.37931%0.308SS..EExtended strand (participates in β ladder)trans-118.9115.6177.6-62.8-63.4170.100109.3G57 V58 Y60 N108 K132G57-E130 CarbonylContact C-O 3.56Å; G57-E130 WeakPolarHBondContact CA-O 3.35Å; V58-E130 PolarHBondContact N-O 2.89Å; V58-E130 PolarHBondContact O-N 3.36Å; Y60-E130 HydrophobicContact CD2-CG 4.47Å; Y60-E130 HydrophobicContact CE2-CB 4.46Å; Y60-E130 HydrophobicContact CE2-CG 3.9Å; N108-E130 PolarHBondContact ND2-OE2 2.9Å; E130-K132 PolarHBondContact O-N 2.9Å
131I92.6Very high91.8Very high14 Ų1465 Ų657%0.07231%0.312CS..EExtended strand (participates in β ladder)trans-65.9123.9167.6-64.1163.1000108.3I55 L107 N108 Y129 I134I55-I131 HydrophobicContact CD1-CD1 4.26Å; I55-I131 HydrophobicContact CD1-CG1 4.14Å; I55-I131 HydrophobicContact CD1-CG2 3.76Å; I55-I131 HydrophobicContact CG1-CG2 4Å; L107-I131 HydrophobicContact CD2-CD1 3.67Å; L107-I131 HydrophobicContact CG-CD1 4.05Å; N108-I131 WeakPolarHBondContact OD1-CD1 3.42Å; N108-I131 WeakPolarHBondContact OD1-CG1 3.35Å; Y129-I131 HydrophobicContact CD1-CG1 4.29Å; Y129-I131 HydrophobicContact CE1-CG1 3.69Å; I131-I134 HydrophobicContact CG2-CD1 3.96Å; I131-I134 HydrophobicContact CG2-CG1 3.72Å
132K91.3Very high92Very high101 Ų10166.5 Ų66.544%0.43931%0.31SS..EExtended strand (participates in β ladder)trans-88.6-79.9-179174.7178.3154.3-68.30109.4D56 E130D56-K132 PolarHBondContact O-N 3.06Å; D56-K132 WeakPolarHBondContact OD1-CB 3.33Å; D56-K132 IonicContact OD1-NZ 3.55Å; D56-K132 IonicContact OD2-NZ 2.69Å; D56-K132 PolarHBondContact OD2-NZ 3.3Å; E130-K132 PolarHBondContact O-N 2.9Å
133D89.4Confident92Very high68 Ų6867.5 Ų67.536%0.36433%0.325SS..EExtended strand (participates in β ladder)trans-114.4152.3179.7-64.9-56.9000112.3I55 D56I55-D133 WeakPolarHBondContact CA-O 3.37Å; D56-D133 PolarHBondContact N-O 3.04Å; D56-D133 WeakPolarHBondContact OD1-CB 3.17Å; D56-D133 PolarHBondContact OD1-N 2.84Å
134I91.4Very high91.9Very high21 Ų2170.1 Ų70.111%0.10834%0.336CS..EExtended strand (participates in β ladder)trans-131106.3174-52.2-176.8000108.1L53 Q54 I55 V100 F101 I131 V136L53-I134 HydrophobicContact CD1-CG2 4Å; L53-I134 HydrophobicContact CD2-CG2 4.1Å; L53-I134 HydrophobicContact CG-CG2 4.5Å; Q54-I134 CarbonylContact O-C 3.6Å; I55-I134 HydrophobicContact CD1-CD1 4.31Å; I55-I134 HydrophobicContact CD1-CG1 4.11Å; I55-I134 HydrophobicContact CG1-CG1 4.26Å; V100-I134 HydrophobicContact CG1-CD1 3.83Å; F101-I134 HydrophobicContact CE1-CB 4.16Å; F101-I134 HydrophobicContact CE1-CD1 4.27Å; F101-I134 HydrophobicContact CE1-CG2 4.33Å; F101-I134 HydrophobicContact CZ-CB 4.19Å; F101-I134 HydrophobicContact CZ-CG2 3.87Å; I131-I134 HydrophobicContact CG2-CD1 3.96Å; I131-I134 HydrophobicContact CG2-CG1 3.72Å; I134-V136 HydrophobicContact CG2-CG2 4.19Å
135H91.4Very high91.9Very high89 Ų8975 Ų7541%0.41236%0.36SS..EExtended strand (participates in β ladder)trans-94.1117.2177.6-57.2117.2000110.2E42 L53 Q54E42-H135 IonicContact OE1-CE1 3.63Å; E42-H135 IonicContact OE1-CG 3.83Å; E42-H135 IonicContact OE1-ND1 2.79Å; E42-H135 PolarHBondContact OE1-ND1 2.94Å; L53-H135 WeakPolarHBondContact CA-O 3.47Å; L53-H135 WeakPolarHBondContact CB-O 3.47Å; Q54-H135 HydrophobicContact CB-CB 4.22Å; Q54-H135 PolarHBondContact N-O 3.29Å; Q54-H135 PolarHBondContact O-N 3.36Å
136V91.8Very high91.9Very high26 Ų2676.1 Ų76.116%0.15837%0.371CS..  trans-111.3139.3177.5-176.60000108.3V51 L53 L97 F101 I134 V140V51-V136 HydrophobicContact CG1-CG1 4.24Å; L53-V136 HydrophobicContact CB-CG2 4.29Å; L97-V136 HydrophobicContact CD1-CG2 4.01Å; L97-V136 HydrophobicContact CD2-CG1 4.27Å; F101-V136 HydrophobicContact CE2-CG2 3.98Å; F101-V136 HydrophobicContact CZ-CG2 3.79Å; I134-V136 HydrophobicContact CG2-CG2 4.19Å; V136-V140 HydrophobicContact CG1-CB 3.98Å; V136-V140 HydrophobicContact CG1-CG1 4.02Å
137P91.4Very high91.7Very high48 Ų4882.5 Ų82.531%0.31240%0.401SS..  trans-51135.9177.1-29.635.5000112.6T52 R139 V140 K141T52-P137 WeakPolarHBondContact O-CD 3.3Å; T52-P137 WeakPolarHBondContact O-CG 3.38Å; P137-R139 VanDerWaalsContact C-N 3.29Å; P137-R139 PolarHBondContact O-N 3.1Å; P137-V140 PolarHBondContact O-N 3.48Å; P137-K141 PolarHBondContact O-N 3.48Å
138P91.4Very high91.6Very high88 Ų8881.8 Ų81.857%0.57140%0.399SS*.Hα-helixtrans-58-39-169.419.5-31.9000113V140 K141 E142P138-V140 VanDerWaalsContact C-N 3.3Å; P138-V140 PolarHBondContact O-N 3.41Å; P138-K141 WeakPolarHBondContact O-CB 3.31Å; P138-K141 PolarHBondContact O-N 2.92Å; P138-K141 VanDerWaalsContact O-N 3.14Å; P138-E142 WeakPolarHBondContact O-CB 3.48Å; P138-E142 WeakPolarHBondContact O-CG 3.47Å; P138-E142 PolarHBondContact O-N 3.12Å
139R90.8Very high91.5Very high213 Ų21383 Ų8380%0.80441%0.409SS*.Hα-helixtrans-55.9-39.3176-68.8-178174175.1-2.3113.7P137 S143P137-R139 VanDerWaalsContact C-N 3.29Å; P137-R139 PolarHBondContact O-N 3.1Å; R139-S143 WeakPolarHBondContact O-CB 3.32Å; R139-S143 PolarHBondContact O-N 3.47Å; R139-S143 VanDerWaalsContact O-N 3.15Å
140V89.7Confident91.5Very high49 Ų4985.8 Ų85.830%0.29743%0.433SS..Hα-helixtrans-74.7-40.8179.3179.50000109.9V51 L97 V136 P137 P138 S143 M144V51-V140 HydrophobicContact CG1-CG1 4.13Å; V51-V140 HydrophobicContact CG1-CG2 4.41Å; V51-V140 HydrophobicContact CG2-CG1 4.27Å; L97-V140 HydrophobicContact CD2-CG1 3.89Å; V136-V140 HydrophobicContact CG1-CB 3.98Å; V136-V140 HydrophobicContact CG1-CG1 4.02Å; P137-V140 PolarHBondContact O-N 3.48Å; P138-V140 VanDerWaalsContact C-N 3.3Å; P138-V140 PolarHBondContact O-N 3.41Å; V140-S143 PolarHBondContact O-N 2.92Å; V140-M144 WeakPolarHBondContact O-CB 3.38Å; V140-M144 PolarHBondContact O-N 2.87Å
141K89.3Confident91.5Very high114 Ų11486.4 Ų86.450%0.49644%0.436SS..Hα-helixtrans-61-45.6175.9-175.4178.8178.2179.70112.1P137 P138 M144 Q145P137-K141 PolarHBondContact O-N 3.48Å; P138-K141 WeakPolarHBondContact O-CB 3.31Å; P138-K141 PolarHBondContact O-N 2.92Å; P138-K141 VanDerWaalsContact O-N 3.14Å; K141-M144 PolarHBondContact O-N 2.96Å; K141-Q145 WeakPolarHBondContact O-CB 3.46Å; K141-Q145 VanDerWaalsContact O-CG 3.27Å; K141-Q145 WeakPolarHBondContact O-CG 3.48Å; K141-Q145 PolarHBondContact O-N 3.01Å
142E92.8Very high91.7Very high117 Ų11794.2 Ų94.255%0.54746%0.464SS..Hα-helixtrans-62-47176.1-73.8163.8-164.600111.7P138 M144 Q145 M146P138-E142 WeakPolarHBondContact O-CB 3.48Å; P138-E142 WeakPolarHBondContact O-CG 3.47Å; P138-E142 PolarHBondContact O-N 3.12Å; E142-M144 PolarHBondContact O-N 3.4Å; E142-Q145 PolarHBondContact O-N 3.41Å; E142-M146 WeakPolarHBondContact O-CB 3.31Å; E142-M146 PolarHBondContact O-N 3.45Å
143S90Very high91.9Very high76 Ų7698.4 Ų98.453%0.53148%0.477SS..Hα-helixtrans-59.9-45.3176.5-175.50000112R139 V140 Q145 M146 Q147R139-S143 WeakPolarHBondContact O-CB 3.32Å; R139-S143 PolarHBondContact O-N 3.47Å; R139-S143 VanDerWaalsContact O-N 3.15Å; V140-S143 PolarHBondContact O-N 2.92Å; S143-Q145 PolarHBondContact O-N 3.22Å; S143-M146 PolarHBondContact O-N 2.94Å; S143-Q147 WeakPolarHBondContact O-CB 3.4Å; S143-Q147 PolarHBondContact O-N 3.01Å
144M89Confident92.3Very high60 Ų60102.4 Ų102.430%0.29649%0.492SS..Hα-helixtrans-64.4-40.2177-170.518075.800112L97 V140 K141 E142 Q147 V148L97-M144 HydrophobicContact CD2-SD 4.48Å; V140-M144 WeakPolarHBondContact O-CB 3.38Å; V140-M144 PolarHBondContact O-N 2.87Å; K141-M144 PolarHBondContact O-N 2.96Å; E142-M144 PolarHBondContact O-N 3.4Å; M144-Q147 PolarHBondContact O-N 3.07Å; M144-V148 WeakPolarHBondContact O-CB 3.34Å; M144-V148 VanDerWaalsContact O-CG2 3.31Å; M144-V148 WeakPolarHBondContact O-CG2 3.42Å; M144-V148 PolarHBondContact O-N 3.32Å
145Q90.5Very high92.5Very high109 Ų109109.2 Ų109.251%0.50952%0.516SS..Hα-helixtrans-62.5-46.6174.5-77.3174.9-28.400111.5K141 E142 S143 Q147 V148 E149K141-Q145 WeakPolarHBondContact O-CB 3.46Å; K141-Q145 VanDerWaalsContact O-CG 3.27Å; K141-Q145 WeakPolarHBondContact O-CG 3.48Å; K141-Q145 PolarHBondContact O-N 3.01Å; E142-Q145 PolarHBondContact O-N 3.41Å; S143-Q145 PolarHBondContact O-N 3.22Å; Q145-Q147 VanDerWaalsContact C-N 3.33Å; Q145-Q147 PolarHBondContact O-N 2.94Å; Q145-V148 PolarHBondContact O-N 3.34Å; Q145-E149 WeakPolarHBondContact O-CB 3.35Å; Q145-E149 PolarHBondContact O-N 2.72Å
146M92.7Very high92.8Very high136 Ų136107.6 Ų107.667%0.6752%0.518SS*.Hα-helixtrans-61.4-40.1176.8-173.8-179.5-68.100112.1E142 S143 A150E142-M146 WeakPolarHBondContact O-CB 3.31Å; E142-M146 PolarHBondContact O-N 3.45Å; S143-M146 PolarHBondContact O-N 2.94Å; M146-A150 VanDerWaalsContact O-CB 3.26Å; M146-A150 WeakPolarHBondContact O-CB 3.22Å; M146-A150 PolarHBondContact O-N 3.39Å
147Q91.6Very high93Very high137 Ų137109.7 Ų109.764%0.6453%0.531SS*.Hα-helixtrans-64.7-46.7175.9-175178.62.500111.9S143 M144 Q145 E149 A150 E151S143-Q147 WeakPolarHBondContact O-CB 3.4Å; S143-Q147 PolarHBondContact O-N 3.01Å; M144-Q147 PolarHBondContact O-N 3.07Å; Q145-Q147 VanDerWaalsContact C-N 3.33Å; Q145-Q147 PolarHBondContact O-N 2.94Å; Q147-E149 VanDerWaalsContact C-N 3.35Å; Q147-A150 PolarHBondContact O-N 3Å; Q147-E151 WeakPolarHBondContact O-CB 3.41Å; Q147-E151 PolarHBondContact O-N 3.43Å
148V92.1Very high93.3Very high58 Ų58110.5 Ų110.535%0.35254%0.535SS..Hα-helixtrans-65.3-38.4177.9170.40000111.3M144 Q145 R152M144-V148 WeakPolarHBondContact O-CB 3.34Å; M144-V148 VanDerWaalsContact O-CG2 3.31Å; M144-V148 WeakPolarHBondContact O-CG2 3.42Å; M144-V148 PolarHBondContact O-N 3.32Å; Q145-V148 PolarHBondContact O-N 3.34Å; V148-R152 HydrophobicContact CG1-CG 4.45Å; V148-R152 WeakPolarHBondContact O-CB 3.4Å; V148-R152 VanDerWaalsContact O-CG 3.22Å; V148-R152 WeakPolarHBondContact O-CG 3.42Å; V148-R152 PolarHBondContact O-N 2.85Å
149E94.2Very high93.6Very high136 Ų136112.2 Ų112.264%0.63654%0.539SS*.Hα-helixtrans-66.4-45.5175.2-172.9177.8176.500111.7Q145 Q147 E151 R152 R153Q145-E149 WeakPolarHBondContact O-CB 3.35Å; Q145-E149 PolarHBondContact O-N 2.72Å; Q147-E149 VanDerWaalsContact C-N 3.35Å; E149-E151 VanDerWaalsContact C-N 3.33Å; E149-E151 PolarHBondContact O-N 3.35Å; E149-R152 PolarHBondContact O-N 2.91Å; E149-R153 VanDerWaalsContact O-CB 3.31Å; E149-R153 WeakPolarHBondContact O-CB 3.4Å; E149-R153 PolarHBondContact O-N 3.22Å
150A94.7Very high93.9Very high61 Ų61108.4 Ų108.450%0.50453%0.53SS..Hα-helixtrans-60.7-41.6175.900000112M146 Q147 R153 K154M146-A150 VanDerWaalsContact O-CB 3.26Å; M146-A150 WeakPolarHBondContact O-CB 3.22Å; M146-A150 PolarHBondContact O-N 3.39Å; Q147-A150 PolarHBondContact O-N 3Å; A150-R153 PolarHBondContact O-N 2.86Å; A150-K154 WeakPolarHBondContact O-CB 3.34Å; A150-K154 PolarHBondContact O-N 2.9Å
151E93.9Very high94.3Very high93 Ų93109.5 Ų109.544%0.43554%0.54SS..Hα-helixtrans-67.4-44.3176.1-165.5-173.4173.400111.9Q147 E149 R153 K154 R155Q147-E151 WeakPolarHBondContact O-CB 3.41Å; Q147-E151 PolarHBondContact O-N 3.43Å; E149-E151 VanDerWaalsContact C-N 3.33Å; E149-E151 PolarHBondContact O-N 3.35Å; E151-R153 VanDerWaalsContact C-N 3.34Å; E151-R153 PolarHBondContact O-N 3.01Å; E151-K154 PolarHBondContact O-N 3.27Å; E151-R155 WeakPolarHBondContact O-CG 3.32Å; E151-R155 PolarHBondContact O-N 3.12Å; E151-R155 IonicContact OE1-CZ 3.26Å; E151-R155 VanDerWaalsContact OE1-CZ 3.26Å; E151-R155 IonicContact OE1-NE 3.08Å; E151-R155 PolarHBondContact OE1-NE 3.02Å; E151-R155 VanDerWaalsContact OE1-NE 3.08Å; E151-R155 IonicContact OE1-NH2 2.66Å; E151-R155 PolarHBondContact OE1-NH2 2.87Å
152R96.1Very high94.6Very high179 Ų179109.4 Ų109.468%0.67554%0.541SS*.Hα-helixtrans-59.1-44.6174.5-77.7174.3178-166.5-0.4111.5V148 E149 R155 A156V148-R152 HydrophobicContact CG1-CG 4.45Å; V148-R152 WeakPolarHBondContact O-CB 3.4Å; V148-R152 VanDerWaalsContact O-CG 3.22Å; V148-R152 WeakPolarHBondContact O-CG 3.42Å; V148-R152 PolarHBondContact O-N 2.85Å; E149-R152 PolarHBondContact O-N 2.91Å; R152-R155 PolarHBondContact O-N 3.4Å; R152-A156 WeakPolarHBondContact O-CB 3.49Å; R152-A156 PolarHBondContact O-N 2.9Å
153R96.3Very high94.9Very high188 Ų188105.6 Ų105.671%0.70953%0.533SS*.Hα-helixtrans-62.8-45.3177.2-173.3175-179.7175.30.5111.4E149 A150 E151 R155 A156 T157E149-R153 VanDerWaalsContact O-CB 3.31Å; E149-R153 WeakPolarHBondContact O-CB 3.4Å; E149-R153 PolarHBondContact O-N 3.22Å; A150-R153 PolarHBondContact O-N 2.86Å; E151-R153 VanDerWaalsContact C-N 3.34Å; E151-R153 PolarHBondContact O-N 3.01Å; R153-R155 PolarHBondContact O-N 3.16Å; R153-A156 PolarHBondContact O-N 2.87Å; R153-T157 PolarHBondContact O-N 3.36Å; R153-T157 PolarHBondContact O-OG1 3.46Å
154K96.9Very high95.2Very high153 Ų153106.4 Ų106.467%0.66554%0.535SS*.Hα-helixtrans-57.8-47.8174.4-177.9-179.4177.5-1780111.5A150 E151 T157 V158A150-K154 WeakPolarHBondContact O-CB 3.34Å; A150-K154 PolarHBondContact O-N 2.9Å; E151-K154 PolarHBondContact O-N 3.27Å; K154-T157 PolarHBondContact O-N 2.82Å; K154-V158 WeakPolarHBondContact O-CG2 3.26Å; K154-V158 PolarHBondContact O-N 3.42Å
155R96.4Very high95.6Very high164 Ų164112.3 Ų112.362%0.61955%0.554SS**Hα-helixtrans-61.7-42.4177.5-70.3173.9-177.8-143.26111.7E151 R152 R153 V158 L159E151-R155 WeakPolarHBondContact O-CG 3.32Å; E151-R155 PolarHBondContact O-N 3.12Å; E151-R155 IonicContact OE1-CZ 3.26Å; E151-R155 VanDerWaalsContact OE1-CZ 3.26Å; E151-R155 IonicContact OE1-NE 3.08Å; E151-R155 PolarHBondContact OE1-NE 3.02Å; E151-R155 VanDerWaalsContact OE1-NE 3.08Å; E151-R155 IonicContact OE1-NH2 2.66Å; E151-R155 PolarHBondContact OE1-NH2 2.87Å; R152-R155 PolarHBondContact O-N 3.4Å; R153-R155 PolarHBondContact O-N 3.16Å; R155-V158 PolarHBondContact O-N 3.02Å; R155-L159 WeakPolarHBondContact O-CB 3.32Å; R155-L159 PolarHBondContact O-N 2.94Å
156A96.7Very high96Very high55 Ų55113 Ų11346%0.45556%0.557SS.*Hα-helixtrans-62.6-47.717700000112.3R152 R153 V158 L159 E160R152-A156 WeakPolarHBondContact O-CB 3.49Å; R152-A156 PolarHBondContact O-N 2.9Å; R153-A156 PolarHBondContact O-N 2.87Å; A156-V158 VanDerWaalsContact C-N 3.34Å; A156-V158 PolarHBondContact O-N 3.44Å; A156-L159 PolarHBondContact O-N 3.49Å; A156-E160 VanDerWaalsContact O-CB 3.31Å; A156-E160 WeakPolarHBondContact O-CB 3.38Å; A156-E160 PolarHBondContact O-N 3.27Å
157T97.6Very high96.2Very high69 Ų69109.8 Ų109.842%0.42355%0.548SS..Hα-helixtrans-64.2-35.4178.1-59.50000112.9R153 K154 S161R153-T157 PolarHBondContact O-N 3.36Å; R153-T157 PolarHBondContact O-OG1 3.46Å; K154-T157 PolarHBondContact O-N 2.82Å; T157-S161 WeakPolarHBondContact O-CB 3.34Å; T157-S161 PolarHBondContact O-N 2.88Å; T157-S161 PolarHBondContact O-OG 3.44Å
158V97Very high96.4Very high66 Ų66106.2 Ų106.240%0.454%0.542SS..Hα-helixtrans-64.8-50.7172.9170.40000110.3K154 R155 A156 E160 S161 E162K154-V158 WeakPolarHBondContact O-CG2 3.26Å; K154-V158 PolarHBondContact O-N 3.42Å; R155-V158 PolarHBondContact O-N 3.02Å; A156-V158 VanDerWaalsContact C-N 3.34Å; A156-V158 PolarHBondContact O-N 3.44Å; V158-E160 VanDerWaalsContact C-N 3.32Å; V158-E160 PolarHBondContact O-N 3.47Å; V158-S161 WeakPolarHBondContact O-CB 3.46Å; V158-S161 PolarHBondContact O-N 3.34Å; V158-S161 VanDerWaalsContact O-N 3.12Å; V158-E162 HydrophobicContact CG1-CG 4.38Å; V158-E162 WeakPolarHBondContact O-CG 3.47Å; V158-E162 PolarHBondContact O-N 3.19Å
159L97.1Very high96.7Very high124 Ų124107.6 Ų107.665%0.64955%0.546SS*.Hα-helixtrans-60-40.8179.6-168.779.1000112.3R155 A156 E162 G163R155-L159 WeakPolarHBondContact O-CB 3.32Å; R155-L159 PolarHBondContact O-N 2.94Å; A156-L159 PolarHBondContact O-N 3.49Å; L159-E162 PolarHBondContact O-N 3.45Å; L159-G163 PolarHBondContact O-N 2.91Å
160E97.4Very high96.8Very high133 Ų133105.4 Ų105.462%0.62154%0.539SS*.Hα-helixtrans-64.6-40.5175.4-177.4175.7-155.300112A156 V158 T164A156-E160 VanDerWaalsContact O-CB 3.31Å; A156-E160 WeakPolarHBondContact O-CB 3.38Å; A156-E160 PolarHBondContact O-N 3.27Å; V158-E160 VanDerWaalsContact C-N 3.32Å; V158-E160 PolarHBondContact O-N 3.47Å; E160-T164 VanDerWaalsContact O-CB 3.3Å; E160-T164 WeakPolarHBondContact O-CB 3.47Å; E160-T164 PolarHBondContact O-N 2.73Å; E160-T164 PolarHBondContact O-OG1 2.92Å
161S97.2Very high97Very high72 Ų72106.2 Ų106.250%0.50354%0.537SS..Hα-helixtrans-67.4-40.6175.6-56.50000112T157 V158 R165T157-S161 WeakPolarHBondContact O-CB 3.34Å; T157-S161 PolarHBondContact O-N 2.88Å; T157-S161 PolarHBondContact O-OG 3.44Å; V158-S161 WeakPolarHBondContact O-CB 3.46Å; V158-S161 PolarHBondContact O-N 3.34Å; V158-S161 VanDerWaalsContact O-N 3.12Å; S161-R165 WeakPolarHBondContact O-CB 3.27Å; S161-R165 PolarHBondContact O-N 3Å
162E97.1Very high97.1Very high112 Ų112104.6 Ų104.652%0.52354%0.54SS..Hα-helixtrans-64.4-49.7175.5-72.9172.6163.500110.9V158 L159 T164 R165 E166V158-E162 HydrophobicContact CG1-CG 4.38Å; V158-E162 WeakPolarHBondContact O-CG 3.47Å; V158-E162 PolarHBondContact O-N 3.19Å; L159-E162 PolarHBondContact O-N 3.45Å; E162-T164 VanDerWaalsContact C-N 3.33Å; E162-T164 PolarHBondContact O-N 2.87Å; E162-R165 WeakPolarHBondContact O-CB 3.45Å; E162-R165 PolarHBondContact O-N 3.32Å; E162-R165 VanDerWaalsContact O-N 3.16Å; E162-E166 WeakPolarHBondContact O-CB 3.31Å; E162-E166 PolarHBondContact O-N 3.43Å
163G97.8Very high97.2Very high37 Ų37101.7 Ų101.738%0.38153%0.534SS..Hα-helixtrans-62.8-35.4176.500000113.5L159 S167L159-G163 PolarHBondContact O-N 2.91Å; G163-S167 WeakPolarHBondContact O-CB 3.35Å; G163-S167 PolarHBondContact O-N 3.05Å
164T97.4Very high97.2Very high93 Ų9394.7 Ų94.757%0.57152%0.521SS*.Hα-helixtrans-64.7-44173.3-59.90000111.1E160 E162 A168E160-T164 VanDerWaalsContact O-CB 3.3Å; E160-T164 WeakPolarHBondContact O-CB 3.47Å; E160-T164 PolarHBondContact O-N 2.73Å; E160-T164 PolarHBondContact O-OG1 2.92Å; E162-T164 VanDerWaalsContact C-N 3.33Å; E162-T164 PolarHBondContact O-N 2.87Å; T164-A168 WeakPolarHBondContact O-CB 3.36Å; T164-A168 PolarHBondContact O-N 2.86Å
165R97.1Very high97.3Very high184 Ų18494.2 Ų94.269%0.69452%0.519SS*.Hα-helixtrans-63.7-46.8176.5176.7-179.4175.9169-0111.7S161 E162 A168 I169S161-R165 WeakPolarHBondContact O-CB 3.27Å; S161-R165 PolarHBondContact O-N 3Å; E162-R165 WeakPolarHBondContact O-CB 3.45Å; E162-R165 PolarHBondContact O-N 3.32Å; E162-R165 VanDerWaalsContact O-N 3.16Å; R165-A168 PolarHBondContact O-N 3.28Å; R165-I169 HydrophobicContact CG-CD1 3.99Å; R165-I169 VanDerWaalsContact O-CG1 3.32Å; R165-I169 WeakPolarHBondContact O-CG1 3.45Å; R165-I169 PolarHBondContact O-N 3.44Å
166E97.6Very high97.3Very high124 Ų12493 Ų9358%0.57952%0.518SS*.Hα-helixtrans-64-44.7179.5-170.4179.4173.300111.3E162 A168 I169 N170E162-E166 WeakPolarHBondContact O-CB 3.31Å; E162-E166 PolarHBondContact O-N 3.43Å; E166-A168 PolarHBondContact O-N 2.66Å; E166-I169 PolarHBondContact O-N 2.93Å; E166-N170 WeakPolarHBondContact O-CB 3.48Å; E166-N170 VanDerWaalsContact O-CG 3.26Å; E166-N170 PolarHBondContact O-N 2.92Å; E166-N170 PolarHBondContact O-ND2 3.4Å
167S97.2Very high97.3Very high68 Ų6895.1 Ų95.148%0.47652%0.518SS..Hα-helixtrans-58.2-44.9173.9-176.30000112.1G163 I169 N170 V171G163-S167 WeakPolarHBondContact O-CB 3.35Å; G163-S167 PolarHBondContact O-N 3.05Å; S167-I169 PolarHBondContact O-N 2.89Å; S167-N170 PolarHBondContact O-N 3.31Å; S167-V171 WeakPolarHBondContact O-CG2 3.26Å; S167-V171 PolarHBondContact O-N 3.32Å
168A97.1Very high97.3Very high61 Ų6194.6 Ų94.650%0.50452%0.521SS..Hα-helixtrans-63.3-39177.200000112.9T164 R165 E166 A172T164-A168 WeakPolarHBondContact O-CB 3.36Å; T164-A168 PolarHBondContact O-N 2.86Å; R165-A168 PolarHBondContact O-N 3.28Å; E166-A168 PolarHBondContact O-N 2.66Å; A168-A172 WeakPolarHBondContact O-CB 3.41Å; A168-A172 PolarHBondContact O-N 3.14Å
169I97.1Very high97.3Very high88 Ų8897.9 Ų97.945%0.45153%0.532SS..Hα-helixtrans-63.7-50.8174.3-69.6164.9000110.1R165 E166 S167 V171 A172 E173R165-I169 HydrophobicContact CG-CD1 3.99Å; R165-I169 VanDerWaalsContact O-CG1 3.32Å; R165-I169 WeakPolarHBondContact O-CG1 3.45Å; R165-I169 PolarHBondContact O-N 3.44Å; E166-I169 PolarHBondContact O-N 2.93Å; S167-I169 PolarHBondContact O-N 2.89Å; I169-V171 VanDerWaalsContact C-N 3.3Å; I169-V171 PolarHBondContact O-N 3.08Å; I169-A172 PolarHBondContact O-N 3.27Å; I169-A172 VanDerWaalsContact O-N 3.07Å; I169-E173 WeakPolarHBondContact O-CB 3.35Å; I169-E173 PolarHBondContact O-N 2.84Å
170N97.5Very high97.3Very high90 Ų9095 Ų9548%0.48152%0.517SS..Hα-helixtrans-59.7-39.1-179.6-69.6-19.3000112.1E166 S167 G174E166-N170 WeakPolarHBondContact O-CB 3.48Å; E166-N170 VanDerWaalsContact O-CG 3.26Å; E166-N170 PolarHBondContact O-N 2.92Å; E166-N170 PolarHBondContact O-ND2 3.4Å; S167-N170 PolarHBondContact O-N 3.31Å; N170-G174 PolarHBondContact O-N 2.91Å
171V97.6Very high97.3Very high77 Ų7793.1 Ų93.147%0.46751%0.51SS..Hα-helixtrans-68.1-40.1174.5170.40000111.9S167 I169 K175S167-V171 WeakPolarHBondContact O-CG2 3.26Å; S167-V171 PolarHBondContact O-N 3.32Å; I169-V171 VanDerWaalsContact C-N 3.3Å; I169-V171 PolarHBondContact O-N 3.08Å; V171-K175 HydrophobicContact CG1-CD 4.28Å; V171-K175 WeakPolarHBondContact O-CB 3.19Å; V171-K175 VanDerWaalsContact O-CG 3.3Å; V171-K175 WeakPolarHBondContact O-CG 3.5Å; V171-K175 PolarHBondContact O-N 3.03Å
172A97.3Very high97.2Very high59 Ų5992.2 Ų92.249%0.48851%0.507SS..Hα-helixtrans-67.6-41.3177.600000112A168 I169 K175 K176A168-A172 WeakPolarHBondContact O-CB 3.41Å; A168-A172 PolarHBondContact O-N 3.14Å; I169-A172 PolarHBondContact O-N 3.27Å; I169-A172 VanDerWaalsContact O-N 3.07Å; A172-K175 PolarHBondContact O-N 2.89Å; A172-K176 WeakPolarHBondContact O-CB 3.43Å; A172-K176 PolarHBondContact O-N 3.27Å
173E97Very high97.2Very high118 Ų11890.2 Ų90.255%0.55151%0.506SS*.Hα-helixtrans-67.4-43.9176.4-175157.3-144.100111.7I169 K175 K176 Q177I169-E173 WeakPolarHBondContact O-CB 3.35Å; I169-E173 PolarHBondContact O-N 2.84Å; E173-K175 VanDerWaalsContact C-N 3.34Å; E173-K175 PolarHBondContact O-N 3.33Å; E173-K176 WeakPolarHBondContact O-CB 3.23Å; E173-K176 PolarHBondContact O-N 3.15Å; E173-Q177 WeakPolarHBondContact O-CB 3.43Å; E173-Q177 PolarHBondContact O-N 3.41Å
174G97.8Very high97.1Very high42 Ų4294 Ų9443%0.43351%0.513SS..Hα-helixtrans-58.1-42.4172.300000112.9N170 Q177 A178N170-G174 PolarHBondContact O-N 2.91Å; G174-Q177 PolarHBondContact O-N 3.44Å; G174-A178 VanDerWaalsContact O-CB 3.3Å; G174-A178 WeakPolarHBondContact O-CB 3.48Å; G174-A178 PolarHBondContact O-N 3.47Å
175K97.4Very high97.1Very high143 Ų14392.3 Ų92.362%0.62251%0.509SS*.Hα-helixtrans-63.9-44.8174.1-77.7174.7178.5179.80112.6V171 A172 E173 A178 Q179V171-K175 HydrophobicContact CG1-CD 4.28Å; V171-K175 WeakPolarHBondContact O-CB 3.19Å; V171-K175 VanDerWaalsContact O-CG 3.3Å; V171-K175 WeakPolarHBondContact O-CG 3.5Å; V171-K175 PolarHBondContact O-N 3.03Å; A172-K175 PolarHBondContact O-N 2.89Å; E173-K175 VanDerWaalsContact C-N 3.34Å; E173-K175 PolarHBondContact O-N 3.33Å; K175-A178 PolarHBondContact O-N 2.69Å; K175-Q179 WeakPolarHBondContact O-CB 3.42Å; K175-Q179 PolarHBondContact O-N 2.79Å
176K97.7Very high97Very high138 Ų13888.7 Ų88.760%0.650%0.5SS*.Hα-helixtrans-58.5-48.3175.8177.5-170.1171.8-166.30110.7A172 E173 Q179 I180A172-K176 WeakPolarHBondContact O-CB 3.43Å; A172-K176 PolarHBondContact O-N 3.27Å; E173-K176 WeakPolarHBondContact O-CB 3.23Å; E173-K176 PolarHBondContact O-N 3.15Å; K176-Q179 PolarHBondContact O-N 3.49Å; K176-I180 HydrophobicContact CG-CD1 4.04Å; K176-I180 WeakPolarHBondContact O-CG1 3.35Å; K176-I180 PolarHBondContact O-N 2.98Å
177Q96.7Very high97Very high100 Ų10089.5 Ų89.547%0.46750%0.501SS..Hα-helixtrans-65.6-41.5-179.3-169.858.929.100111.8E173 G174 Q179 I180 L181E173-Q177 WeakPolarHBondContact O-CB 3.43Å; E173-Q177 PolarHBondContact O-N 3.41Å; G174-Q177 PolarHBondContact O-N 3.44Å; Q177-Q179 VanDerWaalsContact C-N 3.35Å; Q177-Q179 PolarHBondContact O-N 2.93Å; Q177-I180 PolarHBondContact O-N 3.42Å; Q177-L181 HydrophobicContact CG-CD1 4.04Å; Q177-L181 WeakPolarHBondContact O-CB 3.35Å; Q177-L181 WeakPolarHBondContact O-CG 3.35Å; Q177-L181 PolarHBondContact O-N 2.91Å
178A96.9Very high96.9Very high57 Ų5788.3 Ų88.347%0.47150%0.496SS..Hα-helixtrans-61.5-40.7174.300000112.5G174 K175 L181 A182G174-A178 VanDerWaalsContact O-CB 3.3Å; G174-A178 WeakPolarHBondContact O-CB 3.48Å; G174-A178 PolarHBondContact O-N 3.47Å; K175-A178 PolarHBondContact O-N 2.69Å; A178-L181 PolarHBondContact O-N 2.79Å; A178-A182 VanDerWaalsContact O-CB 3.31Å; A178-A182 WeakPolarHBondContact O-CB 3.03Å; A178-A182 PolarHBondContact O-N 2.82Å
179Q97.5Very high96.8Very high135 Ų13591.6 Ų91.663%0.63150%0.501SS*.Hα-helixtrans-66.7-38.1177.7-172.763.66600112.6K175 K176 Q177 S183K175-Q179 WeakPolarHBondContact O-CB 3.42Å; K175-Q179 PolarHBondContact O-N 2.79Å; K176-Q179 PolarHBondContact O-N 3.49Å; Q177-Q179 VanDerWaalsContact C-N 3.35Å; Q177-Q179 PolarHBondContact O-N 2.93Å; Q179-S183 PolarHBondContact O-N 2.91Å; Q179-S183 VanDerWaalsContact O-N 3.12Å
180I97Very high96.8Very high65 Ų6592.8 Ų92.833%0.33350%0.504SS..Hα-helixtrans-64.6-52.6174.3-68.2165.3000109.7K176 Q177 A182 S183 E184K176-I180 HydrophobicContact CG-CD1 4.04Å; K176-I180 WeakPolarHBondContact O-CG1 3.35Å; K176-I180 PolarHBondContact O-N 2.98Å; Q177-I180 PolarHBondContact O-N 3.42Å; I180-A182 VanDerWaalsContact C-N 3.28Å; I180-A182 PolarHBondContact O-N 3.32Å; I180-S183 PolarHBondContact O-N 2.83Å; I180-S183 VanDerWaalsContact O-N 3.1Å; I180-E184 HydrophobicContact CG2-CG 4.39Å; I180-E184 WeakPolarHBondContact O-CG 3.25Å; I180-E184 PolarHBondContact O-N 2.88Å
181L96.4Very high96.7Very high92 Ų9293.3 Ų93.348%0.48251%0.506SS..Hα-helixtrans-58.1-38.6178.6-74.7165000112.5Q177 A178 A185Q177-L181 HydrophobicContact CG-CD1 4.04Å; Q177-L181 WeakPolarHBondContact O-CB 3.35Å; Q177-L181 WeakPolarHBondContact O-CG 3.35Å; Q177-L181 PolarHBondContact O-N 2.91Å; A178-L181 PolarHBondContact O-N 2.79Å; L181-A185 VanDerWaalsContact O-CB 3.24Å; L181-A185 WeakPolarHBondContact O-CB 3.34Å; L181-A185 PolarHBondContact O-N 2.81Å
182A96.4Very high96.6Very high53 Ų5395 Ų9544%0.43851%0.513SS..Hα-helixtrans-64.9-43.4175.500000112.2A178 I180 A185 E186A178-A182 VanDerWaalsContact O-CB 3.31Å; A178-A182 WeakPolarHBondContact O-CB 3.03Å; A178-A182 PolarHBondContact O-N 2.82Å; I180-A182 VanDerWaalsContact C-N 3.28Å; I180-A182 PolarHBondContact O-N 3.32Å; A182-A185 PolarHBondContact O-N 3.06Å; A182-E186 WeakPolarHBondContact O-CB 3.34Å; A182-E186 PolarHBondContact O-N 3.36Å
183S96.8Very high96.5Very high71 Ų7197.6 Ų97.650%0.49752%0.515SS..Hα-helixtrans-67.4-37.6177.4-1750000112.4Q179 I180 K187Q179-S183 PolarHBondContact O-N 2.91Å; Q179-S183 VanDerWaalsContact O-N 3.12Å; I180-S183 PolarHBondContact O-N 2.83Å; I180-S183 VanDerWaalsContact O-N 3.1Å; S183-K187 WeakPolarHBondContact O-CB 3.39Å; S183-K187 PolarHBondContact O-N 2.83Å
184E96.3Very high96.4Very high115 Ų11594.8 Ų94.854%0.53751%0.512SS..Hα-helixtrans-66.4-41.3173.4-71.4177.8165.200111.8I180 A188I180-E184 HydrophobicContact CG2-CG 4.39Å; I180-E184 WeakPolarHBondContact O-CG 3.25Å; I180-E184 PolarHBondContact O-N 2.88Å; E184-A188 WeakPolarHBondContact O-CB 3.42Å; E184-A188 PolarHBondContact O-N 3.06Å
185A96.3Very high96.2Very high58 Ų5895.5 Ų95.548%0.47951%0.513SS..Hα-helixtrans-64.3-46.917600000112L181 A182 K187 A188 E189L181-A185 VanDerWaalsContact O-CB 3.24Å; L181-A185 WeakPolarHBondContact O-CB 3.34Å; L181-A185 PolarHBondContact O-N 2.81Å; A182-A185 PolarHBondContact O-N 3.06Å; A185-K187 PolarHBondContact O-N 3.14Å; A185-A188 PolarHBondContact O-N 3.27Å; A185-E189 WeakPolarHBondContact O-CB 3.49Å; A185-E189 PolarHBondContact O-N 3.48Å
186E96.3Very high96.1Very high109 Ų10990.2 Ų90.251%0.50950%0.5SS..Hα-helixtrans-60.2-44.8176.8-173.2-172.216900111.3A182 A188 E189 Q190A182-E186 WeakPolarHBondContact O-CB 3.34Å; A182-E186 PolarHBondContact O-N 3.36Å; E186-A188 VanDerWaalsContact C-N 3.33Å; E186-A188 PolarHBondContact O-N 3.22Å; E186-E189 PolarHBondContact O-N 3.12Å; E186-Q190 WeakPolarHBondContact O-CG 3.4Å; E186-Q190 PolarHBondContact O-N 2.84Å; E186-Q190 PolarHBondContact OE1-NE2 3.47Å; E186-Q190 VanDerWaalsContact OE1-NE2 3.09Å
187K96.7Very high96Very high140 Ų14088.9 Ų88.961%0.60950%0.495SS*.Hα-helixtrans-59.8-43.2174.9179.1-177.8174.8-1750111.8S183 A185 I191S183-K187 WeakPolarHBondContact O-CB 3.39Å; S183-K187 PolarHBondContact O-N 2.83Å; A185-K187 PolarHBondContact O-N 3.14Å; K187-I191 HydrophobicContact CG-CD1 4Å; K187-I191 WeakPolarHBondContact O-CD1 3.48Å; K187-I191 VanDerWaalsContact O-CG1 3.24Å; K187-I191 WeakPolarHBondContact O-CG1 3.48Å; K187-I191 PolarHBondContact O-N 2.87Å; K187-I191 VanDerWaalsContact O-N 3.1Å
188A95.8Very high95.8Very high44 Ų4486.7 Ų86.736%0.36449%0.494SS..Hα-helixtrans-66.5-39.9177.500000111.8E184 A185 E186 I191 N192E184-A188 WeakPolarHBondContact O-CB 3.42Å; E184-A188 PolarHBondContact O-N 3.06Å; A185-A188 PolarHBondContact O-N 3.27Å; E186-A188 VanDerWaalsContact C-N 3.33Å; E186-A188 PolarHBondContact O-N 3.22Å; A188-I191 PolarHBondContact O-N 2.78Å; A188-N192 VanDerWaalsContact O-CB 3.31Å; A188-N192 WeakPolarHBondContact O-CB 3.36Å; A188-N192 PolarHBondContact O-N 2.92Å; A188-N192 PolarHBondContact O-ND2 2.86Å; A188-N192 VanDerWaalsContact O-ND2 3.13Å
189E95.5Very high95.6Very high130 Ų13087.3 Ų87.361%0.60750%0.496SS*.Hα-helixtrans-61.1-50.1175.2-176.5172.2-167.900111.5A185 E186 I191 N192 Q193A185-E189 WeakPolarHBondContact O-CB 3.49Å; A185-E189 PolarHBondContact O-N 3.48Å; E186-E189 PolarHBondContact O-N 3.12Å; E189-I191 VanDerWaalsContact C-N 3.34Å; E189-I191 PolarHBondContact O-N 2.76Å; E189-N192 PolarHBondContact O-N 2.86Å; E189-Q193 WeakPolarHBondContact O-CB 3.48Å; E189-Q193 PolarHBondContact O-N 3.01Å
190Q95.4Very high95.4Very high112 Ų11282.8 Ų82.852%0.52348%0.481SS..Hα-helixtrans-59.4-42176.9-69.5179.422.600112.3E186 A194E186-Q190 WeakPolarHBondContact O-CG 3.4Å; E186-Q190 PolarHBondContact O-N 2.84Å; E186-Q190 PolarHBondContact OE1-NE2 3.47Å; E186-Q190 VanDerWaalsContact OE1-NE2 3.09Å; Q190-A194 WeakPolarHBondContact O-CB 3.41Å; Q190-A194 PolarHBondContact O-N 3.42Å
191I96Very high95.2Very high101 Ų10184.3 Ų84.352%0.51849%0.493SS..Hα-helixtrans-63.8-45.7175.5-70.4166.5000110.9K187 A188 E189 A194 A195K187-I191 HydrophobicContact CG-CD1 4Å; K187-I191 WeakPolarHBondContact O-CD1 3.48Å; K187-I191 VanDerWaalsContact O-CG1 3.24Å; K187-I191 WeakPolarHBondContact O-CG1 3.48Å; K187-I191 PolarHBondContact O-N 2.87Å; K187-I191 VanDerWaalsContact O-N 3.1Å; A188-I191 PolarHBondContact O-N 2.78Å; E189-I191 VanDerWaalsContact C-N 3.34Å; E189-I191 PolarHBondContact O-N 2.76Å; I191-A194 PolarHBondContact O-N 2.87Å; I191-A195 VanDerWaalsContact O-CB 3.27Å; I191-A195 WeakPolarHBondContact O-CB 3.39Å; I191-A195 PolarHBondContact O-N 3.33Å
192N94.8Very high95.1Very high114 Ų11485.1 Ų85.161%0.6150%0.497SS*.Hα-helixtrans-64.9-39.8179.7-73.1-26.5000111.8A188 E189 G196A188-N192 VanDerWaalsContact O-CB 3.31Å; A188-N192 WeakPolarHBondContact O-CB 3.36Å; A188-N192 PolarHBondContact O-N 2.92Å; A188-N192 PolarHBondContact O-ND2 2.86Å; A188-N192 VanDerWaalsContact O-ND2 3.13Å; E189-N192 PolarHBondContact O-N 2.86Å; N192-G196 PolarHBondContact O-N 2.98Å
193Q95.6Very high94.9Very high113 Ų11385.4 Ų85.453%0.52850%0.5SS..Hα-helixtrans-65.1-49.9175.2-176.9175.8-11.200111.1E189 A195 G196 E197E189-Q193 WeakPolarHBondContact O-CB 3.48Å; E189-Q193 PolarHBondContact O-N 3.01Å; Q193-A195 VanDerWaalsContact C-N 3.33Å; Q193-A195 PolarHBondContact O-N 3.18Å; Q193-G196 CarbonylContact O-C 3.59Å; Q193-G196 WeakPolarHBondContact O-CA 3.38Å; Q193-G196 PolarHBondContact O-N 3.18Å; Q193-G196 VanDerWaalsContact O-N 3.12Å; Q193-E197 HydrophobicContact CG-CG 4.47Å; Q193-E197 WeakPolarHBondContact CG-OE1 3.42Å; Q193-E197 PolarHBondContact NE2-OE1 3.39Å; Q193-E197 WeakPolarHBondContact O-CG 3.31Å; Q193-E197 PolarHBondContact O-N 3.4Å
194A94.9Very high94.7Very high59 Ų5988.8 Ų88.849%0.48851%0.506SS..Hα-helixtrans-61-40.1178.400000112.4Q190 I191 A198Q190-A194 WeakPolarHBondContact O-CB 3.41Å; Q190-A194 PolarHBondContact O-N 3.42Å; I191-A194 PolarHBondContact O-N 2.87Å; A194-A198 VanDerWaalsContact O-CB 3.29Å; A194-A198 WeakPolarHBondContact O-CB 3.22Å; A194-A198 PolarHBondContact O-N 2.88Å
195A94.9Very high94.4Very high56 Ų5685.8 Ų85.846%0.46350%0.5SS..Hα-helixtrans-65.9-41.1173.700000112I191 Q193 S199I191-A195 VanDerWaalsContact O-CB 3.27Å; I191-A195 WeakPolarHBondContact O-CB 3.39Å; I191-A195 PolarHBondContact O-N 3.33Å; Q193-A195 VanDerWaalsContact C-N 3.33Å; Q193-A195 PolarHBondContact O-N 3.18Å; A195-S199 VanDerWaalsContact O-CB 3.3Å; A195-S199 WeakPolarHBondContact O-CB 3.36Å; A195-S199 PolarHBondContact O-N 3.09Å; A195-S199 PolarHBondContact O-OG 3.03Å
196G95.3Very high94.3Very high33 Ų3390.3 Ų90.334%0.3451%0.509SS..Hα-helixtrans-58.1-51.9173.200000112N192 Q193 S199 A200N192-G196 PolarHBondContact O-N 2.98Å; Q193-G196 CarbonylContact O-C 3.59Å; Q193-G196 WeakPolarHBondContact O-CA 3.38Å; Q193-G196 PolarHBondContact O-N 3.18Å; Q193-G196 VanDerWaalsContact O-N 3.12Å; G196-S199 PolarHBondContact O-N 2.86Å; G196-S199 PolarHBondContact O-OG 2.97Å; G196-A200 WeakPolarHBondContact O-CB 3.41Å; G196-A200 PolarHBondContact O-N 3.42Å
197E94.3Very high94Very high109 Ų10987.9 Ų87.951%0.50951%0.508SS..Hα-helixtrans-60.5-47.4177.1-72177.4-163.200112.1Q193 S199 A200 V201Q193-E197 HydrophobicContact CG-CG 4.47Å; Q193-E197 WeakPolarHBondContact CG-OE1 3.42Å; Q193-E197 PolarHBondContact NE2-OE1 3.39Å; Q193-E197 WeakPolarHBondContact O-CG 3.31Å; Q193-E197 PolarHBondContact O-N 3.4Å; E197-S199 PolarHBondContact O-N 3.34Å; E197-A200 PolarHBondContact O-N 3.04Å; E197-V201 WeakPolarHBondContact O-CG2 3.28Å; E197-V201 PolarHBondContact O-N 3.16Å
198A93.4Very high93.5Very high54 Ų5488.3 Ų88.345%0.44651%0.51SS..Hα-helixtrans-59.8-44176.200000112A194 A200 V201 L202A194-A198 VanDerWaalsContact O-CB 3.29Å; A194-A198 WeakPolarHBondContact O-CB 3.22Å; A194-A198 PolarHBondContact O-N 2.88Å; A198-A200 PolarHBondContact O-N 3.48Å; A198-V201 PolarHBondContact O-N 2.92Å; A198-L202 WeakPolarHBondContact O-CB 3.49Å; A198-L202 WeakPolarHBondContact O-CG 3.47Å; A198-L202 PolarHBondContact O-N 2.97Å
199S93.1Very high93.2Very high71 Ų7189 Ų8950%0.49752%0.516SS..Hα-helixtrans-64.5-39.2176.778.30000112.2A195 G196 E197 L202 A203A195-S199 VanDerWaalsContact O-CB 3.3Å; A195-S199 WeakPolarHBondContact O-CB 3.36Å; A195-S199 PolarHBondContact O-N 3.09Å; A195-S199 PolarHBondContact O-OG 3.03Å; G196-S199 PolarHBondContact O-N 2.86Å; G196-S199 PolarHBondContact O-OG 2.97Å; E197-S199 PolarHBondContact O-N 3.34Å; S199-L202 PolarHBondContact O-N 3.18Å; S199-A203 WeakPolarHBondContact O-CB 3.46Å; S199-A203 PolarHBondContact O-N 3.21Å
200A92.5Very high92.8Very high40 Ų4089 Ų8933%0.33152%0.515SS..Hα-helixtrans-68.6-38.1177.200000112.1G196 E197 A198 K204G196-A200 WeakPolarHBondContact O-CB 3.41Å; G196-A200 PolarHBondContact O-N 3.42Å; E197-A200 PolarHBondContact O-N 3.04Å; A198-A200 PolarHBondContact O-N 3.48Å; A200-K204 WeakPolarHBondContact O-CB 3.25Å; A200-K204 WeakPolarHBondContact O-CG 3.41Å; A200-K204 PolarHBondContact O-N 3.32Å
201V92.7Very high92.3Very high96 Ų9686.3 Ų86.358%0.58251%0.513SS*.Hα-helixtrans-64.6-46.3172.7170.50000110.5E197 A198 A203 K204 A205E197-V201 WeakPolarHBondContact O-CG2 3.28Å; E197-V201 PolarHBondContact O-N 3.16Å; A198-V201 PolarHBondContact O-N 2.92Å; V201-A203 PolarHBondContact O-N 2.99Å; V201-K204 PolarHBondContact O-N 3.28Å; V201-A205 VanDerWaalsContact O-CB 3.28Å; V201-A205 WeakPolarHBondContact O-CB 3.47Å; V201-A205 PolarHBondContact O-N 3.49Å
202L93.8Very high91.7Very high109 Ų10987 Ų8757%0.57152%0.516SS*.Hα-helixtrans-62.5-41.5176.2-74.3174.5000112.5A198 S199 A205 K206A198-L202 WeakPolarHBondContact O-CB 3.49Å; A198-L202 WeakPolarHBondContact O-CG 3.47Å; A198-L202 PolarHBondContact O-N 2.97Å; S199-L202 PolarHBondContact O-N 3.18Å; L202-A205 PolarHBondContact O-N 3.34Å; L202-K206 WeakPolarHBondContact O-CB 3.24Å; L202-K206 WeakPolarHBondContact O-CG 3.38Å; L202-K206 PolarHBondContact O-N 2.72Å
203A92.7Very high91.3Very high59 Ų5991.1 Ų91.149%0.48852%0.523SS..Hα-helixtrans-63.1-46.6175.800000111.6S199 V201 A205 K206 A207S199-A203 WeakPolarHBondContact O-CB 3.46Å; S199-A203 PolarHBondContact O-N 3.21Å; V201-A203 PolarHBondContact O-N 2.99Å; A203-A205 VanDerWaalsContact C-N 3.35Å; A203-A205 PolarHBondContact O-N 3.05Å; A203-K206 PolarHBondContact O-N 2.88Å; A203-A207 WeakPolarHBondContact O-CB 3.42Å; A203-A207 PolarHBondContact O-N 3.28Å
204K91.9Very high90.7Very high143 Ų14391.1 Ų91.162%0.62253%0.526SS*.Hα-helixtrans-61.9-39.8174.7-73.1169.4-176.1174.40112.1A200 V201 K208A200-K204 WeakPolarHBondContact O-CB 3.25Å; A200-K204 WeakPolarHBondContact O-CG 3.41Å; A200-K204 PolarHBondContact O-N 3.32Å; V201-K204 PolarHBondContact O-N 3.28Å; K204-K208 WeakPolarHBondContact O-CB 3.37Å; K204-K208 VanDerWaalsContact O-CG 3.32Å; K204-K208 WeakPolarHBondContact O-CG 3.48Å; K204-K208 PolarHBondContact O-N 2.71Å
205A90.8Very high89.9Confident51 Ų5192.9 Ų92.942%0.42153%0.526SS..Hα-helixtrans-67.3-4417800000112V201 L202 A203 K208 A209V201-A205 VanDerWaalsContact O-CB 3.28Å; V201-A205 WeakPolarHBondContact O-CB 3.47Å; V201-A205 PolarHBondContact O-N 3.49Å; L202-A205 PolarHBondContact O-N 3.34Å; A203-A205 VanDerWaalsContact C-N 3.35Å; A203-A205 PolarHBondContact O-N 3.05Å; A205-K208 PolarHBondContact O-N 3.06Å; A205-A209 WeakPolarHBondContact O-CB 3.39Å; A205-A209 PolarHBondContact O-N 2.86Å
206K93.1Very high88.9Confident153 Ų15392.8 Ų92.867%0.66553%0.526SS*.Hα-helixtrans-60-50.2173.4-75.3176.9178.9-178.20111.6L202 A203 K208 A209 E210L202-K206 WeakPolarHBondContact O-CB 3.24Å; L202-K206 WeakPolarHBondContact O-CG 3.38Å; L202-K206 PolarHBondContact O-N 2.72Å; A203-K206 PolarHBondContact O-N 2.88Å; K206-K208 VanDerWaalsContact C-N 3.31Å; K206-K208 PolarHBondContact O-N 3.08Å; K206-A209 PolarHBondContact O-N 2.92Å; K206-A209 VanDerWaalsContact O-N 3.15Å; K206-E210 WeakPolarHBondContact O-CB 3.42Å; K206-E210 PolarHBondContact O-N 3.47Å
207A91.1Very high88Confident59 Ų5994.2 Ų94.249%0.48853%0.534SS..Hα-helixtrans-60-39.6178.100000112.4A203 A211A203-A207 WeakPolarHBondContact O-CB 3.42Å; A203-A207 PolarHBondContact O-N 3.28Å; A207-A211 VanDerWaalsContact O-CB 3.29Å; A207-A211 WeakPolarHBondContact O-CB 3.41Å; A207-A211 PolarHBondContact O-N 2.97Å
208K86.7Confident87Confident149 Ų14991.7 Ų91.765%0.64853%0.532SS*.Hα-helixtrans-64.4-45.4172.6-78.6179.9176.3-172.80112.5K204 A205 K206 E210 A211 I212K204-K208 WeakPolarHBondContact O-CB 3.37Å; K204-K208 VanDerWaalsContact O-CG 3.32Å; K204-K208 WeakPolarHBondContact O-CG 3.48Å; K204-K208 PolarHBondContact O-N 2.71Å; A205-K208 PolarHBondContact O-N 3.06Å; K206-K208 VanDerWaalsContact C-N 3.31Å; K206-K208 PolarHBondContact O-N 3.08Å; K208-E210 VanDerWaalsContact C-N 3.32Å; K208-E210 PolarHBondContact O-N 3.02Å; K208-A211 PolarHBondContact O-N 3.35Å; K208-I212 WeakPolarHBondContact O-CB 3.42Å; K208-I212 VanDerWaalsContact O-CG1 3.24Å; K208-I212 WeakPolarHBondContact O-CG1 3.47Å; K208-I212 PolarHBondContact O-N 2.84Å
209A88.1Confident85.8Confident59 Ų5991.4 Ų91.449%0.48852%0.523SS..Hα-helixtrans-63.2-39.7178.900000111.8A205 K206 R213A205-A209 WeakPolarHBondContact O-CB 3.39Å; A205-A209 PolarHBondContact O-N 2.86Å; K206-A209 PolarHBondContact O-N 2.92Å; K206-A209 VanDerWaalsContact O-N 3.15Å; A209-R213 WeakPolarHBondContact O-CB 3.4Å; A209-R213 PolarHBondContact O-N 2.86Å
210E88.3Confident84.4Confident128 Ų12893.8 Ų93.860%0.59854%0.535SS*.Hα-helixtrans-66.7-45175-172.4165-153.900111.8K206 K208 I212 R213 I214K206-E210 WeakPolarHBondContact O-CB 3.42Å; K206-E210 PolarHBondContact O-N 3.47Å; K208-E210 VanDerWaalsContact C-N 3.32Å; K208-E210 PolarHBondContact O-N 3.02Å; E210-I212 PolarHBondContact O-N 3.31Å; E210-R213 PolarHBondContact O-N 3.36Å; E210-I214 HydrophobicContact CG-CD1 4.2Å; E210-I214 WeakPolarHBondContact O-CG1 3.43Å; E210-I214 PolarHBondContact O-N 3.02Å
211A84.8Confident83.1Confident57 Ų5799 Ų9947%0.47155%0.552SS.*Hα-helixtrans-60.7-42.8174.100000112.7A207 K208 R213 I214 L215A207-A211 VanDerWaalsContact O-CB 3.29Å; A207-A211 WeakPolarHBondContact O-CB 3.41Å; A207-A211 PolarHBondContact O-N 2.97Å; K208-A211 PolarHBondContact O-N 3.35Å; A211-R213 VanDerWaalsContact C-N 3.33Å; A211-R213 PolarHBondContact O-N 2.99Å; A211-I214 PolarHBondContact O-N 3.35Å; A211-L215 WeakPolarHBondContact O-CB 3.11Å; A211-L215 PolarHBondContact O-N 3.48Å
212I83.9Confident81.1Confident115 Ų115104 Ų10459%0.5957%0.569SS**Hα-helixtrans-62.3-41.4174.4-70.6164.3000110.6K208 E210 L215 A216K208-I212 WeakPolarHBondContact O-CB 3.42Å; K208-I212 VanDerWaalsContact O-CG1 3.24Å; K208-I212 WeakPolarHBondContact O-CG1 3.47Å; K208-I212 PolarHBondContact O-N 2.84Å; E210-I212 PolarHBondContact O-N 3.31Å; I212-L215 PolarHBondContact O-N 2.79Å; I212-A216 WeakPolarHBondContact O-CB 3.27Å; I212-A216 PolarHBondContact O-N 3.18Å
213R84.7Confident79.4Confident200 Ų200105.3 Ų105.376%0.75558%0.576SS**Hα-helixtrans-65.8-40.8177.9179-178.2151.4132.90.1112.2A209 E210 A211 A217A209-R213 WeakPolarHBondContact O-CB 3.4Å; A209-R213 PolarHBondContact O-N 2.86Å; E210-R213 PolarHBondContact O-N 3.36Å; A211-R213 VanDerWaalsContact C-N 3.33Å; A211-R213 PolarHBondContact O-N 2.99Å; R213-A217 PolarHBondContact O-N 2.93Å; R213-A217 VanDerWaalsContact O-N 3.12Å
214I84.5Confident77.9Confident113 Ų113103 Ų10358%0.57956%0.558SS**Hα-helixtrans-63.5-46173.8-68.1164.7000110E210 A211 A217 A218E210-I214 HydrophobicContact CG-CD1 4.2Å; E210-I214 WeakPolarHBondContact O-CG1 3.43Å; E210-I214 PolarHBondContact O-N 3.02Å; A211-I214 PolarHBondContact O-N 3.35Å; I214-A217 PolarHBondContact O-N 3.31Å; I214-A218 PolarHBondContact O-N 2.9Å
215L77.4Confident76.5Confident96 Ų96102.6 Ų102.650%0.50356%0.563SS.*Hα-helixtrans-62.5-45178.1-176.362.4000111.7A211 I212 A217 A218 L219A211-L215 WeakPolarHBondContact O-CB 3.11Å; A211-L215 PolarHBondContact O-N 3.48Å; I212-L215 PolarHBondContact O-N 2.79Å; L215-A217 VanDerWaalsContact C-N 3.31Å; L215-A217 PolarHBondContact O-N 3.4Å; L215-A218 PolarHBondContact O-N 3.14Å; L215-A218 VanDerWaalsContact O-N 3.12Å; L215-L219 HydrophobicContact CD1-CD1 4.3Å; L215-L219 HydrophobicContact CD1-CG 4.19Å; L215-L219 HydrophobicContact CD2-CD1 4.48Å; L215-L219 HydrophobicContact CG-CD1 3.88Å; L215-L219 HydrophobicContact CG-CG 4.23Å; L215-L219 WeakPolarHBondContact O-CB 3.12Å; L215-L219 VanDerWaalsContact O-CG 3.25Å; L215-L219 WeakPolarHBondContact O-CG 3.48Å; L215-L219 PolarHBondContact O-N 2.98Å
216A73.6Confident75.1Confident54 Ų54102.9 Ų102.945%0.44657%0.565SS.*Hα-helixtrans-59.9-40177.300000112.4I212 L219 T220I212-A216 WeakPolarHBondContact O-CB 3.27Å; I212-A216 PolarHBondContact O-N 3.18Å; A216-L219 PolarHBondContact O-N 2.78Å; A216-T220 PolarHBondContact O-N 3.42Å; A216-T220 PolarHBondContact O-OG1 2.95Å
217A77Confident73.6Confident63 Ų6398.2 Ų98.252%0.52156%0.555SS.*Hα-helixtrans-67.9-34.4174.700000113R213 I214 L215 T220R213-A217 PolarHBondContact O-N 2.93Å; R213-A217 VanDerWaalsContact O-N 3.12Å; I214-A217 PolarHBondContact O-N 3.31Å; L215-A217 VanDerWaalsContact C-N 3.31Å; L215-A217 PolarHBondContact O-N 3.4Å; A217-T220 PolarHBondContact O-OG1 2.95Å
218A73.2Confident72.4Confident56 Ų5696.9 Ų96.946%0.46354%0.544SS..Hα-helixtrans-70.9-41.2173.900000112I214 L215 T220 Q221I214-A218 PolarHBondContact O-N 2.9Å; L215-A218 PolarHBondContact O-N 3.14Å; L215-A218 VanDerWaalsContact O-N 3.12Å; A218-T220 PolarHBondContact O-N 2.96Å; A218-Q221 PolarHBondContact O-N 3.1Å; A218-Q221 VanDerWaalsContact O-N 3.12Å
219L67Low71.5Confident49 Ų4993.3 Ų93.326%0.25754%0.538SS..Hα-helixtrans-67-19.3178.2-69.6172.5000113.6L215 A216 Q221 G224 A228L215-L219 HydrophobicContact CD1-CD1 4.3Å; L215-L219 HydrophobicContact CD1-CG 4.19Å; L215-L219 HydrophobicContact CD2-CD1 4.48Å; L215-L219 HydrophobicContact CG-CD1 3.88Å; L215-L219 HydrophobicContact CG-CG 4.23Å; L215-L219 WeakPolarHBondContact O-CB 3.12Å; L215-L219 VanDerWaalsContact O-CG 3.25Å; L215-L219 WeakPolarHBondContact O-CG 3.48Å; L215-L219 PolarHBondContact O-N 2.98Å; A216-L219 PolarHBondContact O-N 2.78Å; L219-Q221 PolarHBondContact O-N 3.09Å; L219-G224 VanDerWaalsContact CD2-O 3.23Å; L219-G224 WeakPolarHBondContact CD2-O 3.43Å; L219-A228 HydrophobicContact CD1-CB 4.03Å; L219-A228 HydrophobicContact CD2-CB 3.88Å
220T65.1Low70.6Confident121 Ų12195.4 Ų95.474%0.74254%0.54SS*.THydrogen-bonded Turntrans-76-8.1173.7-3.70000113.3A216 A217 A218A216-T220 PolarHBondContact O-N 3.42Å; A216-T220 PolarHBondContact O-OG1 2.95Å; A217-T220 PolarHBondContact O-OG1 2.95Å; A218-T220 PolarHBondContact O-N 2.96Å
221Q64.6Low69.8Low150 Ų15092.3 Ų92.370%0.70153%0.53SS*.THydrogen-bonded Turntrans-89.5155.6169.9-62.4-174.9-1200110.5A218 L219 N223 G224A218-Q221 PolarHBondContact O-N 3.1Å; A218-Q221 VanDerWaalsContact O-N 3.12Å; L219-Q221 PolarHBondContact O-N 3.09Å; Q221-N223 PolarHBondContact O-N 2.92Å; Q221-G224 PolarHBondContact O-N 3.01Å
222H51.3Low69.3Low200 Ų20094.1 Ų94.193%0.92654%0.535SS*.THydrogen-bonded Turntrans-39.9123.8-163.5-96.7-93.5000115.7
223N57.2Low68.7Low136 Ų13691.1 Ų91.173%0.72753%0.528SS*.THydrogen-bonded Turntrans70.227.7170.4-15031.7000116.7Q221 D225Q221-N223 PolarHBondContact O-N 2.92Å; N223-D225 PolarHBondContact O-N 3.46Å
224G61.1Low68.3Low10 Ų1087.3 Ų87.310%0.10352%0.518CS..Hα-helixtrans-61.1-35.6-179.700000116.3L219 Q221 A226 A227 A228L219-G224 VanDerWaalsContact CD2-O 3.23Å; L219-G224 WeakPolarHBondContact CD2-O 3.43Å; Q221-G224 PolarHBondContact O-N 3.01Å; G224-A226 VanDerWaalsContact C-N 3.27Å; G224-A226 PolarHBondContact O-N 3.42Å; G224-A227 WeakPolarHBondContact O-CA 3.41Å; G224-A227 WeakPolarHBondContact O-CB 3.36Å; G224-A227 PolarHBondContact O-N 3.14Å; G224-A228 PolarHBondContact O-N 3.06Å
225D63.5Low68Low136 Ų13687.9 Ų87.973%0.72752%0.518SS*.Hα-helixtrans-61.4-32-171.9-61.7-38.7000113.9N223 S229N223-D225 PolarHBondContact O-N 3.46Å; D225-S229 PolarHBondContact O-N 3.4Å; D225-S229 PolarHBondContact O-OG 2.95Å
226A60.9Low67.8Low57 Ų5790.7 Ų90.747%0.47152%0.523SS..Hα-helixtrans-70.4-31.5173.900000112.8G224 S229 L230G224-A226 VanDerWaalsContact C-N 3.27Å; G224-A226 PolarHBondContact O-N 3.42Å; A226-S229 PolarHBondContact O-OG 3.28Å; A226-S229 VanDerWaalsContact O-OG 3.11Å; A226-L230 PolarHBondContact O-N 3.09Å
227A61.8Low68Low54 Ų5492.7 Ų92.745%0.44653%0.53SS..Hα-helixtrans-77.4-39.7176.400000111.7G224 S229 L230 T231G224-A227 WeakPolarHBondContact O-CA 3.41Å; G224-A227 WeakPolarHBondContact O-CB 3.36Å; G224-A227 PolarHBondContact O-N 3.14Å; A227-S229 PolarHBondContact O-N 2.99Å; A227-L230 PolarHBondContact O-N 3.07Å; A227-T231 PolarHBondContact O-N 3.05Å; A227-T231 PolarHBondContact O-OG1 2.89Å; A227-T231 VanDerWaalsContact O-OG1 3.06Å
228A65.1Low68.1Low31 Ų3192.5 Ų92.526%0.25653%0.525SS..Hα-helixtrans-59.7-45.2176.800000112.1L219 G224 T231 V232L219-A228 HydrophobicContact CD1-CB 4.03Å; L219-A228 HydrophobicContact CD2-CB 3.88Å; G224-A228 PolarHBondContact O-N 3.06Å; A228-T231 PolarHBondContact O-N 3.4Å; A228-V232 WeakPolarHBondContact O-CG2 3.46Å; A228-V232 PolarHBondContact O-N 3.01Å
229S68.6Low68.3Low75 Ų7592.6 Ų92.652%0.52453%0.525SS..Hα-helixtrans-64.4-38.9178.745.40000112.7D225 A226 A227 V232 A233D225-S229 PolarHBondContact O-N 3.4Å; D225-S229 PolarHBondContact O-OG 2.95Å; A226-S229 PolarHBondContact O-OG 3.28Å; A226-S229 VanDerWaalsContact O-OG 3.11Å; A227-S229 PolarHBondContact O-N 2.99Å; S229-V232 PolarHBondContact O-N 2.85Å; S229-A233 PolarHBondContact O-N 3.12Å; S229-A233 VanDerWaalsContact O-N 3.1Å
230L68.2Low68.6Low102 Ų10295.9 Ų95.953%0.53454%0.538SS..Hα-helixtrans-63.3-46.6172.4-176.563.9000112A226 A227 V232 A233 E234A226-L230 PolarHBondContact O-N 3.09Å; A227-L230 PolarHBondContact O-N 3.07Å; L230-V232 VanDerWaalsContact C-N 3.31Å; L230-V232 PolarHBondContact O-N 3.33Å; L230-A233 WeakPolarHBondContact O-CB 3.46Å; L230-A233 PolarHBondContact O-N 2.86Å; L230-A233 VanDerWaalsContact O-N 3.14Å; L230-E234 WeakPolarHBondContact O-CG 3.08Å; L230-E234 PolarHBondContact O-N 3.43Å
231T71.3Confident69Low63 Ų6393 Ų9339%0.38752%0.523SS..Hα-helixtrans-62-36.6178.9-56.40000112.5A227 A228 Q235A227-T231 PolarHBondContact O-N 3.05Å; A227-T231 PolarHBondContact O-OG1 2.89Å; A227-T231 VanDerWaalsContact O-OG1 3.06Å; A228-T231 PolarHBondContact O-N 3.4Å; T231-Q235 WeakPolarHBondContact O-CB 3.4Å; T231-Q235 WeakPolarHBondContact O-CG 3.15Å; T231-Q235 PolarHBondContact O-N 3.08Å
232V75.1Confident69.5Low96 Ų9692.5 Ų92.558%0.58252%0.518SS*.Hα-helixtrans-67.3-40.3174.7171.90000111.2A228 S229 L230 Q235 Y236A228-V232 WeakPolarHBondContact O-CG2 3.46Å; A228-V232 PolarHBondContact O-N 3.01Å; S229-V232 PolarHBondContact O-N 2.85Å; L230-V232 VanDerWaalsContact C-N 3.31Å; L230-V232 PolarHBondContact O-N 3.33Å; V232-Q235 PolarHBondContact O-N 3.15Å; V232-Y236 WeakPolarHBondContact O-CB 3.34Å; V232-Y236 PolarHBondContact O-N 3.45Å
233A71.6Confident70.1Confident52 Ų5288.7 Ų88.743%0.4350%0.504SS..Hα-helixtrans-63.3-43.9175.200000112.1S229 L230 Y236 V237S229-A233 PolarHBondContact O-N 3.12Å; S229-A233 VanDerWaalsContact O-N 3.1Å; L230-A233 WeakPolarHBondContact O-CB 3.46Å; L230-A233 PolarHBondContact O-N 2.86Å; L230-A233 VanDerWaalsContact O-N 3.14Å; A233-Y236 PolarHBondContact O-N 3.4Å; A233-V237 WeakPolarHBondContact O-CG2 3.09Å; A233-V237 PolarHBondContact O-N 3.39Å
234E75.4Confident70.4Confident119 Ų11984.4 Ų84.456%0.55649%0.488SS*.Hα-helixtrans-61.8-43.6174.9-71.8179172.100112.2L230 Y236 V237 S238L230-E234 WeakPolarHBondContact O-CG 3.08Å; L230-E234 PolarHBondContact O-N 3.43Å; E234-Y236 PolarHBondContact O-N 3.41Å; E234-V237 PolarHBondContact O-N 2.87Å; E234-S238 WeakPolarHBondContact O-CB 3.32Å; E234-S238 PolarHBondContact O-N 2.96Å
235Q78.8Confident70.6Confident125 Ų12592 Ų9258%0.58452%0.518SS*.Hα-helixtrans-61.9-43.9175.4-75.9-177.532.800111.7T231 V232 S238 A239T231-Q235 WeakPolarHBondContact O-CB 3.4Å; T231-Q235 WeakPolarHBondContact O-CG 3.15Å; T231-Q235 PolarHBondContact O-N 3.08Å; V232-Q235 PolarHBondContact O-N 3.15Å; Q235-S238 PolarHBondContact O-N 3.3Å; Q235-S238 PolarHBondContact O-OG 3.23Å; Q235-A239 WeakPolarHBondContact O-CB 3.46Å; Q235-A239 PolarHBondContact O-N 3.33Å
236Y73.8Confident70.4Confident155 Ų15592.6 Ų92.661%0.60852%0.521SS*.Hα-helixtrans-59.4-48.8176.4-177.7-93.6000111.9V232 A233 E234 S238 A239 F240V232-Y236 WeakPolarHBondContact O-CB 3.34Å; V232-Y236 PolarHBondContact O-N 3.45Å; A233-Y236 PolarHBondContact O-N 3.4Å; E234-Y236 PolarHBondContact O-N 3.41Å; Y236-S238 VanDerWaalsContact C-N 3.33Å; Y236-S238 PolarHBondContact O-N 3.15Å; Y236-A239 PolarHBondContact O-N 3.38Å; Y236-F240 WeakPolarHBondContact O-CB 3.43Å; Y236-F240 PolarHBondContact O-N 2.93Å
237V78.4Confident69.5Low97 Ų9792.3 Ų92.359%0.58852%0.515SS*.Hα-helixtrans-61.3-40.6176.4172.60000111.3A233 E234 S241A233-V237 WeakPolarHBondContact O-CG2 3.09Å; A233-V237 PolarHBondContact O-N 3.39Å; E234-V237 PolarHBondContact O-N 2.87Å; V237-S241 WeakPolarHBondContact O-CB 3.46Å; V237-S241 PolarHBondContact O-N 3.37Å
238S78.1Confident69.2Low58 Ų5897.8 Ų97.841%0.40654%0.537SS..Hα-helixtrans-68.2-37.2177.8850000113.1E234 Q235 Y236 S241 K242E234-S238 WeakPolarHBondContact O-CB 3.32Å; E234-S238 PolarHBondContact O-N 2.96Å; Q235-S238 PolarHBondContact O-N 3.3Å; Q235-S238 PolarHBondContact O-OG 3.23Å; Y236-S238 VanDerWaalsContact C-N 3.33Å; Y236-S238 PolarHBondContact O-N 3.15Å; S238-S241 PolarHBondContact O-N 3.14Å; S238-K242 WeakPolarHBondContact O-CG 3.48Å; S238-K242 PolarHBondContact O-N 3.32Å
239A77.8Confident68.5Low58 Ų58102 Ų10248%0.47956%0.56SS.*Hα-helixtrans-69.4-44.1177.500000110.6Q235 Y236 S241 K242 L243Q235-A239 WeakPolarHBondContact O-CB 3.46Å; Q235-A239 PolarHBondContact O-N 3.33Å; Y236-A239 PolarHBondContact O-N 3.38Å; A239-S241 VanDerWaalsContact C-N 3.33Å; A239-S241 PolarHBondContact O-N 3.03Å; A239-K242 PolarHBondContact O-N 3.21Å; A239-L243 WeakPolarHBondContact O-CB 3.42Å; A239-L243 PolarHBondContact O-N 3.25Å
240F73.1Confident67.8Low118 Ų118102.7 Ų102.752%0.51856%0.557SS.*Hα-helixtrans-59.5-42.6172.6-169.1-94.1000111.7Y236 K242 L243 A244Y236-F240 WeakPolarHBondContact O-CB 3.43Å; Y236-F240 PolarHBondContact O-N 2.93Å; F240-K242 PolarHBondContact O-N 2.64Å; F240-L243 PolarHBondContact O-N 3.39Å; F240-A244 WeakPolarHBondContact O-CB 3.25Å; F240-A244 PolarHBondContact O-N 2.69Å
241S74.2Confident67Low60 Ų60105.3 Ų105.342%0.4257%0.571SS.*Hα-helixtrans-63.8-34.8176.4-175.20000113.6V237 S238 A239 K245V237-S241 WeakPolarHBondContact O-CB 3.46Å; V237-S241 PolarHBondContact O-N 3.37Å; S238-S241 PolarHBondContact O-N 3.14Å; A239-S241 VanDerWaalsContact C-N 3.33Å; A239-S241 PolarHBondContact O-N 3.03Å; S241-K245 WeakPolarHBondContact O-CG 3.5Å; S241-K245 PolarHBondContact O-N 3.1Å
242K74.1Confident66.2Low140 Ų140108.8 Ų108.861%0.60959%0.586SS**Hα-helixtrans-72.8-43173.6-73.7176.9179.5176.90111.8S238 A239 F240 A244 K245 D246S238-K242 WeakPolarHBondContact O-CG 3.48Å; S238-K242 PolarHBondContact O-N 3.32Å; A239-K242 PolarHBondContact O-N 3.21Å; F240-K242 PolarHBondContact O-N 2.64Å; K242-A244 VanDerWaalsContact C-N 3.27Å; K242-A244 PolarHBondContact O-N 2.92Å; K242-K245 PolarHBondContact O-N 2.92Å; K242-D246 PolarHBondContact O-N 3.3Å; K242-D246 VanDerWaalsContact O-N 3.11Å
243L64.3Low65.1Low120 Ų120106.9 Ų106.963%0.62858%0.576SS**Hα-helixtrans-58.4-41.9176-151.774.6000111.5A239 F240 K245 D246 S247A239-L243 WeakPolarHBondContact O-CB 3.42Å; A239-L243 PolarHBondContact O-N 3.25Å; F240-L243 PolarHBondContact O-N 3.39Å; L243-K245 PolarHBondContact O-N 3.21Å; L243-D246 PolarHBondContact O-N 2.66Å; L243-S247 PolarHBondContact O-N 3.02Å; L243-S247 VanDerWaalsContact O-N 3.12Å; L243-S247 PolarHBondContact O-OG 2.88Å
244A64Low64.3Low47 Ų47110.8 Ų110.839%0.38860%0.6SS.*Hα-helixtrans-69.3-9175.300000115F240 K242 I250F240-A244 WeakPolarHBondContact O-CB 3.25Å; F240-A244 PolarHBondContact O-N 2.69Å; K242-A244 VanDerWaalsContact C-N 3.27Å; K242-A244 PolarHBondContact O-N 2.92Å; A244-I250 HydrophobicContact CB-CD1 3.94Å
245K64.4Low63.4Low168 Ų168110.2 Ų110.273%0.7360%0.601SS**Hα-helixtrans-97.6-38.6173.2-77.1-179.8177.8-176.30113S241 K242 L243S241-K245 WeakPolarHBondContact O-CG 3.5Å; S241-K245 PolarHBondContact O-N 3.1Å; K242-K245 PolarHBondContact O-N 2.92Å; L243-K245 PolarHBondContact O-N 3.21Å
246D58.7Low62.2Low150 Ų150110.8 Ų110.880%0.80262%0.615SS**Hα-helixtrans-90.8-19.9-174-66.5-23.4000113.6K242 L243K242-D246 PolarHBondContact O-N 3.3Å; K242-D246 VanDerWaalsContact O-N 3.11Å; L243-D246 PolarHBondContact O-N 2.66Å
247S43.6Very low61.6Low50 Ų50106.4 Ų106.435%0.3562%0.618SS.*  trans-111.2108.3177.260.60000113.3L243 T249L243-S247 PolarHBondContact O-N 3.02Å; L243-S247 VanDerWaalsContact O-N 3.12Å; L243-S247 PolarHBondContact O-OG 2.88Å; S247-T249 PolarHBondContact O-N 3.12Å; S247-T249 VanDerWaalsContact O-N 3.14Å
248N54.3Low60.7Low170 Ų170105.8 Ų105.891%0.90961%0.611SS**SBendtrans-7711.1-180-164.544000114.6
249T51.3Low59.8Low119 Ų119107.9 Ų107.973%0.7362%0.621SS**  trans-133.983.8174.2-54.40000109.3S247 L251S247-T249 PolarHBondContact O-N 3.12Å; S247-T249 VanDerWaalsContact O-N 3.14Å; T249-L251 PolarHBondContact O-N 3.35Å
250I53.2Low58.8Low89 Ų89110 Ų11046%0.45663%0.628SS.*  trans-82.8107.3166.6-55.1177.1000107.7A244 L252A244-I250 HydrophobicContact CB-CD1 3.94Å; I250-L252 VanDerWaalsContact C-N 3.26Å; I250-L252 HydrophobicContact CB-CD1 4.39Å; I250-L252 HydrophobicContact CG2-CD1 3.43Å; I250-L252 VanDerWaalsContact CG2-CD1 3.43Å; I250-L252 PolarHBondContact O-N 3.03Å
251L52.1Low58.2Low157 Ų157107 Ų10782%0.82262%0.622SS**  trans-71.987.4162.6-84164.9000108.4T249 P253T249-L251 PolarHBondContact O-N 3.35Å; L251-P253 VanDerWaalsContact O-CD 3.26Å; L251-P253 WeakPolarHBondContact O-CD 3.45Å
252L54.4Low57.4Low136 Ų136109.4 Ų109.471%0.71263%0.628SS**  trans-63.5117.2169-121.466.7000108.4I250 S254I250-L252 VanDerWaalsContact C-N 3.26Å; I250-L252 HydrophobicContact CB-CD1 4.39Å; I250-L252 HydrophobicContact CG2-CD1 3.43Å; I250-L252 VanDerWaalsContact CG2-CD1 3.43Å; I250-L252 PolarHBondContact O-N 3.03Å; L252-S254 PolarHBondContact O-N 3.01Å
253P52.3Low56.7Low57 Ų57106.8 Ų106.837%0.3762%0.623SS.*  trans-62.8131.2162.6-12.828.7000107.2L251 N255 M262L251-P253 VanDerWaalsContact O-CD 3.26Å; L251-P253 WeakPolarHBondContact O-CD 3.45Å; P253-N255 PolarHBondContact O-N 3.34Å; P253-M262 HydrophobicContact CG-CG 3.83Å; P253-M262 HydrophobicContact CG-SD 4Å
254S53.7Low56.5Low133 Ų133104.2 Ų104.293%0.9362%0.619SS**SBendtrans-70.817.2-174.748.20000114.7L252L252-S254 PolarHBondContact O-N 3.01Å
255N56.5Low56.4Low107 Ų107108.8 Ų108.857%0.57263%0.633SS**  trans-145.8106175.1-168.623.9000110.6P253 G257P253-N255 PolarHBondContact O-N 3.34Å; N255-G257 PolarHBondContact O-N 3.43Å
256P54.8Low56Low137 Ų137103.7 Ų103.789%0.8962%0.622SS**THydrogen-bonded Turntrans-74.912.2-173.830.8-36.1000115
257G60Low56.1Low64 Ų64102.3 Ų102.366%0.6661%0.612SS**THydrogen-bonded Turntrans-97.4-13.7-174.600000116.5N255N255-G257 PolarHBondContact O-N 3.43Å
258D61.1Low57.2Low83 Ų83102 Ų10244%0.44462%0.617SS.*  trans-129.275.6-162.4-140.9-32.3000114.4T260 S261D258-T260 PolarHBondContact O-N 3.02Å; D258-T260 VanDerWaalsContact O-N 3.11Å; D258-T260 WeakPolarHBondContact OD1-CB 3.16Å; D258-T260 PolarHBondContact OD1-OG1 3.28Å; D258-S261 PolarHBondContact O-N 2.78Å; D258-S261 PolarHBondContact O-OG 3.39Å
259V58.7Low57.6Low103 Ų10398.1 Ų98.162%0.62460%0.599SS**Hα-helixtrans-52.7-30.4175.4-171.60000111.9S261 M262 V263V259-S261 VanDerWaalsContact C-N 3.25Å; V259-S261 PolarHBondContact O-N 2.92Å; V259-M262 PolarHBondContact O-N 3.18Å; V259-V263 HydrophobicContact CG1-CG2 4.46Å; V259-V263 WeakPolarHBondContact O-CG2 3.36Å; V259-V263 PolarHBondContact O-N 3.12Å; V259-V263 VanDerWaalsContact O-N 3.1Å
260T56.8Low58.1Low103 Ų10399.7 Ų99.763%0.63259%0.593SS**Hα-helixtrans-54-39.6176-240000112.6D258 V263 A264D258-T260 PolarHBondContact O-N 3.02Å; D258-T260 VanDerWaalsContact O-N 3.11Å; D258-T260 WeakPolarHBondContact OD1-CB 3.16Å; D258-T260 PolarHBondContact OD1-OG1 3.28Å; T260-V263 PolarHBondContact O-N 2.88Å; T260-A264 WeakPolarHBondContact O-CB 3.47Å; T260-A264 PolarHBondContact O-N 3.31Å
261S60.1Low57.9Low55 Ų5597 Ų9739%0.38559%0.587SS.*Hα-helixtrans-69.8-41.9-179.168.10000112.5D258 V259 A264 Q265D258-S261 PolarHBondContact O-N 2.78Å; D258-S261 PolarHBondContact O-OG 3.39Å; V259-S261 VanDerWaalsContact C-N 3.25Å; V259-S261 PolarHBondContact O-N 2.92Å; S261-A264 PolarHBondContact O-N 3.37Å; S261-Q265 WeakPolarHBondContact O-CB 3.33Å; S261-Q265 PolarHBondContact O-N 3.19Å
262M57.7Low58.1Low109 Ų10992.6 Ų92.654%0.53757%0.573SS.*Hα-helixtrans-62.8-42173.6-85.7-174.465.400111.9P253 V259 Q265 A266P253-M262 HydrophobicContact CG-CG 3.83Å; P253-M262 HydrophobicContact CG-SD 4Å; V259-M262 PolarHBondContact O-N 3.18Å; M262-Q265 PolarHBondContact O-N 3.47Å; M262-A266 WeakPolarHBondContact O-CB 3.27Å; M262-A266 PolarHBondContact O-N 3.2Å
263V59.1Low57.7Low85 Ų8592.6 Ų92.652%0.51557%0.573SS.*Hα-helixtrans-65.1-42.4177.3175.10000110.8V259 T260 Q265 A266 M267V259-V263 HydrophobicContact CG1-CG2 4.46Å; V259-V263 WeakPolarHBondContact O-CG2 3.36Å; V259-V263 PolarHBondContact O-N 3.12Å; V259-V263 VanDerWaalsContact O-N 3.1Å; T260-V263 PolarHBondContact O-N 2.88Å; V263-Q265 VanDerWaalsContact C-N 3.33Å; V263-Q265 PolarHBondContact O-N 3.19Å; V263-A266 PolarHBondContact O-N 3.43Å; V263-M267 HydrophobicContact CG1-CG 4.29Å; V263-M267 VanDerWaalsContact O-CB 3.3Å; V263-M267 WeakPolarHBondContact O-CB 3.29Å; V263-M267 VanDerWaalsContact O-CG 3.23Å; V263-M267 WeakPolarHBondContact O-CG 3.5Å; V263-M267 PolarHBondContact O-N 3.17Å
264A60.1Low57.6Low66 Ų6694.4 Ų94.455%0.54558%0.584SS.*Hα-helixtrans-61.4-40.7175.100000112.3T260 S261 G268T260-A264 WeakPolarHBondContact O-CB 3.47Å; T260-A264 PolarHBondContact O-N 3.31Å; S261-A264 PolarHBondContact O-N 3.37Å; A264-G268 PolarHBondContact O-N 3.26Å
265Q61.9Low57Low143 Ų14396.3 Ų96.367%0.66858%0.575SS**Hα-helixtrans-72.6-38.6-179.9-153.6162.911.300112S261 M262 V263 G268 V269S261-Q265 WeakPolarHBondContact O-CB 3.33Å; S261-Q265 PolarHBondContact O-N 3.19Å; M262-Q265 PolarHBondContact O-N 3.47Å; V263-Q265 VanDerWaalsContact C-N 3.33Å; V263-Q265 PolarHBondContact O-N 3.19Å; Q265-G268 PolarHBondContact O-N 3.36Å; Q265-V269 WeakPolarHBondContact O-CG2 3.21Å; Q265-V269 PolarHBondContact O-N 2.87Å
266A56.6Low55.8Low62 Ų6295.1 Ų95.151%0.51258%0.58SS.*Hα-helixtrans-65.1-41.917200000112.4M262 V263 G268 V269 Y270M262-A266 WeakPolarHBondContact O-CB 3.27Å; M262-A266 PolarHBondContact O-N 3.2Å; V263-A266 PolarHBondContact O-N 3.43Å; A266-G268 VanDerWaalsContact C-N 3.3Å; A266-G268 PolarHBondContact O-N 3.35Å; A266-V269 PolarHBondContact O-N 3.21Å; A266-Y270 PolarHBondContact O-N 2.98Å
267M60.4Low54.9Low120 Ų12093.9 Ų93.959%0.59157%0.572SS**Hα-helixtrans-65.8-32173-72.8-65-69.800112.1V263 Y270 G271V263-M267 HydrophobicContact CG1-CG 4.29Å; V263-M267 VanDerWaalsContact O-CB 3.3Å; V263-M267 WeakPolarHBondContact O-CB 3.29Å; V263-M267 VanDerWaalsContact O-CG 3.23Å; V263-M267 WeakPolarHBondContact O-CG 3.5Å; V263-M267 PolarHBondContact O-N 3.17Å; M267-Y270 PolarHBondContact O-N 3.25Å; M267-G271 PolarHBondContact O-N 3.23Å
268G66.2Low54.2Low44 Ų4497.3 Ų97.345%0.45458%0.58SS.*Hα-helixtrans-64.8-41.6171.500000112.9A264 Q265 A266 G271 A272A264-G268 PolarHBondContact O-N 3.26Å; Q265-G268 PolarHBondContact O-N 3.36Å; A266-G268 VanDerWaalsContact C-N 3.3Å; A266-G268 PolarHBondContact O-N 3.35Å; G268-G271 PolarHBondContact O-N 2.71Å; G268-A272 PolarHBondContact O-N 3.13Å
269V62.8Low53Low88 Ų8899.3 Ų99.353%0.53360%0.597SS.*Hα-helixtrans-68-41.7174.2175.10000111.2Q265 A266 G271 A272 L273Q265-V269 WeakPolarHBondContact O-CG2 3.21Å; Q265-V269 PolarHBondContact O-N 2.87Å; A266-V269 PolarHBondContact O-N 3.21Å; V269-G271 VanDerWaalsContact C-N 3.3Å; V269-G271 PolarHBondContact O-N 3.41Å; V269-A272 PolarHBondContact O-N 3.4Å; V269-L273 HydrophobicContact CG1-CD1 3.95Å; V269-L273 HydrophobicContact CG1-CG 4.45Å; V269-L273 WeakPolarHBondContact O-CG 3.29Å; V269-L273 PolarHBondContact O-N 3.48Å
270Y61Low51.6Low152 Ų15297.4 Ų97.460%0.59660%0.598SS**Hα-helixtrans-60.4-39.9171.8-173.1-97.2000111.8A266 M267 L273 T274A266-Y270 PolarHBondContact O-N 2.98Å; M267-Y270 PolarHBondContact O-N 3.25Å; Y270-L273 PolarHBondContact O-N 3.07Å; Y270-T274 HydrophobicContact CD1-CG2 4.26Å; Y270-T274 HydrophobicContact CE1-CG2 3.9Å; Y270-T274 WeakPolarHBondContact O-CB 3.48Å; Y270-T274 WeakPolarHBondContact O-CG2 3.33Å; Y270-T274 PolarHBondContact O-N 3.05Å; Y270-T274 PolarHBondContact O-OG1 3.38Å
271G50.6Low50.7Low32 Ų3298.9 Ų98.933%0.3361%0.607SS.*Hα-helixtrans-65.6-33.8174.100000113.8M267 G268 V269 T274 K275M267-G271 PolarHBondContact O-N 3.23Å; G268-G271 PolarHBondContact O-N 2.71Å; V269-G271 VanDerWaalsContact C-N 3.3Å; V269-G271 PolarHBondContact O-N 3.41Å; G271-T274 WeakPolarHBondContact CA-OG1 3.4Å; G271-T274 PolarHBondContact O-OG1 3.45Å; G271-K275 WeakPolarHBondContact O-CB 3.28Å; G271-K275 PolarHBondContact O-N 2.89Å
272A55.3Low49.7Very low65 Ų65101.9 Ų101.954%0.53763%0.625SS.*Hα-helixtrans-73.3-41.9174.600000111.9G268 V269 K275G268-A272 PolarHBondContact O-N 3.13Å; V269-A272 PolarHBondContact O-N 3.4Å; A272-K275 CarbonylContact O-C 3.59Å; A272-K275 PolarHBondContact O-N 3.2Å; A272-K275 VanDerWaalsContact O-N 3.15Å
273L45.3Very low48.3Very low137 Ų137103.6 Ų103.672%0.71764%0.637SS**Hα-helixtrans-71-29.2178.2-68.1170.8000113V269 Y270 K275V269-L273 HydrophobicContact CG1-CD1 3.95Å; V269-L273 HydrophobicContact CG1-CG 4.45Å; V269-L273 WeakPolarHBondContact O-CG 3.29Å; V269-L273 PolarHBondContact O-N 3.48Å; Y270-L273 PolarHBondContact O-N 3.07Å; L273-K275 VanDerWaalsContact C-N 3.32Å
274T50.1Low46.9Very low95 Ų95104.4 Ų104.458%0.58365%0.646SS**THydrogen-bonded Turntrans-81.1-9.6170.750.10000113.4Y270 G271Y270-T274 HydrophobicContact CD1-CG2 4.26Å; Y270-T274 HydrophobicContact CE1-CG2 3.9Å; Y270-T274 WeakPolarHBondContact O-CB 3.48Å; Y270-T274 WeakPolarHBondContact O-CG2 3.33Å; Y270-T274 PolarHBondContact O-N 3.05Å; Y270-T274 PolarHBondContact O-OG1 3.38Å; G271-T274 WeakPolarHBondContact CA-OG1 3.4Å; G271-T274 PolarHBondContact O-OG1 3.45Å
275K41.1Very low45.6Very low173 Ų173109 Ų10975%0.75266%0.661SS**  trans-113.348.8179.4-161-176177.3-178.90112.4G271 A272 L273 P277G271-K275 WeakPolarHBondContact O-CB 3.28Å; G271-K275 PolarHBondContact O-N 2.89Å; A272-K275 CarbonylContact O-C 3.59Å; A272-K275 PolarHBondContact O-N 3.2Å; A272-K275 VanDerWaalsContact O-N 3.15Å; L273-K275 VanDerWaalsContact C-N 3.32Å; K275-P277 WeakPolarHBondContact O-CD 3.5Å
276A31.3Very low44Very low81 Ų81107.4 Ų107.467%0.66967%0.665SS**  trans-112.291.4162.500000109.9
277P36.1Very low42.8Very low111 Ų111110.1 Ų110.172%0.72168%0.68SS**  trans-73.3131.9172-11.928.6000110.5K275 P279K275-P277 WeakPolarHBondContact O-CD 3.5Å; P277-P279 WeakPolarHBondContact O-CD 3.35Å
278V46.9Very low41.2Very low137 Ų137108.3 Ų108.383%0.8369%0.693SS**  trans-66.4127.4170.7179.50000109.8
279P34.4Very low39.4Very low125 Ų125112.2 Ų112.281%0.81271%0.713SS**  trans-9398.81664.615.8000109.6P277P277-P279 WeakPolarHBondContact O-CD 3.35Å
280G30.7Very low37.8Very low62 Ų62113.2 Ų113.264%0.63972%0.724SS**  trans-79.3160.7157.700000111.2
281T36.2Very low36.4Very low134 Ų134116.6 Ų116.682%0.82274%0.736SS**  trans-49153.4175.2-21.30000113.4
282P39.7Very low35.4Very low118 Ų118121.6 Ų121.677%0.76676%0.755SS**  -147.2168.6104.536.5-19.9000116.5
283D29.5Very low34.4Very low146 Ų146125.3 Ų125.378%0.78177%0.771SS**  trans-66.3156.1178.7-61.5-74.4000115.6
284S29.5Very low33.7Very low102 Ų102128 Ų12871%0.71378%0.779SS**  149.6139.3101.461.60000117.7
285L31.3Very low32.7Very low162 Ų162126.8 Ų126.885%0.84879%0.786SS**  trans64.8107.8141.9-67.7161.3000123.3
286S30.1Very low32.3Very low109 Ų109125.2 Ų125.276%0.76279%0.791SS**  178.8109.8121.637.10000109
287S29.4Very low32.4Very low119 Ų119128.2 Ų128.283%0.83280%0.796SS**  92.2110.76471.40000114.3
288G26.8Very low32.6Very low83 Ų83128.1 Ų128.186%0.85680%0.804SS**  trans120.693147.300000118.8
289S29.9Very low32.3Very low126 Ų126126 Ų12688%0.88180%0.796SS**  174.3142.5114.1-168.70000111.1
290S29.4Very low32.6Very low108 Ų108128.3 Ų128.376%0.75580%0.8SS**  trans-98.5176.9-172.3-48.10000113.6
291R30.5Very low33.2Very low223 Ų223133.6 Ų133.684%0.84281%0.814SS**  trans84.1135.4169.5-62-172.1178.4132.6-0.7115.6
292D30.2Very low33.7Very low137 Ų137136.7 Ų136.773%0.73382%0.819SS**  cis-142-178.2-12.1-86.5-37.6000106.4
293V33.8Very low34Very low144 Ų144140.3 Ų140.387%0.87383%0.826SS**  cis-148.616129.4179.50000109
294Q31.5Very low34.6Very low192 Ų192141.5 Ų141.590%0.89783%0.831SS**  trans-129.6126.6175.7-1701719.800112.7
295G29Very low35.4Very low70 Ų70144.1 Ų144.172%0.72284%0.837SS**  trans87.7108.6149.200000120
296T31Very low36.3Very low140 Ų140148.1 Ų148.186%0.85984%0.841SS**  trans-155155.2130.9-20000111.4
297D35.2Very low37.2Very low144 Ų144149.7 Ų149.777%0.7785%0.846SS**  trans86.579173.1-63.9-2.1000119
298A40.4Very low38.1Very low109 Ų109153.3 Ų153.390%0.90185%0.846SS**  trans-116100.7146.500000108.2
299S39.4Very low39.1Very low92 Ų92158.7 Ų158.764%0.64385%0.852SS**  trans-16346.5-171.849.20000113.9
300L41.6Very low39.7Very low174 Ų174161.7 Ų161.791%0.91187%0.873SS**SBendtrans-13938.2175.2-76.2179.5000113.8
301D42Very low40.3Very low174 Ų174164.4 Ų164.493%0.9388%0.878SS**SBendtrans-139.932.9177.5-100.8-34.2000113.2
302E47.8Very low40.8Very low198 Ų198161.3 Ų161.393%0.92588%0.88SS**  trans-136.640.5-179.9-150.1173.4-165.700114.1
303E45Very low41.4Very low194 Ų194162.6 Ų162.691%0.90789%0.889SS**SBendtrans-136.441.1175.8-149.4-179.1-161.500114.4
304L43.2Very low41.8Very low171 Ų171163.7 Ų163.790%0.89589%0.89SS**SBendtrans-133.6-0.7179.1-114.4158.8000116.8
305D45.7Very low42.4Very low157 Ų157161.9 Ų161.984%0.8489%0.889SS**SBendtrans-114.829-175.5-136.27.3000114.6
306R49.8Very low43.3Very low246 Ų246168.1 Ų168.193%0.92890%0.9SS**SBendtrans-124.532.9-179.6-137.9-179.5-146.5-120.45.6115.8
307V50Low44.2Very low142 Ų142170.1 Ų170.186%0.86190%0.903SS**SBendtrans-127.811170.1-169.80000112.5
308K47.6Very low44.9Very low195 Ų195172.1 Ų172.185%0.84891%0.913SS**SBendtrans-12355174.7-80.6-173.5175.8174.60113.7
309M48Very low45.3Very low197 Ų197177.3 Ų177.397%0.9791%0.914SS**  trans-166.775.1150.2-88.1-126-179.400110.3
310S43.4Very low45.8Very low188 Ų188185.1 Ų185.1100%1.31594%0.939SS**  trans-161.50151.6-174.60000109.7

Retrieved 310 of 310 residues in 165.1 ms (Link to these results)