A0A087XZA6_POEFO Loading...

Epsin 1a

AlphaFold DB (A0A3B3UES3), UniProt , Accession A0A087XZA6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 646 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
1M52.4Low72.1Confident196 Ų19694.6 Ų94.697%0.96649%0.486SS*.  0146.40-68.5175.7173.300109.2L6M1-L6 HydrophobicContact SD-CD1 4.05Å
2S65.2Low72.8Confident57 Ų5787.3 Ų87.340%0.39945%0.448SS..  trans-78.3149.6174.9178.20000111.3S4 S5 L6S2-S4 PolarHBondContact O-N 3.21Å; S2-S4 PolarHBondContact OG-N 3.22Å; S2-S5 WeakPolarHBondContact O-CB 3.42Å; S2-S5 PolarHBondContact O-N 2.95Å; S2-L6 PolarHBondContact O-N 2.86Å
3T66.9Low73.1Confident104 Ų10490.5 Ų90.564%0.63847%0.465SS*.Hα-helixtrans-66.5-18.8175.664.30000112.6R7T3-R7 VanDerWaalsContact O-CG 3.29Å; T3-R7 WeakPolarHBondContact O-CG 3.39Å; T3-R7 PolarHBondContact O-N 3.12Å
4S67.6Low73.3Confident61 Ų6191.5 Ų91.543%0.42748%0.477SS..Hα-helixtrans-64-51.2166.9-179.90000111.2S2 L6 R7 R8S2-S4 PolarHBondContact O-N 3.21Å; S2-S4 PolarHBondContact OG-N 3.22Å; S4-L6 PolarHBondContact O-N 3.2Å; S4-R7 PolarHBondContact O-N 3.02Å; S4-R8 PolarHBondContact O-N 2.89Å
5S73.8Confident73.3Confident30 Ų3091.2 Ų91.221%0.2147%0.472CS..Hα-helixtrans-58.6-44.6-179.2-41.90000111.7S2 R8 Q9S2-S5 WeakPolarHBondContact O-CB 3.42Å; S2-S5 PolarHBondContact O-N 2.95Å; S5-R8 WeakPolarHBondContact O-CB 3.32Å; S5-R8 PolarHBondContact O-N 2.91Å; S5-Q9 WeakPolarHBondContact O-CG 3.36Å; S5-Q9 PolarHBondContact O-N 3.27Å
6L76.5Confident73.9Confident95 Ų9594.8 Ų94.850%0.49749%0.492SS..Hα-helixtrans-64.5-45.1-179.8-132.778.5000112.3M1 S2 S4 R8 Q9 V10M1-L6 HydrophobicContact SD-CD1 4.05Å; S2-L6 PolarHBondContact O-N 2.86Å; S4-L6 PolarHBondContact O-N 3.2Å; L6-R8 VanDerWaalsContact C-N 3.27Å; L6-R8 PolarHBondContact O-N 3.22Å; L6-Q9 PolarHBondContact O-N 2.94Å; L6-V10 WeakPolarHBondContact O-CG2 3.47Å; L6-V10 PolarHBondContact O-N 3.3Å
7R78.4Confident74.5Confident188 Ų18892.2 Ų92.271%0.70948%0.475SS*.Hα-helixtrans-62.1-36.2174.7-68.3174-156.7-117.76.7111.6T3 S4 K11T3-R7 VanDerWaalsContact O-CG 3.29Å; T3-R7 WeakPolarHBondContact O-CG 3.39Å; T3-R7 PolarHBondContact O-N 3.12Å; S4-R7 PolarHBondContact O-N 3.02Å; R7-K11 WeakPolarHBondContact O-CB 3.47Å; R7-K11 PolarHBondContact O-N 2.86Å
8R80.8Confident75.3Confident39 Ų3989.1 Ų89.115%0.14746%0.462CS..Hα-helixtrans-66.7-46174.9-175.7176.7142.7-73.3-16.2111.1S4 S5 L6 V10 K11 N12 I22 R25 E26S4-R8 PolarHBondContact O-N 2.89Å; S5-R8 WeakPolarHBondContact O-CB 3.32Å; S5-R8 PolarHBondContact O-N 2.91Å; L6-R8 VanDerWaalsContact C-N 3.27Å; L6-R8 PolarHBondContact O-N 3.22Å; R8-V10 PolarHBondContact O-N 3.46Å; R8-K11 CarbonylContact O-C 3.52Å; R8-K11 WeakPolarHBondContact O-CA 3.47Å; R8-K11 PolarHBondContact O-N 2.79Å; R8-K11 VanDerWaalsContact O-N 3.13Å; R8-N12 PolarHBondContact O-N 2.84Å; R8-N12 PolarHBondContact O-OD1 3.44Å; R8-I22 PolarHBondContact NH2-O 2.87Å; R8-R25 PolarHBondContact NE-O 3.06Å; R8-E26 IonicContact CZ-OE2 3.17Å; R8-E26 IonicContact NH1-OE2 2.65Å; R8-E26 PolarHBondContact NH1-OE2 3.47Å; R8-E26 VanDerWaalsContact NH2-CA 3.34Å; R8-E26 VanDerWaalsContact NH2-N 3.17Å; R8-E26 IonicContact NH2-OE2 2.83Å; R8-E26 PolarHBondContact NH2-OE2 3.29Å
9Q75.1Confident75.9Confident74 Ų7491 Ų9135%0.34647%0.469SS..Hα-helixtrans-59-45.8175.5-74.9170.8-29.700112.4S5 L6 K11 N12 I13S5-Q9 WeakPolarHBondContact O-CG 3.36Å; S5-Q9 PolarHBondContact O-N 3.27Å; L6-Q9 PolarHBondContact O-N 2.94Å; Q9-K11 VanDerWaalsContact C-N 3.33Å; Q9-K11 PolarHBondContact O-N 2.69Å; Q9-N12 VanDerWaalsContact O-CB 3.3Å; Q9-N12 WeakPolarHBondContact O-CB 3.28Å; Q9-N12 PolarHBondContact O-N 3.26Å; Q9-I13 PolarHBondContact O-N 2.95Å
10V79.6Confident76.6Confident89 Ų8986.6 Ų86.654%0.53945%0.447SS..Hα-helixtrans-59.6-43.7173.1173.50000111L6 R8 N12 I13 V14L6-V10 WeakPolarHBondContact O-CG2 3.47Å; L6-V10 PolarHBondContact O-N 3.3Å; R8-V10 PolarHBondContact O-N 3.46Å; V10-N12 PolarHBondContact O-N 3.33Å; V10-I13 PolarHBondContact O-N 3.04Å; V10-V14 HydrophobicContact CG1-CG2 4.37Å; V10-V14 VanDerWaalsContact O-CG2 3.31Å; V10-V14 WeakPolarHBondContact O-CG2 3.49Å; V10-V14 PolarHBondContact O-N 2.83Å
11K77.3Confident77.3Confident108 Ų10884.2 Ų84.247%0.4743%0.433SS..Hα-helixtrans-63.5-27.2174.8-171.1166.7-176.2171.90112.7R7 R8 Q9 H15R7-K11 WeakPolarHBondContact O-CB 3.47Å; R7-K11 PolarHBondContact O-N 2.86Å; R8-K11 CarbonylContact O-C 3.52Å; R8-K11 WeakPolarHBondContact O-CA 3.47Å; R8-K11 PolarHBondContact O-N 2.79Å; R8-K11 VanDerWaalsContact O-N 3.13Å; Q9-K11 VanDerWaalsContact C-N 3.33Å; Q9-K11 PolarHBondContact O-N 2.69Å; K11-H15 VanDerWaalsContact CE-CE1 3.43Å; K11-H15 WeakPolarHBondContact CE-CE1 3.45Å; K11-H15 WeakPolarHBondContact CE-NE2 3.43Å; K11-H15 WeakPolarHBondContact O-CB 3.33Å; K11-H15 PolarHBondContact O-N 3.39Å; K11-H15 PolarHBondContact O-ND1 3.03Å
12N80.4Confident79.1Confident6 Ų677.2 Ų77.23%0.03240%0.399CS..Hα-helixtrans-67.3-51.5175.9-59.5-12.6000111.2R8 Q9 V10 V14 H15 N16 Y17 I22 R25R8-N12 PolarHBondContact O-N 2.84Å; R8-N12 PolarHBondContact O-OD1 3.44Å; Q9-N12 VanDerWaalsContact O-CB 3.3Å; Q9-N12 WeakPolarHBondContact O-CB 3.28Å; Q9-N12 PolarHBondContact O-N 3.26Å; V10-N12 PolarHBondContact O-N 3.33Å; N12-V14 VanDerWaalsContact C-N 3.34Å; N12-V14 PolarHBondContact O-N 3.44Å; N12-H15 PolarHBondContact O-N 2.93Å; N12-H15 VanDerWaalsContact O-N 3.13Å; N12-N16 PolarHBondContact O-N 3.41Å; N12-N16 VanDerWaalsContact O-N 3.11Å; N12-Y17 HydrophobicContact CB-CD2 4.42Å; N12-Y17 PolarHBondContact O-N 3.17Å; N12-I22 HydrophobicContact CB-CD1 3.95Å; N12-I22 HydrophobicContact CB-CG1 3.96Å; N12-R25 PolarHBondContact OD1-NH1 3.22Å
13I76.3Confident80.4Confident129 Ų12975.6 Ų75.666%0.66239%0.385SS*.Hα-helixtrans-59.3-46.2179.1-60.7164.1000110Q9 V10 H15 N16Q9-I13 PolarHBondContact O-N 2.95Å; V10-I13 PolarHBondContact O-N 3.04Å; I13-H15 PolarHBondContact O-N 2.84Å; I13-N16 PolarHBondContact O-N 2.84Å; I13-N16 PolarHBondContact O-OD1 3.46Å
14V75.3Confident81.7Confident105 Ų10570.7 Ų70.764%0.63636%0.355SS*.Hα-helixtrans-63.7-21.6179.6171.70000113.5V10 N12V10-V14 HydrophobicContact CG1-CG2 4.37Å; V10-V14 VanDerWaalsContact O-CG2 3.31Å; V10-V14 WeakPolarHBondContact O-CG2 3.49Å; V10-V14 PolarHBondContact O-N 2.83Å; N12-V14 VanDerWaalsContact C-N 3.34Å; N12-V14 PolarHBondContact O-N 3.44Å
15H74.4Confident82.8Confident87 Ų8768.8 Ų68.840%0.40334%0.339SS..Hα-helixtrans-106.11.5-179.5-67.946.3000113.1K11 N12 I13 Y17K11-H15 VanDerWaalsContact CE-CE1 3.43Å; K11-H15 WeakPolarHBondContact CE-CE1 3.45Å; K11-H15 WeakPolarHBondContact CE-NE2 3.43Å; K11-H15 WeakPolarHBondContact O-CB 3.33Å; K11-H15 PolarHBondContact O-N 3.39Å; K11-H15 PolarHBondContact O-ND1 3.03Å; N12-H15 PolarHBondContact O-N 2.93Å; N12-H15 VanDerWaalsContact O-N 3.13Å; I13-H15 PolarHBondContact O-N 2.84Å; H15-Y17 HydrophobicContact CB-CD2 3.89Å; H15-Y17 HydrophobicContact CB-CE1 4.24Å; H15-Y17 HydrophobicContact CB-CE2 3.51Å; H15-Y17 HydrophobicContact CB-CG 4.34Å; H15-Y17 AromaticContact CD2-CZ 3.96Å; H15-Y17 PolarHBondContact CD2-OH 3.49Å; H15-Y17 AromaticContact CG-CE2 3.97Å; H15-Y17 PolarHBondContact O-N 2.94Å
16N83.1Confident83.7Confident148 Ų14871.2 Ų71.279%0.79135%0.347SS*.THydrogen-bonded Turntrans49.738-176.4-59.4-44000114.1N12 I13N12-N16 PolarHBondContact O-N 3.41Å; N12-N16 VanDerWaalsContact O-N 3.11Å; I13-N16 PolarHBondContact O-N 2.84Å; I13-N16 PolarHBondContact O-OD1 3.46Å
17Y83.6Confident84.4Confident52 Ų5266.7 Ų66.720%0.20432%0.323CS..  trans-63.8140176.6-69.7-52.4000111.3N12 H15 E21 I22 R25 M59N12-Y17 HydrophobicContact CB-CD2 4.42Å; N12-Y17 PolarHBondContact O-N 3.17Å; H15-Y17 HydrophobicContact CB-CD2 3.89Å; H15-Y17 HydrophobicContact CB-CE1 4.24Å; H15-Y17 HydrophobicContact CB-CE2 3.51Å; H15-Y17 HydrophobicContact CB-CG 4.34Å; H15-Y17 AromaticContact CD2-CZ 3.96Å; H15-Y17 PolarHBondContact CD2-OH 3.49Å; H15-Y17 AromaticContact CG-CE2 3.97Å; H15-Y17 PolarHBondContact O-N 2.94Å; Y17-E21 VanDerWaalsContact CA-OE2 3.29Å; Y17-E21 WeakPolarHBondContact CA-OE2 3.46Å; Y17-E21 HydrophobicContact CD1-CB 4.43Å; Y17-E21 WeakPolarHBondContact CD1-OE1 3.27Å; Y17-E21 WeakPolarHBondContact CD1-OE2 3.25Å; Y17-E21 HydrophobicContact CG-CB 4.47Å; Y17-I22 WeakPolarHBondContact O-CD1 3.45Å; Y17-R25 VanDerWaalsContact CE2-NH2 3.29Å; Y17-M59 HydrophobicContact CD1-CE 4.48Å; Y17-M59 HydrophobicContact CE1-CE 4.24Å
18S88.4Confident85.1Confident35 Ų3557.8 Ų57.825%0.24529%0.289CS..  trans-58.9154.3171.3165.50000111.5A20 E21 I22 E55S18-A20 PolarHBondContact O-N 3.43Å; S18-A20 PolarHBondContact OG-N 3.33Å; S18-E21 PolarHBondContact N-OE2 2.95Å; S18-E21 WeakPolarHBondContact O-CB 3.41Å; S18-E21 PolarHBondContact O-N 2.98Å; S18-E21 VanDerWaalsContact O-N 3.11Å; S18-I22 WeakPolarHBondContact O-CG1 3.27Å; S18-I22 PolarHBondContact O-N 3.31Å; S18-E55 VanDerWaalsContact CB-CD 3.45Å; S18-E55 WeakPolarHBondContact CB-OE1 3.47Å; S18-E55 WeakPolarHBondContact CB-OE2 3.35Å; S18-E55 PolarHBondContact OG-OE2 3.23Å
19E86.9Confident85.4Confident126 Ų12656.3 Ų56.359%0.58929%0.285SS*.Hα-helixtrans-55.9-37.5176.1-167-174.3154.600111.9I22 K23E19-I22 PolarHBondContact O-N 3.46Å; E19-K23 HydrophobicContact CG-CD 4.39Å; E19-K23 WeakPolarHBondContact O-CG 3.42Å; E19-K23 PolarHBondContact O-N 2.85Å; E19-K23 VanDerWaalsContact OE1-CE 3.26Å; E19-K23 WeakPolarHBondContact OE1-CE 3.4Å; E19-K23 IonicContact OE1-NZ 2.67Å; E19-K23 PolarHBondContact OE1-NZ 2.72Å
20A90.3Very high86Confident3 Ų356.7 Ų56.73%0.02529%0.29CS..Hα-helixtrans-65.5-45176.500000111.8S18 I22 K23 V24 L46 A52 I56S18-A20 PolarHBondContact O-N 3.43Å; S18-A20 PolarHBondContact OG-N 3.33Å; A20-I22 VanDerWaalsContact C-N 3.32Å; A20-I22 PolarHBondContact O-N 2.87Å; A20-K23 PolarHBondContact O-N 3.16Å; A20-V24 WeakPolarHBondContact O-CG2 3.39Å; A20-V24 PolarHBondContact O-N 2.9Å; A20-L46 HydrophobicContact CB-CD1 4.3Å; A20-A52 HydrophobicContact CB-CB 3.86Å; A20-I56 HydrophobicContact CB-CD1 4.17Å; A20-I56 HydrophobicContact CB-CG1 3.95Å
21E90.3Very high86.2Confident36 Ų3653.8 Ų53.817%0.16827%0.271CS..Hα-helixtrans-63-37.7173-66.6-17697.800112.3Y17 S18 R25 E55 M59Y17-E21 VanDerWaalsContact CA-OE2 3.29Å; Y17-E21 WeakPolarHBondContact CA-OE2 3.46Å; Y17-E21 HydrophobicContact CD1-CB 4.43Å; Y17-E21 WeakPolarHBondContact CD1-OE1 3.27Å; Y17-E21 WeakPolarHBondContact CD1-OE2 3.25Å; Y17-E21 HydrophobicContact CG-CB 4.47Å; S18-E21 PolarHBondContact N-OE2 2.95Å; S18-E21 WeakPolarHBondContact O-CB 3.41Å; S18-E21 PolarHBondContact O-N 2.98Å; S18-E21 VanDerWaalsContact O-N 3.11Å; E21-R25 VanDerWaalsContact O-CB 3.23Å; E21-R25 WeakPolarHBondContact O-CB 3.27Å; E21-R25 WeakPolarHBondContact O-CD 3.25Å; E21-R25 WeakPolarHBondContact O-CG 3.48Å; E21-R25 PolarHBondContact O-N 2.92Å; E21-E55 HydrophobicContact CG-CB 3.92Å; E21-M59 HydrophobicContact CB-CE 4.27Å; E21-M59 HydrophobicContact CG-CE 4.13Å; E21-M59 WeakPolarHBondContact OE1-CE 3.3Å
22I90.9Very high86.4Confident49 Ų4953 Ų5325%0.25128%0.277SS..Hα-helixtrans-61.6-50.1177.2-72.7172.1000109.7R8 N12 Y17 S18 E19 A20 R25 E26R8-I22 PolarHBondContact NH2-O 2.87Å; N12-I22 HydrophobicContact CB-CD1 3.95Å; N12-I22 HydrophobicContact CB-CG1 3.96Å; Y17-I22 WeakPolarHBondContact O-CD1 3.45Å; S18-I22 WeakPolarHBondContact O-CG1 3.27Å; S18-I22 PolarHBondContact O-N 3.31Å; E19-I22 PolarHBondContact O-N 3.46Å; A20-I22 VanDerWaalsContact C-N 3.32Å; A20-I22 PolarHBondContact O-N 2.87Å; I22-R25 PolarHBondContact O-N 3.46Å; I22-E26 PolarHBondContact O-N 3.36Å
23K92Very high86.5Confident24 Ų2459.9 Ų59.910%0.10430%0.303CS..Hα-helixtrans-60.7-47.8177.6-71.9169.7177.4177.60111.7E19 A20 R25 E26 A27 L39 E42 I43 L46E19-K23 HydrophobicContact CG-CD 4.39Å; E19-K23 WeakPolarHBondContact O-CG 3.42Å; E19-K23 PolarHBondContact O-N 2.85Å; E19-K23 VanDerWaalsContact OE1-CE 3.26Å; E19-K23 WeakPolarHBondContact OE1-CE 3.4Å; E19-K23 IonicContact OE1-NZ 2.67Å; E19-K23 PolarHBondContact OE1-NZ 2.72Å; A20-K23 PolarHBondContact O-N 3.16Å; K23-R25 PolarHBondContact O-N 3.11Å; K23-E26 WeakPolarHBondContact O-CA 3.35Å; K23-E26 VanDerWaalsContact O-CB 3.26Å; K23-E26 WeakPolarHBondContact O-CB 3.38Å; K23-E26 PolarHBondContact O-N 2.89Å; K23-A27 PolarHBondContact O-N 3.1Å; K23-L39 HydrophobicContact CB-CD1 4.11Å; K23-L39 HydrophobicContact CG-CD1 4.11Å; K23-E42 HydrophobicContact CD-CG 4.22Å; K23-E42 WeakPolarHBondContact CD-OE2 3.41Å; K23-E42 WeakPolarHBondContact CE-OE1 3.35Å; K23-E42 WeakPolarHBondContact CE-OE2 3.46Å; K23-E42 IonicContact NZ-OE1 2.67Å; K23-E42 PolarHBondContact NZ-OE1 2.95Å; K23-E42 IonicContact NZ-OE2 2.77Å; K23-E42 PolarHBondContact NZ-OE2 3.36Å; K23-I43 HydrophobicContact CB-CD1 4.2Å; K23-I43 HydrophobicContact CB-CG1 3.79Å; K23-L46 HydrophobicContact CD-CD1 3.72Å
24V94.2Very high86.9Confident0 Ų056 Ų560%029%0.294CS..Hα-helixtrans-58.5-47.3174.4172.40000111.6A20 E26 A27 T28 I43 I56 M59 V60 L80A20-V24 WeakPolarHBondContact O-CG2 3.39Å; A20-V24 PolarHBondContact O-N 2.9Å; V24-E26 PolarHBondContact O-N 3.34Å; V24-E26 VanDerWaalsContact O-N 3.11Å; V24-A27 PolarHBondContact O-N 3.24Å; V24-T28 HydrophobicContact CG1-CG2 4.33Å; V24-T28 WeakPolarHBondContact O-CG2 3.47Å; V24-T28 PolarHBondContact O-N 3.43Å; V24-T28 PolarHBondContact O-OG1 2.89Å; V24-I43 HydrophobicContact CG2-CD1 4.31Å; V24-I43 HydrophobicContact CG2-CG1 4.47Å; V24-I43 HydrophobicContact CG2-CG2 3.8Å; V24-I56 HydrophobicContact CG2-CB 4.1Å; V24-I56 HydrophobicContact CG2-CG1 3.79Å; V24-I56 HydrophobicContact CG2-CG2 3.85Å; V24-M59 HydrophobicContact CB-CB 4.47Å; V24-M59 HydrophobicContact CB-CG 4.22Å; V24-M59 HydrophobicContact CG1-CB 3.92Å; V24-M59 HydrophobicContact CG1-CG 3.7Å; V24-V60 HydrophobicContact CG1-CG2 3.68Å; V24-L80 HydrophobicContact CG1-CD2 4.1Å; V24-L80 HydrophobicContact CG2-CD2 4.3Å
25R91.9Very high87.5Confident22 Ų2252.1 Ų52.18%0.08327%0.271CS..Hα-helixtrans-67.9-10178.7-67.5168.177.9-96.26113.2R8 N12 Y17 E21 I22 K23 M59 R63R8-R25 PolarHBondContact NE-O 3.06Å; N12-R25 PolarHBondContact OD1-NH1 3.22Å; Y17-R25 VanDerWaalsContact CE2-NH2 3.29Å; E21-R25 VanDerWaalsContact O-CB 3.23Å; E21-R25 WeakPolarHBondContact O-CB 3.27Å; E21-R25 WeakPolarHBondContact O-CD 3.25Å; E21-R25 WeakPolarHBondContact O-CG 3.48Å; E21-R25 PolarHBondContact O-N 2.92Å; I22-R25 PolarHBondContact O-N 3.46Å; K23-R25 PolarHBondContact O-N 3.11Å; R25-M59 VanDerWaalsContact CD-SD 3.53Å; R25-M59 HydrophobicContact CG-CE 4.29Å; R25-M59 HydrophobicContact CG-CG 3.59Å; R25-M59 HydrophobicContact CG-SD 3.47Å; R25-M59 WeakPolarHBondContact CG-SD 3.43Å; R25-R63 PolarHBondContact O-NH2 3.17Å
26E91.1Very high88.2Confident81 Ų8151.2 Ų51.238%0.37928%0.275SS..Hα-helixtrans-88.1-48.8171.4-160.6130159.700110.9R8 I22 K23 V24 T28 S29 L39R8-E26 IonicContact CZ-OE2 3.17Å; R8-E26 IonicContact NH1-OE2 2.65Å; R8-E26 PolarHBondContact NH1-OE2 3.47Å; R8-E26 VanDerWaalsContact NH2-CA 3.34Å; R8-E26 VanDerWaalsContact NH2-N 3.17Å; R8-E26 IonicContact NH2-OE2 2.83Å; R8-E26 PolarHBondContact NH2-OE2 3.29Å; I22-E26 PolarHBondContact O-N 3.36Å; K23-E26 WeakPolarHBondContact O-CA 3.35Å; K23-E26 VanDerWaalsContact O-CB 3.26Å; K23-E26 WeakPolarHBondContact O-CB 3.38Å; K23-E26 PolarHBondContact O-N 2.89Å; V24-E26 PolarHBondContact O-N 3.34Å; V24-E26 VanDerWaalsContact O-N 3.11Å; E26-T28 VanDerWaalsContact C-N 3.25Å; E26-T28 PolarHBondContact O-N 3.43Å; E26-S29 VanDerWaalsContact O-CB 3.25Å; E26-S29 WeakPolarHBondContact O-CB 3.42Å; E26-S29 PolarHBondContact O-N 3.25Å; E26-L39 HydrophobicContact CB-CD2 3.93Å; E26-L39 HydrophobicContact CG-CD2 4.05Å
27A92.4Very high88.5Confident0 Ų048.2 Ų48.20%027%0.265CS..Hα-helixtrans-57.7-40.3173.500000111.3K23 V24 S29 P35 L39 I43 K76 L80K23-A27 PolarHBondContact O-N 3.1Å; V24-A27 PolarHBondContact O-N 3.24Å; A27-S29 VanDerWaalsContact C-N 3.32Å; A27-S29 PolarHBondContact O-N 2.99Å; A27-P35 HydrophobicContact CB-CB 4.02Å; A27-L39 HydrophobicContact CB-CD2 3.9Å; A27-I43 HydrophobicContact CB-CD1 3.76Å; A27-K76 WeakPolarHBondContact O-CB 3.22Å; A27-K76 WeakPolarHBondContact O-CD 3.16Å; A27-L80 HydrophobicContact CB-CD1 4.48Å; A27-L80 HydrophobicContact CB-CD2 4.02Å
28T92.3Very high88.9Confident0 Ų049.8 Ų49.80%028%0.284CS..THydrogen-bonded Turntrans-91.335.6174.680.10000113.2V24 E26 R63 H73 A77 L80V24-T28 HydrophobicContact CG1-CG2 4.33Å; V24-T28 WeakPolarHBondContact O-CG2 3.47Å; V24-T28 PolarHBondContact O-N 3.43Å; V24-T28 PolarHBondContact O-OG1 2.89Å; E26-T28 VanDerWaalsContact C-N 3.25Å; E26-T28 PolarHBondContact O-N 3.43Å; T28-R63 HydrophobicContact CG2-CB 4.36Å; T28-R63 HydrophobicContact CG2-CG 4.46Å; T28-R63 PolarHBondContact O-NH2 3Å; T28-R63 PolarHBondContact OG1-NE 3.41Å; T28-R63 PolarHBondContact OG1-NH2 3.01Å; T28-H73 PolarHBondContact O-CD2 3.03Å; T28-H73 VanDerWaalsContact O-CD2 3.23Å; T28-A77 HydrophobicContact CG2-CB 4.03Å; T28-L80 HydrophobicContact CG2-CD2 4.33Å
29S87.7Confident89Confident8 Ų849.4 Ų49.46%0.05628%0.279CS..  trans-70161.8175.379.10000112.6E26 A27 D31 K76E26-S29 VanDerWaalsContact O-CB 3.25Å; E26-S29 WeakPolarHBondContact O-CB 3.42Å; E26-S29 PolarHBondContact O-N 3.25Å; A27-S29 VanDerWaalsContact C-N 3.32Å; A27-S29 PolarHBondContact O-N 2.99Å; S29-D31 WeakPolarHBondContact CB-OD2 3.36Å; S29-D31 PolarHBondContact O-N 2.96Å; S29-D31 WeakPolarHBondContact OG-CB 3.43Å; S29-D31 VanDerWaalsContact OG-CG 3.31Å; S29-D31 PolarHBondContact OG-N 3.46Å; S29-D31 PolarHBondContact OG-OD2 3.3Å; S29-K76 WeakPolarHBondContact O-CD 3.33Å; S29-K76 WeakPolarHBondContact O-CE 3.27Å; S29-K76 PolarHBondContact O-NZ 3.08Å; S29-K76 PolarHBondContact OG-NZ 2.76Å
30N86.7Confident89.4Confident83 Ų8344.4 Ų44.444%0.44426%0.256SS..SBendtrans-81.15.4172.8-159.343.6000113.7R72N30-R72 WeakPolarHBondContact O-CD 3.35Å
31D85.3Confident89.5Confident27 Ų2745.6 Ų45.614%0.14426%0.264CS..SBendtrans-66153.4-177.3-56.3-54.7000111.2S29 W33 K76S29-D31 WeakPolarHBondContact CB-OD2 3.36Å; S29-D31 PolarHBondContact O-N 2.96Å; S29-D31 WeakPolarHBondContact OG-CB 3.43Å; S29-D31 VanDerWaalsContact OG-CG 3.31Å; S29-D31 PolarHBondContact OG-N 3.46Å; S29-D31 PolarHBondContact OG-OD2 3.3Å; D31-W33 VanDerWaalsContact C-N 3.33Å; D31-W33 HydrophobicContact CB-CD2 3.89Å; D31-W33 HydrophobicContact CB-CE3 4.11Å; D31-W33 HydrophobicContact CB-CH2 3.67Å; D31-W33 HydrophobicContact CB-CZ2 3.42Å; D31-W33 VanDerWaalsContact CB-CZ2 3.42Å; D31-W33 HydrophobicContact CB-CZ3 4.01Å; D31-W33 PolarHBondContact O-N 2.67Å; D31-K76 VanDerWaalsContact O-CE 3.27Å; D31-K76 WeakPolarHBondContact O-CE 3.47Å; D31-K76 PolarHBondContact O-NZ 2.86Å
32P81.3Confident89.6Confident92 Ų9247.7 Ų47.760%0.59727%0.273SS*.SBendtrans-70.2-23.6-171.924.2-32.7000114.9R72P32-R72 PolarHBondContact O-NH1 3Å
33W83.3Confident89.8Confident151 Ų15145.3 Ų45.357%0.57226%0.261SS*.SBendtrans-83.6156.3177.45789.6000112.9D31 K76D31-W33 VanDerWaalsContact C-N 3.33Å; D31-W33 HydrophobicContact CB-CD2 3.89Å; D31-W33 HydrophobicContact CB-CE3 4.11Å; D31-W33 HydrophobicContact CB-CH2 3.67Å; D31-W33 HydrophobicContact CB-CZ2 3.42Å; D31-W33 VanDerWaalsContact CB-CZ2 3.42Å; D31-W33 HydrophobicContact CB-CZ3 4.01Å; D31-W33 PolarHBondContact O-N 2.67Å; W33-K76 WeakPolarHBondContact O-CE 3.48Å; W33-K76 PolarHBondContact O-NZ 3.09Å
34G84.2Confident89.9Confident47 Ų4744.2 Ų44.249%0.48526%0.256SS..PPolyproline II helixtrans-67.2167.4175.300000113.8
35P87.9Confident89.9Confident23 Ų2348.2 Ų48.215%0.14928%0.278CS..PPolyproline II helixtrans-60.4143.6172.427.8-35.5000111.5A27 M40 T79A27-P35 HydrophobicContact CB-CB 4.02Å; P35-M40 HydrophobicContact CB-CE 4.49Å; P35-M40 HydrophobicContact CB-CG 3.91Å; P35-M40 HydrophobicContact CB-SD 3.85Å; P35-M40 HydrophobicContact CG-CE 4.08Å; P35-M40 HydrophobicContact CG-CG 4.2Å; P35-M40 HydrophobicContact CG-SD 3.45Å; P35-M40 WeakPolarHBondContact CG-SD 3.34Å; P35-T79 HydrophobicContact CG-CG2 3.96Å
36S89.3Confident90Very high69 Ų6949.2 Ų49.248%0.48329%0.285SS..PPolyproline II helixtrans-67.5137.1175.1176.30000110.9S38 L39 M40S36-S38 VanDerWaalsContact C-N 3.34Å; S36-S38 PolarHBondContact O-N 2.88Å; S36-L39 PolarHBondContact O-N 3.47Å; S36-M40 WeakPolarHBondContact O-CG 3.24Å; S36-M40 PolarHBondContact O-N 3.5Å
37S89.2Confident90.1Very high84 Ų8445.5 Ų45.559%0.58727%0.267SS*.Hα-helixtrans-57.9-44177.750.70000112.4L39 M40 S41S37-L39 VanDerWaalsContact C-N 3.34Å; S37-L39 PolarHBondContact O-N 2.72Å; S37-M40 PolarHBondContact O-N 3.44Å; S37-S41 PolarHBondContact O-N 2.77Å; S37-S41 PolarHBondContact O-OG 3.46Å
38S90.7Very high90.1Very high85 Ų8551.1 Ų51.159%0.59429%0.29SS*.Hα-helixtrans-59.6-42.1175.8162.80000112.3S36 S41 E42S36-S38 VanDerWaalsContact C-N 3.34Å; S36-S38 PolarHBondContact O-N 2.88Å; S38-S41 WeakPolarHBondContact O-CB 3.46Å; S38-S41 PolarHBondContact O-N 3.34Å; S38-E42 WeakPolarHBondContact O-CB 3.33Å; S38-E42 PolarHBondContact O-N 3.19Å
39L92.3Very high90.2Very high28 Ų2855.2 Ų55.215%0.14731%0.312CS..Hα-helixtrans-67.2-36.7176.6-177.472.6000111.7K23 E26 A27 S36 S37 E42 I43K23-L39 HydrophobicContact CB-CD1 4.11Å; K23-L39 HydrophobicContact CG-CD1 4.11Å; E26-L39 HydrophobicContact CB-CD2 3.93Å; E26-L39 HydrophobicContact CG-CD2 4.05Å; A27-L39 HydrophobicContact CB-CD2 3.9Å; S36-L39 PolarHBondContact O-N 3.47Å; S37-L39 VanDerWaalsContact C-N 3.34Å; S37-L39 PolarHBondContact O-N 2.72Å; L39-E42 PolarHBondContact O-N 3.24Å; L39-I43 HydrophobicContact CG-CD1 4.17Å; L39-I43 WeakPolarHBondContact O-CD1 3.38Å; L39-I43 VanDerWaalsContact O-CG1 3.24Å; L39-I43 WeakPolarHBondContact O-CG1 3.42Å; L39-I43 PolarHBondContact O-N 2.95Å
40M93.3Very high90.3Very high21 Ų2158.9 Ų58.910%0.10333%0.333CS..Hα-helixtrans-68.3-41.2175-67.1-168.9-69.200111.9P35 S36 S37 E42 I43 A44 T79 L80 Y83P35-M40 HydrophobicContact CB-CE 4.49Å; P35-M40 HydrophobicContact CB-CG 3.91Å; P35-M40 HydrophobicContact CB-SD 3.85Å; P35-M40 HydrophobicContact CG-CE 4.08Å; P35-M40 HydrophobicContact CG-CG 4.2Å; P35-M40 HydrophobicContact CG-SD 3.45Å; P35-M40 WeakPolarHBondContact CG-SD 3.34Å; S36-M40 WeakPolarHBondContact O-CG 3.24Å; S36-M40 PolarHBondContact O-N 3.5Å; S37-M40 PolarHBondContact O-N 3.44Å; M40-E42 VanDerWaalsContact C-N 3.34Å; M40-E42 PolarHBondContact O-N 3.49Å; M40-I43 PolarHBondContact O-N 3.18Å; M40-A44 WeakPolarHBondContact O-CB 3.48Å; M40-A44 PolarHBondContact O-N 2.85Å; M40-T79 HydrophobicContact SD-CG2 4.34Å; M40-L80 HydrophobicContact CB-CD1 4.38Å; M40-L80 HydrophobicContact CG-CD1 4.01Å; M40-Y83 VanDerWaalsContact C-CE1 3.43Å; M40-Y83 HydrophobicContact CB-CD1 3.6Å; M40-Y83 HydrophobicContact CB-CE1 3.8Å; M40-Y83 HydrophobicContact CB-CG 4.04Å; M40-Y83 WeakPolarHBondContact O-CE1 3.3Å; M40-Y83 HydrophobicContact SD-CG 4.33Å
41S92.5Very high90.5Very high27 Ų2759.6 Ų59.619%0.18934%0.341CS..Hα-helixtrans-55.4-48.9170.9-66.50000111.4S37 S38 I43 A44 D45 Y83S37-S41 PolarHBondContact O-N 2.77Å; S37-S41 PolarHBondContact O-OG 3.46Å; S38-S41 WeakPolarHBondContact O-CB 3.46Å; S38-S41 PolarHBondContact O-N 3.34Å; S41-I43 PolarHBondContact O-N 3.29Å; S41-A44 WeakPolarHBondContact O-CA 3.28Å; S41-A44 VanDerWaalsContact O-CB 3.32Å; S41-A44 WeakPolarHBondContact O-CB 3.36Å; S41-A44 PolarHBondContact O-N 3.19Å; S41-A44 VanDerWaalsContact O-N 3.09Å; S41-D45 PolarHBondContact O-N 3.18Å; S41-Y83 PolarHBondContact OG-OH 3.07Å; S41-Y83 VanDerWaalsContact OG-OH 3.07Å
42E93.7Very high90.8Very high80 Ų8058.6 Ų58.637%0.37434%0.336SS..Hα-helixtrans-64.4-39.3-178.1-169.5-177.8-147.100112.6K23 S38 L39 M40 D45 L46K23-E42 HydrophobicContact CD-CG 4.22Å; K23-E42 WeakPolarHBondContact CD-OE2 3.41Å; K23-E42 WeakPolarHBondContact CE-OE1 3.35Å; K23-E42 WeakPolarHBondContact CE-OE2 3.46Å; K23-E42 IonicContact NZ-OE1 2.67Å; K23-E42 PolarHBondContact NZ-OE1 2.95Å; K23-E42 IonicContact NZ-OE2 2.77Å; K23-E42 PolarHBondContact NZ-OE2 3.36Å; S38-E42 WeakPolarHBondContact O-CB 3.33Å; S38-E42 PolarHBondContact O-N 3.19Å; L39-E42 PolarHBondContact O-N 3.24Å; M40-E42 VanDerWaalsContact C-N 3.34Å; M40-E42 PolarHBondContact O-N 3.49Å; E42-D45 PolarHBondContact O-N 3.29Å; E42-L46 WeakPolarHBondContact O-CG 3.3Å; E42-L46 PolarHBondContact O-N 2.93Å
43I94.6Very high91.4Very high0 Ų055.1 Ų55.10%031%0.311CS..Hα-helixtrans-66.3-39.7172.1-61160.5000110.3K23 V24 A27 L39 M40 S41 D45 L46 T47 I56 L80 L84K23-I43 HydrophobicContact CB-CD1 4.2Å; K23-I43 HydrophobicContact CB-CG1 3.79Å; V24-I43 HydrophobicContact CG2-CD1 4.31Å; V24-I43 HydrophobicContact CG2-CG1 4.47Å; V24-I43 HydrophobicContact CG2-CG2 3.8Å; A27-I43 HydrophobicContact CB-CD1 3.76Å; L39-I43 HydrophobicContact CG-CD1 4.17Å; L39-I43 WeakPolarHBondContact O-CD1 3.38Å; L39-I43 VanDerWaalsContact O-CG1 3.24Å; L39-I43 WeakPolarHBondContact O-CG1 3.42Å; L39-I43 PolarHBondContact O-N 2.95Å; M40-I43 PolarHBondContact O-N 3.18Å; S41-I43 PolarHBondContact O-N 3.29Å; I43-D45 VanDerWaalsContact C-N 3.34Å; I43-D45 PolarHBondContact O-N 3.44Å; I43-L46 PolarHBondContact O-N 2.97Å; I43-T47 WeakPolarHBondContact O-CG2 3.49Å; I43-T47 PolarHBondContact O-N 3.05Å; I43-I56 HydrophobicContact CG2-CD1 4Å; I43-I56 HydrophobicContact CG2-CG1 4.24Å; I43-I56 HydrophobicContact CG2-CG2 4.01Å; I43-L80 HydrophobicContact CB-CD1 4.32Å; I43-L80 HydrophobicContact CD1-CD1 3.91Å; I43-L80 HydrophobicContact CD1-CD2 4.13Å; I43-L80 HydrophobicContact CG2-CD1 4.24Å; I43-L84 HydrophobicContact CB-CD2 4.4Å; I43-L84 HydrophobicContact CG2-CD1 4.22Å; I43-L84 HydrophobicContact CG2-CD2 3.95Å
44A94.3Very high91.8Very high0 Ų051.3 Ų51.30%031%0.308CS..Hα-helixtrans-59.9-43.6176.100000111.8M40 S41 L46 T47 Y48 Y83 L84M40-A44 WeakPolarHBondContact O-CB 3.48Å; M40-A44 PolarHBondContact O-N 2.85Å; S41-A44 WeakPolarHBondContact O-CA 3.28Å; S41-A44 VanDerWaalsContact O-CB 3.32Å; S41-A44 WeakPolarHBondContact O-CB 3.36Å; S41-A44 PolarHBondContact O-N 3.19Å; S41-A44 VanDerWaalsContact O-N 3.09Å; A44-L46 VanDerWaalsContact C-N 3.34Å; A44-L46 PolarHBondContact O-N 3.43Å; A44-T47 PolarHBondContact O-N 3.41Å; A44-T47 VanDerWaalsContact O-N 3.14Å; A44-T47 PolarHBondContact O-OG1 3.35Å; A44-Y48 WeakPolarHBondContact O-CD2 3.37Å; A44-Y83 HydrophobicContact CB-CD1 4.35Å; A44-Y83 HydrophobicContact CB-CE1 3.95Å; A44-L84 HydrophobicContact CB-CD2 3.75Å
45D93.4Very high92.2Very high84 Ų8451.8 Ų51.845%0.44930%0.298SS..Hα-helixtrans-68.7-33.8177.6-62.1-40.2000111.7S41 E42 I43 T47 Y48 K151S41-D45 PolarHBondContact O-N 3.18Å; E42-D45 PolarHBondContact O-N 3.29Å; I43-D45 VanDerWaalsContact C-N 3.34Å; I43-D45 PolarHBondContact O-N 3.44Å; D45-T47 VanDerWaalsContact C-N 3.31Å; D45-T47 PolarHBondContact O-N 3Å; D45-Y48 PolarHBondContact O-N 3.36Å; D45-K151 IonicContact OD1-NZ 3.79Å; D45-K151 PolarHBondContact OD1-NZ 3.11Å; D45-K151 IonicContact OD2-NZ 3.03Å; D45-K151 PolarHBondContact OD2-NZ 3.36Å
46L94.1Very high92.6Very high44 Ų4450.7 Ų50.723%0.2329%0.29CS..Hα-helixtrans-66-25.7170.6-73.4170.9000114A20 K23 E42 I43 A44 Y48 N49 I56A20-L46 HydrophobicContact CB-CD1 4.3Å; K23-L46 HydrophobicContact CD-CD1 3.72Å; E42-L46 WeakPolarHBondContact O-CG 3.3Å; E42-L46 PolarHBondContact O-N 2.93Å; I43-L46 PolarHBondContact O-N 2.97Å; A44-L46 VanDerWaalsContact C-N 3.34Å; A44-L46 PolarHBondContact O-N 3.43Å; L46-Y48 PolarHBondContact O-N 2.82Å; L46-N49 WeakPolarHBondContact O-CB 3.47Å; L46-N49 PolarHBondContact O-N 3.4Å; L46-I56 HydrophobicContact CB-CD1 3.86Å
47T93.8Very high92.8Very high2 Ų247.6 Ų47.61%0.01227%0.269CS..THydrogen-bonded Turntrans-68.2-11177.662.90000114.6I43 A44 D45 N49 I56 L84 G88 S89 V92I43-T47 WeakPolarHBondContact O-CG2 3.49Å; I43-T47 PolarHBondContact O-N 3.05Å; A44-T47 PolarHBondContact O-N 3.41Å; A44-T47 VanDerWaalsContact O-N 3.14Å; A44-T47 PolarHBondContact O-OG1 3.35Å; D45-T47 VanDerWaalsContact C-N 3.31Å; D45-T47 PolarHBondContact O-N 3Å; T47-N49 VanDerWaalsContact C-N 3.32Å; T47-I56 HydrophobicContact CG2-CD1 3.85Å; T47-I56 HydrophobicContact CG2-CG2 4.02Å; T47-L84 HydrophobicContact CG2-CD1 4.3Å; T47-L84 HydrophobicContact CG2-CD2 3.97Å; T47-G88 WeakPolarHBondContact OG1-CA 3.39Å; T47-S89 WeakPolarHBondContact O-CB 3.27Å; T47-S89 PolarHBondContact OG1-N 3.44Å; T47-V92 HydrophobicContact CG2-CG2 4.04Å
48Y92.7Very high92.9Very high119 Ų11947.3 Ų47.347%0.46727%0.266SS..THydrogen-bonded Turntrans-77.1-18.7171.1-65.8-85.8000112.6A44 D45 L46 T87 G88A44-Y48 WeakPolarHBondContact O-CD2 3.37Å; D45-Y48 PolarHBondContact O-N 3.36Å; L46-Y48 PolarHBondContact O-N 2.82Å; Y48-T87 PolarHBondContact OH-O 2.91Å; Y48-G88 PolarHBondContact OH-O 2.98Å; Y48-G88 VanDerWaalsContact OH-O 3.09Å
49N94Very high93Very high86 Ų8643.6 Ų43.646%0.4624%0.24SC..SBendtrans-82.6122.4170.6176.5-16.7000110.2L46 T47 V51 A52 F53L46-N49 WeakPolarHBondContact O-CB 3.47Å; L46-N49 PolarHBondContact O-N 3.4Å; T47-N49 VanDerWaalsContact C-N 3.32Å; N49-V51 VanDerWaalsContact C-N 3.3Å; N49-V51 PolarHBondContact O-N 2.81Å; N49-V51 PolarHBondContact OD1-N 3.29Å; N49-A52 HydrophobicContact CB-CB 4.11Å; N49-A52 PolarHBondContact O-N 2.95Å; N49-F53 WeakPolarHBondContact O-CB 3.42Å; N49-F53 PolarHBondContact O-N 2.75Å
50V90.1Very high93.2Very high84 Ų8442.3 Ų42.351%0.50923%0.233SC..Hα-helixtrans-61.3-32.8-174.2-172.80000113.6S54V50-S54 PolarHBondContact O-OG 3.39Å; V50-S54 VanDerWaalsContact O-OG 3.14Å
51V90.2Very high93.2Very high99 Ų9943.4 Ų43.460%0.624%0.236SC*.Hα-helixtrans-73.5-56.5178-177.50000109.5N49 F53 S54 E55N49-V51 VanDerWaalsContact C-N 3.3Å; N49-V51 PolarHBondContact O-N 2.81Å; N49-V51 PolarHBondContact OD1-N 3.29Å; V51-F53 VanDerWaalsContact C-N 3.27Å; V51-F53 PolarHBondContact O-N 3Å; V51-S54 WeakPolarHBondContact O-CB 3.38Å; V51-S54 PolarHBondContact O-N 2.98Å; V51-E55 PolarHBondContact O-N 3.06Å
52A91.3Very high93.2Very high6 Ų648.8 Ų48.85%0.0526%0.256CS..Hα-helixtrans-59.4-35.7179.600000112.5A20 N49 S54 E55 I56A20-A52 HydrophobicContact CB-CB 3.86Å; N49-A52 HydrophobicContact CB-CB 4.11Å; N49-A52 PolarHBondContact O-N 2.95Å; A52-S54 VanDerWaalsContact C-N 3.29Å; A52-S54 PolarHBondContact O-N 3.08Å; A52-E55 PolarHBondContact O-N 3.29Å; A52-I56 HydrophobicContact CB-CD1 4.37Å; A52-I56 WeakPolarHBondContact O-CB 3.42Å; A52-I56 WeakPolarHBondContact O-CD1 3.45Å; A52-I56 WeakPolarHBondContact O-CG1 3.33Å; A52-I56 PolarHBondContact O-N 3.2Å
53F93.9Very high93.2Very high18 Ų1846.4 Ų46.48%0.07924%0.243CC..Hα-helixtrans-51.8-46.7173.2173.7-91.8000112.4N49 V51 I56 M57 R91 V92 Q95N49-F53 WeakPolarHBondContact O-CB 3.42Å; N49-F53 PolarHBondContact O-N 2.75Å; V51-F53 VanDerWaalsContact C-N 3.27Å; V51-F53 PolarHBondContact O-N 3Å; F53-I56 PolarHBondContact O-N 2.91Å; F53-M57 HydrophobicContact CD2-CG 4.39Å; F53-M57 HydrophobicContact CE1-CG 4.14Å; F53-M57 HydrophobicContact CE2-CG 4.01Å; F53-M57 HydrophobicContact CZ-CG 3.87Å; F53-M57 WeakPolarHBondContact O-CB 3.11Å; F53-M57 WeakPolarHBondContact O-CG 3.31Å; F53-M57 PolarHBondContact O-N 3.15Å; F53-R91 HydrophobicContact CD2-CB 4.34Å; F53-R91 HydrophobicContact CE1-CB 4.39Å; F53-R91 HydrophobicContact CE2-CB 3.56Å; F53-R91 HydrophobicContact CZ-CB 3.59Å; F53-V92 HydrophobicContact CD2-CG2 4.24Å; F53-V92 HydrophobicContact CE2-CB 4.45Å; F53-V92 HydrophobicContact CE2-CG2 3.69Å; F53-Q95 HydrophobicContact CE1-CG 4.39Å; F53-Q95 HydrophobicContact CZ-CG 4.08Å
54S92.6Very high93.1Very high72 Ų7246.5 Ų46.550%0.50324%0.244SC..Hα-helixtrans-68.7-40.4-176.6-54.60000111.3V50 V51 A52 S58V50-S54 PolarHBondContact O-OG 3.39Å; V50-S54 VanDerWaalsContact O-OG 3.14Å; V51-S54 WeakPolarHBondContact O-CB 3.38Å; V51-S54 PolarHBondContact O-N 2.98Å; A52-S54 VanDerWaalsContact C-N 3.29Å; A52-S54 PolarHBondContact O-N 3.08Å; S54-S58 WeakPolarHBondContact O-CB 3.23Å; S54-S58 PolarHBondContact O-N 3.02Å
55E93.3Very high93Very high56 Ų5651.8 Ų51.826%0.26227%0.272SS..Hα-helixtrans-64.3-46.2174.1-61.3176.2153.300111.8S18 E21 V51 A52 M59S18-E55 VanDerWaalsContact CB-CD 3.45Å; S18-E55 WeakPolarHBondContact CB-OE1 3.47Å; S18-E55 WeakPolarHBondContact CB-OE2 3.35Å; S18-E55 PolarHBondContact OG-OE2 3.23Å; E21-E55 HydrophobicContact CG-CB 3.92Å; V51-E55 PolarHBondContact O-N 3.06Å; A52-E55 PolarHBondContact O-N 3.29Å; E55-M59 VanDerWaalsContact O-CB 3.26Å; E55-M59 WeakPolarHBondContact O-CB 3.32Å; E55-M59 PolarHBondContact O-N 3.13Å
56I94.4Very high92.9Very high0 Ų049.4 Ų49.40%026%0.259CS..Hα-helixtrans-59.5-54.3178.1-72163000110A20 V24 I43 L46 T47 A52 F53 S58 M59 V60 L84A20-I56 HydrophobicContact CB-CD1 4.17Å; A20-I56 HydrophobicContact CB-CG1 3.95Å; V24-I56 HydrophobicContact CG2-CB 4.1Å; V24-I56 HydrophobicContact CG2-CG1 3.79Å; V24-I56 HydrophobicContact CG2-CG2 3.85Å; I43-I56 HydrophobicContact CG2-CD1 4Å; I43-I56 HydrophobicContact CG2-CG1 4.24Å; I43-I56 HydrophobicContact CG2-CG2 4.01Å; L46-I56 HydrophobicContact CB-CD1 3.86Å; T47-I56 HydrophobicContact CG2-CD1 3.85Å; T47-I56 HydrophobicContact CG2-CG2 4.02Å; A52-I56 HydrophobicContact CB-CD1 4.37Å; A52-I56 WeakPolarHBondContact O-CB 3.42Å; A52-I56 WeakPolarHBondContact O-CD1 3.45Å; A52-I56 WeakPolarHBondContact O-CG1 3.33Å; A52-I56 PolarHBondContact O-N 3.2Å; F53-I56 PolarHBondContact O-N 2.91Å; I56-S58 PolarHBondContact O-N 3.43Å; I56-M59 PolarHBondContact O-N 2.73Å; I56-V60 HydrophobicContact CG2-CG2 4.38Å; I56-V60 WeakPolarHBondContact O-CG2 3.47Å; I56-V60 PolarHBondContact O-N 3.04Å; I56-L84 HydrophobicContact CG2-CD1 3.95Å
57M93.6Very high92.5Very high5 Ų552.7 Ų52.73%0.02527%0.274CS..Hα-helixtrans-63.5-44.9-177.3-69-58.9-70.400111.7F53 M59 V60 W61 M81 V92 Q95F53-M57 HydrophobicContact CD2-CG 4.39Å; F53-M57 HydrophobicContact CE1-CG 4.14Å; F53-M57 HydrophobicContact CE2-CG 4.01Å; F53-M57 HydrophobicContact CZ-CG 3.87Å; F53-M57 WeakPolarHBondContact O-CB 3.11Å; F53-M57 WeakPolarHBondContact O-CG 3.31Å; F53-M57 PolarHBondContact O-N 3.15Å; M57-M59 VanDerWaalsContact C-N 3.32Å; M57-M59 PolarHBondContact O-N 3.09Å; M57-V60 PolarHBondContact O-N 3.11Å; M57-W61 HydrophobicContact CE-CZ2 4.38Å; M57-W61 PolarHBondContact O-N 2.91Å; M57-M81 HydrophobicContact CE-CE 4.38Å; M57-V92 HydrophobicContact CE-CG1 4.28Å; M57-V92 HydrophobicContact SD-CG1 3.94Å; M57-V92 HydrophobicContact SD-CG2 4.31Å; M57-Q95 HydrophobicContact CE-CB 3.93Å
58S93.1Very high92.2Very high77 Ų7753.9 Ų53.954%0.53829%0.286SS..Hα-helixtrans-56-45.7174.7-179.90000111.9S54 I56 K62S54-S58 WeakPolarHBondContact O-CB 3.23Å; S54-S58 PolarHBondContact O-N 3.02Å; I56-S58 PolarHBondContact O-N 3.43Å; S58-K62 VanDerWaalsContact O-CB 3.27Å; S58-K62 WeakPolarHBondContact O-CB 3.32Å; S58-K62 PolarHBondContact O-N 3.39Å; S58-K62 VanDerWaalsContact O-N 3.09Å
59M92.9Very high91.9Very high8 Ų855.6 Ų55.64%0.03930%0.296CS..Hα-helixtrans-70.6-35.9179.3-168.158.859.100112.8Y17 E21 V24 R25 E55 I56 M57 R63Y17-M59 HydrophobicContact CD1-CE 4.48Å; Y17-M59 HydrophobicContact CE1-CE 4.24Å; E21-M59 HydrophobicContact CB-CE 4.27Å; E21-M59 HydrophobicContact CG-CE 4.13Å; E21-M59 WeakPolarHBondContact OE1-CE 3.3Å; V24-M59 HydrophobicContact CB-CB 4.47Å; V24-M59 HydrophobicContact CB-CG 4.22Å; V24-M59 HydrophobicContact CG1-CB 3.92Å; V24-M59 HydrophobicContact CG1-CG 3.7Å; R25-M59 VanDerWaalsContact CD-SD 3.53Å; R25-M59 HydrophobicContact CG-CE 4.29Å; R25-M59 HydrophobicContact CG-CG 3.59Å; R25-M59 HydrophobicContact CG-SD 3.47Å; R25-M59 WeakPolarHBondContact CG-SD 3.43Å; E55-M59 VanDerWaalsContact O-CB 3.26Å; E55-M59 WeakPolarHBondContact O-CB 3.32Å; E55-M59 PolarHBondContact O-N 3.13Å; I56-M59 PolarHBondContact O-N 2.73Å; M57-M59 VanDerWaalsContact C-N 3.32Å; M57-M59 PolarHBondContact O-N 3.09Å; M59-R63 WeakPolarHBondContact O-CG 3.27Å; M59-R63 PolarHBondContact O-N 3.42Å
60V94.9Very high91.7Very high0 Ų053.6 Ų53.60%029%0.285CS..Hα-helixtrans-67.2-501751740000110.7V24 I56 M57 K62 R63 L64 A77 L80 M81V24-V60 HydrophobicContact CG1-CG2 3.68Å; I56-V60 HydrophobicContact CG2-CG2 4.38Å; I56-V60 WeakPolarHBondContact O-CG2 3.47Å; I56-V60 PolarHBondContact O-N 3.04Å; M57-V60 PolarHBondContact O-N 3.11Å; V60-K62 VanDerWaalsContact C-N 3.28Å; V60-K62 PolarHBondContact O-N 2.95Å; V60-R63 CarbonylContact O-C 3.55Å; V60-R63 WeakPolarHBondContact O-CA 3.11Å; V60-R63 PolarHBondContact O-N 3.01Å; V60-L64 WeakPolarHBondContact O-CB 3.35Å; V60-L64 PolarHBondContact O-N 2.87Å; V60-A77 HydrophobicContact CG1-CB 4.33Å; V60-L80 HydrophobicContact CG2-CD2 3.87Å; V60-M81 HydrophobicContact CG1-CB 4.31Å; V60-M81 HydrophobicContact CG1-CE 3.85Å
61W93.7Very high91.7Very high44 Ų4450.4 Ų50.417%0.16726%0.264CS..Hα-helixtrans-57.1-41.3177.6-72.8124.6000112.2M57 R63 L64 N65 M81 N99 A102 V103M57-W61 HydrophobicContact CE-CZ2 4.38Å; M57-W61 PolarHBondContact O-N 2.91Å; W61-R63 PolarHBondContact O-N 3.19Å; W61-L64 HydrophobicContact CE3-CB 4.48Å; W61-L64 HydrophobicContact CE3-CD1 3.92Å; W61-L64 HydrophobicContact CE3-CD2 4.11Å; W61-L64 HydrophobicContact CE3-CG 4.41Å; W61-L64 HydrophobicContact CZ3-CD1 3.81Å; W61-L64 HydrophobicContact CZ3-CD2 4.11Å; W61-L64 PolarHBondContact O-N 2.96Å; W61-N65 PolarHBondContact O-N 3.36Å; W61-M81 HydrophobicContact CD2-CE 4.1Å; W61-M81 HydrophobicContact CE3-CE 4.07Å; W61-M81 HydrophobicContact CH2-CE 3.69Å; W61-M81 HydrophobicContact CH2-SD 4.3Å; W61-M81 HydrophobicContact CZ2-CE 3.72Å; W61-M81 HydrophobicContact CZ3-CE 3.87Å; W61-M81 HydrophobicContact CZ3-SD 4.5Å; W61-N99 HydrophobicContact CH2-CB 3.82Å; W61-N99 HydrophobicContact CZ2-CB 3.7Å; W61-A102 HydrophobicContact CE3-CB 4.34Å; W61-A102 HydrophobicContact CZ3-CB 3.85Å; W61-V103 HydrophobicContact CH2-CG2 3.75Å; W61-V103 HydrophobicContact CZ3-CG2 3.92Å
62K93.3Very high91.9Very high141 Ų14149 Ų4961%0.61325%0.248SC*.Hα-helixtrans-61.7-22.7175.6-172.8170.1-172.3164.80114.3S58 V60S58-K62 VanDerWaalsContact O-CB 3.27Å; S58-K62 WeakPolarHBondContact O-CB 3.32Å; S58-K62 PolarHBondContact O-N 3.39Å; S58-K62 VanDerWaalsContact O-N 3.09Å; V60-K62 VanDerWaalsContact C-N 3.28Å; V60-K62 PolarHBondContact O-N 2.95Å
63R93.6Very high91.9Very high29 Ų2949.9 Ų49.911%0.10925%0.251CS..Hα-helixtrans-99.9-23.8177.1-63.6-65.5-148.8130.725.2113.2R25 T28 M59 V60 W61 N65 D66 H73 A77R25-R63 PolarHBondContact O-NH2 3.17Å; T28-R63 HydrophobicContact CG2-CB 4.36Å; T28-R63 HydrophobicContact CG2-CG 4.46Å; T28-R63 PolarHBondContact O-NH2 3Å; T28-R63 PolarHBondContact OG1-NE 3.41Å; T28-R63 PolarHBondContact OG1-NH2 3.01Å; M59-R63 WeakPolarHBondContact O-CG 3.27Å; M59-R63 PolarHBondContact O-N 3.42Å; V60-R63 CarbonylContact O-C 3.55Å; V60-R63 WeakPolarHBondContact O-CA 3.11Å; V60-R63 PolarHBondContact O-N 3.01Å; W61-R63 PolarHBondContact O-N 3.19Å; R63-N65 VanDerWaalsContact C-N 3.3Å; R63-D66 WeakPolarHBondContact O-CB 3.1Å; R63-D66 PolarHBondContact O-N 3.41Å; R63-H73 PolarHBondContact NH1-CD2 2.98Å; R63-H73 PolarHBondContact NH1-CE1 2.94Å; R63-H73 PolarHBondContact NH1-ND1 2.96Å; R63-H73 VanDerWaalsContact NH1-ND1 3.11Å; R63-H73 PolarHBondContact NH1-NE2 3.37Å; R63-A77 HydrophobicContact CB-CB 3.91Å
64L92.5Very high91.9Very high3 Ų349 Ų492%0.01625%0.247CC..Hα-helixtrans-68.5-34.5171-167.5151000110.1V60 W61 D66 A77 M81 A102 L106V60-L64 WeakPolarHBondContact O-CB 3.35Å; V60-L64 PolarHBondContact O-N 2.87Å; W61-L64 HydrophobicContact CE3-CB 4.48Å; W61-L64 HydrophobicContact CE3-CD1 3.92Å; W61-L64 HydrophobicContact CE3-CD2 4.11Å; W61-L64 HydrophobicContact CE3-CG 4.41Å; W61-L64 HydrophobicContact CZ3-CD1 3.81Å; W61-L64 HydrophobicContact CZ3-CD2 4.11Å; W61-L64 PolarHBondContact O-N 2.96Å; L64-D66 VanDerWaalsContact C-N 3.34Å; L64-D66 PolarHBondContact O-N 3.24Å; L64-A77 HydrophobicContact CB-CB 4.34Å; L64-M81 HydrophobicContact CD1-CE 3.81Å; L64-M81 HydrophobicContact CD1-SD 3.69Å; L64-A102 WeakPolarHBondContact CD2-O 3.26Å; L64-L106 HydrophobicContact CD1-CD1 4.43Å; L64-L106 HydrophobicContact CD2-CD1 3.45Å; L64-L106 VanDerWaalsContact CD2-CD1 3.45Å; L64-L106 HydrophobicContact CD2-CG 4.09Å; L64-L106 HydrophobicContact CG-CD1 3.62Å
65N91.6Very high92Very high110 Ų11049.6 Ų49.659%0.58824%0.239SC*.THydrogen-bonded Turntrans-89.822.5173.9-154.358.3000114.8W61 R63 H67W61-N65 PolarHBondContact O-N 3.36Å; R63-N65 VanDerWaalsContact C-N 3.3Å; N65-H67 PolarHBondContact OD1-CE1 2.98Å
66D90.9Very high92Very high34 Ų3447.2 Ų47.218%0.18223%0.228CC..  trans-77.2152.9165.3-114-43.5000109.7R63 L64 N70 H73 V74R63-D66 WeakPolarHBondContact O-CB 3.1Å; R63-D66 PolarHBondContact O-N 3.41Å; L64-D66 VanDerWaalsContact C-N 3.34Å; L64-D66 PolarHBondContact O-N 3.24Å; D66-N70 HydrophobicContact CB-CB 3.9Å; D66-N70 WeakPolarHBondContact OD1-CB 3.3Å; D66-N70 PolarHBondContact OD1-ND2 3.45Å; D66-H73 HydrophobicContact CB-CB 4.11Å; D66-H73 WeakPolarHBondContact OD2-CB 3.37Å; D66-H73 IonicContact OD2-CE1 3.34Å; D66-H73 IonicContact OD2-CG 2.69Å; D66-H73 IonicContact OD2-ND1 3.3Å; D66-H73 PolarHBondContact OD2-ND1 3.01Å; D66-V74 HydrophobicContact CB-CG2 3.94Å; D66-V74 WeakPolarHBondContact O-CG2 3.45Å
67H86.4Confident92Very high114 Ų11447.2 Ų47.253%0.52823%0.228SC..  trans-134.4160.5-174.6-60.7-20000113.9N65 K69 N70N65-H67 PolarHBondContact OD1-CE1 2.98Å; H67-K69 PolarHBondContact O-N 3.14Å; H67-N70 PolarHBondContact O-N 2.88Å
68G86.6Confident92Very high26 Ų2647 Ų4727%0.26823%0.226SC..G310 helixtrans58.4-122.2173.400000113.4N70 W71G68-N70 PolarHBondContact O-N 3.49Å; G68-W71 WeakPolarHBondContact O-CB 3.22Å; G68-W71 PolarHBondContact O-N 3Å
69K86.8Confident92.1Very high156 Ų15644.4 Ų44.468%0.67821%0.207SC*.G310 helixtrans-55.3-18-179.472.9-174.3-179.1-172.80114.8H67 W71H67-K69 PolarHBondContact O-N 3.14Å; K69-W71 VanDerWaalsContact C-N 3.31Å
70N89.9Confident92.2Very high43 Ų4344 Ų4423%0.2321%0.205CC..G310 helixtrans-89.113.5176.8-69.10.6000112.9D66 H67 G68 R72 H73D66-N70 HydrophobicContact CB-CB 3.9Å; D66-N70 WeakPolarHBondContact OD1-CB 3.3Å; D66-N70 PolarHBondContact OD1-ND2 3.45Å; H67-N70 PolarHBondContact O-N 2.88Å; G68-N70 PolarHBondContact O-N 3.49Å; N70-R72 PolarHBondContact O-N 2.76Å; N70-H73 WeakPolarHBondContact O-CB 3.32Å; N70-H73 PolarHBondContact O-N 3.43Å
71W91Very high92.1Very high18 Ų1844 Ų447%0.06821%0.206CC..Hα-helixtrans-48.3-30.5-178.968.2-95.7000114.7G68 K69 H73 V74 Y75 F109 Y111 Q119G68-W71 WeakPolarHBondContact O-CB 3.22Å; G68-W71 PolarHBondContact O-N 3Å; K69-W71 VanDerWaalsContact C-N 3.31Å; W71-H73 VanDerWaalsContact C-N 3.33Å; W71-H73 PolarHBondContact O-N 3.48Å; W71-V74 WeakPolarHBondContact O-CB 3.48Å; W71-V74 PolarHBondContact O-N 3.03Å; W71-Y75 WeakPolarHBondContact O-CB 3.42Å; W71-Y75 PolarHBondContact O-N 2.9Å; W71-F109 HydrophobicContact CB-CE1 3.87Å; W71-F109 HydrophobicContact CB-CZ 3.85Å; W71-Y111 HydrophobicContact CB-CD1 4.39Å; W71-Y111 AromaticContact CD1-CD1 3.24Å; W71-Y111 AromaticContact CD1-CE1 3.34Å; W71-Y111 AromaticContact CG-CD1 3.95Å; W71-Y111 HydrophobicContact CG-CD1 3.95Å; W71-Y111 HydrophobicContact CG-CE1 4.42Å; W71-Y111 AromaticContact NE1-CD1 3.76Å; W71-Y111 AromaticContact NE1-CE1 3.56Å; W71-Q119 HydrophobicContact CD2-CB 3.74Å; W71-Q119 HydrophobicContact CD2-CG 4.33Å; W71-Q119 HydrophobicContact CE3-CB 4.07Å; W71-Q119 HydrophobicContact CG-CB 4.2Å; W71-Q119 HydrophobicContact CH2-CB 4.16Å; W71-Q119 HydrophobicContact CH2-CG 4.29Å; W71-Q119 HydrophobicContact CZ2-CB 3.84Å; W71-Q119 HydrophobicContact CZ2-CG 3.65Å; W71-Q119 HydrophobicContact CZ3-CB 4.28Å
72R92.7Very high92.1Very high70 Ų7044 Ų4426%0.26421%0.207SC..Hα-helixtrans-63-36.6175-63.2-175.3179.4-82.5-1112.6N30 P32 N70 K76N30-R72 WeakPolarHBondContact O-CD 3.35Å; P32-R72 PolarHBondContact O-NH1 3Å; N70-R72 PolarHBondContact O-N 2.76Å; R72-K76 WeakPolarHBondContact O-CB 3.41Å; R72-K76 VanDerWaalsContact O-CG 3.29Å; R72-K76 WeakPolarHBondContact O-CG 3.43Å; R72-K76 PolarHBondContact O-N 3.09Å
73H93.1Very high92.2Very high23 Ų2339.8 Ų39.811%0.10619%0.188CC..Hα-helixtrans-63.4-45173.8-61.3158.9000110.8T28 R63 D66 N70 W71 A77T28-H73 PolarHBondContact O-CD2 3.03Å; T28-H73 VanDerWaalsContact O-CD2 3.23Å; R63-H73 PolarHBondContact NH1-CD2 2.98Å; R63-H73 PolarHBondContact NH1-CE1 2.94Å; R63-H73 PolarHBondContact NH1-ND1 2.96Å; R63-H73 VanDerWaalsContact NH1-ND1 3.11Å; R63-H73 PolarHBondContact NH1-NE2 3.37Å; D66-H73 HydrophobicContact CB-CB 4.11Å; D66-H73 WeakPolarHBondContact OD2-CB 3.37Å; D66-H73 IonicContact OD2-CE1 3.34Å; D66-H73 IonicContact OD2-CG 2.69Å; D66-H73 IonicContact OD2-ND1 3.3Å; D66-H73 PolarHBondContact OD2-ND1 3.01Å; N70-H73 WeakPolarHBondContact O-CB 3.32Å; N70-H73 PolarHBondContact O-N 3.43Å; W71-H73 VanDerWaalsContact C-N 3.33Å; W71-H73 PolarHBondContact O-N 3.48Å; H73-A77 WeakPolarHBondContact O-CB 3.5Å; H73-A77 PolarHBondContact O-N 3.22Å
74V93.4Very high92.2Very high0 Ų038.4 Ų38.40%018%0.183CC..Hα-helixtrans-60.5-56.2177.6-172.20000110.2D66 W71 K76 A77 M78 L106 F109 V123D66-V74 HydrophobicContact CB-CG2 3.94Å; D66-V74 WeakPolarHBondContact O-CG2 3.45Å; W71-V74 WeakPolarHBondContact O-CB 3.48Å; W71-V74 PolarHBondContact O-N 3.03Å; V74-K76 VanDerWaalsContact C-N 3.31Å; V74-K76 PolarHBondContact O-N 2.98Å; V74-A77 WeakPolarHBondContact O-CB 3.28Å; V74-A77 PolarHBondContact O-N 2.97Å; V74-M78 HydrophobicContact CG1-CG 4.44Å; V74-M78 WeakPolarHBondContact O-CG 3.28Å; V74-M78 PolarHBondContact O-N 3.16Å; V74-L106 HydrophobicContact CG1-CD1 3.61Å; V74-L106 HydrophobicContact CG1-CD2 4.01Å; V74-L106 HydrophobicContact CG1-CG 4.46Å; V74-F109 HydrophobicContact CG2-CE2 4.03Å; V74-F109 HydrophobicContact CG2-CZ 4.32Å; V74-V123 HydrophobicContact CG1-CG1 3.78Å
75Y93.6Very high92.3Very high84 Ų8438.3 Ų38.333%0.32918%0.182SC..Hα-helixtrans-57.4-41.2-178.2-176.1-102.1000112.9W71 T79 N122 V123 K126W71-Y75 WeakPolarHBondContact O-CB 3.42Å; W71-Y75 PolarHBondContact O-N 2.9Å; Y75-T79 WeakPolarHBondContact O-CB 3.2Å; Y75-T79 PolarHBondContact O-N 2.93Å; Y75-T79 PolarHBondContact O-OG1 2.76Å; Y75-N122 HydrophobicContact CD2-CB 4.15Å; Y75-N122 HydrophobicContact CE2-CB 3.94Å; Y75-V123 HydrophobicContact CD2-CG2 4.36Å; Y75-K126 HydrophobicContact CE2-CB 4.32Å; Y75-K126 HydrophobicContact CE2-CD 3.93Å
76K94.1Very high92.4Very high7 Ų734.8 Ų34.83%0.0316%0.162CC..Hα-helixtrans-73.9-34.4175.4-66.1-168-154.6-173.50113A27 S29 D31 W33 R72 V74 T79 L80A27-K76 WeakPolarHBondContact O-CB 3.22Å; A27-K76 WeakPolarHBondContact O-CD 3.16Å; S29-K76 WeakPolarHBondContact O-CD 3.33Å; S29-K76 WeakPolarHBondContact O-CE 3.27Å; S29-K76 PolarHBondContact O-NZ 3.08Å; S29-K76 PolarHBondContact OG-NZ 2.76Å; D31-K76 VanDerWaalsContact O-CE 3.27Å; D31-K76 WeakPolarHBondContact O-CE 3.47Å; D31-K76 PolarHBondContact O-NZ 2.86Å; W33-K76 WeakPolarHBondContact O-CE 3.48Å; W33-K76 PolarHBondContact O-NZ 3.09Å; R72-K76 WeakPolarHBondContact O-CB 3.41Å; R72-K76 VanDerWaalsContact O-CG 3.29Å; R72-K76 WeakPolarHBondContact O-CG 3.43Å; R72-K76 PolarHBondContact O-N 3.09Å; V74-K76 VanDerWaalsContact C-N 3.31Å; V74-K76 PolarHBondContact O-N 2.98Å; K76-T79 PolarHBondContact O-N 3.41Å; K76-L80 WeakPolarHBondContact O-CB 3.38Å; K76-L80 PolarHBondContact O-N 3.18Å
77A95.1Very high92.5Very high0 Ų033.3 Ų33.30%015%0.154CC..Hα-helixtrans-64.1-42173.300000111.3T28 V60 R63 L64 H73 V74 L80 M81T28-A77 HydrophobicContact CG2-CB 4.03Å; V60-A77 HydrophobicContact CG1-CB 4.33Å; R63-A77 HydrophobicContact CB-CB 3.91Å; L64-A77 HydrophobicContact CB-CB 4.34Å; H73-A77 WeakPolarHBondContact O-CB 3.5Å; H73-A77 PolarHBondContact O-N 3.22Å; V74-A77 WeakPolarHBondContact O-CB 3.28Å; V74-A77 PolarHBondContact O-N 2.97Å; A77-L80 PolarHBondContact O-N 3.05Å; A77-M81 VanDerWaalsContact O-CB 3.27Å; A77-M81 WeakPolarHBondContact O-CB 3.45Å; A77-M81 PolarHBondContact O-N 3.39Å
78M93.2Very high92.7Very high0 Ų027.9 Ų27.90%013%0.129CC..Hα-helixtrans-63.9-41172.1-60.3-156.380.300112.3V74 M81 E82 V103 L106 V123 K126 A127 L130V74-M78 HydrophobicContact CG1-CG 4.44Å; V74-M78 WeakPolarHBondContact O-CG 3.28Å; V74-M78 PolarHBondContact O-N 3.16Å; M78-M81 PolarHBondContact O-N 3.33Å; M78-E82 WeakPolarHBondContact O-CB 3.31Å; M78-E82 PolarHBondContact O-N 3.06Å; M78-V103 HydrophobicContact CE-CG1 3.88Å; M78-L106 HydrophobicContact CE-CB 4.37Å; M78-L106 HydrophobicContact CE-CD1 3.94Å; M78-L106 HydrophobicContact CG-CD1 3.91Å; M78-L106 HydrophobicContact SD-CB 4.16Å; M78-L106 HydrophobicContact SD-CD1 3.5Å; M78-L106 WeakPolarHBondContact SD-CD1 3.32Å; M78-V123 HydrophobicContact SD-CG1 4.07Å; M78-K126 HydrophobicContact CB-CG 4.16Å; M78-A127 VanDerWaalsContact CE-CA 3.47Å; M78-A127 HydrophobicContact CE-CB 3.64Å; M78-A127 HydrophobicContact SD-CB 4.05Å; M78-L130 HydrophobicContact CE-CB 4.45Å; M78-L130 HydrophobicContact CE-CD2 3.77Å
79T94.3Very high93Very high22 Ų2227.3 Ų27.314%0.13512%0.12CC..Hα-helixtrans-64.6-41.6177.1-62.50000112.3P35 M40 Y75 K76 Y83 K126P35-T79 HydrophobicContact CG-CG2 3.96Å; M40-T79 HydrophobicContact SD-CG2 4.34Å; Y75-T79 WeakPolarHBondContact O-CB 3.2Å; Y75-T79 PolarHBondContact O-N 2.93Å; Y75-T79 PolarHBondContact O-OG1 2.76Å; K76-T79 PolarHBondContact O-N 3.41Å; T79-Y83 PolarHBondContact O-N 2.82Å; T79-K126 WeakPolarHBondContact OG1-CE 3.37Å; T79-K126 PolarHBondContact OG1-NZ 2.84Å
80L94.9Very high93.2Very high0 Ų026.5 Ų26.50%012%0.119CC..Hα-helixtrans-65.5-47.2172.9179.462.5000110.8V24 A27 T28 M40 I43 V60 K76 A77 E82 Y83 L84V24-L80 HydrophobicContact CG1-CD2 4.1Å; V24-L80 HydrophobicContact CG2-CD2 4.3Å; A27-L80 HydrophobicContact CB-CD1 4.48Å; A27-L80 HydrophobicContact CB-CD2 4.02Å; T28-L80 HydrophobicContact CG2-CD2 4.33Å; M40-L80 HydrophobicContact CB-CD1 4.38Å; M40-L80 HydrophobicContact CG-CD1 4.01Å; I43-L80 HydrophobicContact CB-CD1 4.32Å; I43-L80 HydrophobicContact CD1-CD1 3.91Å; I43-L80 HydrophobicContact CD1-CD2 4.13Å; I43-L80 HydrophobicContact CG2-CD1 4.24Å; V60-L80 HydrophobicContact CG2-CD2 3.87Å; K76-L80 WeakPolarHBondContact O-CB 3.38Å; K76-L80 PolarHBondContact O-N 3.18Å; A77-L80 PolarHBondContact O-N 3.05Å; L80-E82 PolarHBondContact O-N 3.14Å; L80-Y83 PolarHBondContact O-N 3.38Å; L80-Y83 VanDerWaalsContact O-N 3.15Å; L80-L84 HydrophobicContact CD1-CD1 4.12Å; L80-L84 HydrophobicContact CD1-CD2 4.29Å; L80-L84 HydrophobicContact CD1-CG 3.99Å; L80-L84 HydrophobicContact CD2-CD1 4.49Å; L80-L84 HydrophobicContact CG-CD1 3.87Å; L80-L84 HydrophobicContact CG-CG 4.16Å; L80-L84 WeakPolarHBondContact O-CB 3.22Å; L80-L84 VanDerWaalsContact O-CG 3.25Å; L80-L84 WeakPolarHBondContact O-CG 3.29Å; L80-L84 PolarHBondContact O-N 3.33Å
81M94.4Very high93.3Very high1 Ų131.1 Ų31.11%0.00513%0.133CC..Hα-helixtrans-58.1-45.5179.3-179.1172.4-87.600112.3M57 V60 W61 L64 A77 M78 Y83 L84 I85 V103 L130M57-M81 HydrophobicContact CE-CE 4.38Å; V60-M81 HydrophobicContact CG1-CB 4.31Å; V60-M81 HydrophobicContact CG1-CE 3.85Å; W61-M81 HydrophobicContact CD2-CE 4.1Å; W61-M81 HydrophobicContact CE3-CE 4.07Å; W61-M81 HydrophobicContact CH2-CE 3.69Å; W61-M81 HydrophobicContact CH2-SD 4.3Å; W61-M81 HydrophobicContact CZ2-CE 3.72Å; W61-M81 HydrophobicContact CZ3-CE 3.87Å; W61-M81 HydrophobicContact CZ3-SD 4.5Å; L64-M81 HydrophobicContact CD1-CE 3.81Å; L64-M81 HydrophobicContact CD1-SD 3.69Å; A77-M81 VanDerWaalsContact O-CB 3.27Å; A77-M81 WeakPolarHBondContact O-CB 3.45Å; A77-M81 PolarHBondContact O-N 3.39Å; M78-M81 PolarHBondContact O-N 3.33Å; M81-Y83 PolarHBondContact O-N 3.02Å; M81-L84 PolarHBondContact O-N 3.23Å; M81-I85 HydrophobicContact CG-CD1 3.9Å; M81-I85 WeakPolarHBondContact O-CD1 3.43Å; M81-I85 VanDerWaalsContact O-CG1 3.3Å; M81-I85 WeakPolarHBondContact O-CG1 3.39Å; M81-I85 PolarHBondContact O-N 3.35Å; M81-V103 HydrophobicContact SD-CG2 4.38Å; M81-L130 HydrophobicContact CG-CD2 4.23Å; M81-L130 HydrophobicContact SD-CD2 4.15Å
82E93.6Very high93.4Very high44 Ų4430.3 Ų30.321%0.20613%0.13CC..Hα-helixtrans-56-48.3173.6-170.3-152.1157.500111.6M78 L80 L84 I85 K86 K126 L130M78-E82 WeakPolarHBondContact O-CB 3.31Å; M78-E82 PolarHBondContact O-N 3.06Å; L80-E82 PolarHBondContact O-N 3.14Å; E82-L84 PolarHBondContact O-N 3.23Å; E82-I85 PolarHBondContact O-N 3.12Å; E82-K86 HydrophobicContact CG-CD 4.42Å; E82-K86 WeakPolarHBondContact O-CG 3.03Å; E82-K86 PolarHBondContact O-N 3.27Å; E82-K86 VanDerWaalsContact O-N 3.1Å; E82-K86 WeakPolarHBondContact OE1-CE 3.43Å; E82-K86 IonicContact OE1-NZ 2.72Å; E82-K86 PolarHBondContact OE1-NZ 2.96Å; E82-K126 WeakPolarHBondContact OE2-CE 3.37Å; E82-K126 IonicContact OE2-NZ 2.76Å; E82-K126 PolarHBondContact OE2-NZ 3.4Å; E82-L130 HydrophobicContact CB-CD1 4.09Å; E82-L130 HydrophobicContact CG-CD1 4.26Å
83Y94.3Very high93.4Very high51 Ų5127.2 Ų27.220%0.212%0.12CC..Hα-helixtrans-64.5-39.4179.4-173.8-90.4000112.5M40 S41 A44 T79 L80 M81 K86 T87M40-Y83 VanDerWaalsContact C-CE1 3.43Å; M40-Y83 HydrophobicContact CB-CD1 3.6Å; M40-Y83 HydrophobicContact CB-CE1 3.8Å; M40-Y83 HydrophobicContact CB-CG 4.04Å; M40-Y83 WeakPolarHBondContact O-CE1 3.3Å; M40-Y83 HydrophobicContact SD-CG 4.33Å; S41-Y83 PolarHBondContact OG-OH 3.07Å; S41-Y83 VanDerWaalsContact OG-OH 3.07Å; A44-Y83 HydrophobicContact CB-CD1 4.35Å; A44-Y83 HydrophobicContact CB-CE1 3.95Å; T79-Y83 PolarHBondContact O-N 2.82Å; L80-Y83 PolarHBondContact O-N 3.38Å; L80-Y83 VanDerWaalsContact O-N 3.15Å; M81-Y83 PolarHBondContact O-N 3.02Å; Y83-K86 PolarHBondContact O-N 3.38Å; Y83-T87 WeakPolarHBondContact CD1-OG1 3.45Å; Y83-T87 HydrophobicContact CE1-CG2 4.34Å; Y83-T87 WeakPolarHBondContact CE1-OG1 3.11Å; Y83-T87 HydrophobicContact CE2-CG2 4.09Å; Y83-T87 PolarHBondContact O-N 3.48Å; Y83-T87 PolarHBondContact O-OG1 3.27Å
84L94.1Very high93.3Very high1 Ų129.8 Ų29.81%0.00513%0.132CC..Hα-helixtrans-68.1-34.3177.4-66.8179000112.5I43 A44 T47 I56 L80 M81 E82 G88 V92I43-L84 HydrophobicContact CB-CD2 4.4Å; I43-L84 HydrophobicContact CG2-CD1 4.22Å; I43-L84 HydrophobicContact CG2-CD2 3.95Å; A44-L84 HydrophobicContact CB-CD2 3.75Å; T47-L84 HydrophobicContact CG2-CD1 4.3Å; T47-L84 HydrophobicContact CG2-CD2 3.97Å; I56-L84 HydrophobicContact CG2-CD1 3.95Å; L80-L84 HydrophobicContact CD1-CD1 4.12Å; L80-L84 HydrophobicContact CD1-CD2 4.29Å; L80-L84 HydrophobicContact CD1-CG 3.99Å; L80-L84 HydrophobicContact CD2-CD1 4.49Å; L80-L84 HydrophobicContact CG-CD1 3.87Å; L80-L84 HydrophobicContact CG-CG 4.16Å; L80-L84 WeakPolarHBondContact O-CB 3.22Å; L80-L84 VanDerWaalsContact O-CG 3.25Å; L80-L84 WeakPolarHBondContact O-CG 3.29Å; L80-L84 PolarHBondContact O-N 3.33Å; M81-L84 PolarHBondContact O-N 3.23Å; E82-L84 PolarHBondContact O-N 3.23Å; L84-G88 WeakPolarHBondContact O-CA 3.42Å; L84-G88 PolarHBondContact O-N 3.26Å; L84-V92 HydrophobicContact CB-CG1 3.88Å; L84-V92 HydrophobicContact CB-CG2 4.35Å
85I94.1Very high93.3Very high0 Ų032.9 Ų32.90%015%0.147CC..Hα-helixtrans-64.9-44.6171.9-71157.7000110.4M81 E82 V92 A93 C96 L130 L134 L140 R144M81-I85 HydrophobicContact CG-CD1 3.9Å; M81-I85 WeakPolarHBondContact O-CD1 3.43Å; M81-I85 VanDerWaalsContact O-CG1 3.3Å; M81-I85 WeakPolarHBondContact O-CG1 3.39Å; M81-I85 PolarHBondContact O-N 3.35Å; E82-I85 PolarHBondContact O-N 3.12Å; I85-V92 HydrophobicContact CG1-CG1 3.9Å; I85-A93 HydrophobicContact CG2-CB 4.17Å; I85-C96 HydrophobicContact CD1-CB 4.13Å; I85-L130 HydrophobicContact CD1-CD1 3.72Å; I85-L134 HydrophobicContact CD1-CD1 4.41Å; I85-L134 HydrophobicContact CD1-CD2 3.86Å; I85-L134 HydrophobicContact CD1-CG 4.31Å; I85-L140 HydrophobicContact CG2-CD1 3.66Å; I85-L140 HydrophobicContact CG2-CD2 4.31Å; I85-L140 HydrophobicContact CG2-CG 3.97Å; I85-R144 PolarHBondContact O-NH1 3.06Å
86K93.1Very high93.2Very high37 Ų3728.9 Ų28.916%0.16113%0.131CC..Hα-helixtrans-72.8-27.7-178.7-69.8179.8177.6-1750114.4E82 Y83 L133 E143 R144 A147E82-K86 HydrophobicContact CG-CD 4.42Å; E82-K86 WeakPolarHBondContact O-CG 3.03Å; E82-K86 PolarHBondContact O-N 3.27Å; E82-K86 VanDerWaalsContact O-N 3.1Å; E82-K86 WeakPolarHBondContact OE1-CE 3.43Å; E82-K86 IonicContact OE1-NZ 2.72Å; E82-K86 PolarHBondContact OE1-NZ 2.96Å; Y83-K86 PolarHBondContact O-N 3.38Å; K86-L133 VanDerWaalsContact CE-CD2 3.46Å; K86-L133 HydrophobicContact CG-CD2 4.33Å; K86-E143 WeakPolarHBondContact CE-OE2 3.42Å; K86-E143 IonicContact NZ-OE2 3.09Å; K86-E143 PolarHBondContact NZ-OE2 3.26Å; K86-R144 WeakPolarHBondContact O-CA 3.24Å; K86-A147 HydrophobicContact CB-CB 4.04Å
87T92.9Very high93.1Very high3 Ų332.3 Ų32.32%0.01814%0.144CC..Hα-helixtrans-136.7-21.4-171.365.90000116.4Y48 Y83 A147Y48-T87 PolarHBondContact OH-O 2.91Å; Y83-T87 WeakPolarHBondContact CD1-OG1 3.45Å; Y83-T87 HydrophobicContact CE1-CG2 4.34Å; Y83-T87 WeakPolarHBondContact CE1-OG1 3.11Å; Y83-T87 HydrophobicContact CE2-CG2 4.09Å; Y83-T87 PolarHBondContact O-N 3.48Å; Y83-T87 PolarHBondContact O-OG1 3.27Å; T87-A147 HydrophobicContact CG2-CB 3.87Å
88G91.8Very high92.9Very high0 Ų037.1 Ų37.10%017%0.166CC..SBendtrans-80.6-166.7177.300000112.4T47 Y48 L84 R144T47-G88 WeakPolarHBondContact OG1-CA 3.39Å; Y48-G88 PolarHBondContact OH-O 2.98Å; Y48-G88 VanDerWaalsContact OH-O 3.09Å; L84-G88 WeakPolarHBondContact O-CA 3.42Å; L84-G88 PolarHBondContact O-N 3.26Å; G88-R144 PolarHBondContact O-NH1 3.38Å; G88-R144 PolarHBondContact O-NH2 2.88Å
89S93.4Very high92.8Very high13 Ų1340.3 Ų40.39%0.09118%0.183CC..  trans-60.4138.8177.6-179.80000112.1T47 R91 V92T47-S89 WeakPolarHBondContact O-CB 3.27Å; T47-S89 PolarHBondContact OG1-N 3.44Å; S89-R91 PolarHBondContact O-N 2.93Å; S89-R91 VanDerWaalsContact O-N 3.09Å; S89-V92 VanDerWaalsContact O-CB 3.28Å; S89-V92 WeakPolarHBondContact O-CB 3.38Å; S89-V92 VanDerWaalsContact O-CG2 3.28Å; S89-V92 WeakPolarHBondContact O-CG2 3.44Å; S89-V92 PolarHBondContact O-N 3.2Å
90E90.8Very high92.7Very high139 Ų13940.6 Ų40.665%0.6518%0.184SC*.Hα-helixtrans-56.8-26.4177.8-175.5172.9-161.900112.9V92 A93 Q94E90-V92 PolarHBondContact O-N 3.12Å; E90-V92 VanDerWaalsContact O-N 3.13Å; E90-A93 WeakPolarHBondContact O-CB 3.38Å; E90-A93 PolarHBondContact O-N 2.85Å; E90-Q94 PolarHBondContact O-N 2.82Å
91R91.4Very high92.5Very high140 Ų14049.2 Ų49.253%0.52822%0.217SC..Hα-helixtrans-56.9-26.2172.5-60.4-176.3-177-170.20.6113.1F53 S89 Q95F53-R91 HydrophobicContact CD2-CB 4.34Å; F53-R91 HydrophobicContact CE1-CB 4.39Å; F53-R91 HydrophobicContact CE2-CB 3.56Å; F53-R91 HydrophobicContact CZ-CB 3.59Å; S89-R91 PolarHBondContact O-N 2.93Å; S89-R91 VanDerWaalsContact O-N 3.09Å; R91-Q95 PolarHBondContact O-N 3.03Å
92V93Very high92.3Very high1 Ų151.1 Ų51.11%0.00623%0.233CC..Hα-helixtrans-64.7-49174.3-179.30000109.8T47 F53 M57 L84 I85 S89 E90 Q94 Q95 C96T47-V92 HydrophobicContact CG2-CG2 4.04Å; F53-V92 HydrophobicContact CD2-CG2 4.24Å; F53-V92 HydrophobicContact CE2-CB 4.45Å; F53-V92 HydrophobicContact CE2-CG2 3.69Å; M57-V92 HydrophobicContact CE-CG1 4.28Å; M57-V92 HydrophobicContact SD-CG1 3.94Å; M57-V92 HydrophobicContact SD-CG2 4.31Å; L84-V92 HydrophobicContact CB-CG1 3.88Å; L84-V92 HydrophobicContact CB-CG2 4.35Å; I85-V92 HydrophobicContact CG1-CG1 3.9Å; S89-V92 VanDerWaalsContact O-CB 3.28Å; S89-V92 WeakPolarHBondContact O-CB 3.38Å; S89-V92 VanDerWaalsContact O-CG2 3.28Å; S89-V92 WeakPolarHBondContact O-CG2 3.44Å; S89-V92 PolarHBondContact O-N 3.2Å; E90-V92 PolarHBondContact O-N 3.12Å; E90-V92 VanDerWaalsContact O-N 3.13Å; V92-Q94 VanDerWaalsContact C-N 3.32Å; V92-Q94 PolarHBondContact O-N 2.64Å; V92-Q95 PolarHBondContact O-N 3.2Å; V92-C96 WeakPolarHBondContact O-CB 3.32Å; V92-C96 PolarHBondContact O-N 3.22Å; V92-C96 PolarHBondContact O-SG 3.35Å
93A92.3Very high92.2Very high6 Ų649 Ų495%0.0522%0.223CC..Hα-helixtrans-60-44.4178.600000110.9I85 E90 C96 R97 L140I85-A93 HydrophobicContact CG2-CB 4.17Å; E90-A93 WeakPolarHBondContact O-CB 3.38Å; E90-A93 PolarHBondContact O-N 2.85Å; A93-C96 PolarHBondContact O-N 2.83Å; A93-R97 WeakPolarHBondContact O-CG 3.2Å; A93-R97 PolarHBondContact O-N 2.96Å; A93-L140 HydrophobicContact CB-CD1 4.33Å; A93-L140 HydrophobicContact CB-CD2 4.25Å
94Q92.7Very high92.1Very high77 Ų7749 Ų4936%0.3623%0.225SC..Hα-helixtrans-58.3-52.4177.2-176.757.420.400112.6E90 V92 C96 R97 E98E90-Q94 PolarHBondContact O-N 2.82Å; V92-Q94 VanDerWaalsContact C-N 3.32Å; V92-Q94 PolarHBondContact O-N 2.64Å; Q94-C96 VanDerWaalsContact C-N 3.26Å; Q94-C96 PolarHBondContact O-N 3.3Å; Q94-R97 PolarHBondContact O-N 3.48Å; Q94-R97 VanDerWaalsContact O-N 3.08Å; Q94-E98 WeakPolarHBondContact CG-OE1 3Å; Q94-E98 PolarHBondContact NE2-OE1 3.45Å; Q94-E98 WeakPolarHBondContact O-CG 3.39Å; Q94-E98 PolarHBondContact O-N 2.86Å
95Q92.2Very high92Very high65 Ų6553.3 Ų53.330%0.30425%0.252SS..Hα-helixtrans-62.4-30.4177.6-82-89.4-79.400113.5F53 M57 R91 V92 E98 N99F53-Q95 HydrophobicContact CE1-CG 4.39Å; F53-Q95 HydrophobicContact CZ-CG 4.08Å; M57-Q95 HydrophobicContact CE-CB 3.93Å; R91-Q95 PolarHBondContact O-N 3.03Å; V92-Q95 PolarHBondContact O-N 3.2Å; Q95-E98 PolarHBondContact NE2-OE2 3.15Å; Q95-N99 WeakPolarHBondContact O-CB 3.27Å; Q95-N99 PolarHBondContact O-N 3.22Å; Q95-N99 VanDerWaalsContact O-N 3.15Å; Q95-N99 PolarHBondContact O-ND2 3.1Å
96C91.8Very high91.8Very high0 Ų053.6 Ų53.60%025%0.253CS..Hα-helixtrans-74-28.1174.9-65.30000113.1I85 V92 A93 Q94 I100 L134I85-C96 HydrophobicContact CD1-CB 4.13Å; V92-C96 WeakPolarHBondContact O-CB 3.32Å; V92-C96 PolarHBondContact O-N 3.22Å; V92-C96 PolarHBondContact O-SG 3.35Å; A93-C96 PolarHBondContact O-N 2.83Å; Q94-C96 VanDerWaalsContact C-N 3.26Å; Q94-C96 PolarHBondContact O-N 3.3Å; C96-I100 WeakPolarHBondContact O-CA 3.35Å; C96-I100 PolarHBondContact O-N 3.42Å; C96-L134 HydrophobicContact CB-CD1 3.86Å; C96-L134 HydrophobicContact CB-CD2 3.63Å; C96-L134 HydrophobicContact CB-CG 4.43Å
97R91Very high91.7Very high79 Ų7954.8 Ų54.830%0.29826%0.258SS..Hα-helixtrans-75.5-44171.6-67.4-170.9-60-174.12.4111.9A93 Q94 N99 I100 L134 E137A93-R97 WeakPolarHBondContact O-CG 3.2Å; A93-R97 PolarHBondContact O-N 2.96Å; Q94-R97 PolarHBondContact O-N 3.48Å; Q94-R97 VanDerWaalsContact O-N 3.08Å; R97-N99 PolarHBondContact O-N 3.29Å; R97-I100 VanDerWaalsContact O-CB 3.3Å; R97-I100 WeakPolarHBondContact O-CB 3.4Å; R97-I100 WeakPolarHBondContact O-CG2 3.32Å; R97-I100 PolarHBondContact O-N 2.91Å; R97-L134 HydrophobicContact CG-CD2 4.05Å; R97-E137 IonicContact CZ-OE2 3.73Å; R97-E137 IonicContact NH1-OE2 3.65Å; R97-E137 PolarHBondContact NH1-OE2 3.44Å; R97-E137 IonicContact NH2-OE2 2.72Å; R97-E137 PolarHBondContact NH2-OE2 2.83Å
98E92.9Very high91.6Very high100 Ų10060.2 Ų60.247%0.46729%0.287SS..Hα-helixtrans-57.9-37.1175.6-71163.5175.700111.9Q94 Q95Q94-E98 WeakPolarHBondContact CG-OE1 3Å; Q94-E98 PolarHBondContact NE2-OE1 3.45Å; Q94-E98 WeakPolarHBondContact O-CG 3.39Å; Q94-E98 PolarHBondContact O-N 2.86Å; Q95-E98 PolarHBondContact NE2-OE2 3.15Å
99N90.6Very high91.6Very high68 Ų6861.1 Ų61.136%0.36429%0.291SS..THydrogen-bonded Turntrans-105.124.5179.9-62.2-86.5000113.2W61 Q95 R97 Y101 A102W61-N99 HydrophobicContact CH2-CB 3.82Å; W61-N99 HydrophobicContact CZ2-CB 3.7Å; Q95-N99 WeakPolarHBondContact O-CB 3.27Å; Q95-N99 PolarHBondContact O-N 3.22Å; Q95-N99 VanDerWaalsContact O-N 3.15Å; Q95-N99 PolarHBondContact O-ND2 3.1Å; R97-N99 PolarHBondContact O-N 3.29Å; N99-Y101 PolarHBondContact O-N 3.32Å; N99-A102 WeakPolarHBondContact O-CB 3.46Å; N99-A102 PolarHBondContact O-N 2.84Å
100I91.2Very high91.4Very high28 Ų2866.8 Ų66.814%0.14432%0.316CS..Hα-helixtrans-56.1-27.2-172-167.4167.8000113.9C96 R97 A102 V103 Q104 L134 K135C96-I100 WeakPolarHBondContact O-CA 3.35Å; C96-I100 PolarHBondContact O-N 3.42Å; R97-I100 VanDerWaalsContact O-CB 3.3Å; R97-I100 WeakPolarHBondContact O-CB 3.4Å; R97-I100 WeakPolarHBondContact O-CG2 3.32Å; R97-I100 PolarHBondContact O-N 2.91Å; I100-A102 VanDerWaalsContact C-N 3.32Å; I100-A102 PolarHBondContact O-N 3.41Å; I100-V103 PolarHBondContact O-N 2.98Å; I100-V103 VanDerWaalsContact O-N 3.17Å; I100-Q104 HydrophobicContact CG1-CG 4.31Å; I100-Q104 WeakPolarHBondContact O-CG 3.14Å; I100-Q104 PolarHBondContact O-N 3.29Å; I100-L134 HydrophobicContact CD1-CB 4.32Å; I100-K135 HydrophobicContact CD1-CG 4.23Å
101Y91.9Very high91.4Very high180 Ų18062.3 Ų62.371%0.70629%0.294SS*.Hα-helixtrans-59.8-38.4174.5-60.9-69.9000113.1N99 V103 Q104 T105N99-Y101 PolarHBondContact O-N 3.32Å; Y101-V103 VanDerWaalsContact C-N 3.26Å; Y101-V103 PolarHBondContact O-N 2.79Å; Y101-Q104 PolarHBondContact O-N 3.17Å; Y101-T105 PolarHBondContact O-N 2.81Å; Y101-T105 VanDerWaalsContact O-N 3.12Å
102A90Very high91.3Very high41 Ų4160.1 Ų60.134%0.33929%0.292SS..Hα-helixtrans-70.2-21.6177.600000113.1W61 L64 N99 I100 T105W61-A102 HydrophobicContact CE3-CB 4.34Å; W61-A102 HydrophobicContact CZ3-CB 3.85Å; L64-A102 WeakPolarHBondContact CD2-O 3.26Å; N99-A102 WeakPolarHBondContact O-CB 3.46Å; N99-A102 PolarHBondContact O-N 2.84Å; I100-A102 VanDerWaalsContact C-N 3.32Å; I100-A102 PolarHBondContact O-N 3.41Å; A102-T105 PolarHBondContact O-OG1 3.3Å
103V90Very high91.2Very high0 Ų061.9 Ų61.90%030%0.301CS..Hα-helixtrans-84.6-35.6170.6-166.50000110.6W61 M78 M81 I100 Y101 L106 L130 V131 L134W61-V103 HydrophobicContact CH2-CG2 3.75Å; W61-V103 HydrophobicContact CZ3-CG2 3.92Å; M78-V103 HydrophobicContact CE-CG1 3.88Å; M81-V103 HydrophobicContact SD-CG2 4.38Å; I100-V103 PolarHBondContact O-N 2.98Å; I100-V103 VanDerWaalsContact O-N 3.17Å; Y101-V103 VanDerWaalsContact C-N 3.26Å; Y101-V103 PolarHBondContact O-N 2.79Å; V103-L106 PolarHBondContact O-N 3.09Å; V103-L130 HydrophobicContact CG1-CD2 3.83Å; V103-L130 HydrophobicContact CG1-CG 4.15Å; V103-V131 HydrophobicContact CB-CG2 4.2Å; V103-V131 HydrophobicContact CG1-CG2 3.84Å; V103-L134 HydrophobicContact CG2-CD1 4.44Å
104Q92.1Very high90.9Very high50 Ų5073 Ų7323%0.23434%0.342CS..Hα-helixtrans-66.9-35.1-179.4-78-178.2102.900113.6I100 Y101 L106 K107 V131I100-Q104 HydrophobicContact CG1-CG 4.31Å; I100-Q104 WeakPolarHBondContact O-CG 3.14Å; I100-Q104 PolarHBondContact O-N 3.29Å; Y101-Q104 PolarHBondContact O-N 3.17Å; Q104-L106 PolarHBondContact O-N 2.91Å; Q104-K107 HydrophobicContact CB-CD 4.45Å; Q104-K107 HydrophobicContact CG-CD 4.39Å; Q104-K107 VanDerWaalsContact O-CB 3.22Å; Q104-K107 WeakPolarHBondContact O-CB 3.39Å; Q104-K107 WeakPolarHBondContact O-CG 3.47Å; Q104-K107 PolarHBondContact O-N 3.26Å; Q104-V131 HydrophobicContact CG-CG1 3.89Å; Q104-V131 HydrophobicContact CG-CG2 3.76Å
105T92.3Very high90.7Very high92 Ų9275 Ų7556%0.56436%0.355SS*.G310 helixtrans-60.6-26.617550.40000112.9Y101 A102 K107 D108Y101-T105 PolarHBondContact O-N 2.81Å; Y101-T105 VanDerWaalsContact O-N 3.12Å; A102-T105 PolarHBondContact O-OG1 3.3Å; T105-K107 PolarHBondContact O-N 3.05Å; T105-D108 PolarHBondContact O-N 2.84Å
106L90.9Very high90.6Very high6 Ų674.7 Ų74.73%0.03137%0.369CS..G310 helixtrans-73.2-13.1176.4-62.3-171.2000114L64 V74 M78 V103 Q104 D108 F109 V123 A127L64-L106 HydrophobicContact CD1-CD1 4.43Å; L64-L106 HydrophobicContact CD2-CD1 3.45Å; L64-L106 VanDerWaalsContact CD2-CD1 3.45Å; L64-L106 HydrophobicContact CD2-CG 4.09Å; L64-L106 HydrophobicContact CG-CD1 3.62Å; V74-L106 HydrophobicContact CG1-CD1 3.61Å; V74-L106 HydrophobicContact CG1-CD2 4.01Å; V74-L106 HydrophobicContact CG1-CG 4.46Å; M78-L106 HydrophobicContact CE-CB 4.37Å; M78-L106 HydrophobicContact CE-CD1 3.94Å; M78-L106 HydrophobicContact CG-CD1 3.91Å; M78-L106 HydrophobicContact SD-CB 4.16Å; M78-L106 HydrophobicContact SD-CD1 3.5Å; M78-L106 WeakPolarHBondContact SD-CD1 3.32Å; V103-L106 PolarHBondContact O-N 3.09Å; Q104-L106 PolarHBondContact O-N 2.91Å; L106-D108 PolarHBondContact O-N 3.39Å; L106-F109 HydrophobicContact CD2-CB 4.45Å; L106-F109 HydrophobicContact CD2-CD2 3.98Å; L106-F109 VanDerWaalsContact O-CB 3.3Å; L106-F109 WeakPolarHBondContact O-CB 3.46Å; L106-F109 PolarHBondContact O-N 3.49Å; L106-V123 HydrophobicContact CB-CG1 4.42Å; L106-A127 HydrophobicContact CB-CB 3.82Å
107K91.1Very high90.5Very high62 Ų6280.6 Ų80.627%0.2739%0.394SS..G310 helixtrans-63.5-20.4171.8-68169.544.4-83.10113.1Q104 T105 R124 A127 K128 V131Q104-K107 HydrophobicContact CB-CD 4.45Å; Q104-K107 HydrophobicContact CG-CD 4.39Å; Q104-K107 VanDerWaalsContact O-CB 3.22Å; Q104-K107 WeakPolarHBondContact O-CB 3.39Å; Q104-K107 WeakPolarHBondContact O-CG 3.47Å; Q104-K107 PolarHBondContact O-N 3.26Å; T105-K107 PolarHBondContact O-N 3.05Å; K107-R124 WeakPolarHBondContact O-CB 3.13Å; K107-R124 VanDerWaalsContact O-CD 3.3Å; K107-R124 WeakPolarHBondContact O-CD 3.29Å; K107-R124 WeakPolarHBondContact O-CG 3.38Å; K107-A127 HydrophobicContact CG-CB 3.98Å; K107-K128 HydrophobicContact CG-CG 4.24Å; K107-V131 HydrophobicContact CD-CB 4.47Å; K107-V131 HydrophobicContact CD-CG1 4.48Å; K107-V131 HydrophobicContact CD-CG2 4.26Å
108D90.7Very high90.5Very high118 Ų11879.3 Ų79.363%0.63139%0.394SS*.G310 helixtrans-113.97.3-177.1-52.7-59000111.6T105 L106 Q110T105-D108 PolarHBondContact O-N 2.84Å; L106-D108 PolarHBondContact O-N 3.39Å; D108-Q110 PolarHBondContact O-N 3.25Å
109F90.9Very high90.3Very high19 Ų1976.4 Ų76.48%0.08338%0.38CS..  trans-57.4120.3178.1-177.2-83.8000112.3W71 V74 L106 V123 R124W71-F109 HydrophobicContact CB-CE1 3.87Å; W71-F109 HydrophobicContact CB-CZ 3.85Å; V74-F109 HydrophobicContact CG2-CE2 4.03Å; V74-F109 HydrophobicContact CG2-CZ 4.32Å; L106-F109 HydrophobicContact CD2-CB 4.45Å; L106-F109 HydrophobicContact CD2-CD2 3.98Å; L106-F109 VanDerWaalsContact O-CB 3.3Å; L106-F109 WeakPolarHBondContact O-CB 3.46Å; L106-F109 PolarHBondContact O-N 3.49Å; F109-V123 HydrophobicContact CB-CB 4.42Å; F109-V123 HydrophobicContact CB-CG1 3.91Å; F109-V123 HydrophobicContact CD1-CB 3.78Å; F109-V123 HydrophobicContact CD1-CG1 3.84Å; F109-V123 HydrophobicContact CD1-CG2 3.97Å; F109-V123 HydrophobicContact CD2-CG1 4.39Å; F109-V123 HydrophobicContact CE1-CB 4.35Å; F109-V123 HydrophobicContact CE1-CG1 4.49Å; F109-V123 HydrophobicContact CE1-CG2 4.02Å; F109-V123 HydrophobicContact CG-CB 4.23Å; F109-V123 HydrophobicContact CG-CG1 3.8Å; F109-R124 HydrophobicContact CB-CG 4.23Å; F109-R124 WeakPolarHBondContact O-CD 3.13Å; F109-R124 WeakPolarHBondContact O-CG 3.36Å; F109-R124 PolarHBondContact O-NE 2.84Å
110Q89.3Confident90.3Very high132 Ų13273.2 Ų73.262%0.61736%0.363SS*.  trans-117.7127.2178.3-167.5171.337.300111.3D108D108-Q110 PolarHBondContact O-N 3.25Å
111Y91.1Very high90.3Very high45 Ų4576.1 Ų76.118%0.17638%0.378CS..  trans-145.1108.6165.4178.7-104.6000109.8W71 D113 Q119 G120W71-Y111 HydrophobicContact CB-CD1 4.39Å; W71-Y111 AromaticContact CD1-CD1 3.24Å; W71-Y111 AromaticContact CD1-CE1 3.34Å; W71-Y111 AromaticContact CG-CD1 3.95Å; W71-Y111 HydrophobicContact CG-CD1 3.95Å; W71-Y111 HydrophobicContact CG-CE1 4.42Å; W71-Y111 AromaticContact NE1-CD1 3.76Å; W71-Y111 AromaticContact NE1-CE1 3.56Å; Y111-D113 HydrophobicContact CE1-CB 3.93Å; Y111-D113 PolarHBondContact OH-OD1 2.88Å; Y111-Q119 HydrophobicContact CD1-CB 4.12Å; Y111-Q119 HydrophobicContact CD1-CG 4.19Å; Y111-Q119 HydrophobicContact CE1-CG 4.42Å; Y111-Q119 PolarHBondContact O-N 3.23Å; Y111-G120 PolarHBondContact O-N 3.46Å
112I89.8Confident90.2Very high94 Ų9470.9 Ų70.948%0.48236%0.362SS..BIsolated β-bridgetrans-90.4121.5169.1-56.2175.8000106.8D118I112-D118 HydrophobicContact CG1-CB 4.43Å
113D89.6Confident90.3Very high38 Ų3868.9 Ų68.920%0.20335%0.346CS..  trans-74.2169.6179.5-144.9-27.4000111.3Y111 D115 G116 K117 Q119Y111-D113 HydrophobicContact CE1-CB 3.93Å; Y111-D113 PolarHBondContact OH-OD1 2.88Å; D113-D115 PolarHBondContact O-N 3.11Å; D113-D115 VanDerWaalsContact O-N 3.09Å; D113-G116 PolarHBondContact O-N 3.37Å; D113-K117 WeakPolarHBondContact CB-O 3.07Å; D113-K117 PolarHBondContact N-O 2.63Å; D113-Q119 HydrophobicContact CB-CG 4.04Å; D113-Q119 PolarHBondContact OD2-NE2 2.95Å
114R86.8Confident90.5Very high240 Ų24071.1 Ų71.191%0.90636%0.355SS*.THydrogen-bonded Turntrans-59.3-24.7-178.7-75-176.9145.5-140-12.1114.3G116R114-G116 VanDerWaalsContact C-N 3.26Å; R114-G116 PolarHBondContact O-N 3.29Å
115D89Confident90.6Very high118 Ų11873.7 Ų73.763%0.63137%0.367SS*.THydrogen-bonded Turntrans-85.710.8176.5-49.1-38.9000113.2D113 K117D113-D115 PolarHBondContact O-N 3.11Å; D113-D115 VanDerWaalsContact O-N 3.09Å; D115-K117 VanDerWaalsContact C-N 3.25Å; D115-K117 HydrophobicContact CB-CD 4.15Å; D115-K117 HydrophobicContact CB-CG 4.26Å; D115-K117 PolarHBondContact O-N 2.82Å
116G88.8Confident90.6Very high58 Ų5870.5 Ų70.560%0.59835%0.345SS*.SBendtrans76.63.5-175.800000115.1D113 R114D113-G116 PolarHBondContact O-N 3.37Å; R114-G116 VanDerWaalsContact C-N 3.26Å; R114-G116 PolarHBondContact O-N 3.29Å
117K89.6Confident90.8Very high124 Ų12470.2 Ų70.254%0.53934%0.343SS..  trans-83.9123.5-176-64.7171.6-176164.70111.5D113 D115 Q119D113-K117 WeakPolarHBondContact CB-O 3.07Å; D113-K117 PolarHBondContact N-O 2.63Å; D115-K117 VanDerWaalsContact C-N 3.25Å; D115-K117 HydrophobicContact CB-CD 4.15Å; D115-K117 HydrophobicContact CB-CG 4.26Å; D115-K117 PolarHBondContact O-N 2.82Å; K117-Q119 PolarHBondContact O-N 3.07Å; K117-Q119 VanDerWaalsContact O-N 3.14Å
118D91.8Very high90.9Very high53 Ų5373 Ų7328%0.28336%0.356SS..BIsolated β-bridgetrans-7895.7175.3-167.4-30.4000111.1I112 G120 L121 R124I112-D118 HydrophobicContact CG1-CB 4.43Å; D118-G120 VanDerWaalsContact C-N 3.25Å; D118-G120 WeakPolarHBondContact OD1-CA 3.12Å; D118-G120 PolarHBondContact OD1-N 3.4Å; D118-L121 PolarHBondContact OD1-N 3.49Å; D118-R124 IonicContact OD1-CZ 2.83Å; D118-R124 IonicContact OD1-NH2 3.03Å; D118-R124 PolarHBondContact OD1-NH2 3.42Å; D118-R124 VanDerWaalsContact OD1-NH2 3.09Å; D118-R124 IonicContact OD2-CZ 3.45Å; D118-R124 IonicContact OD2-NH1 2.85Å; D118-R124 IonicContact OD2-NH2 2.66Å; D118-R124 PolarHBondContact OD2-NH2 3.14Å
119Q89Confident91Very high39 Ų3972.5 Ų72.518%0.18235%0.35CS..THydrogen-bonded Turntrans-77.7-15.5173.6-47.9-77.64.900111.6W71 Y111 D113 K117 L121W71-Q119 HydrophobicContact CD2-CB 3.74Å; W71-Q119 HydrophobicContact CD2-CG 4.33Å; W71-Q119 HydrophobicContact CE3-CB 4.07Å; W71-Q119 HydrophobicContact CG-CB 4.2Å; W71-Q119 HydrophobicContact CH2-CB 4.16Å; W71-Q119 HydrophobicContact CH2-CG 4.29Å; W71-Q119 HydrophobicContact CZ2-CB 3.84Å; W71-Q119 HydrophobicContact CZ2-CG 3.65Å; W71-Q119 HydrophobicContact CZ3-CB 4.28Å; Y111-Q119 HydrophobicContact CD1-CB 4.12Å; Y111-Q119 HydrophobicContact CD1-CG 4.19Å; Y111-Q119 HydrophobicContact CE1-CG 4.42Å; Y111-Q119 PolarHBondContact O-N 3.23Å; D113-Q119 HydrophobicContact CB-CG 4.04Å; D113-Q119 PolarHBondContact OD2-NE2 2.95Å; K117-Q119 PolarHBondContact O-N 3.07Å; K117-Q119 VanDerWaalsContact O-N 3.14Å; Q119-L121 VanDerWaalsContact C-N 3.28Å; Q119-L121 PolarHBondContact O-N 3.03Å
120G89.8Confident91.1Very high0 Ų071.7 Ų71.70%035%0.346CS..Hα-helixtrans-68.5-25.4175.700000113Y111 D118 N122 V123 R124Y111-G120 PolarHBondContact O-N 3.46Å; D118-G120 VanDerWaalsContact C-N 3.25Å; D118-G120 WeakPolarHBondContact OD1-CA 3.12Å; D118-G120 PolarHBondContact OD1-N 3.4Å; G120-N122 VanDerWaalsContact C-N 3.33Å; G120-N122 PolarHBondContact O-N 2.67Å; G120-V123 WeakPolarHBondContact O-CB 3.3Å; G120-V123 PolarHBondContact O-N 2.77Å; G120-R124 WeakPolarHBondContact O-CG 3.33Å; G120-R124 PolarHBondContact O-N 3.36Å
121L91.6Very high91.3Very high89 Ų8965.8 Ų65.847%0.46632%0.319SS..Hα-helixtrans-49.6-51.6173.2-168.5157.9000111.9D118 Q119 V123 R124 E125D118-L121 PolarHBondContact OD1-N 3.49Å; Q119-L121 VanDerWaalsContact C-N 3.28Å; Q119-L121 PolarHBondContact O-N 3.03Å; L121-V123 VanDerWaalsContact C-N 3.28Å; L121-V123 PolarHBondContact O-N 3.46Å; L121-R124 PolarHBondContact O-N 2.9Å; L121-E125 PolarHBondContact O-N 2.96Å
122N91Very high91.4Very high70 Ų7068 Ų6837%0.37434%0.337SS..Hα-helixtrans-60.4-35.4178.7-62.8-35.4000112.9Y75 G120 K126Y75-N122 HydrophobicContact CD2-CB 4.15Å; Y75-N122 HydrophobicContact CE2-CB 3.94Å; G120-N122 VanDerWaalsContact C-N 3.33Å; G120-N122 PolarHBondContact O-N 2.67Å; N122-K126 VanDerWaalsContact O-CB 3.28Å; N122-K126 WeakPolarHBondContact O-CB 3.28Å; N122-K126 PolarHBondContact O-N 3.27Å
123V92.3Very high91.5Very high0 Ų064.1 Ų64.10%032%0.317CS..Hα-helixtrans-70.3-46.5176.5-179.30000110.5V74 Y75 M78 L106 F109 G120 L121 K126 A127V74-V123 HydrophobicContact CG1-CG1 3.78Å; Y75-V123 HydrophobicContact CD2-CG2 4.36Å; M78-V123 HydrophobicContact SD-CG1 4.07Å; L106-V123 HydrophobicContact CB-CG1 4.42Å; F109-V123 HydrophobicContact CB-CB 4.42Å; F109-V123 HydrophobicContact CB-CG1 3.91Å; F109-V123 HydrophobicContact CD1-CB 3.78Å; F109-V123 HydrophobicContact CD1-CG1 3.84Å; F109-V123 HydrophobicContact CD1-CG2 3.97Å; F109-V123 HydrophobicContact CD2-CG1 4.39Å; F109-V123 HydrophobicContact CE1-CB 4.35Å; F109-V123 HydrophobicContact CE1-CG1 4.49Å; F109-V123 HydrophobicContact CE1-CG2 4.02Å; F109-V123 HydrophobicContact CG-CB 4.23Å; F109-V123 HydrophobicContact CG-CG1 3.8Å; G120-V123 WeakPolarHBondContact O-CB 3.3Å; G120-V123 PolarHBondContact O-N 2.77Å; L121-V123 VanDerWaalsContact C-N 3.28Å; L121-V123 PolarHBondContact O-N 3.46Å; V123-K126 PolarHBondContact O-N 2.6Å; V123-A127 VanDerWaalsContact O-CB 3.31Å; V123-A127 WeakPolarHBondContact O-CB 3.36Å; V123-A127 PolarHBondContact O-N 3.15Å
124R94.1Very high91.6Very high47 Ų4762.5 Ų62.518%0.17731%0.308CS..Hα-helixtrans-65.6-40.4-178.9-67.7-177.8-69-141.9-4.1112.7K107 F109 D118 G120 L121 A127 K128K107-R124 WeakPolarHBondContact O-CB 3.13Å; K107-R124 VanDerWaalsContact O-CD 3.3Å; K107-R124 WeakPolarHBondContact O-CD 3.29Å; K107-R124 WeakPolarHBondContact O-CG 3.38Å; F109-R124 HydrophobicContact CB-CG 4.23Å; F109-R124 WeakPolarHBondContact O-CD 3.13Å; F109-R124 WeakPolarHBondContact O-CG 3.36Å; F109-R124 PolarHBondContact O-NE 2.84Å; D118-R124 IonicContact OD1-CZ 2.83Å; D118-R124 IonicContact OD1-NH2 3.03Å; D118-R124 PolarHBondContact OD1-NH2 3.42Å; D118-R124 VanDerWaalsContact OD1-NH2 3.09Å; D118-R124 IonicContact OD2-CZ 3.45Å; D118-R124 IonicContact OD2-NH1 2.85Å; D118-R124 IonicContact OD2-NH2 2.66Å; D118-R124 PolarHBondContact OD2-NH2 3.14Å; G120-R124 WeakPolarHBondContact O-CG 3.33Å; G120-R124 PolarHBondContact O-N 3.36Å; L121-R124 PolarHBondContact O-N 2.9Å; R124-A127 PolarHBondContact O-N 3.27Å; R124-K128 VanDerWaalsContact O-CG 3.29Å; R124-K128 WeakPolarHBondContact O-CG 3.5Å; R124-K128 PolarHBondContact O-N 2.93Å
125E93.8Very high91.7Very high103 Ų10357.9 Ų57.948%0.48130%0.295SS..Hα-helixtrans-64.9-47.5175.6179.9156.2-142.100111.3L121 A127 K128 Q129L121-E125 PolarHBondContact O-N 2.96Å; E125-A127 VanDerWaalsContact C-N 3.28Å; E125-A127 PolarHBondContact O-N 3.34Å; E125-K128 WeakPolarHBondContact O-CB 2.97Å; E125-K128 PolarHBondContact O-N 3.21Å; E125-K128 VanDerWaalsContact O-N 3.12Å; E125-Q129 WeakPolarHBondContact O-CG 3.3Å; E125-Q129 PolarHBondContact O-N 2.7Å
126K91.9Very high91.9Very high25 Ų2555.6 Ų55.611%0.10928%0.283CS..Hα-helixtrans-61.3-36.1174.8-170.2133-164.5159.40112.6Y75 M78 T79 E82 N122 V123 Q129 L130Y75-K126 HydrophobicContact CE2-CB 4.32Å; Y75-K126 HydrophobicContact CE2-CD 3.93Å; M78-K126 HydrophobicContact CB-CG 4.16Å; T79-K126 WeakPolarHBondContact OG1-CE 3.37Å; T79-K126 PolarHBondContact OG1-NZ 2.84Å; E82-K126 WeakPolarHBondContact OE2-CE 3.37Å; E82-K126 IonicContact OE2-NZ 2.76Å; E82-K126 PolarHBondContact OE2-NZ 3.4Å; N122-K126 VanDerWaalsContact O-CB 3.28Å; N122-K126 WeakPolarHBondContact O-CB 3.28Å; N122-K126 PolarHBondContact O-N 3.27Å; V123-K126 PolarHBondContact O-N 2.6Å; K126-Q129 PolarHBondContact O-N 3.42Å; K126-L130 VanDerWaalsContact O-CB 3.3Å; K126-L130 WeakPolarHBondContact O-CB 3.44Å; K126-L130 PolarHBondContact O-N 2.89Å
127A93.9Very high91.8Very high0 Ų057 Ų570%027%0.274CS..Hα-helixtrans-66.9-38.6173.800000113M78 L106 K107 V123 R124 E125 V131M78-A127 VanDerWaalsContact CE-CA 3.47Å; M78-A127 HydrophobicContact CE-CB 3.64Å; M78-A127 HydrophobicContact SD-CB 4.05Å; L106-A127 HydrophobicContact CB-CB 3.82Å; K107-A127 HydrophobicContact CG-CB 3.98Å; V123-A127 VanDerWaalsContact O-CB 3.31Å; V123-A127 WeakPolarHBondContact O-CB 3.36Å; V123-A127 PolarHBondContact O-N 3.15Å; R124-A127 PolarHBondContact O-N 3.27Å; E125-A127 VanDerWaalsContact C-N 3.28Å; E125-A127 PolarHBondContact O-N 3.34Å; A127-V131 WeakPolarHBondContact O-CB 2.97Å; A127-V131 VanDerWaalsContact O-CG2 3.23Å; A127-V131 WeakPolarHBondContact O-CG2 3.42Å; A127-V131 PolarHBondContact O-N 2.86Å
128K94.4Very high91.8Very high121 Ų12157.1 Ų57.153%0.52628%0.276SS..Hα-helixtrans-62-50.1172.3-70.1165.7-174179.50110.8K107 R124 E125 L130 V131 T132K107-K128 HydrophobicContact CG-CG 4.24Å; R124-K128 VanDerWaalsContact O-CG 3.29Å; R124-K128 WeakPolarHBondContact O-CG 3.5Å; R124-K128 PolarHBondContact O-N 2.93Å; E125-K128 WeakPolarHBondContact O-CB 2.97Å; E125-K128 PolarHBondContact O-N 3.21Å; E125-K128 VanDerWaalsContact O-N 3.12Å; K128-L130 PolarHBondContact O-N 3.33Å; K128-V131 PolarHBondContact O-N 3.47Å; K128-T132 PolarHBondContact O-N 3.23Å; K128-T132 PolarHBondContact O-OG1 3.48Å; K128-T132 VanDerWaalsContact O-OG1 3.11Å
129Q93.4Very high91.8Very high108 Ų10859.2 Ų59.251%0.50528%0.283SS..Hα-helixtrans-56.9-48.3178-68.7170.4-2.100111.8E125 K126 T132 L133E125-Q129 WeakPolarHBondContact O-CG 3.3Å; E125-Q129 PolarHBondContact O-N 2.7Å; K126-Q129 PolarHBondContact O-N 3.42Å; Q129-T132 PolarHBondContact O-N 3.32Å; Q129-L133 PolarHBondContact O-N 3.46Å
130L92.8Very high91.9Very high2 Ų258 Ų581%0.0128%0.278CS..Hα-helixtrans-67-39.4-179.1-172.859000113M78 M81 E82 I85 V103 K126 K128 L133 L134M78-L130 HydrophobicContact CE-CB 4.45Å; M78-L130 HydrophobicContact CE-CD2 3.77Å; M81-L130 HydrophobicContact CG-CD2 4.23Å; M81-L130 HydrophobicContact SD-CD2 4.15Å; E82-L130 HydrophobicContact CB-CD1 4.09Å; E82-L130 HydrophobicContact CG-CD1 4.26Å; I85-L130 HydrophobicContact CD1-CD1 3.72Å; V103-L130 HydrophobicContact CG1-CD2 3.83Å; V103-L130 HydrophobicContact CG1-CG 4.15Å; K126-L130 VanDerWaalsContact O-CB 3.3Å; K126-L130 WeakPolarHBondContact O-CB 3.44Å; K126-L130 PolarHBondContact O-N 2.89Å; K128-L130 PolarHBondContact O-N 3.33Å; L130-L133 PolarHBondContact O-N 3.28Å; L130-L134 HydrophobicContact CD1-CD1 4.4Å; L130-L134 HydrophobicContact CG-CD1 4.1Å; L130-L134 WeakPolarHBondContact O-CB 3.48Å; L130-L134 WeakPolarHBondContact O-CG 3.33Å; L130-L134 PolarHBondContact O-N 2.85Å
131V93Very high91.9Very high7 Ų763.1 Ų63.14%0.04230%0.297CS..Hα-helixtrans-68.7-35.5175.9168.80000111.7V103 Q104 K107 A127 K128 K135V103-V131 HydrophobicContact CB-CG2 4.2Å; V103-V131 HydrophobicContact CG1-CG2 3.84Å; Q104-V131 HydrophobicContact CG-CG1 3.89Å; Q104-V131 HydrophobicContact CG-CG2 3.76Å; K107-V131 HydrophobicContact CD-CB 4.47Å; K107-V131 HydrophobicContact CD-CG1 4.48Å; K107-V131 HydrophobicContact CD-CG2 4.26Å; A127-V131 WeakPolarHBondContact O-CB 2.97Å; A127-V131 VanDerWaalsContact O-CG2 3.23Å; A127-V131 WeakPolarHBondContact O-CG2 3.42Å; A127-V131 PolarHBondContact O-N 2.86Å; K128-V131 PolarHBondContact O-N 3.47Å; V131-K135 HydrophobicContact CG1-CD 4.33Å; V131-K135 WeakPolarHBondContact O-CG 3.49Å; V131-K135 PolarHBondContact O-N 3Å
132T93.7Very high91.9Very high91 Ų9165 Ų6556%0.55830%0.303SS*.Hα-helixtrans-63.9-47.3172.5-62.40000110.8K128 Q129 L134 K135 D136K128-T132 PolarHBondContact O-N 3.23Å; K128-T132 PolarHBondContact O-OG1 3.48Å; K128-T132 VanDerWaalsContact O-OG1 3.11Å; Q129-T132 PolarHBondContact O-N 3.32Å; T132-L134 VanDerWaalsContact C-N 3.33Å; T132-L134 PolarHBondContact O-N 3.06Å; T132-K135 PolarHBondContact O-N 3.32Å; T132-D136 PolarHBondContact O-N 2.91Å
133L91.6Very high91.8Very high13 Ų1364.6 Ų64.67%0.06830%0.299CS..Hα-helixtrans-61.6-37.4177.4-17465.4000112.7K86 Q129 L130 K135 L140 E143K86-L133 VanDerWaalsContact CE-CD2 3.46Å; K86-L133 HydrophobicContact CG-CD2 4.33Å; Q129-L133 PolarHBondContact O-N 3.46Å; L130-L133 PolarHBondContact O-N 3.28Å; L133-K135 VanDerWaalsContact C-N 3.31Å; L133-K135 PolarHBondContact O-N 3.37Å; L133-L140 HydrophobicContact CD1-CB 4.16Å; L133-L140 HydrophobicContact CG-CB 4.48Å; L133-L140 HydrophobicContact CG-CD1 4.45Å; L133-L140 HydrophobicContact CG-CG 4.47Å; L133-L140 WeakPolarHBondContact O-CD1 3.17Å; L133-E143 HydrophobicContact CD1-CB 4.36Å; L133-E143 HydrophobicContact CD1-CG 4.01Å
134L90.3Very high91.8Very high4 Ų466.2 Ų66.22%0.02131%0.305CS..Hα-helixtrans-74.7-15.7178.3-76.2168.8000114.5I85 C96 R97 I100 V103 L130 T132 L140I85-L134 HydrophobicContact CD1-CD1 4.41Å; I85-L134 HydrophobicContact CD1-CD2 3.86Å; I85-L134 HydrophobicContact CD1-CG 4.31Å; C96-L134 HydrophobicContact CB-CD1 3.86Å; C96-L134 HydrophobicContact CB-CD2 3.63Å; C96-L134 HydrophobicContact CB-CG 4.43Å; R97-L134 HydrophobicContact CG-CD2 4.05Å; I100-L134 HydrophobicContact CD1-CB 4.32Å; V103-L134 HydrophobicContact CG2-CD1 4.44Å; L130-L134 HydrophobicContact CD1-CD1 4.4Å; L130-L134 HydrophobicContact CG-CD1 4.1Å; L130-L134 WeakPolarHBondContact O-CB 3.48Å; L130-L134 WeakPolarHBondContact O-CG 3.33Å; L130-L134 PolarHBondContact O-N 2.85Å; T132-L134 VanDerWaalsContact C-N 3.33Å; T132-L134 PolarHBondContact O-N 3.06Å; L134-L140 HydrophobicContact CD2-CD1 4.28Å
135K90.8Very high91.5Very high144 Ų14469.3 Ų69.363%0.62632%0.324SS*.Hα-helixtrans-87.5-29.8176.3-77.9178.8176.9-168.60113.1I100 V131 T132 L133I100-K135 HydrophobicContact CD1-CG 4.23Å; V131-K135 HydrophobicContact CG1-CD 4.33Å; V131-K135 WeakPolarHBondContact O-CG 3.49Å; V131-K135 PolarHBondContact O-N 3Å; T132-K135 PolarHBondContact O-N 3.32Å; L133-K135 VanDerWaalsContact C-N 3.31Å; L133-K135 PolarHBondContact O-N 3.37Å
136D91.3Very high91.3Very high69 Ų6970.5 Ų70.537%0.36933%0.33SS..  trans-103.392.6-177.5-174.2-16.3000109.7T132 E138 K139 L140T132-D136 PolarHBondContact O-N 2.91Å; D136-E138 VanDerWaalsContact C-N 3.29Å; D136-E138 PolarHBondContact O-N 2.86Å; D136-E138 PolarHBondContact OD1-N 3.45Å; D136-K139 HydrophobicContact CB-CB 4.08Å; D136-K139 WeakPolarHBondContact OD1-CB 3.4Å; D136-K139 PolarHBondContact OD1-N 2.86Å; D136-K139 VanDerWaalsContact OD2-CB 3.27Å; D136-K139 WeakPolarHBondContact OD2-CB 3.25Å; D136-L140 VanDerWaalsContact O-CB 3.24Å; D136-L140 WeakPolarHBondContact O-CB 3.5Å; D136-L140 PolarHBondContact O-N 2.67Å
137E88.1Confident91.1Very high87 Ų8770.3 Ų70.341%0.40733%0.333SS..Hα-helixtrans-65.8-32.9-178.6-166.6-169.3110.700112.2R97 L140 R141R97-E137 IonicContact CZ-OE2 3.73Å; R97-E137 IonicContact NH1-OE2 3.65Å; R97-E137 PolarHBondContact NH1-OE2 3.44Å; R97-E137 IonicContact NH2-OE2 2.72Å; R97-E137 PolarHBondContact NH2-OE2 2.83Å; E137-L140 PolarHBondContact O-N 3.18Å; E137-R141 WeakPolarHBondContact O-CB 3.5Å; E137-R141 PolarHBondContact O-N 3.41Å; E137-R141 IonicContact OE1-CZ 3.97Å; E137-R141 IonicContact OE1-NH2 3.53Å; E137-R141 PolarHBondContact OE1-NH2 3.07Å
138E89.4Confident90.7Very high127 Ų12773.3 Ų73.359%0.59335%0.348SS*.Hα-helixtrans-68.1-51.1-178.7-176.3152.7-118.400110.5D136 L140 R141 E142D136-E138 VanDerWaalsContact C-N 3.29Å; D136-E138 PolarHBondContact O-N 2.86Å; D136-E138 PolarHBondContact OD1-N 3.45Å; E138-L140 VanDerWaalsContact C-N 3.3Å; E138-L140 PolarHBondContact O-N 2.82Å; E138-R141 WeakPolarHBondContact O-CA 3.45Å; E138-R141 VanDerWaalsContact O-CB 3.28Å; E138-R141 WeakPolarHBondContact O-CB 3.38Å; E138-R141 PolarHBondContact O-N 3.47Å; E138-E142 PolarHBondContact O-N 2.89Å
139K90.9Very high90.5Very high97 Ų9773.9 Ų73.942%0.42235%0.351SS..Hα-helixtrans-60.9-37.1172.6-176.1167.9-176.1162.10112.9D136 R141 E142 E143D136-K139 HydrophobicContact CB-CB 4.08Å; D136-K139 WeakPolarHBondContact OD1-CB 3.4Å; D136-K139 PolarHBondContact OD1-N 2.86Å; D136-K139 VanDerWaalsContact OD2-CB 3.27Å; D136-K139 WeakPolarHBondContact OD2-CB 3.25Å; K139-R141 VanDerWaalsContact C-N 3.28Å; K139-R141 PolarHBondContact O-N 2.96Å; K139-E142 PolarHBondContact O-N 3.38Å; K139-E143 HydrophobicContact CG-CG 4.27Å; K139-E143 WeakPolarHBondContact O-CB 3.34Å; K139-E143 VanDerWaalsContact O-CG 3.31Å; K139-E143 WeakPolarHBondContact O-CG 3.2Å; K139-E143 PolarHBondContact O-N 3.18Å
140L91.3Very high90.1Very high14 Ų1471.5 Ų71.57%0.07334%0.344CS..Hα-helixtrans-61.8-37.7174.4-174.8155.8000111.3I85 A93 L133 L134 D136 E137 E138 R144I85-L140 HydrophobicContact CG2-CD1 3.66Å; I85-L140 HydrophobicContact CG2-CD2 4.31Å; I85-L140 HydrophobicContact CG2-CG 3.97Å; A93-L140 HydrophobicContact CB-CD1 4.33Å; A93-L140 HydrophobicContact CB-CD2 4.25Å; L133-L140 HydrophobicContact CD1-CB 4.16Å; L133-L140 HydrophobicContact CG-CB 4.48Å; L133-L140 HydrophobicContact CG-CD1 4.45Å; L133-L140 HydrophobicContact CG-CG 4.47Å; L133-L140 WeakPolarHBondContact O-CD1 3.17Å; L134-L140 HydrophobicContact CD2-CD1 4.28Å; D136-L140 VanDerWaalsContact O-CB 3.24Å; D136-L140 WeakPolarHBondContact O-CB 3.5Å; D136-L140 PolarHBondContact O-N 2.67Å; E137-L140 PolarHBondContact O-N 3.18Å; E138-L140 VanDerWaalsContact C-N 3.3Å; E138-L140 PolarHBondContact O-N 2.82Å; L140-R144 WeakPolarHBondContact O-CB 3.41Å; L140-R144 PolarHBondContact O-N 3.09Å
141R89.5Confident89.6Confident108 Ų10873.4 Ų73.441%0.40835%0.352SS..Hα-helixtrans-67.8-42.9176.2-156.6-177.1-53.7112.5-0.2111.6E137 E138 K139 R144 I145E137-R141 WeakPolarHBondContact O-CB 3.5Å; E137-R141 PolarHBondContact O-N 3.41Å; E137-R141 IonicContact OE1-CZ 3.97Å; E137-R141 IonicContact OE1-NH2 3.53Å; E137-R141 PolarHBondContact OE1-NH2 3.07Å; E138-R141 WeakPolarHBondContact O-CA 3.45Å; E138-R141 VanDerWaalsContact O-CB 3.28Å; E138-R141 WeakPolarHBondContact O-CB 3.38Å; E138-R141 PolarHBondContact O-N 3.47Å; K139-R141 VanDerWaalsContact C-N 3.28Å; K139-R141 PolarHBondContact O-N 2.96Å; R141-R144 PolarHBondContact O-N 3.08Å; R141-I145 VanDerWaalsContact O-CG1 3.3Å; R141-I145 WeakPolarHBondContact O-CG1 3Å; R141-I145 PolarHBondContact O-N 3.34Å
142E91.3Very high89.1Confident127 Ų12778.5 Ų78.559%0.59338%0.375SS*.Hα-helixtrans-63.9-51.2174.7-66.7-177.5150.600112.4E138 K139 R144 I145 H146E138-E142 PolarHBondContact O-N 2.89Å; K139-E142 PolarHBondContact O-N 3.38Å; E142-R144 PolarHBondContact O-N 2.97Å; E142-I145 PolarHBondContact O-N 2.91Å; E142-I145 VanDerWaalsContact O-N 3.14Å; E142-H146 WeakPolarHBondContact O-CB 3.47Å; E142-H146 PolarHBondContact O-N 3.48Å
143E90.3Very high88.7Confident62 Ų6280.7 Ų80.729%0.2938%0.377SS..Hα-helixtrans-55.3-37.9175.2-77.7-100.4176.700111.3K86 L133 K139 A147K86-E143 WeakPolarHBondContact CE-OE2 3.42Å; K86-E143 IonicContact NZ-OE2 3.09Å; K86-E143 PolarHBondContact NZ-OE2 3.26Å; L133-E143 HydrophobicContact CD1-CB 4.36Å; L133-E143 HydrophobicContact CD1-CG 4.01Å; K139-E143 HydrophobicContact CG-CG 4.27Å; K139-E143 WeakPolarHBondContact O-CB 3.34Å; K139-E143 VanDerWaalsContact O-CG 3.31Å; K139-E143 WeakPolarHBondContact O-CG 3.2Å; K139-E143 PolarHBondContact O-N 3.18Å; E143-A147 WeakPolarHBondContact O-CB 3.38Å; E143-A147 PolarHBondContact O-N 3.4Å
144R91.4Very high87.9Confident34 Ų3486.2 Ų86.213%0.12840%0.404CS..Hα-helixtrans-68.9-44.4176.9178.9175.5-178.57611.8112.5I85 K86 G88 L140 R141 E142 L148I85-R144 PolarHBondContact O-NH1 3.06Å; K86-R144 WeakPolarHBondContact O-CA 3.24Å; G88-R144 PolarHBondContact O-NH1 3.38Å; G88-R144 PolarHBondContact O-NH2 2.88Å; L140-R144 WeakPolarHBondContact O-CB 3.41Å; L140-R144 PolarHBondContact O-N 3.09Å; R141-R144 PolarHBondContact O-N 3.08Å; E142-R144 PolarHBondContact O-N 2.97Å; R144-L148 HydrophobicContact CG-CD1 4.06Å; R144-L148 WeakPolarHBondContact O-CB 3.35Å; R144-L148 VanDerWaalsContact O-CG 3.22Å; R144-L148 WeakPolarHBondContact O-CG 3.48Å; R144-L148 PolarHBondContact O-N 3.32Å
145I88.6Confident87.2Confident113 Ų11388.6 Ų88.658%0.57942%0.424SS*.Hα-helixtrans-60.9-46.4173.7-68.8161.8000110.2R141 E142 K149R141-I145 VanDerWaalsContact O-CG1 3.3Å; R141-I145 WeakPolarHBondContact O-CG1 3Å; R141-I145 PolarHBondContact O-N 3.34Å; E142-I145 PolarHBondContact O-N 2.91Å; E142-I145 VanDerWaalsContact O-N 3.14Å; I145-K149 WeakPolarHBondContact O-CB 3.39Å; I145-K149 PolarHBondContact O-N 3.2Å
146H88.9Confident86.2Confident128 Ų12887 Ų8759%0.59342%0.419SS*.Hα-helixtrans-65.1-43.6179.4-176-106000112.9E142 T150E142-H146 WeakPolarHBondContact O-CB 3.47Å; E142-H146 PolarHBondContact O-N 3.48Å; H146-T150 WeakPolarHBondContact O-CB 3.38Å; H146-T150 PolarHBondContact O-N 3.05Å; H146-T150 PolarHBondContact O-OG1 3Å
147A87.2Confident84.8Confident21 Ų2188.2 Ų88.217%0.17443%0.429CS..Hα-helixtrans-68.1-38.1178.800000112K86 T87 E143 T150 K151K86-A147 HydrophobicContact CB-CB 4.04Å; T87-A147 HydrophobicContact CG2-CB 3.87Å; E143-A147 WeakPolarHBondContact O-CB 3.38Å; E143-A147 PolarHBondContact O-N 3.4Å; A147-T150 PolarHBondContact O-N 3.39Å; A147-K151 WeakPolarHBondContact O-CB 3.29Å; A147-K151 PolarHBondContact O-N 2.96Å
148L87.1Confident83.3Confident62 Ų6288.6 Ų88.633%0.32544%0.437SS..Hα-helixtrans-66.6-46.6174.8-72.3170.9000111.7R144 T150 K151 E152R144-L148 HydrophobicContact CG-CD1 4.06Å; R144-L148 WeakPolarHBondContact O-CB 3.35Å; R144-L148 VanDerWaalsContact O-CG 3.22Å; R144-L148 WeakPolarHBondContact O-CG 3.48Å; R144-L148 PolarHBondContact O-N 3.32Å; L148-T150 PolarHBondContact O-N 3.46Å; L148-K151 PolarHBondContact O-N 2.89Å; L148-E152 WeakPolarHBondContact O-CB 3.39Å; L148-E152 PolarHBondContact O-N 3.38Å
149K88.9Confident81.5Confident134 Ų13486.4 Ų86.458%0.58344%0.436SS*.Hα-helixtrans-58.9-35.6174.4-169.9173.1-174.4174.80112I145 K153I145-K149 WeakPolarHBondContact O-CB 3.39Å; I145-K149 PolarHBondContact O-N 3.2Å; K149-K153 WeakPolarHBondContact O-CG 3.46Å; K149-K153 PolarHBondContact O-N 3.45Å; K149-K153 VanDerWaalsContact O-N 3.17Å
150T85.9Confident79.4Confident58 Ų5885.1 Ų85.136%0.35644%0.444SS..Hα-helixtrans-72.6-43175.3-56.70000112.4H146 A147 L148 E152 K153 M154H146-T150 WeakPolarHBondContact O-CB 3.38Å; H146-T150 PolarHBondContact O-N 3.05Å; H146-T150 PolarHBondContact O-OG1 3Å; A147-T150 PolarHBondContact O-N 3.39Å; L148-T150 PolarHBondContact O-N 3.46Å; T150-E152 VanDerWaalsContact C-N 3.33Å; T150-E152 PolarHBondContact O-N 3.09Å; T150-K153 PolarHBondContact O-N 3Å; T150-M154 PolarHBondContact O-N 3.46Å; T150-M154 VanDerWaalsContact O-N 3.09Å
151K82.8Confident77.3Confident41 Ų4189 Ų8918%0.17847%0.472CS..Hα-helixtrans-59.3-44.5174.8-179.3-177.5176.5179.90110.8D45 A147 L148 M154 A155D45-K151 IonicContact OD1-NZ 3.79Å; D45-K151 PolarHBondContact OD1-NZ 3.11Å; D45-K151 IonicContact OD2-NZ 3.03Å; D45-K151 PolarHBondContact OD2-NZ 3.36Å; A147-K151 WeakPolarHBondContact O-CB 3.29Å; A147-K151 PolarHBondContact O-N 2.96Å; L148-K151 PolarHBondContact O-N 2.89Å; K151-M154 PolarHBondContact O-N 3.39Å; K151-A155 PolarHBondContact O-N 3.2Å
152E82.3Confident75Confident115 Ų11588.7 Ų88.754%0.53749%0.486SS..Hα-helixtrans-62-49.8178.2-179.3172.5-159.400111.7L148 T150 M154 A155 Q156L148-E152 WeakPolarHBondContact O-CB 3.39Å; L148-E152 PolarHBondContact O-N 3.38Å; T150-E152 VanDerWaalsContact C-N 3.33Å; T150-E152 PolarHBondContact O-N 3.09Å; E152-M154 VanDerWaalsContact C-N 3.31Å; E152-M154 PolarHBondContact O-N 3.09Å; E152-A155 PolarHBondContact O-N 3.18Å; E152-A155 VanDerWaalsContact O-N 3.08Å; E152-Q156 HydrophobicContact CG-CG 4.32Å; E152-Q156 WeakPolarHBondContact O-CG 3.33Å; E152-Q156 PolarHBondContact O-N 3.24Å; E152-Q156 PolarHBondContact OE1-NE2 3.09Å; E152-Q156 VanDerWaalsContact OE1-NE2 3.11Å
153K84.6Confident72.8Confident136 Ų13686.1 Ų86.159%0.59149%0.487SS*.Hα-helixtrans-54.3-45.3175.1-78.5-174.3173.1-1630112.3K149 T150 Q156 T157K149-K153 WeakPolarHBondContact O-CG 3.46Å; K149-K153 PolarHBondContact O-N 3.45Å; K149-K153 VanDerWaalsContact O-N 3.17Å; T150-K153 PolarHBondContact O-N 3Å; K153-Q156 PolarHBondContact O-N 3.31Å; K153-T157 PolarHBondContact O-N 2.86Å; K153-T157 PolarHBondContact O-OG1 3.22Å
154M75.4Confident70.6Confident130 Ų13089.3 Ų89.364%0.6451%0.513SS*.Hα-helixtrans-65.1-37176.6-77.9-171165.700113.4T150 K151 E152 T157 T158T150-M154 PolarHBondContact O-N 3.46Å; T150-M154 VanDerWaalsContact O-N 3.09Å; K151-M154 PolarHBondContact O-N 3.39Å; E152-M154 VanDerWaalsContact C-N 3.31Å; E152-M154 PolarHBondContact O-N 3.09Å; M154-T157 PolarHBondContact O-OG1 3.1Å; M154-T157 VanDerWaalsContact O-OG1 3.08Å; M154-T158 PolarHBondContact O-N 2.72Å; M154-T158 PolarHBondContact O-OG1 2.97Å
155A75.1Confident68.2Low54 Ų5493.5 Ų93.545%0.44655%0.548SS..Hα-helixtrans-66.9-42175.200000111.8K151 E152 T158 S159K151-A155 PolarHBondContact O-N 3.2Å; E152-A155 PolarHBondContact O-N 3.18Å; E152-A155 VanDerWaalsContact O-N 3.08Å; A155-T158 PolarHBondContact O-N 3.11Å; A155-S159 PolarHBondContact O-N 2.99Å; A155-S159 PolarHBondContact O-OG 2.72Å
156Q70.1Confident66Low110 Ų11092.4 Ų92.451%0.51456%0.555SS.*Hα-helixtrans-65.1-43.4177.8-70.2177.22.400112E152 K153 T158 S159 A160E152-Q156 HydrophobicContact CG-CG 4.32Å; E152-Q156 WeakPolarHBondContact O-CG 3.33Å; E152-Q156 PolarHBondContact O-N 3.24Å; E152-Q156 PolarHBondContact OE1-NE2 3.09Å; E152-Q156 VanDerWaalsContact OE1-NE2 3.11Å; K153-Q156 PolarHBondContact O-N 3.31Å; Q156-T158 VanDerWaalsContact C-N 3.29Å; Q156-T158 PolarHBondContact O-N 2.84Å; Q156-S159 WeakPolarHBondContact O-CB 3.16Å; Q156-S159 PolarHBondContact O-N 3.31Å; Q156-S159 VanDerWaalsContact O-N 3.15Å; Q156-A160 PolarHBondContact O-N 2.78Å
157T62.7Low64Low95 Ų9592.8 Ų92.858%0.58357%0.569SS**Hα-helixtrans-64.5-33.2175.150.80000112.8K153 M154 A160 S161K153-T157 PolarHBondContact O-N 2.86Å; K153-T157 PolarHBondContact O-OG1 3.22Å; M154-T157 PolarHBondContact O-OG1 3.1Å; M154-T157 VanDerWaalsContact O-OG1 3.08Å; T157-A160 PolarHBondContact O-N 3.25Å; T157-S161 PolarHBondContact O-N 2.98Å; T157-S161 PolarHBondContact O-OG 3.49Å
158T56.2Low61.6Low94 Ų9497.6 Ų97.658%0.57760%0.602SS**Hα-helixtrans-69.3-34.1174.2-48.90000111.8M154 A155 Q156 S161M154-T158 PolarHBondContact O-N 2.72Å; M154-T158 PolarHBondContact O-OG1 2.97Å; A155-T158 PolarHBondContact O-N 3.11Å; Q156-T158 VanDerWaalsContact C-N 3.29Å; Q156-T158 PolarHBondContact O-N 2.84Å; T158-S161 PolarHBondContact O-OG 3.34Å
159S50.2Low59.6Low81 Ų81102.8 Ų102.857%0.56663%0.629SS**Hα-helixtrans-69-36.8171.6-60.10000112.4A155 Q156 S161 S162A155-S159 PolarHBondContact O-N 2.99Å; A155-S159 PolarHBondContact O-OG 2.72Å; Q156-S159 WeakPolarHBondContact O-CB 3.16Å; Q156-S159 PolarHBondContact O-N 3.31Å; Q156-S159 VanDerWaalsContact O-N 3.15Å; S159-S161 VanDerWaalsContact C-N 3.27Å; S159-S161 PolarHBondContact O-N 2.94Å; S159-S162 VanDerWaalsContact O-CB 3.24Å; S159-S162 WeakPolarHBondContact O-CB 3.33Å; S159-S162 PolarHBondContact O-N 3.19Å; S159-S162 PolarHBondContact O-OG 3Å
160A48.2Very low57.3Low71 Ų7199.9 Ų99.959%0.58764%0.637SS**Hα-helixtrans-61.9-31.9178.900000113.1Q156 T157 S162 A163Q156-A160 PolarHBondContact O-N 2.78Å; T157-A160 PolarHBondContact O-N 3.25Å; A160-S162 PolarHBondContact O-N 3.45Å; A160-A163 PolarHBondContact O-N 2.92Å
161S46.3Very low55Low96 Ų96100.8 Ų100.867%0.67166%0.658SS**THydrogen-bonded Turntrans-67.25.1170.535.20000115.4T157 T158 S159T157-S161 PolarHBondContact O-N 2.98Å; T157-S161 PolarHBondContact O-OG 3.49Å; T158-S161 PolarHBondContact O-OG 3.34Å; S159-S161 VanDerWaalsContact C-N 3.27Å; S159-S161 PolarHBondContact O-N 2.94Å
162S41.7Very low52.8Low100 Ų100104.2 Ų104.270%0.69969%0.687SS**THydrogen-bonded Turntrans-103.310.5175.9-51.90000114.2S159 A160S159-S162 VanDerWaalsContact O-CB 3.24Å; S159-S162 WeakPolarHBondContact O-CB 3.33Å; S159-S162 PolarHBondContact O-N 3.19Å; S159-S162 PolarHBondContact O-OG 3Å; A160-S162 PolarHBondContact O-N 3.45Å
163A44.1Very low50.9Low74 Ų74107 Ų10761%0.61270%0.704SS**SBendtrans-76.7138.5173.300000111.7A160A160-A163 PolarHBondContact O-N 2.92Å
164P46.1Very low49.1Very low128 Ų128105.9 Ų105.983%0.83171%0.714SS**PPolyproline II helixtrans-69.7132.5179.628.4-34.3000111.7A166P164-A166 PolarHBondContact O-N 3.31Å
165S39.1Very low47.5Very low123 Ų123107.9 Ų107.986%0.8672%0.724SS**PPolyproline II helixtrans-63.3116.7-170.6-45.20000114
166A43.1Very low45.6Very low89 Ų89107.3 Ų107.374%0.73672%0.723SS**PPolyproline II helixtrans-80.2142.1156.300000109.8P164 S168P164-A166 PolarHBondContact O-N 3.31Å; A166-S168 PolarHBondContact O-N 3.33Å
167P46.7Very low44.3Very low136 Ų136108.2 Ų108.288%0.88374%0.741SS**  trans-79.7102.4-177.230.9-33.7000111.5
168S38.3Very low43.1Very low123 Ų123111.1 Ų111.186%0.8675%0.748SS**  trans-83.8135167.5-164.80000111A166A166-S168 PolarHBondContact O-N 3.33Å
169L44.4Very low42.5Very low170 Ų170112.8 Ų112.889%0.8976%0.763SS**  trans-101.6117.2-171.1174.165.4000112
170G40Very low41.7Very low74 Ų74112.2 Ų112.276%0.76377%0.77SS**  trans82.2151.7164.600000115.4
171G37Very low41.1Very low76 Ų76114.5 Ų114.578%0.78477%0.773SS**  trans140.74.9176.600000117.3L173G171-L173 PolarHBondContact O-N 2.64Å
172S38.4Very low41Very low113 Ų113115.2 Ų115.279%0.7978%0.775SS**  trans-76.291.4179.7-178.60000112.5
173L40.5Very low41.3Very low173 Ų173116.5 Ų116.591%0.90677%0.774SS**  trans-98.2104.3162.1-71.8177.1000110G171 M175G171-L173 PolarHBondContact O-N 2.64Å; L173-M175 PolarHBondContact O-N 3.05Å
174S47.3Very low41.6Very low113 Ų113120.3 Ų120.379%0.7978%0.779SS**PPolyproline II helixtrans-70.5118.1169.5-580000109.8
175M42.9Very low41.8Very low173 Ų173118.2 Ų118.285%0.85277%0.772SS**PPolyproline II helixtrans-98.9130.4158.4-165.957.8175.200109L173L173-M175 PolarHBondContact O-N 3.05Å
176G35.5Very low42.2Very low41 Ų41122.3 Ų122.342%0.42377%0.769SS.*PPolyproline II helixtrans-69.8144.7-172.800000112.9H178G176-H178 PolarHBondContact O-CD2 3.49Å; G176-H178 PolarHBondContact O-N 3.29Å
177S41.3Very low42.5Very low129 Ų129121.3 Ų121.390%0.90276%0.755SS**  trans-72.296.5165.6-173.60000108.8
178H37.5Very low42.9Very low156 Ų156123.2 Ų123.272%0.72275%0.752SS**  trans-101.8103.7173.3-64.6-73.4000108.6G176 G180G176-H178 PolarHBondContact O-CD2 3.49Å; G176-H178 PolarHBondContact O-N 3.29Å; H178-G180 PolarHBondContact O-N 3.38Å; H178-G180 VanDerWaalsContact O-N 3.08Å
179S44.2Very low44.1Very low129 Ų129120.3 Ų120.390%0.90273%0.732SS**  trans-66103.9170.151.90000109.2
180G33.6Very low44.9Very low69 Ų69116.6 Ų116.671%0.71172%0.72SS**  trans-129149.3-17700000112.1H178H178-G180 PolarHBondContact O-N 3.38Å; H178-G180 VanDerWaalsContact O-N 3.08Å
181D34.7Very low46.3Very low120 Ų120115.9 Ų115.964%0.64271%0.713SS**  trans-63.8144.8-175.6-164.1-87.6000113.5D183D181-D183 PolarHBondContact O-N 2.81Å; D181-D183 PolarHBondContact OD1-N 3.32Å
182P45.3Very low47.9Very low110 Ų110117.2 Ų117.271%0.71470%0.699SS**THydrogen-bonded Turntrans-77.3-12.5-174.231.9-37.1000115.6
183D47.9Very low49.1Very low127 Ų127116.6 Ų116.668%0.67968%0.683SS**THydrogen-bonded Turntrans-84.6-7-173.8-92.6-91.4000114.7D181 A185D181-D183 PolarHBondContact O-N 2.81Å; D181-D183 PolarHBondContact OD1-N 3.32Å; D183-A185 PolarHBondContact O-N 3.26Å; D183-A185 VanDerWaalsContact O-N 3.1Å
184Q49.1Very low50.8Low155 Ų155113.5 Ų113.572%0.72467%0.668SS**  trans-84.930.5-177-153.170.968.800114
185A50.1Low52.4Low83 Ų83113.5 Ų113.569%0.68666%0.658SS**  trans-103.814.6-172.400000115.2D183D183-A185 PolarHBondContact O-N 3.26Å; D183-A185 VanDerWaalsContact O-N 3.1Å
186W48.7Very low54.2Low210 Ų210111.4 Ų111.480%0.79565%0.646SS**SBendtrans-104.3126.7177.5-7091000111.4Q188W186-Q188 PolarHBondContact O-N 2.89Å
187P48.4Very low56.4Low68 Ų68114.1 Ų114.144%0.44265%0.651SS.*  trans-66.5121.3179.426.9-33.2000110.3S189 E193P187-S189 VanDerWaalsContact C-N 3.28Å; P187-S189 PolarHBondContact O-N 2.93Å; P187-E193 HydrophobicContact CG-CB 4.37Å
188Q56Low58.5Low175 Ų175114.5 Ų114.582%0.81864%0.638SS**SBendtrans-84.45-176.5-63.7-155.3-81.400114.1W186W186-Q188 PolarHBondContact O-N 2.89Å
189S62.7Low60.8Low62 Ų62111.7 Ų111.743%0.43463%0.628SS.*SBendtrans-145.5141.6173.982.10000113.3P187 G191 E192P187-S189 VanDerWaalsContact C-N 3.28Å; P187-S189 PolarHBondContact O-N 2.93Å; S189-G191 PolarHBondContact O-N 3.23Å; S189-G191 VanDerWaalsContact O-N 3.13Å; S189-E192 PolarHBondContact O-N 3.46Å
190S61.8Low62.6Low92 Ų92108.2 Ų108.264%0.64361%0.607SS**THydrogen-bonded Turntrans-69.7-4.5179.5-173.80000114E193S190-E193 WeakPolarHBondContact CA-OE1 3.3Å; S190-E193 WeakPolarHBondContact CB-OE1 3.2Å; S190-E193 PolarHBondContact OG-OE1 2.85Å
191G69.5Low64.9Low59 Ų59110.2 Ų110.261%0.60860%0.601SS**THydrogen-bonded Turntrans-87.8-18.9168.500000113.9S189S189-G191 PolarHBondContact O-N 3.23Å; S189-G191 VanDerWaalsContact O-N 3.13Å
192E70.7Confident67Low105 Ų105107.1 Ų107.149%0.49159%0.592SS.*Hα-helixtrans-91.9-31.6-178-169.7166.2-163.700111.7S189 D194 L195 Q196S189-E192 PolarHBondContact O-N 3.46Å; E192-D194 VanDerWaalsContact C-N 3.31Å; E192-D194 PolarHBondContact O-N 3.11Å; E192-L195 PolarHBondContact O-N 2.74Å; E192-Q196 VanDerWaalsContact O-CB 3.27Å; E192-Q196 WeakPolarHBondContact O-CB 3.48Å; E192-Q196 PolarHBondContact O-N 2.83Å
193E63.4Low68.3Low99 Ų99107.4 Ų107.446%0.46359%0.585SS.*Hα-helixtrans-60.6-38.5172.769.4-168.7164.500112.5P187 S190 Q196 L197P187-E193 HydrophobicContact CG-CB 4.37Å; S190-E193 WeakPolarHBondContact CA-OE1 3.3Å; S190-E193 WeakPolarHBondContact CB-OE1 3.2Å; S190-E193 PolarHBondContact OG-OE1 2.85Å; E193-Q196 PolarHBondContact O-N 2.72Å; E193-L197 VanDerWaalsContact O-CB 3.25Å; E193-L197 WeakPolarHBondContact O-CB 3.14Å; E193-L197 PolarHBondContact O-N 3.29Å
194D75.4Confident69.6Low109 Ų109104.7 Ų104.758%0.58358%0.576SS**Hα-helixtrans-74.1-33.6-179.7-149.939.8000111.5E192 Q198E192-D194 VanDerWaalsContact C-N 3.31Å; E192-D194 PolarHBondContact O-N 3.11Å; D194-Q198 VanDerWaalsContact O-CB 3.29Å; D194-Q198 WeakPolarHBondContact O-CB 3.43Å; D194-Q198 PolarHBondContact O-N 3.22Å
195L81.9Confident71Confident113 Ų113103.2 Ų103.259%0.59257%0.567SS**Hα-helixtrans-68.9-42.5171-177.364.9000111.7E192 L197 Q198 L199E192-L195 PolarHBondContact O-N 2.74Å; L195-L197 VanDerWaalsContact C-N 3.34Å; L195-Q198 PolarHBondContact O-N 3.5Å; L195-L199 WeakPolarHBondContact O-CB 3.47Å; L195-L199 PolarHBondContact O-N 3.01Å
196Q79.9Confident71.8Confident129 Ų129104.9 Ų104.960%0.60356%0.561SS**Hα-helixtrans-63-41.1175.3-167.780.9-21.700110.8E192 E193 L199 A200E192-Q196 VanDerWaalsContact O-CB 3.27Å; E192-Q196 WeakPolarHBondContact O-CB 3.48Å; E192-Q196 PolarHBondContact O-N 2.83Å; E193-Q196 PolarHBondContact O-N 2.72Å; Q196-L199 PolarHBondContact O-N 3.04Å; Q196-A200 VanDerWaalsContact O-CB 3.3Å; Q196-A200 WeakPolarHBondContact O-CB 3.41Å; Q196-A200 PolarHBondContact O-N 3.03Å
197L81.6Confident72.4Confident97 Ų97101.2 Ų101.251%0.50855%0.553SS.*Hα-helixtrans-66.7-43.2175.1-172.870.2000111.5E193 L195 A200 L201E193-L197 VanDerWaalsContact O-CB 3.25Å; E193-L197 WeakPolarHBondContact O-CB 3.14Å; E193-L197 PolarHBondContact O-N 3.29Å; L195-L197 VanDerWaalsContact C-N 3.34Å; L197-A200 PolarHBondContact O-N 3.4Å; L197-L201 HydrophobicContact CG-CD1 4.23Å; L197-L201 WeakPolarHBondContact O-CB 3.34Å; L197-L201 VanDerWaalsContact O-CG 3.3Å; L197-L201 WeakPolarHBondContact O-CG 3.48Å; L197-L201 PolarHBondContact O-N 2.89Å
198Q85.5Confident72.7Confident137 Ų137100.6 Ų100.664%0.6455%0.554SS**Hα-helixtrans-65.5-37.5176.3-175.4164.369.100112.1D194 L195 A202D194-Q198 VanDerWaalsContact O-CB 3.29Å; D194-Q198 WeakPolarHBondContact O-CB 3.43Å; D194-Q198 PolarHBondContact O-N 3.22Å; L195-Q198 PolarHBondContact O-N 3.5Å; Q198-A202 WeakPolarHBondContact O-CB 3.47Å; Q198-A202 PolarHBondContact O-N 3.22Å
199L87.1Confident72.6Confident98 Ų9897.7 Ų97.751%0.51354%0.54SS..Hα-helixtrans-66.7-42.6172-179.760.2000111.6L195 Q196 L201 A202 M203L195-L199 WeakPolarHBondContact O-CB 3.47Å; L195-L199 PolarHBondContact O-N 3.01Å; Q196-L199 PolarHBondContact O-N 3.04Å; L199-L201 PolarHBondContact O-N 3.33Å; L199-A202 PolarHBondContact O-N 2.98Å; L199-M203 HydrophobicContact CD1-CG 4.33Å; L199-M203 WeakPolarHBondContact O-CB 3.29Å; L199-M203 WeakPolarHBondContact O-CG 3.48Å; L199-M203 PolarHBondContact O-N 3.11Å
200A80.7Confident71.7Confident56 Ų56102 Ų10246%0.46355%0.553SS.*Hα-helixtrans-64.1-38.117600000112.4Q196 L197 S204Q196-A200 VanDerWaalsContact O-CB 3.3Å; Q196-A200 WeakPolarHBondContact O-CB 3.41Å; Q196-A200 PolarHBondContact O-N 3.03Å; L197-A200 PolarHBondContact O-N 3.4Å; A200-S204 WeakPolarHBondContact O-CB 3.45Å; A200-S204 PolarHBondContact O-N 3.27Å
201L83.1Confident70.7Confident111 Ų111102.9 Ų102.958%0.58156%0.555SS**Hα-helixtrans-69.4-37.2173.4-72.7169.3000112.2L197 L199 K205L197-L201 HydrophobicContact CG-CD1 4.23Å; L197-L201 WeakPolarHBondContact O-CB 3.34Å; L197-L201 VanDerWaalsContact O-CG 3.3Å; L197-L201 WeakPolarHBondContact O-CG 3.48Å; L197-L201 PolarHBondContact O-N 2.89Å; L199-L201 PolarHBondContact O-N 3.33Å; L201-K205 WeakPolarHBondContact O-CB 3.48Å; L201-K205 PolarHBondContact O-N 3.37Å
202A77.9Confident69.6Low55 Ų55104.4 Ų104.446%0.45556%0.556SS.*Hα-helixtrans-65-47.5173.500000111.5Q198 L199 K205 E206Q198-A202 WeakPolarHBondContact O-CB 3.47Å; Q198-A202 PolarHBondContact O-N 3.22Å; L199-A202 PolarHBondContact O-N 2.98Å; A202-K205 PolarHBondContact O-N 3.18Å; A202-E206 PolarHBondContact O-N 2.68Å
203M72.9Confident68.4Low115 Ų115102.5 Ų102.557%0.56756%0.558SS**Hα-helixtrans-65.9-39.9176.2-74.9-158.970.400112.7L199 K205 E206 E207L199-M203 HydrophobicContact CD1-CG 4.33Å; L199-M203 WeakPolarHBondContact O-CB 3.29Å; L199-M203 WeakPolarHBondContact O-CG 3.48Å; L199-M203 PolarHBondContact O-N 3.11Å; M203-K205 VanDerWaalsContact C-N 3.3Å; M203-K205 PolarHBondContact O-N 3.18Å; M203-E206 PolarHBondContact O-N 2.97Å; M203-E207 VanDerWaalsContact O-CB 3.3Å; M203-E207 WeakPolarHBondContact O-CB 3.38Å; M203-E207 PolarHBondContact O-N 3.42Å
204S75.3Confident67.8Low71 Ų71103.3 Ų103.350%0.49757%0.566SS.*Hα-helixtrans-66.6-32.8176.1-178.90000112A200 A208A200-S204 WeakPolarHBondContact O-CB 3.45Å; A200-S204 PolarHBondContact O-N 3.27Å; S204-A208 VanDerWaalsContact O-CB 3.29Å; S204-A208 WeakPolarHBondContact O-CB 3.44Å; S204-A208 PolarHBondContact O-N 3.43Å
205K78.6Confident67Low123 Ų123103 Ų10354%0.53557%0.57SS.*Hα-helixtrans-68.1-44.7170.4-177.9-179.8178.8-74.70111.7L201 A202 M203 A208 E209L201-K205 WeakPolarHBondContact O-CB 3.48Å; L201-K205 PolarHBondContact O-N 3.37Å; A202-K205 PolarHBondContact O-N 3.18Å; M203-K205 VanDerWaalsContact C-N 3.3Å; M203-K205 PolarHBondContact O-N 3.18Å; K205-A208 PolarHBondContact O-N 2.76Å; K205-E209 IonicContact NZ-OE1 3.45Å; K205-E209 IonicContact NZ-OE2 2.64Å; K205-E209 PolarHBondContact NZ-OE2 3.08Å; K205-E209 PolarHBondContact O-N 3.19Å
206E67.8Low65.9Low119 Ų119104 Ų10456%0.55658%0.575SS**Hα-helixtrans-63.9-42.3177.2-174.6168.3-148.700111.6A202 M203 A208 E209 Q210A202-E206 PolarHBondContact O-N 2.68Å; M203-E206 PolarHBondContact O-N 2.97Å; E206-A208 PolarHBondContact O-N 2.86Å; E206-E209 PolarHBondContact O-N 3.03Å; E206-Q210 WeakPolarHBondContact O-CB 3.46Å; E206-Q210 PolarHBondContact O-N 3.03Å
207E59.3Low65.2Low132 Ų132104.6 Ų104.662%0.61758%0.578SS**Hα-helixtrans-63.6-38.5173.9-173.9175.9-169.800111.8M203 Q210 T211M203-E207 VanDerWaalsContact O-CB 3.3Å; M203-E207 WeakPolarHBondContact O-CB 3.38Å; M203-E207 PolarHBondContact O-N 3.42Å; E207-Q210 PolarHBondContact O-N 2.87Å; E207-T211 HydrophobicContact CG-CG2 4.39Å; E207-T211 WeakPolarHBondContact O-CB 3.11Å; E207-T211 WeakPolarHBondContact O-CG2 3.23Å; E207-T211 PolarHBondContact O-N 3.42Å; E207-T211 PolarHBondContact O-OG1 3.3Å
208A56.5Low64.7Low56 Ų56103.3 Ų103.346%0.46357%0.571SS.*Hα-helixtrans-65.7-43.1173.900000112.4S204 K205 E206 Q210 T211 S212S204-A208 VanDerWaalsContact O-CB 3.29Å; S204-A208 WeakPolarHBondContact O-CB 3.44Å; S204-A208 PolarHBondContact O-N 3.43Å; K205-A208 PolarHBondContact O-N 2.76Å; E206-A208 PolarHBondContact O-N 2.86Å; A208-Q210 VanDerWaalsContact C-N 3.33Å; A208-T211 PolarHBondContact O-OG1 2.98Å; A208-S212 WeakPolarHBondContact O-CB 3.26Å; A208-S212 PolarHBondContact O-N 2.83Å; A208-S212 PolarHBondContact O-OG 3.16Å
209E53.8Low64.4Low114 Ų11499.3 Ų99.353%0.53356%0.562SS.*Hα-helixtrans-70.2-28.7175-72.2179.211500112.2K205 E206 S212 A213K205-E209 IonicContact NZ-OE1 3.45Å; K205-E209 IonicContact NZ-OE2 2.64Å; K205-E209 PolarHBondContact NZ-OE2 3.08Å; K205-E209 PolarHBondContact O-N 3.19Å; E206-E209 PolarHBondContact O-N 3.03Å; E209-S212 PolarHBondContact O-OG 3.02Å; E209-A213 WeakPolarHBondContact O-CB 3.41Å
210Q43.1Very low64.1Low151 Ų151100 Ų10071%0.70657%0.566SS**Hα-helixtrans-86.6-20.6-180-169.7151.191.800113.8E206 E207 A208E206-Q210 WeakPolarHBondContact O-CB 3.46Å; E206-Q210 PolarHBondContact O-N 3.03Å; E207-Q210 PolarHBondContact O-N 2.87Å; A208-Q210 VanDerWaalsContact C-N 3.33Å
211T41.1Very low64.2Low112 Ų112102.3 Ų102.369%0.68757%0.57SS**Hα-helixtrans-89.6-8.1170.751.50000113.7E207 A208E207-T211 HydrophobicContact CG-CG2 4.39Å; E207-T211 WeakPolarHBondContact O-CB 3.11Å; E207-T211 WeakPolarHBondContact O-CG2 3.23Å; E207-T211 PolarHBondContact O-N 3.42Å; E207-T211 PolarHBondContact O-OG1 3.3Å; A208-T211 PolarHBondContact O-OG1 2.98Å
212S45.4Very low64.2Low90 Ų90104.2 Ų104.263%0.62957%0.57SS**SBendtrans-107.322.2178.777.70000114.5A208 E209A208-S212 WeakPolarHBondContact O-CB 3.26Å; A208-S212 PolarHBondContact O-N 2.83Å; A208-S212 PolarHBondContact O-OG 3.16Å; E209-S212 PolarHBondContact O-OG 3.02Å
213A46.6Very low64.8Low65 Ų65109 Ų10954%0.53758%0.577SS.*  trans-132.750.3-163.300000115.2E209 P215E209-A213 WeakPolarHBondContact O-CB 3.41Å; A213-P215 WeakPolarHBondContact O-CD 3.46Å
214D51.2Low65.5Low116 Ų116106.1 Ų106.162%0.6257%0.571SS**  trans-79.5110153.6-113-44000108L216 E217 D218D214-L216 PolarHBondContact O-N 3.33Å; D214-E217 HydrophobicContact CB-CG 4.37Å; D214-E217 PolarHBondContact O-N 3.15Å; D214-D218 PolarHBondContact O-N 3.44Å
215P58.5Low66.2Low102 Ų102108.1 Ų108.166%0.66258%0.576SS**THydrogen-bonded Turntrans-71-5.8-168.128.2-35.8000114.5A213A213-P215 WeakPolarHBondContact O-CD 3.46Å
216L58.6Low66.8Low134 Ų134106.5 Ų106.570%0.70258%0.576SS**THydrogen-bonded Turntrans-78.6-42.9166-105.172.8000111.9D214 A219 D220D214-L216 PolarHBondContact O-N 3.33Å; L216-A219 WeakPolarHBondContact O-CB 3.45Å; L216-A219 PolarHBondContact O-N 3.32Å; L216-A219 VanDerWaalsContact O-N 3.16Å; L216-D220 PolarHBondContact O-N 2.92Å
217E64.5Low68Low142 Ų142104.3 Ų104.366%0.66457%0.568SS**Hα-helixtrans-69.3-36.9-174.7-68.9-163143.500111.9D214 A219 D220 L221D214-E217 HydrophobicContact CB-CG 4.37Å; D214-E217 PolarHBondContact O-N 3.15Å; E217-A219 VanDerWaalsContact C-N 3.3Å; E217-A219 PolarHBondContact O-N 2.75Å; E217-D220 PolarHBondContact O-N 3.39Å; E217-L221 WeakPolarHBondContact O-CB 3.46Å; E217-L221 PolarHBondContact O-N 3Å
218D71.4Confident69.5Low70 Ų70101.6 Ų101.637%0.37456%0.564SS.*Hα-helixtrans-66.2-32172.5-179.941.7000112D214 R222D214-D218 PolarHBondContact O-N 3.44Å; D218-R222 VanDerWaalsContact O-CB 3.27Å; D218-R222 WeakPolarHBondContact O-CB 3.45Å; D218-R222 WeakPolarHBondContact O-CD 3.18Å; D218-R222 WeakPolarHBondContact O-CG 3.26Å; D218-R222 PolarHBondContact O-N 2.66Å; D218-R222 IonicContact OD1-CZ 2.72Å; D218-R222 IonicContact OD1-NE 3.47Å; D218-R222 PolarHBondContact OD1-NE 2.69Å; D218-R222 IonicContact OD1-NH2 3.78Å; D218-R222 PolarHBondContact OD1-NH2 3.4Å; D218-R222 IonicContact OD2-CZ 2.64Å; D218-R222 IonicContact OD2-NE 2.67Å; D218-R222 PolarHBondContact OD2-NE 3.37Å; D218-R222 IonicContact OD2-NH2 3.64Å; D218-R222 PolarHBondContact OD2-NH2 3.46Å
219A78.9Confident71.2Confident53 Ų53106.9 Ų106.944%0.43858%0.576SS.*Hα-helixtrans-68.5-47.7174.100000111.8L216 E217 R222 Y223L216-A219 WeakPolarHBondContact O-CB 3.45Å; L216-A219 PolarHBondContact O-N 3.32Å; L216-A219 VanDerWaalsContact O-N 3.16Å; E217-A219 VanDerWaalsContact C-N 3.3Å; E217-A219 PolarHBondContact O-N 2.75Å; A219-R222 PolarHBondContact O-N 3.34Å; A219-Y223 WeakPolarHBondContact O-CB 3.06Å; A219-Y223 PolarHBondContact O-N 2.97Å
220D81.6Confident73Confident113 Ų113107.2 Ų107.260%0.60458%0.578SS**Hα-helixtrans-66.9-37.5177.5-82.3-10.4000112.2L216 E217 Y223 A224L216-D220 PolarHBondContact O-N 2.92Å; E217-D220 PolarHBondContact O-N 3.39Å; D220-Y223 WeakPolarHBondContact O-CB 3.43Å; D220-Y223 PolarHBondContact O-N 3.21Å; D220-A224 WeakPolarHBondContact O-CB 3.36Å; D220-A224 PolarHBondContact O-N 3.32Å
221L82.3Confident75.2Confident105 Ų105104.8 Ų104.855%0.5557%0.569SS.*Hα-helixtrans-70.4-39178.1-164.5153.9000111.3E217 Y223 A224 L225E217-L221 WeakPolarHBondContact O-CB 3.46Å; E217-L221 PolarHBondContact O-N 3Å; L221-Y223 VanDerWaalsContact C-N 3.35Å; L221-A224 PolarHBondContact O-N 3.44Å; L221-L225 HydrophobicContact CD2-CD1 3.66Å; L221-L225 HydrophobicContact CD2-CG 4.12Å; L221-L225 WeakPolarHBondContact O-CB 3.24Å; L221-L225 WeakPolarHBondContact O-CG 3.25Å; L221-L225 PolarHBondContact O-N 3.4Å
222R82.9Confident77.5Confident151 Ų151105 Ų10557%0.5756%0.562SS**Hα-helixtrans-63.6-39.1169.5-73.7170.3-167.4-151.17.5112.3D218 A219 T226D218-R222 VanDerWaalsContact O-CB 3.27Å; D218-R222 WeakPolarHBondContact O-CB 3.45Å; D218-R222 WeakPolarHBondContact O-CD 3.18Å; D218-R222 WeakPolarHBondContact O-CG 3.26Å; D218-R222 PolarHBondContact O-N 2.66Å; D218-R222 IonicContact OD1-CZ 2.72Å; D218-R222 IonicContact OD1-NE 3.47Å; D218-R222 PolarHBondContact OD1-NE 2.69Å; D218-R222 IonicContact OD1-NH2 3.78Å; D218-R222 PolarHBondContact OD1-NH2 3.4Å; D218-R222 IonicContact OD2-CZ 2.64Å; D218-R222 IonicContact OD2-NE 2.67Å; D218-R222 PolarHBondContact OD2-NE 3.37Å; D218-R222 IonicContact OD2-NH2 3.64Å; D218-R222 PolarHBondContact OD2-NH2 3.46Å; A219-R222 PolarHBondContact O-N 3.34Å; R222-T226 WeakPolarHBondContact O-CB 3.3Å; R222-T226 PolarHBondContact O-N 3.31Å; R222-T226 PolarHBondContact O-OG1 3.24Å
223Y89.6Confident79.8Confident156 Ų156105.5 Ų105.561%0.61255%0.554SS**Hα-helixtrans-64-46.5174.8-178.4-107.2000111.2A219 D220 L221 L225 T226 L227A219-Y223 WeakPolarHBondContact O-CB 3.06Å; A219-Y223 PolarHBondContact O-N 2.97Å; D220-Y223 WeakPolarHBondContact O-CB 3.43Å; D220-Y223 PolarHBondContact O-N 3.21Å; L221-Y223 VanDerWaalsContact C-N 3.35Å; Y223-L225 PolarHBondContact O-N 3.11Å; Y223-T226 WeakPolarHBondContact O-CB 3.36Å; Y223-T226 PolarHBondContact O-N 3.17Å; Y223-L227 HydrophobicContact CE1-CD2 4.49Å; Y223-L227 WeakPolarHBondContact O-CB 3.3Å; Y223-L227 PolarHBondContact O-N 3.13Å
224A88.4Confident81.8Confident53 Ų53108.8 Ų108.844%0.43856%0.556SS.*Hα-helixtrans-61.8-42.8176.900000112.9D220 L221 T226 L227 S228D220-A224 WeakPolarHBondContact O-CB 3.36Å; D220-A224 PolarHBondContact O-N 3.32Å; L221-A224 PolarHBondContact O-N 3.44Å; A224-T226 VanDerWaalsContact C-N 3.34Å; A224-T226 PolarHBondContact O-N 3.44Å; A224-L227 PolarHBondContact O-N 3.11Å; A224-S228 VanDerWaalsContact O-CB 3.25Å; A224-S228 WeakPolarHBondContact O-CB 3.41Å; A224-S228 PolarHBondContact O-N 2.82Å
225L90.4Very high83.7Confident113 Ų113108 Ų10859%0.59255%0.549SS*.Hα-helixtrans-63.1-39.2173.7-74.7175.2000112.1L221 Y223 K229L221-L225 HydrophobicContact CD2-CD1 3.66Å; L221-L225 HydrophobicContact CD2-CG 4.12Å; L221-L225 WeakPolarHBondContact O-CB 3.24Å; L221-L225 WeakPolarHBondContact O-CG 3.25Å; L221-L225 PolarHBondContact O-N 3.4Å; Y223-L225 PolarHBondContact O-N 3.11Å; L225-K229 WeakPolarHBondContact O-CB 3.35Å; L225-K229 PolarHBondContact O-N 3.29Å; L225-K229 VanDerWaalsContact O-N 3.08Å
226T91.9Very high85.1Confident90 Ų90107 Ų10755%0.55254%0.535SS*.Hα-helixtrans-65.8-47.5176.7-58.30000111R222 Y223 A224 K229 E230R222-T226 WeakPolarHBondContact O-CB 3.3Å; R222-T226 PolarHBondContact O-N 3.31Å; R222-T226 PolarHBondContact O-OG1 3.24Å; Y223-T226 WeakPolarHBondContact O-CB 3.36Å; Y223-T226 PolarHBondContact O-N 3.17Å; A224-T226 VanDerWaalsContact C-N 3.34Å; A224-T226 PolarHBondContact O-N 3.44Å; T226-K229 PolarHBondContact O-N 2.92Å; T226-E230 PolarHBondContact O-N 2.84Å
227L91.4Very high86.6Confident72 Ų72107.6 Ų107.638%0.37753%0.528SS..Hα-helixtrans-63.1-43.6178.7-17367.9000111.8Y223 A224 K229 E230 I231Y223-L227 HydrophobicContact CE1-CD2 4.49Å; Y223-L227 WeakPolarHBondContact O-CB 3.3Å; Y223-L227 PolarHBondContact O-N 3.13Å; A224-L227 PolarHBondContact O-N 3.11Å; L227-K229 VanDerWaalsContact C-N 3.35Å; L227-K229 PolarHBondContact O-N 3.27Å; L227-E230 PolarHBondContact O-N 3.49Å; L227-I231 HydrophobicContact CD1-CD1 4.46Å; L227-I231 HydrophobicContact CG-CD1 3.96Å; L227-I231 WeakPolarHBondContact O-CB 3.5Å; L227-I231 VanDerWaalsContact O-CG1 3.27Å; L227-I231 WeakPolarHBondContact O-CG1 3.38Å; L227-I231 PolarHBondContact O-N 3.35Å
228S91.3Very high87.8Confident76 Ų76105.8 Ų105.853%0.53152%0.522SS..Hα-helixtrans-59.8-43.6175.3-177.40000111.9A224 I231 H232A224-S228 VanDerWaalsContact O-CB 3.25Å; A224-S228 WeakPolarHBondContact O-CB 3.41Å; A224-S228 PolarHBondContact O-N 2.82Å; S228-I231 PolarHBondContact O-N 2.87Å; S228-H232 WeakPolarHBondContact O-CB 3.1Å; S228-H232 PolarHBondContact O-N 3.38Å
229K92.4Very high88.7Confident166 Ų166111.1 Ų111.172%0.72254%0.537SS*.Hα-helixtrans-64.9-38.2175.9-172176-177.7177.40112.6L225 T226 L227 Q233L225-K229 WeakPolarHBondContact O-CB 3.35Å; L225-K229 PolarHBondContact O-N 3.29Å; L225-K229 VanDerWaalsContact O-N 3.08Å; T226-K229 PolarHBondContact O-N 2.92Å; L227-K229 VanDerWaalsContact C-N 3.35Å; L227-K229 PolarHBondContact O-N 3.27Å; K229-Q233 WeakPolarHBondContact O-CB 3.46Å; K229-Q233 PolarHBondContact O-N 2.96Å; K229-Q233 VanDerWaalsContact O-N 3.1Å
230E91.8Very high89.3Confident121 Ų121115.3 Ų115.357%0.56554%0.542SS*.Hα-helixtrans-67.1-47.6174.8-172.5-178.8174.900111.7T226 L227 H232 Q233 K234T226-E230 PolarHBondContact O-N 2.84Å; L227-E230 PolarHBondContact O-N 3.49Å; E230-H232 PolarHBondContact O-N 2.82Å; E230-Q233 PolarHBondContact O-N 2.84Å; E230-K234 WeakPolarHBondContact O-CB 3.37Å; E230-K234 PolarHBondContact O-N 3.09Å
231I88.1Confident89.8Confident101 Ų101111.7 Ų111.752%0.51853%0.531SS..Hα-helixtrans-56.2-49.7177.8-71.4166.3000110.4L227 S228 Q233 K234 E235L227-I231 HydrophobicContact CD1-CD1 4.46Å; L227-I231 HydrophobicContact CG-CD1 3.96Å; L227-I231 WeakPolarHBondContact O-CB 3.5Å; L227-I231 VanDerWaalsContact O-CG1 3.27Å; L227-I231 WeakPolarHBondContact O-CG1 3.38Å; L227-I231 PolarHBondContact O-N 3.35Å; S228-I231 PolarHBondContact O-N 2.87Å; I231-Q233 PolarHBondContact O-N 3.07Å; I231-K234 WeakPolarHBondContact O-CB 3.47Å; I231-K234 PolarHBondContact O-N 3Å; I231-K234 VanDerWaalsContact O-N 3.11Å; I231-E235 PolarHBondContact O-N 3.18Å
232H90.4Very high90.2Very high116 Ų116111 Ų11154%0.53753%0.528SS..Hα-helixtrans-63.5-41.1179.3-173.557.5000112.4S228 E230 K234 E235 E236S228-H232 WeakPolarHBondContact O-CB 3.1Å; S228-H232 PolarHBondContact O-N 3.38Å; E230-H232 PolarHBondContact O-N 2.82Å; H232-K234 PolarHBondContact O-N 3.14Å; H232-E235 IonicContact ND1-OE2 3.81Å; H232-E235 PolarHBondContact O-N 3.29Å; H232-E236 WeakPolarHBondContact O-CB 3.1Å; H232-E236 PolarHBondContact O-N 3.23Å
233Q92.8Very high90.6Very high100 Ų100108.7 Ų108.747%0.46753%0.527SS..Hα-helixtrans-69.1-22.2175.7-154.4-165.762.600112.9K229 E230 I231 R237K229-Q233 WeakPolarHBondContact O-CB 3.46Å; K229-Q233 PolarHBondContact O-N 2.96Å; K229-Q233 VanDerWaalsContact O-N 3.1Å; E230-Q233 PolarHBondContact O-N 2.84Å; I231-Q233 PolarHBondContact O-N 3.07Å; Q233-R237 WeakPolarHBondContact O-CG 3.27Å; Q233-R237 PolarHBondContact O-N 3Å; Q233-R237 PolarHBondContact O-NH1 2.77Å; Q233-R237 VanDerWaalsContact OE1-CZ 3.23Å
234K89.9Confident90.7Very high134 Ų134106.6 Ų106.658%0.58353%0.526SS*.Hα-helixtrans-79.7-41.4174-170174.7-177.3175.10111.4E230 I231 H232 R237 L238E230-K234 WeakPolarHBondContact O-CB 3.37Å; E230-K234 PolarHBondContact O-N 3.09Å; I231-K234 WeakPolarHBondContact O-CB 3.47Å; I231-K234 PolarHBondContact O-N 3Å; I231-K234 VanDerWaalsContact O-N 3.11Å; H232-K234 PolarHBondContact O-N 3.14Å; K234-R237 PolarHBondContact O-N 2.73Å; K234-L238 PolarHBondContact O-N 3.05Å
235E90.3Very high90.8Very high100 Ų100112.8 Ų112.847%0.46754%0.538SS..Hα-helixtrans-59.6-46.3171.5-174.3-174.4-171.100111.4I231 H232 R237 L238 R239I231-E235 PolarHBondContact O-N 3.18Å; H232-E235 IonicContact ND1-OE2 3.81Å; H232-E235 PolarHBondContact O-N 3.29Å; E235-R237 VanDerWaalsContact C-N 3.29Å; E235-R237 PolarHBondContact O-N 2.94Å; E235-L238 WeakPolarHBondContact O-CB 3.11Å; E235-L238 PolarHBondContact O-N 2.96Å; E235-L238 VanDerWaalsContact O-N 3.16Å; E235-R239 PolarHBondContact O-N 3.18Å
236E88.3Confident90.8Very high81 Ų81112.1 Ų112.138%0.37953%0.534SS..Hα-helixtrans-57.7-36.5173.7-99.9-122.2126.800113.3H232 R240H232-E236 WeakPolarHBondContact O-CB 3.1Å; H232-E236 PolarHBondContact O-N 3.23Å; E236-R240 WeakPolarHBondContact O-CG 3.41Å; E236-R240 PolarHBondContact O-N 2.6Å; E236-R240 VanDerWaalsContact O-N 3.17Å; E236-R240 PolarHBondContact O-NH1 3.37Å; E236-R240 IonicContact OE1-CZ 3.51Å; E236-R240 IonicContact OE1-NH1 3.56Å; E236-R240 IonicContact OE1-NH2 2.85Å; E236-R240 PolarHBondContact OE1-NH2 3.31Å; E236-R240 IonicContact OE2-CZ 3.25Å; E236-R240 VanDerWaalsContact OE2-CZ 3.25Å; E236-R240 IonicContact OE2-NH1 2.72Å; E236-R240 PolarHBondContact OE2-NH1 2.65Å; E236-R240 IonicContact OE2-NH2 2.87Å; E236-R240 PolarHBondContact OE2-NH2 3.39Å
237R89.4Confident90.7Very high147 Ų147113.1 Ų113.156%0.55553%0.533SS*.Hα-helixtrans-73.8-37.9175.3-76.9-174.5-17092.4-7.6112.2Q233 K234 E235 R240 G241Q233-R237 WeakPolarHBondContact O-CG 3.27Å; Q233-R237 PolarHBondContact O-N 3Å; Q233-R237 PolarHBondContact O-NH1 2.77Å; Q233-R237 VanDerWaalsContact OE1-CZ 3.23Å; K234-R237 PolarHBondContact O-N 2.73Å; E235-R237 VanDerWaalsContact C-N 3.29Å; E235-R237 PolarHBondContact O-N 2.94Å; R237-R240 PolarHBondContact O-N 3.07Å; R237-G241 PolarHBondContact O-N 3.04Å
238L90.4Very high90.5Very high103 Ų103115.7 Ų115.754%0.53954%0.544SS..Hα-helixtrans-60.6-51.9173.5-111.1139.8000110.5K234 E235 R240 G241 D242K234-L238 PolarHBondContact O-N 3.05Å; E235-L238 WeakPolarHBondContact O-CB 3.11Å; E235-L238 PolarHBondContact O-N 2.96Å; E235-L238 VanDerWaalsContact O-N 3.16Å; L238-R240 VanDerWaalsContact C-N 3.35Å; L238-R240 PolarHBondContact O-N 2.83Å; L238-G241 CarbonylContact O-C 3.58Å; L238-G241 WeakPolarHBondContact O-CA 3.25Å; L238-G241 PolarHBondContact O-N 3.28Å; L238-D242 PolarHBondContact O-N 2.99Å
239R90.3Very high90.3Very high182 Ų182114.3 Ų114.369%0.68754%0.537SS*.Hα-helixtrans-56-43.1176-83-173.5155-158.6-6.7113.5E235 G241 D242 D243E235-R239 PolarHBondContact O-N 3.18Å; R239-G241 VanDerWaalsContact C-N 3.35Å; R239-D242 PolarHBondContact O-N 3.34Å; R239-D243 VanDerWaalsContact O-CB 3.25Å; R239-D243 WeakPolarHBondContact O-CB 3.12Å; R239-D243 PolarHBondContact O-N 3.13Å
240R90.5Very high90Very high142 Ų142110.4 Ų110.454%0.53652%0.524SS..Hα-helixtrans-68-32.3174.5-71.9-173.8-170.993.42.1113.2E236 R237 L238 L244E236-R240 WeakPolarHBondContact O-CG 3.41Å; E236-R240 PolarHBondContact O-N 2.6Å; E236-R240 VanDerWaalsContact O-N 3.17Å; E236-R240 PolarHBondContact O-NH1 3.37Å; E236-R240 IonicContact OE1-CZ 3.51Å; E236-R240 IonicContact OE1-NH1 3.56Å; E236-R240 IonicContact OE1-NH2 2.85Å; E236-R240 PolarHBondContact OE1-NH2 3.31Å; E236-R240 IonicContact OE2-CZ 3.25Å; E236-R240 VanDerWaalsContact OE2-CZ 3.25Å; E236-R240 IonicContact OE2-NH1 2.72Å; E236-R240 PolarHBondContact OE2-NH1 2.65Å; E236-R240 IonicContact OE2-NH2 2.87Å; E236-R240 PolarHBondContact OE2-NH2 3.39Å; R237-R240 PolarHBondContact O-N 3.07Å; L238-R240 VanDerWaalsContact C-N 3.35Å; L238-R240 PolarHBondContact O-N 2.83Å; R240-L244 VanDerWaalsContact O-CB 3.27Å; R240-L244 WeakPolarHBondContact O-CB 3.47Å; R240-L244 PolarHBondContact O-N 2.87Å
241G92.4Very high89.7Confident37 Ų37108.9 Ų108.938%0.38152%0.516SS..Hα-helixtrans-69-42.4174.400000112.7R237 L238 R239 R245R237-G241 PolarHBondContact O-N 3.04Å; L238-G241 CarbonylContact O-C 3.58Å; L238-G241 WeakPolarHBondContact O-CA 3.25Å; L238-G241 PolarHBondContact O-N 3.28Å; R239-G241 VanDerWaalsContact C-N 3.35Å; G241-R245 VanDerWaalsContact O-CB 3.27Å; G241-R245 WeakPolarHBondContact O-CB 3.42Å; G241-R245 PolarHBondContact O-N 3.01Å
242D91.1Very high89.4Confident89 Ų89110.2 Ų110.248%0.47652%0.521SS..Hα-helixtrans-70.4-38.3177.5-66.5-35.3000111.8L238 R239 R245 L246L238-D242 PolarHBondContact O-N 2.99Å; R239-D242 PolarHBondContact O-N 3.34Å; D242-R245 PolarHBondContact O-N 3.42Å; D242-L246 WeakPolarHBondContact O-CB 3.49Å; D242-L246 PolarHBondContact O-N 3.3Å
243D91.8Very high88.9Confident103 Ų103108.8 Ų108.855%0.55152%0.524SS*.Hα-helixtrans-63.6-45.9172.8-172.955.7000111.8R239 R245 L246 Q247R239-D243 VanDerWaalsContact O-CB 3.25Å; R239-D243 WeakPolarHBondContact O-CB 3.12Å; R239-D243 PolarHBondContact O-N 3.13Å; D243-R245 VanDerWaalsContact C-N 3.31Å; D243-R245 PolarHBondContact O-N 2.88Å; D243-L246 PolarHBondContact O-N 3.26Å; D243-Q247 WeakPolarHBondContact O-CB 3.3Å; D243-Q247 PolarHBondContact O-N 2.87Å
244L92.3Very high88.1Confident112 Ų112111.3 Ų111.359%0.58653%0.533SS*.Hα-helixtrans-62.9-37.3174-175.366.8000112.1R240 Q247 M248R240-L244 VanDerWaalsContact O-CB 3.27Å; R240-L244 WeakPolarHBondContact O-CB 3.47Å; R240-L244 PolarHBondContact O-N 2.87Å; L244-Q247 PolarHBondContact O-N 3.49Å; L244-M248 WeakPolarHBondContact O-CB 3.45Å; L244-M248 PolarHBondContact O-N 3.25Å
245R88.8Confident86.9Confident183 Ų183113.4 Ų113.469%0.69154%0.537SS*.Hα-helixtrans-67.5-40.4175.8-174.3176.9-173.2155.64.4111.8G241 D242 D243 M248 A249G241-R245 VanDerWaalsContact O-CB 3.27Å; G241-R245 WeakPolarHBondContact O-CB 3.42Å; G241-R245 PolarHBondContact O-N 3.01Å; D242-R245 PolarHBondContact O-N 3.42Å; D243-R245 VanDerWaalsContact C-N 3.31Å; D243-R245 PolarHBondContact O-N 2.88Å; R245-M248 PolarHBondContact O-N 3.06Å; R245-A249 PolarHBondContact O-N 2.84Å
246L90.9Very high85.3Confident100 Ų100116.6 Ų116.652%0.52455%0.552SS.*Hα-helixtrans-64.7-44.5173.6177.661.3000111D242 D243 M248 A249 I250D242-L246 WeakPolarHBondContact O-CB 3.49Å; D242-L246 PolarHBondContact O-N 3.3Å; D243-L246 PolarHBondContact O-N 3.26Å; L246-M248 VanDerWaalsContact C-N 3.33Å; L246-M248 PolarHBondContact O-N 3.36Å; L246-A249 PolarHBondContact O-N 3.43Å; L246-I250 HydrophobicContact CD1-CD1 3.93Å; L246-I250 HydrophobicContact CD1-CG1 4.32Å; L246-I250 HydrophobicContact CG-CD1 3.87Å; L246-I250 WeakPolarHBondContact O-CB 3.31Å; L246-I250 VanDerWaalsContact O-CG1 3.28Å; L246-I250 WeakPolarHBondContact O-CG1 3.19Å; L246-I250 PolarHBondContact O-N 2.87Å
247Q90.8Very high83.5Confident110 Ų110120.7 Ų120.751%0.51457%0.569SS.*Hα-helixtrans-57.8-45.4174.5-175.8-179.64.800111.4D243 L244 I250 E251D243-Q247 WeakPolarHBondContact O-CB 3.3Å; D243-Q247 PolarHBondContact O-N 2.87Å; L244-Q247 PolarHBondContact O-N 3.49Å; Q247-I250 PolarHBondContact O-N 3.36Å; Q247-E251 PolarHBondContact O-N 3.35Å
248M87.3Confident81.6Confident126 Ų126119.5 Ų119.562%0.62158%0.58SS**Hα-helixtrans-63-43.4178.2-168.9172.771.500112L244 R245 L246 I250 E251 E252L244-M248 WeakPolarHBondContact O-CB 3.45Å; L244-M248 PolarHBondContact O-N 3.25Å; R245-M248 PolarHBondContact O-N 3.06Å; L246-M248 VanDerWaalsContact C-N 3.33Å; L246-M248 PolarHBondContact O-N 3.36Å; M248-I250 VanDerWaalsContact C-N 3.34Å; M248-I250 PolarHBondContact O-N 2.86Å; M248-E251 PolarHBondContact O-N 3.42Å; M248-E252 WeakPolarHBondContact O-CB 3.27Å; M248-E252 PolarHBondContact O-N 3.19Å
249A86.8Confident79Confident47 Ų47124.1 Ų124.139%0.38860%0.596SS.*Hα-helixtrans-64.6-35.3175.400000112.9R245 L246 S253R245-A249 PolarHBondContact O-N 2.84Å; L246-A249 PolarHBondContact O-N 3.43Å; A249-S253 WeakPolarHBondContact O-CB 3.29Å; A249-S253 PolarHBondContact O-N 3.49Å
250I86.1Confident77Confident85 Ų85121.5 Ų121.544%0.43660%0.603SS.*Hα-helixtrans-70.2-34.4174.2-69.4167.3000111.4L246 Q247 M248 K254L246-I250 HydrophobicContact CD1-CD1 3.93Å; L246-I250 HydrophobicContact CD1-CG1 4.32Å; L246-I250 HydrophobicContact CG-CD1 3.87Å; L246-I250 WeakPolarHBondContact O-CB 3.31Å; L246-I250 VanDerWaalsContact O-CG1 3.28Å; L246-I250 WeakPolarHBondContact O-CG1 3.19Å; L246-I250 PolarHBondContact O-N 2.87Å; Q247-I250 PolarHBondContact O-N 3.36Å; M248-I250 VanDerWaalsContact C-N 3.34Å; M248-I250 PolarHBondContact O-N 2.86Å; I250-K254 WeakPolarHBondContact O-CB 3.38Å; I250-K254 WeakPolarHBondContact O-CG 3.37Å; I250-K254 PolarHBondContact O-N 2.87Å; I250-K254 VanDerWaalsContact O-N 3.12Å
251E85.7Confident74.4Confident88 Ų88124 Ų12441%0.41162%0.62SS.*Hα-helixtrans-72.8-38.6174.5-163.3-17714100112Q247 M248 K254 R255Q247-E251 PolarHBondContact O-N 3.35Å; M248-E251 PolarHBondContact O-N 3.42Å; E251-K254 CarbonylContact O-C 3.59Å; E251-K254 PolarHBondContact O-N 3.47Å; E251-R255 PolarHBondContact O-N 2.92Å; E251-R255 IonicContact OE1-CZ 3.15Å; E251-R255 IonicContact OE1-NH1 2.69Å; E251-R255 PolarHBondContact OE1-NH1 3.09Å; E251-R255 IonicContact OE1-NH2 2.79Å; E251-R255 PolarHBondContact OE1-NH2 3.24Å
252E81.9Confident71.9Confident130 Ų130131.2 Ų131.261%0.60764%0.644SS**Hα-helixtrans-61.5-50.5173.4-174.4166.4-136.400111.1M248 K254 R255 E256M248-E252 WeakPolarHBondContact O-CB 3.27Å; M248-E252 PolarHBondContact O-N 3.19Å; E252-K254 PolarHBondContact O-N 3.34Å; E252-R255 WeakPolarHBondContact O-CA 3.46Å; E252-R255 WeakPolarHBondContact O-CB 3.19Å; E252-R255 PolarHBondContact O-N 3.45Å; E252-E256 PolarHBondContact O-N 3.43Å
253S79.3Confident69.5Low86 Ų86132.7 Ų132.760%0.60166%0.661SS**Hα-helixtrans-58.5-29.9172.7178.30000113.2A249A249-S253 WeakPolarHBondContact O-CB 3.29Å; A249-S253 PolarHBondContact O-N 3.49Å
254K75.4Confident67Low152 Ų152132.8 Ų132.866%0.66168%0.677SS**Hα-helixtrans-77.5-20.7172.3-82.9178176.9174.30114.1I250 E251 E252I250-K254 WeakPolarHBondContact O-CB 3.38Å; I250-K254 WeakPolarHBondContact O-CG 3.37Å; I250-K254 PolarHBondContact O-N 2.87Å; I250-K254 VanDerWaalsContact O-N 3.12Å; E251-K254 CarbonylContact O-C 3.59Å; E251-K254 PolarHBondContact O-N 3.47Å; E252-K254 PolarHBondContact O-N 3.34Å
255R66Low64.4Low179 Ų179135.4 Ų135.468%0.67569%0.69SS**Hα-helixtrans-79.8-27.8173.1-78.5-166.5174.58610.9112.7E251 E252 K257E251-R255 PolarHBondContact O-N 2.92Å; E251-R255 IonicContact OE1-CZ 3.15Å; E251-R255 IonicContact OE1-NH1 2.69Å; E251-R255 PolarHBondContact OE1-NH1 3.09Å; E251-R255 IonicContact OE1-NH2 2.79Å; E251-R255 PolarHBondContact OE1-NH2 3.24Å; E252-R255 WeakPolarHBondContact O-CA 3.46Å; E252-R255 WeakPolarHBondContact O-CB 3.19Å; E252-R255 PolarHBondContact O-N 3.45Å; R255-K257 PolarHBondContact O-N 3.28Å
256E55.7Low62.1Low166 Ų166134.8 Ų134.878%0.77670%0.697SS**  trans-74.546.9172.7-69-149.9121.800114E252 P258E252-E256 PolarHBondContact O-N 3.43Å; E256-P258 WeakPolarHBondContact O-CD 3.29Å
257K51.5Low59.4Low168 Ų168136.6 Ų136.673%0.7370%0.703SS**  trans-105.898.4166.6-74.5-161.9172.7-1660110.6R255R255-K257 PolarHBondContact O-N 3.28Å
258P48Very low56.8Low122 Ų122138.3 Ų138.379%0.79272%0.715SS**PPolyproline II helixtrans-59.3150.1163.226.9-33.6000110E256E256-P258 WeakPolarHBondContact O-CD 3.29Å
259K36.9Very low54.2Low200 Ų200137 Ų13787%0.8772%0.718SS**PPolyproline II helixtrans-75154176.5-92.9-176.5175.21790111.1
260P48.3Very low52.1Low127 Ų127139.7 Ų139.783%0.82574%0.74SS**PPolyproline II helixtrans-77146.1-171.431.8-36000112.4
261E34.6Very low49.9Very low193 Ų193142.1 Ų142.190%0.90276%0.759SS**  trans-120139153.858.9-167.9155.800108.6
262E41.7Very low48Very low189 Ų189144.8 Ų144.888%0.88378%0.776SS**  trans-114.6116.7-162.8178.5-172.8163.100110.6
263S39.8Very low46Very low121 Ų121144.1 Ų144.185%0.84678%0.783SS**  trans-169.7156.7162.4-87.80000113
264A38.6Very low44.4Very low105 Ų105152.3 Ų152.387%0.86880%0.801SS**  trans68.2108.2172.800000117.5
265L39Very low42.4Very low167 Ų167148.8 Ų148.887%0.87481%0.807SS**  trans-86.6-178.6164.2-67.2163.8000110.6
266M39.2Very low40.9Very low170 Ų170144.9 Ų144.984%0.83781%0.814SS**  trans73.5140168.7-81.3168156.300116.3
267E34.3Very low40.8Very low137 Ų137142.8 Ų142.864%0.6481%0.814SS**  cis-164169-11.3-143.3-173.612700110.7
268L35.8Very low39.8Very low147 Ų147139.1 Ų139.177%0.7782%0.816SS**  trans64.5149.9160.2-60.5161.4000117.5
269S32.8Very low38.8Very low97 Ų97141.1 Ų141.168%0.67882%0.819SS**  cis-162.9152.7-19.448.70000109.2
270A43.8Very low38.5Very low104 Ų104134.9 Ų134.986%0.8681%0.805SS**  trans-71.3142.9178.800000113.3
271V40.3Very low37.6Very low137 Ų137135 Ų13583%0.8380%0.804SS**  trans-141.5135.4164.9-170.40000108.8
272D45.1Very low37.4Very low144 Ų144132.2 Ų132.277%0.7780%0.8SS**  trans-104.9130.4-175.6-177.517.9000111.1
273P39.1Very low36.9Very low115 Ų115128.5 Ų128.575%0.74780%0.795SS**  trans-114.752.7-169.742.5-34.7000116
274W46.2Very low36.6Very low258 Ų258128.4 Ų128.498%0.97779%0.794SS**  trans-98.383.2158.7-99.383.4000111.1
275G33Very low36.3Very low78 Ų78128.2 Ų128.280%0.80479%0.792SS**  trans-169.9142.9177.800000114
276A36.2Very low35.7Very low98 Ų98123.6 Ų123.681%0.8179%0.785SS**  trans-147.6171.3177.200000108.5
277P53.4Low36.1Very low121 Ų121121.2 Ų121.279%0.78678%0.782SS**  cis-136.5-170.44.240.9-22.2000115.5
278A28.9Very low36.2Very low92 Ų92120.2 Ų120.276%0.7679%0.79SS**  trans95113.3142.200000123.3
279N28.3Very low37Very low163 Ų163118.6 Ų118.687%0.87279%0.789SS**  92.8149.4127.9-156.329.7000122.4
280A31.2Very low37.7Very low69 Ų69119 Ų11957%0.5779%0.789SS**  trans64.198.2166.700000118.7
281T28.6Very low37.1Very low129 Ų129121.5 Ų121.579%0.79179%0.787SS**  58.6129.392.462.90000115.3
282V30.7Very low36.7Very low135 Ų135120.4 Ų120.482%0.81878%0.781SS**  cis-146.7175.349.3-66.30000115.1
283S30.8Very low36Very low112 Ų112121.5 Ų121.578%0.78379%0.786SS**  trans-32.4152.5174.5-37.50000117.5
284S32.8Very low35.6Very low119 Ų119121.3 Ų121.383%0.83279%0.788SS**  cis-163.7-177.619.7-140.40000110.1
285A32.3Very low34.9Very low100 Ų100112.4 Ų112.483%0.82678%0.775SS**  cis-147.6-86.47.500000114.2
286G26.5Very low35.8Very low70 Ų70114.9 Ų114.972%0.72278%0.777SS**  trans179.2-173-174.800000113.7
287P48.8Very low35.5Very low120 Ų120115.5 Ų115.578%0.77978%0.776SS**  cis-133.8166.613.942.1-26.2000117.7
288S35.8Very low34.5Very low116 Ų116113.7 Ų113.781%0.81177%0.771SS**  trans80.1163152.3-66.80000119.3
289P52.1Low34.7Very low114 Ų114115.1 Ų115.174%0.7478%0.776SS**  trans-128.5-155.8-136.649.7-37.3000113.6
290P49Very low35.1Very low106 Ų106110.6 Ų110.669%0.68877%0.768SS**  cis-133.1167.9-11.938.9-21.6000116.5
291L29.3Very low35.7Very low155 Ų155112.4 Ų112.481%0.81277%0.774SS**  168.1142.8121.7-89174.5000114.9
292T32.8Very low35.9Very low115 Ų115118.5 Ų118.571%0.70678%0.782SS**  trans41.6118.8155.357.90000122.6
293L29.9Very low36.3Very low166 Ų166115.5 Ų115.587%0.86978%0.778SS**  -162.9-176.3104.8-134.571.6000112.8
294S30.4Very low37.2Very low112 Ų112116.6 Ų116.678%0.78378%0.783SS**  trans-59.9155.7-169.8-48.10000117.2
295G33.2Very low37.2Very low70 Ų70115.1 Ų115.172%0.72278%0.778SS**  trans-74.5-178.1169.200000114.1
296P51.6Low38Very low130 Ų130115.5 Ų115.584%0.84477%0.772SS**  -149.6176.859.142.2-23.8000118.3
297S29.1Very low38.3Very low112 Ų112118.2 Ų118.278%0.78378%0.775SS**  trans84126.2147.6-148.60000122.8
298A32.5Very low37.7Very low83 Ų83120.3 Ų120.369%0.68678%0.779SS**  trans74.6140.6144.700000123.5
299S32.6Very low38Very low122 Ų122119.2 Ų119.285%0.85377%0.769SS**  trans81.2120162.5-32.60000118.7
300G38.4Very low37.2Very low68 Ų68125.8 Ų125.870%0.70178%0.78SS**  trans-82.9-162.2161.900000112.3
301P42.2Very low36.4Very low107 Ų107124.7 Ų124.770%0.69579%0.787SS**  -157.8163.16240.4-19000119.1
302W33.7Very low36.6Very low257 Ų257124 Ų12497%0.97379%0.789SS**  trans58.5138175-38.186.2000115.2
303G38Very low36.7Very low71 Ų71122.6 Ų122.673%0.73279%0.789SS**  cis138.9150.617.800000107.1
304P49.5Very low36.9Very low136 Ų136119.8 Ų119.888%0.88378%0.784SS**  cis-128.7-164.719.343.8-27000114.9
305A33.9Very low37.9Very low88 Ų88119.9 Ų119.973%0.72778%0.781SS**  trans-95.9-176.8174.800000111.3
306P48.6Very low37.7Very low107 Ų107123 Ų12370%0.69579%0.787SS**  cis-144.4170.529.843.3-23000119.8
307T34Very low36.7Very low128 Ų128122.3 Ų122.379%0.78579%0.785SS**  trans50.9127.8148.650.60000123.3
308D34.8Very low37.2Very low164 Ų164123 Ų12388%0.87779%0.787SS**  -155.3169.4127.1-124.114.3000109.9
309P41.8Very low37.1Very low93 Ų93125.7 Ų125.760%0.60480%0.795SS**  trans-117.6-172.5-158.829.4-9.6000115.9
310W35.8Very low37.1Very low252 Ų252125.6 Ų125.696%0.95579%0.794SS**  trans72.880.4173.8-52.990.4000117
311G33.5Very low37.2Very low82 Ų82128.1 Ų128.185%0.84580%0.796SS**  trans-155.2130.6161.400000109.5
312V33.4Very low37.1Very low142 Ų142130.4 Ų130.486%0.86180%0.802SS**  trans-118.2138.2-163.678.50000112.7
313A33.6Very low37.5Very low84 Ų84122.1 Ų122.169%0.69478%0.781SS**  trans32.5144.1148.900000120.7
314S35.6Very low37.4Very low108 Ų108130.5 Ų130.576%0.75579%0.791SS**  cis172.5-174.11.8-100.40000107.3
315P49.7Very low36.6Very low114 Ų114128.1 Ų128.174%0.7479%0.791SS**  cis-133.6168.9-39.736.3-21.1000113.1
316T29Very low36.5Very low136 Ų136128.1 Ų128.183%0.83480%0.8SS**  trans-141.9133.7150.537.90000111.5
317S30.8Very low35.8Very low114 Ų114126.9 Ų126.980%0.79781%0.806SS**  trans46.1122.8161.3-570000120.7
318P39.3Very low35.8Very low128 Ų128127.6 Ų127.683%0.83181%0.811SS**  trans-85.1142.8170.734.8-32.9000112.7
319T31.2Very low35.9Very low139 Ų139124.3 Ų124.385%0.85381%0.806SS**  trans-128.2126.8155.5-58.50000107.1
320S33.1Very low35.9Very low119 Ų119125.6 Ų125.683%0.83282%0.815SS**  trans-128.1125.8176.9-173.40000109.8
321T40.3Very low36Very low122 Ų122120.2 Ų120.275%0.74881%0.81SS**  trans-120.7130.6172.450.10000108.2
322D39.3Very low36Very low155 Ų155123 Ų12383%0.82981%0.81SS**  trans-157.2173.7153-133.924.3000109.4
323P43.3Very low36.3Very low82 Ų82120.1 Ų120.153%0.53280%0.801SS.*  -130.5-149.9-109.739.8-19.5000112.3
324W35.8Very low36.7Very low248 Ų248121.8 Ų121.894%0.93981%0.805SS**  trans6990.2-176.3-47.299.6000113.6
325G32.1Very low37.2Very low85 Ų85122.4 Ų122.488%0.87681%0.807SS**  trans-105.9178.9179.200000114.4
326G32.7Very low37Very low89 Ų89123.1 Ų123.192%0.91881%0.811SS**  trans132.591.1170.700000113.8
327G32.9Very low37.5Very low80 Ų80124.1 Ų124.183%0.82581%0.812SS**  trans175.1133.4174.400000112.6
328T34.9Very low37.8Very low144 Ų144123.5 Ų123.588%0.88380%0.804SS**  trans-78.3145.5-179.645.80000112.6
329A35.5Very low38Very low94 Ų94129.2 Ų129.278%0.77781%0.81SS**  trans-75.3154.5-178.500000114.4
330P42.7Very low38.1Very low121 Ų121126 Ų12679%0.78680%0.804SS**  trans-119.3141.714135.4-27.8000111.7
331T36.4Very low38Very low139 Ų139129.3 Ų129.385%0.85381%0.806SS**  trans-92.2130.6178.3-58.70000111.4
332V34Very low37.6Very low139 Ų139128.4 Ų128.484%0.84280%0.801SS**  trans-138140.7165.1-1790000108.6
333A40.2Very low37.2Very low82 Ų82126.6 Ų126.668%0.67880%0.8SS**  trans-108.9154.7-175.800000112.9
334P43Very low36.7Very low120 Ų120130.8 Ų130.878%0.77981%0.812SS**PPolyproline II helixtrans-78161.2171.732.8-34.7000113.2
335P45.7Very low36.5Very low121 Ų121129 Ų12979%0.78681%0.811SS**PPolyproline II helixtrans-83.7167-171.534.1-37.3000115.4
336P44Very low36.5Very low129 Ų129131.1 Ų131.184%0.83881%0.807SS**PPolyproline II helixtrans-90.3168.1-171.736.7-37.9000116
337D41.3Very low36.5Very low157 Ų157133.6 Ų133.684%0.8480%0.799SS**PPolyproline II helixtrans-87.8143.3-177.1-144.86000112.3W339D337-W339 PolarHBondContact O-N 3.07Å
338P37.2Very low36.5Very low100 Ų100136.6 Ų136.665%0.64980%0.796SS**SBendtrans-107.246.2-151.442.2-38.3000116.7
339W42.2Very low36.6Very low249 Ų249135.3 Ų135.394%0.94379%0.788SS**  trans-131.837.3176.2-71.892.8000114.6D337D337-W339 PolarHBondContact O-N 3.07Å
340G33.3Very low36.7Very low71 Ų71136 Ų13673%0.73278%0.779SS**  trans-113.2100168.600000111.4
341E31.2Very low36.4Very low188 Ų188136 Ų13688%0.87978%0.778SS**  trans-82.4131.6-171.8-165.5171.3115.500112.9
342T31.9Very low36.4Very low103 Ų103140.7 Ų140.763%0.63278%0.781SS**  trans-110115.817657.90000111.1
343S31.1Very low36.1Very low117 Ų117137.7 Ų137.782%0.81878%0.778SS**  trans-91.3116.7165.1-92.30000109.9
344H33.8Very low36Very low170 Ų170141.3 Ų141.379%0.78779%0.786SS**  trans-76.9147.9-176.7-52.7-79.9000112.5
345K29.7Very low35.6Very low211 Ų211141.2 Ų141.292%0.91779%0.788SS**  trans-132.3146.6162.5-135.4-179.7-175.6-175.80109.8
346V32.3Very low35Very low130 Ų130139.7 Ų139.779%0.78879%0.785SS**  trans-106.6158.1-168-157.60000111
347N33.6Very low34.4Very low141 Ų141140.3 Ų140.375%0.75479%0.787SS**  trans-24.2136.5174.9-66.2-4.8000116.8
348N31.7Very low34.2Very low142 Ų142139 Ų13976%0.75979%0.785SS**  65.2126.769.2-145.718.9000110.7
349V37.3Very low35.1Very low118 Ų118139.8 Ų139.872%0.71579%0.789SS**  cis-147.7154.736.9175.20000113.3
350D38.7Very low35.5Very low109 Ų109134.1 Ų134.158%0.58379%0.785SS**  trans-13.8155153.3-151.216.3000119.7W352D350-W352 PolarHBondContact OD1-N 2.99Å; D350-W352 PolarHBondContact OD2-NE1 3.32Å
351P35.6Very low35.7Very low119 Ų119136.4 Ų136.477%0.77379%0.79SS**  -148.7118.883.536.2-15.6000118.3
352W36.7Very low36Very low238 Ų238132.2 Ų132.290%0.90279%0.787SS**  trans55.1110.5142.8-73.157.2000120.7D350D350-W352 PolarHBondContact OD1-N 2.99Å; D350-W352 PolarHBondContact OD2-NE1 3.32Å
353G28.4Very low36.4Very low76 Ų76134 Ų13478%0.78479%0.793SS**  trans-173.7123.7160.600000113
354N37.5Very low36.8Very low159 Ų159133.9 Ų133.985%0.8579%0.789SS**  trans-107.5162.4-170.4-10222.4000114.7
355S34.7Very low37.5Very low118 Ų118137.1 Ų137.183%0.82580%0.795SS**  trans81141.9163.8-59.10000117.8
356A32.6Very low37.9Very low88 Ų88130.6 Ų130.673%0.72779%0.787SS**  cis-169.1-179.6-11.800000112
357V32.6Very low38Very low143 Ų143130.1 Ų130.187%0.86779%0.789SS**  trans90157.5163.3-169.40000117.2
358T36.6Very low38.3Very low130 Ų130129.4 Ų129.480%0.79879%0.793SS**  trans-128.6173.2-147.921.10000114.7
359P55.6Low38.7Very low115 Ų115129.3 Ų129.375%0.74780%0.797SS**  trans-98.1-166-16041-38.9000115.4
360P51.3Low38.8Very low130 Ų130128.9 Ų128.984%0.84480%0.796SS**  -141.1-178.495.940.4-26.3000116.1
361S36.7Very low38.8Very low119 Ų119129.9 Ų129.983%0.83281%0.809SS**  trans-104159.4-171.3-179.60000114.2
362A38.4Very low38.5Very low101 Ų101129 Ų12984%0.83581%0.806SS**  trans-153.4143.8154.400000110.8
363D38.8Very low38.1Very low141 Ų141123.8 Ų123.875%0.75480%0.8SS**  trans-114.9131.5-171.4-154.9-20.2000110.1W365D363-W365 PolarHBondContact O-N 3.39Å
364P40.7Very low38.1Very low113 Ų113125.7 Ų125.773%0.73480%0.802SS**SBendtrans-88.417.6-161.733.7-36.8000117
365W47.8Very low37.8Very low239 Ų239123.3 Ų123.391%0.90580%0.798SS**  trans-122.573.3-172.5-65.398.3000114.1D363D363-W365 PolarHBondContact O-N 3.39Å
366G39.3Very low37.7Very low73 Ų73123.8 Ų123.875%0.75380%0.801SS**  trans-131.7143.1176.900000114
367S32.9Very low37.5Very low120 Ų120123.9 Ų123.984%0.83981%0.81SS**  trans-80.9146.8-173.6-55.30000114.2
368P40.7Very low37.4Very low126 Ų126120.6 Ų120.682%0.81881%0.806SS**  trans-91.9141.6-17835.2-34.6000114.5
369V40Very low38Very low141 Ų141120.3 Ų120.386%0.85581%0.806SS**  trans-149.1159.7164-107.30000109.2
370P40.1Very low36.9Very low108 Ų108122.1 Ų122.170%0.70181%0.814SS**  trans-97.4158.6-143.736.5-39000116.6
371P38.8Very low36.5Very low130 Ų130122.5 Ų122.584%0.84481%0.809SS**  trans-88.9136.1167.434.7-31.5000112.5
372S29.3Very low36.2Very low102 Ų102122.1 Ų122.171%0.71380%0.804SS**  trans-114.4129.2172.3-700000112.2
373T27.8Very low35.7Very low128 Ų128127.1 Ų127.179%0.78580%0.801SS**  trans49.2111.9146.757.40000120.3
374S28.9Very low35.2Very low116 Ų116125 Ų12581%0.81180%0.804SS**  175.1145120.7-76.10000111.3
375S30.2Very low34.8Very low109 Ų109127 Ų12776%0.76280%0.801SS**  cis177.7112.8-35.444.70000109.2
376S32Very low33.8Very low128 Ų128123 Ų12390%0.89580%0.797SS**  trans-170123.8164.456.90000112.5
377G29.4Very low33.3Very low90 Ų90122.6 Ų122.693%0.92879%0.793SS**  trans111.3111.8162.100000116.6
378G30.8Very low33.7Very low74 Ų74122.3 Ų122.376%0.76379%0.788SS**  trans-169-172.8161.300000107.5
379P47.6Very low33.6Very low124 Ų124122.7 Ų122.781%0.80579%0.788SS**  cis-126.3160.4-10.539.2-25.8000113.2
380V34Very low33.5Very low152 Ų152121.4 Ų121.492%0.92178%0.782SS**  trans-143.2122.8153.7-780000110.8
381D42Very low32.9Very low139 Ų139121.1 Ų121.174%0.74379%0.789SS**  trans-154.7129166.1169.121.7000105.4W383D381-W383 PolarHBondContact OD1-N 2.97Å; D381-W383 VanDerWaalsContact OD1-N 3.15Å
382P30.2Very low32.5Very low111 Ų111120.2 Ų120.272%0.72179%0.786SS**  -146.1121.8128.232.5-14.5000116.2
383W27.9Very low32.4Very low205 Ų205122.6 Ų122.678%0.77779%0.791SS**  trans67.194132.3-74.870.7000120.8D381 K385D381-W383 PolarHBondContact OD1-N 2.97Å; D381-W383 VanDerWaalsContact OD1-N 3.15Å; W383-K385 HydrophobicContact CE3-CD 4.48Å; W383-K385 HydrophobicContact CZ3-CD 4.29Å
384A28.8Very low33Very low97 Ų97121.9 Ų121.980%0.80279%0.788SS**  trans-167.9120.3137.700000106.5
385K32.1Very low33.1Very low155 Ų155123 Ų12367%0.67478%0.784SS**  cis59.313627.2-95.6-169.9174.1-174.90113.3W383W383-K385 HydrophobicContact CE3-CD 4.48Å; W383-K385 HydrophobicContact CZ3-CD 4.29Å
386D27.8Very low33.3Very low155 Ų155123.8 Ų123.883%0.82978%0.784SS**  cis-120.8-168.732.3-76.2-59.6000117.2
387G28.6Very low33.5Very low65 Ų65121.5 Ų121.567%0.6777%0.768SS**  trans-127-125.2-179.800000114.3
388P41.5Very low33.6Very low114 Ų114124.8 Ų124.874%0.7477%0.765SS**  -139.9166.9-99.338.2-21.8000118.2
389V37.2Very low33.7Very low134 Ų134128 Ų12881%0.81276%0.763SS**  trans65.2163.2155.2-69.10000118.2
390P39.5Very low33.1Very low113 Ų113133.7 Ų133.773%0.73477%0.768SS**  cis-144.6170.119.144.5-25.3000121.2
391A27.2Very low33Very low102 Ų102132.6 Ų132.684%0.84377%0.767SS**  trans63.8149152.100000119.4
392S30Very low32.4Very low112 Ų112129.6 Ų129.678%0.78377%0.769SS**  cis-142.4150.515.758.10000115.2
393D26.9Very low32.5Very low152 Ų152129.6 Ų129.681%0.81377%0.772SS**  trans-57.7171.8156-70.3-69.4000112.4
394P40.3Very low32.8Very low112 Ų112124.9 Ų124.973%0.72778%0.776SS**  cis-143.8-165.322.534.9-9.6000117.5
395I30.3Very low33Very low140 Ų140129.2 Ų129.272%0.71878%0.777SS**  trans86.385.9165.4-48.3-177.1000115.9
396T35.7Very low33.1Very low126 Ų126131 Ų13177%0.77379%0.787SS**  trans-75.5147.7130.5177.60000109.4
397S35.3Very low33.5Very low79 Ų79129.4 Ų129.455%0.55278%0.783SS**  trans-153.479.9166.4650000111.8I399S397-I399 PolarHBondContact O-N 3.38Å
398D31.7Very low33.6Very low160 Ų160134.2 Ų134.286%0.85679%0.794SS**  trans-61.7120.3151.2-83.2-64.5000108.7
399I33.3Very low33.1Very low141 Ų141131.9 Ų131.972%0.72379%0.79SS**  trans-124.677.8179.6-52.4-179.5000110.3S397S397-I399 PolarHBondContact O-N 3.38Å
400W34.8Very low32.8Very low244 Ų244133 Ų13392%0.92480%0.797SS**  trans-161.699137.7-141.6-65.6000113.1
401S32.6Very low32.4Very low128 Ų128131.2 Ų131.290%0.89580%0.8SS**  trans-161.8116.6156.6-86.50000110.2
402G29.2Very low32.5Very low76 Ų76133.3 Ų133.378%0.78480%0.797SS**  trans-98.3125.1-173.700000113.7
403S32.6Very low33.7Very low112 Ų112133.3 Ų133.378%0.78379%0.794SS**  trans48.6101.4148.5179.60000119.3
404A33.1Very low34Very low105 Ų105132.1 Ų132.187%0.86878%0.784SS**  trans-125.3125.8142.400000109.1
405K33.3Very low33.7Very low189 Ų189135.3 Ų135.382%0.82278%0.782SS**  trans-84.5134.4179-67.9177.8178.8175.50110.6
406H35.2Very low33.8Very low191 Ų191138.8 Ų138.888%0.88479%0.786SS**  trans-146.8164.5152.7-112.3-85.3000110.9
407T34.3Very low33.5Very low122 Ų122136.3 Ų136.375%0.74879%0.785SS**  trans-117.2176.9-161.250.10000113.9
408N32.5Very low33.3Very low167 Ų167138 Ų13889%0.89380%0.797SS**  trans72.2149.9-172.9-67.1-1.9000115.7
409G30.3Very low33.4Very low64 Ų64134.9 Ų134.966%0.6679%0.787SS**  cis152.4110.7-11.700000115.2
410T30.6Very low33.4Very low157 Ų157134.3 Ų134.396%0.96379%0.791SS**  trans53.9113.6150.1-45.30000119.8
411G31.1Very low33.4Very low77 Ų77129.1 Ų129.179%0.79479%0.786SS**  trans162.390.7159.200000117.9
412D29.7Very low33.3Very low146 Ų146126.9 Ų126.978%0.78178%0.783SS**  trans-85.8165.4154.9-150.6-125.9000107.8
413P54.5Low33.3Very low111 Ų111128.9 Ų128.972%0.72178%0.784SS**  cis-156.5161.444.242.6-18.6000124.1
414E33.4Very low33.2Very low128 Ų128130.1 Ų130.160%0.59878%0.782SS**  trans70.1135.7141-82.4-139.4115.800126.4
415R34.9Very low33.1Very low178 Ų178129.9 Ų129.967%0.67277%0.773SS**  trans79.2133.4140.7-78.5176.5-165.3-66.7-21.6120.9
416R31.3Very low32.9Very low214 Ų214127.9 Ų127.981%0.80878%0.778SS**  cis179.2126.834.3161.3-167-71.5-96.95.1114
417G29.4Very low32.6Very low73 Ų73122.7 Ų122.775%0.75378%0.775SS**  trans65.3164.8157.100000119.7
418S32.1Very low32.4Very low116 Ų116122.5 Ų122.581%0.81178%0.779SS**  cis175.9164.3-11.6-94.40000109.3
419S33.3Very low32.9Very low93 Ų93119.4 Ų119.465%0.6577%0.768SS**  cis-174.7168.8-17-80.90000110.5
420T32.4Very low33.3Very low130 Ų130122.7 Ų122.780%0.79878%0.775SS**  trans66.1153.1155.344.70000121.9
421T34.8Very low33.8Very low135 Ų135120 Ų12083%0.82876%0.76SS**  cis179.3141.6-42.228.10000113.6
422G30.4Very low34Very low80 Ų80125.4 Ų125.483%0.82576%0.762SS**  trans90.2162.7162.200000117.5
423C30.2Very low34.3Very low119 Ų119124.8 Ų124.880%0.80476%0.759SS**  cis-176.3171.9-25.163.60000107.7
424D29.5Very low34.1Very low138 Ų138126.8 Ų126.874%0.73876%0.763SS**  cis-163.2171.7-2.3-143.7-78.4000113.1
425S31.4Very low34.6Very low99 Ų99125.5 Ų125.569%0.69277%0.768SS**  trans66.3126.3145.3-78.80000126.8
426T29.2Very low35.2Very low148 Ų148122.5 Ų122.591%0.90877%0.774SS**  trans114.3117.5137.4-35.20000119.3
427G29.4Very low35.8Very low81 Ų81120.6 Ų120.684%0.83578%0.779SS**  trans137.7114.8154.900000117.5
428S29.3Very low36.5Very low118 Ų118120.8 Ų120.883%0.82578%0.781SS**  trans-123.4164.2171.4-1590000107.8
429P43.8Very low36.9Very low103 Ų103120.9 Ų120.967%0.66978%0.782SS**  cis-145.6-178.220.338.9-15.5000118.5
430V38.5Very low37.2Very low132 Ų132122 Ų12280%0.879%0.789SS**  trans46.8126.4159-66.60000122.4
431P40.3Very low37.4Very low100 Ų100123.6 Ų123.665%0.64979%0.792SS**  trans-100.9169.5160.136.8-30.5000114.3
432F35.3Very low37.9Very low192 Ų192123.1 Ų123.184%0.84279%0.791SS**  trans81.478.7168.8-50.8-63.6000119.4
433D35.8Very low38.5Very low132 Ų132125.9 Ų125.971%0.70679%0.792SS**  trans-103143.2141.2178.40.6000107.9S435D433-S435 VanDerWaalsContact OD1-CB 3.32Å; D433-S435 WeakPolarHBondContact OD1-CB 3.32Å; D433-S435 PolarHBondContact OD1-N 3.22Å; D433-S435 VanDerWaalsContact OD1-N 3.08Å; D433-S435 PolarHBondContact OD1-OG 2.59Å
434L50.5Low39Very low154 Ų154131.5 Ų131.581%0.80680%0.796SS**  trans-104.913.9-174.7-70.3173.2000113.9S436L434-S436 VanDerWaalsContact C-N 3.31Å; L434-S436 PolarHBondContact O-N 3.38Å; L434-S436 VanDerWaalsContact O-N 3.11Å
435S45Very low39.8Very low100 Ų100134.1 Ų134.170%0.69980%0.801SS**  trans-79.820.3-168.8-59.80000117D433D433-S435 VanDerWaalsContact OD1-CB 3.32Å; D433-S435 WeakPolarHBondContact OD1-CB 3.32Å; D433-S435 PolarHBondContact OD1-N 3.22Å; D433-S435 VanDerWaalsContact OD1-N 3.08Å; D433-S435 PolarHBondContact OD1-OG 2.59Å
436S47.2Very low41.1Very low115 Ų115133.6 Ų133.680%0.80479%0.794SS**  trans-146.943.1-171.2-134.50000118.4L434L434-S436 VanDerWaalsContact C-N 3.31Å; L434-S436 PolarHBondContact O-N 3.38Å; L434-S436 VanDerWaalsContact O-N 3.11Å
437L44.4Very low42.2Very low174 Ų174131.6 Ų131.691%0.91178%0.783SS**  trans-112.623.9170.1-79170.4000114.3
438G42.6Very low43.4Very low77 Ų77134.7 Ų134.779%0.79478%0.776SS**  trans-80.7-6.1-177.500000116.8
439S41.7Very low44.7Very low119 Ų119133 Ų13383%0.83276%0.764SS**SBendtrans-144.372.3-161.2-62.30000115.5
440S38.9Very low45.3Very low116 Ų116136.6 Ų136.681%0.81177%0.77SS**  trans-175.7107.1141.1-1720000112.1
441L37.6Very low46.5Very low164 Ų164136.5 Ų136.586%0.85976%0.764SS**  trans-143.9140.8160.7-75.2179.3000109.3
442P44.9Very low47.6Very low124 Ų124133.8 Ų133.881%0.80575%0.754SS**PPolyproline II helixtrans-70.2147.4179.428.4-34.2000112.7
443V43Very low48.7Very low139 Ų139131 Ų13184%0.84276%0.755SS**PPolyproline II helixtrans-72.5145.5-170.4176.90000113
444R41.3Very low49.4Very low237 Ų237130.1 Ų130.189%0.89475%0.75SS**PPolyproline II helixtrans-60.2142.3176-71178.1170.1167.7-3.9112.6
445K46.4Very low49.8Very low192 Ų192124.8 Ų124.884%0.83573%0.729SS**PPolyproline II helixtrans-94.7142.2162.6-65.9179.8178.3179.20110.1
446T57.4Low50.4Low88 Ų88124.9 Ų124.954%0.5474%0.735SS.*PPolyproline II helixtrans-96.7150.8177.547.70000112E448 S449T446-E448 VanDerWaalsContact C-N 3.3Å; T446-E448 PolarHBondContact O-N 3.01Å; T446-S449 PolarHBondContact O-N 3.13Å; T446-S449 PolarHBondContact O-OG 3.25Å
447P53.3Low50.9Low106 Ų106126.3 Ų126.369%0.68873%0.733SS**G310 helixtrans-69.6-20.2-173.127.4-35.5000114.6S449 F450P447-S449 PolarHBondContact O-N 3.37Å; P447-S449 VanDerWaalsContact O-N 3.11Å; P447-F450 PolarHBondContact O-N 3.36Å; P447-F450 VanDerWaalsContact O-N 3.1Å
448E54.3Low51.6Low147 Ų147122.6 Ų122.669%0.68772%0.718SS**G310 helixtrans-58.5-25.6177.2-63179.2120.900112.9T446 F450T446-E448 VanDerWaalsContact C-N 3.3Å; T446-E448 PolarHBondContact O-N 3.01Å; E448-F450 PolarHBondContact O-N 3.23Å; E448-F450 VanDerWaalsContact O-N 3.09Å
449S56.4Low52.1Low82 Ų82124.7 Ų124.757%0.57371%0.711SS**G310 helixtrans-64.7-7.7176.361.80000115.2T446 P447T446-S449 PolarHBondContact O-N 3.13Å; T446-S449 PolarHBondContact O-OG 3.25Å; P447-S449 PolarHBondContact O-N 3.37Å; P447-S449 VanDerWaalsContact O-N 3.11Å
450F55.9Low52.7Low179 Ų179124.2 Ų124.279%0.78570%0.698SS**G310 helixtrans-108.4-12.5-177.1-83.5-89.3000116P447 E448P447-F450 PolarHBondContact O-N 3.36Å; P447-F450 VanDerWaalsContact O-N 3.1Å; E448-F450 PolarHBondContact O-N 3.23Å; E448-F450 VanDerWaalsContact O-N 3.09Å
451L63.4Low53.4Low130 Ų130124.8 Ų124.868%0.68169%0.692SS**THydrogen-bonded Turntrans-119.9-13.1-171.8-70173.7000115.4A455L451-A455 HydrophobicContact CB-CB 4.35Å
452G65.2Low54.2Low43 Ų43121.7 Ų121.744%0.44368%0.684SS.*G310 helixtrans60.7-153.9176.400000113.7N454 A455G452-N454 PolarHBondContact O-N 3.2Å; G452-A455 PolarHBondContact O-N 3.27Å
453P57.3Low54.6Low133 Ų133122.6 Ų122.686%0.86468%0.682SS**G310 helixtrans-68.9-1.1-167.527.2-35.3000115.8
454N50.9Low55Low113 Ų113122 Ų12260%0.60468%0.678SS**G310 helixtrans-95.3-0.4175.9-69.9-61.5000113.9G452 A456 L457G452-N454 PolarHBondContact O-N 3.2Å; N454-A456 PolarHBondContact O-N 3.11Å; N454-A456 VanDerWaalsContact O-N 3.11Å; N454-L457 PolarHBondContact O-N 3.08Å
455A59Low55.1Low43 Ų43115.8 Ų115.836%0.35567%0.671SS.*G310 helixtrans-57.4-27.2-179.500000113.8L451 G452 L457L451-A455 HydrophobicContact CB-CB 4.35Å; G452-A455 PolarHBondContact O-N 3.27Å; A455-L457 PolarHBondContact O-N 3.25Å
456A58Low54.7Low101 Ų101112.7 Ų112.784%0.83567%0.673SS**G310 helixtrans-73.1-2.5-179.800000115.4N454N454-A456 PolarHBondContact O-N 3.11Å; N454-A456 VanDerWaalsContact O-N 3.11Å
457L56.8Low53.8Low145 Ų145117.7 Ų117.776%0.75969%0.687SS**G310 helixtrans-96.2-0.6-179.7-83167.6000114.7N454 A455N454-L457 PolarHBondContact O-N 3.08Å; A455-L457 PolarHBondContact O-N 3.25Å
458V60.6Low53.5Low97 Ų97118.6 Ų118.659%0.58869%0.694SS**  trans-129.282.9-178.1-166.60000110.4L460V458-L460 HydrophobicContact CG1-CD2 3.7Å; V458-L460 HydrophobicContact CG1-CG 4.01Å; V458-L460 PolarHBondContact O-N 3.1Å
459D52Low52.7Low121 Ų121121.3 Ų121.365%0.64770%0.703SS**  trans-76.387.3178.6-172.66.6000111.6D461D459-D461 VanDerWaalsContact C-N 3.28Å; D459-D461 PolarHBondContact O-N 3.47Å; D459-D461 PolarHBondContact OD1-N 2.65Å
460L53.5Low51.9Low109 Ų109123.4 Ų123.457%0.57172%0.715SS**G310 helixtrans-72.3-14.1-175.3-66.9175.8000114.2V458 S462 L463V458-L460 HydrophobicContact CG1-CD2 3.7Å; V458-L460 HydrophobicContact CG1-CG 4.01Å; V458-L460 PolarHBondContact O-N 3.1Å; L460-S462 PolarHBondContact O-N 3.38Å; L460-L463 HydrophobicContact CD2-CD1 4.11Å; L460-L463 PolarHBondContact O-N 3.03Å
461D54.2Low51.1Low128 Ų128124.8 Ų124.868%0.68472%0.721SS**G310 helixtrans-63.2-35.8-179.8-165.165.6000111.2D459 L463 V464D459-D461 VanDerWaalsContact C-N 3.28Å; D459-D461 PolarHBondContact O-N 3.47Å; D459-D461 PolarHBondContact OD1-N 2.65Å; D461-L463 PolarHBondContact O-N 3.08Å; D461-L463 VanDerWaalsContact O-N 3.09Å; D461-V464 PolarHBondContact O-N 3.21Å
462S54.8Low50Low98 Ų98127.5 Ų127.569%0.68573%0.73SS**G310 helixtrans-64.3-11.7175.2-72.10000114.7L460L460-S462 PolarHBondContact O-N 3.38Å
463L52.7Low49Very low144 Ų144130.5 Ų130.575%0.75474%0.741SS**G310 helixtrans-99.2-8.8177.5-73.2170000114.1L460 D461L460-L463 HydrophobicContact CD2-CD1 4.11Å; L460-L463 PolarHBondContact O-N 3.03Å; D461-L463 PolarHBondContact O-N 3.08Å; D461-L463 VanDerWaalsContact O-N 3.09Å
464V52.8Low48.6Very low127 Ų127129.8 Ų129.877%0.7774%0.737SS**SBendtrans-119.828.3-173.5-163.30000112.8D461D461-V464 PolarHBondContact O-N 3.21Å
465S42.7Very low48.4Very low105 Ų105129.9 Ų129.973%0.73474%0.744SS**  trans-137.2104.4173.3-164.30000113.3
466S37.9Very low47.6Very low127 Ų127134 Ų13489%0.88877%0.767SS**  trans-122.975.4-17751.60000113.4
467K39.4Very low46.6Very low193 Ų193134.6 Ų134.684%0.83977%0.765SS**  trans-148.5133.1163.2-150.3163.4-173.8177.10111.8
468P45.6Very low45.6Very low126 Ų126135.8 Ų135.882%0.81877%0.77SS**  trans-80.4152.6-16531-36.8000114.5
469K38.4Very low44.3Very low203 Ų203137 Ų13788%0.88378%0.783SS**  trans-107.6161.8166.8-97.7-178.9176.9174.60111.2
470P39.9Very low43.2Very low127 Ų127135.8 Ų135.883%0.82579%0.79SS**  trans-79.4171.2-171.832.8-36.7000114.4
471K38.3Very low42Very low208 Ų208135.5 Ų135.590%0.90480%0.797SS**  trans-64.5144.3-173.7-58.8177.6178.9-179.40114
472Q41.1Very low41.1Very low186 Ų186134.4 Ų134.487%0.86980%0.799SS**  trans-114161.3153.2-102.1-174.5-101.200110.4
473P43.5Very low40.2Very low106 Ų106135.6 Ų135.669%0.68881%0.808SS**PPolyproline II helixtrans-80.4161.6-178.133.8-35.7000113.2
474P48.3Very low39.6Very low119 Ų119136.2 Ų136.277%0.77381%0.812SS**PPolyproline II helixtrans-83.3148.3-174.333.3-35.9000114.2
475P46.3Very low39Very low115 Ų115137.8 Ų137.875%0.74782%0.816SS**PPolyproline II helixtrans-76.7163.3162.833.9-34.3000111.9
476P43.6Very low38.8Very low129 Ų129138.4 Ų138.484%0.83882%0.817SS**PPolyproline II helixtrans-77.8161.2-173.731.8-36.7000114.6
477S36.7Very low38.6Very low114 Ų114141.8 Ų141.880%0.79782%0.816SS**PPolyproline II helixtrans-63.9146.6-176.1-48.50000115.2
478I35.4Very low38.5Very low169 Ų169141.2 Ų141.287%0.86782%0.821SS**  trans-126.1144.5149.955173.2000109.1
479S32.7Very low38.1Very low123 Ų123143.6 Ų143.686%0.8682%0.822SS**  trans-109.2117-165.2-590000113.3
480A29.8Very low37.9Very low96 Ų96141.2 Ų141.279%0.79382%0.818SS**  trans-173.5150.816000000108.6
481S29Very low37.6Very low102 Ų102141.6 Ų141.671%0.71382%0.819SS**  cis-176.7168.1-2648.40000107.2
482S34.5Very low37.3Very low106 Ų106134.8 Ų134.874%0.74181%0.807SS**  trans68.475.7156.7-48.60000118.7
483S36.1Very low37Very low123 Ų123132.2 Ų132.286%0.8681%0.81SS**  trans-8998.9155.157.60000110.4
484N39.1Very low36.7Very low156 Ų156132.7 Ų132.783%0.83482%0.816SS**  trans-111.8123.4174.2-89.6-13.8000110.6
485N41.2Very low36.8Very low160 Ų160133.1 Ų133.186%0.85682%0.819SS**  trans-116.3113.2177-154.69.6000108.5F487N485-F487 PolarHBondContact O-N 3.02Å
486P38Very low36.1Very low118 Ų118131.9 Ų131.977%0.76682%0.819SS**  trans-90.953.5-154.436.9-39.3000114.5
487F34.3Very low36.6Very low199 Ų199132 Ų13287%0.87382%0.819SS**  trans-152.596.6170.4-130.9-86.4000112.7N485N485-F487 PolarHBondContact O-N 3.02Å
488L37Very low36.4Very low180 Ų180129.6 Ų129.694%0.94281%0.812SS**  trans161.4120152.3-91.7163.9000108.5
489Q36.5Very low36.3Very low177 Ų177130.6 Ų130.683%0.82782%0.815SS**  trans-141.2132.3-174.1-177.7172.6-6.600111
490N33.7Very low36.1Very low152 Ų152128.1 Ų128.181%0.81380%0.802SS**  trans62.9138.4-179.4-80.43.4000115.7
491T35.1Very low36.4Very low135 Ų135130.1 Ų130.183%0.82881%0.805SS**  cis-141.1165.3-2.246.80000109.3
492G31.7Very low36.6Very low65 Ų65131.2 Ų131.267%0.6781%0.807SS**  cis148.2-176.91.600000111.7
493S33.9Very low37.1Very low132 Ų132132.1 Ų132.192%0.92381%0.81SS**  trans67151.3178.3-63.50000118.1
494S36.9Very low36.8Very low116 Ų116129.3 Ų129.381%0.81180%0.801SS**  trans-123.5-177.8-173.5-50.80000109.2
495P50.9Low36.5Very low128 Ų128127.4 Ų127.483%0.83180%0.8SS**  cis-138.1-16611.342.4-21.1000116.6
496A33Very low36Very low90 Ų90125.3 Ų125.374%0.74479%0.793SS**  trans-83.9-162.1-178.800000111.9
497P52.6Low36.1Very low131 Ų131127 Ų12785%0.85179%0.794SS**  cis-141.8-173.48.444.8-25.8000117.1
498G32Very low36Very low63 Ų63122.2 Ų122.265%0.64979%0.785SS**  trans14496.2141.100000120
499M33.4Very low36.1Very low190 Ų190117.9 Ų117.994%0.93677%0.77SS**  trans54.9172.1134.8-64.6171.269.700121.2
500A30.4Very low36Very low71 Ų71121 Ų12159%0.58777%0.774SS**  cis-168.5170.8-4800000110.2
501V34.9Very low35.9Very low139 Ų139117 Ų11784%0.84277%0.769SS**  trans68.6148.6160.8-129.40000120.5
502T33Very low35.9Very low125 Ų125117.6 Ų117.677%0.76777%0.772SS**  trans-112.3-163.2168.862.20000108.4
503P46Very low36.1Very low124 Ų124119.8 Ų119.881%0.80578%0.777SS**  cis-129-175.8-2638.1-21.7000113.3
504G29.6Very low36.9Very low64 Ų64119.5 Ų119.566%0.6677%0.772SS**  trans130.1116.4137.800000120.9
505S31.6Very low36.9Very low117 Ų117120.1 Ų120.182%0.81877%0.771SS**  trans62.9158148.7-56.20000119.3
506T32.6Very low37.2Very low115 Ų115119.4 Ų119.471%0.70677%0.767SS**  cis-15915022.1-28.90000111.8
507I38.2Very low37.1Very low154 Ų154121.7 Ų121.779%0.7977%0.771SS**  trans61.4137.6150-84.7164.7000117.7
508S33.6Very low36.2Very low98 Ų98120 Ų12069%0.68576%0.763SS**  cis-172.7172.6-2.8-1000000108.5
509S37.6Very low36.5Very low89 Ų89122 Ų12262%0.62277%0.766SS**  cis-176.8163-25.162.40000109
510R34.6Very low37Very low242 Ų242120.3 Ų120.391%0.91376%0.761SS**  trans71131174.6-57.7174.6168.6165.2-4114.6
511G32Very low38Very low68 Ų68121.9 Ų121.970%0.70177%0.765SS**  cis94.1137.6900000112
512V35Very low37.8Very low148 Ų148125.1 Ų125.190%0.89777%0.768SS**  cis-153.6170.623.1-68.30000113.2
513S37.2Very low37.7Very low112 Ų112122.1 Ų122.178%0.78376%0.762SS**  trans-102.6176163.4-37.30000110
514P50.4Low37.2Very low126 Ų126123.6 Ų123.682%0.81877%0.768SS**  -152.5-151.757.743.1-19000116.2
515T35.4Very low37.5Very low129 Ų129124.7 Ų124.779%0.79177%0.772SS**  trans-102.2-170.5-172.951.60000113.3
516P58.3Low38.8Very low113 Ų113124.5 Ų124.573%0.73477%0.768SS**  cis-133.9-166.3-41.832.4-11000114.5
517V30.3Very low38.8Very low137 Ų137124.9 Ų124.983%0.8378%0.775SS**  trans111.7132.9138105.70000122.9
518S34.3Very low38.6Very low97 Ų97125.6 Ų125.668%0.67878%0.777SS**  trans79.4137.9144.5-155.80000126.5
519S37.3Very low38.6Very low103 Ų103127.7 Ų127.772%0.7279%0.786SS**  trans80.9111.9141.232.50000125.6
520N45.6Very low38.4Very low156 Ų156128.2 Ų128.283%0.83479%0.79SS**  trans-12.4160.4137.5-70.138.8000119.1
521P50Low38.2Very low104 Ų104124.5 Ų124.568%0.67579%0.786SS**  cis-156.7-176.946.145.8-24.4000120.6
522F32.3Very low38.2Very low207 Ų207126.1 Ų126.191%0.90879%0.786SS**  trans57147.6167.5-76.3-85.9000119.5
523G30.7Very low39.5Very low62 Ų62123.9 Ų123.964%0.63978%0.775SS**  cis137.189.5-16.200000116.5
524V34.9Very low39.4Very low154 Ų154126.6 Ų126.693%0.93378%0.775SS**  trans-151155.3159.5-146.50000111.2
525A36Very low39.9Very low88 Ų88125.7 Ų125.773%0.72777%0.769SS**  trans-154.8-173169.500000107.7
526P58.5Low39.7Very low113 Ų113125.6 Ų125.673%0.73477%0.774SS**  cis-126.5-176.1-19.741.4-27.3000112.3
527S32.9Very low38.6Very low122 Ų122125.4 Ų125.485%0.85378%0.775SS**  trans-153.9147.5148.154.10000112.1
528M33.6Very low38.7Very low169 Ų169127 Ų12783%0.83378%0.778SS**  trans-104.8159179.6-50.8-73.1-177.800109.8
529T33.5Very low38.5Very low143 Ų143125.7 Ų125.788%0.87778%0.78SS**  trans-172.1151.9133.1-76.60000110
530S33Very low38.4Very low100 Ų100128.6 Ų128.670%0.69979%0.787SS**  trans-90.6162.1-177.5-1770000112.8
531I31.6Very low37.8Very low163 Ų163127 Ų12784%0.83679%0.788SS**  trans163.9156.6131-84.8159.7000112.1
532S31.1Very low37Very low102 Ų102125.9 Ų125.971%0.71380%0.795SS**  trans-159.4163.7-176.3-176.70000107.6
533P62.4Low37Very low101 Ų101123.7 Ų123.766%0.65679%0.792SS**  cis-128.8-157.6-14.2223.9000112.5
534Q35.2Very low37.1Very low169 Ų169131 Ų13179%0.7980%0.8SS**  trans107.9148.4151.9-60.7-60.4-3900118.6
535P61.9Low37Very low107 Ų107129.4 Ų129.470%0.69579%0.791SS**  trans-109.4-174.3-160.943.7-38.3000114.7
536S31Very low36.9Very low128 Ų128129.6 Ų129.690%0.89579%0.787SS**  trans-148.7165.6162.6-80.40000111.7
537S33.7Very low36.5Very low108 Ų108130.4 Ų130.476%0.75579%0.792SS**  trans-116-169.5-162.3-169.90000112.8
538L33.2Very low36.9Very low171 Ų171130.2 Ų130.290%0.89579%0.786SS**  trans78.6147.6173.5-43.6177.5000114.8
539G30.9Very low37.6Very low69 Ų69127.8 Ų127.871%0.71178%0.782SS**  cis-164.8-1722.500000114.1
540L34.9Very low38.6Very low165 Ų165126.5 Ų126.586%0.86478%0.776SS**  trans-73.2153.1-171.5-72.265.9000114.3
541S31.9Very low38.6Very low123 Ų123129.3 Ų129.386%0.8678%0.784SS**  135.1144.5128.2-60.90000113.9
542G33Very low39.7Very low79 Ų79126.8 Ų126.881%0.81478%0.778SS**  trans153.462.9166.700000119
543L32.7Very low39.8Very low162 Ų162130.1 Ų130.185%0.84878%0.784SS**  trans-29.2138.3164.2-54.1156.3000116.5
544R32.3Very low38.5Very low215 Ų215133.1 Ų133.181%0.81179%0.794SS**  169.5139.3101.8-92-166.8173.8-106-7.5117.4
545T33.3Very low38.4Very low120 Ų120129 Ų12974%0.73680%0.796SS**  trans57.6125.8145.355.70000122.6
546S34.6Very low37.2Very low92 Ų92132.7 Ų132.764%0.64381%0.807SS**  trans-83.9174163.3-175.90000111.8
547P48.8Very low37.4Very low130 Ų130132.4 Ų132.484%0.84480%0.799SS**  -139.9170.3100.739.4-27.4000115.7
548V42Very low37.8Very low119 Ų119135.1 Ų135.172%0.72180%0.8SS**  trans-133.4143.6-177.4169.40000110.4
549P47.5Very low38.6Very low118 Ų118132 Ų13277%0.76679%0.789SS**  trans-102.1157.6160.135.6-27.9000112.9
550P56.2Low38.6Very low115 Ų115132 Ų13275%0.74779%0.79SS**  trans-119.3178.8-148.342.8-33.6000116
551N32.4Very low38.8Very low160 Ų160133.6 Ų133.686%0.85680%0.795SS**  trans-157.2162.1136.7-111.2-2.1000112.2
552P53.8Low38.9Very low110 Ų110131 Ų13171%0.71479%0.789SS**  trans-117.1164.5-162.341.3-32.8000115.8
553M33Very low39.1Very low172 Ų172135.8 Ų135.885%0.84780%0.795SS**  -167.4162.3129.7-107.9-172.683.400114.8
554L35.4Very low39.2Very low164 Ų164130.9 Ų130.986%0.85978%0.783SS**  trans-30.1144.5-174-58.6171.4000121.4
555G33.2Very low40.3Very low81 Ų81126.3 Ų126.384%0.83578%0.781SS**  trans-169.9134.9157.300000109.8
556M36.7Very low40.6Very low186 Ų186130 Ų13092%0.91679%0.792SS**  trans-136141.5-160.7-170.4171.8176.700113.5
557V34.9Very low40.7Very low121 Ų121131.1 Ų131.173%0.73380%0.8SS**  trans57.1115.416785.30000116.6
558Q42.5Very low40.2Very low166 Ų166132.2 Ų132.278%0.77680%0.804SS**  cis76156.848.4-150.2-11813.700113.8
559P50.4Low40Very low104 Ų104129.8 Ų129.868%0.67580%0.803SS**  -100.2-170.7-54.837.3-22.7000111.2
560G30.1Very low39.5Very low70 Ų70133.3 Ų133.372%0.72281%0.812SS**  cis124.596.5-0.700000113.7
561M40.8Very low38.7Very low198 Ų198130.7 Ų130.798%0.97581%0.806SS**  trans-153.7139.1165.5-81.3179.617000107.5
562G33.1Very low39.7Very low70 Ų70129 Ų12972%0.72280%0.804SS**  cis119.880.9-6.500000113.5
563L37.7Very low39.6Very low179 Ų179130.1 Ų130.194%0.93781%0.811SS**  trans-178.5151.1154-103.6165.5000112
564G35.3Very low39.8Very low58 Ų58125.4 Ų125.460%0.59881%0.807SS**  trans-166.4-161.5163.400000106.4
565P54.4Low40.3Very low120 Ų120127.3 Ų127.378%0.77981%0.814SS**  cis-122.4171.8-22.540.4-28.3000111.4
566M39.3Very low40.3Very low197 Ų197126.4 Ų126.497%0.9780%0.804SS**  trans-146144154.7-78.1-156.8175.400111.6
567S36.7Very low40.4Very low116 Ų116126.5 Ų126.581%0.81181%0.807SS**  trans-125.3126.3-176.2-54.70000110.9
568V39.6Very low40.3Very low152 Ų152123.9 Ų123.992%0.92181%0.805SS**  trans-141.9135.4155.9-173.40000107.1
569G36Very low40.1Very low69 Ų69124.4 Ų124.471%0.71181%0.81SS**  trans-124.2153.5171.900000110.5
570M38.8Very low39.7Very low191 Ų191128.9 Ų128.994%0.94182%0.824SS**  trans-148.3139.9170.9-159.358.9147.200110.8
571G37.5Very low40Very low60 Ų60134.3 Ų134.362%0.61983%0.83SS**  trans-86.3179.2177.800000113.8
572P54.4Low39.6Very low126 Ų126129.4 Ų129.482%0.81882%0.822SS**  trans-92.8171-169.738.1-37.5000113.7
573P52.3Low39.7Very low132 Ų132131.6 Ų131.686%0.85783%0.825SS**  trans-113.5156145.736.8-28.3000111.8
574G36.4Very low41Very low74 Ų74128.5 Ų128.576%0.76382%0.816SS**  trans-134.2158.6165.300000110.4
575M45.3Very low41Very low204 Ų204135.4 Ų135.4100%1.00584%0.835SS**  trans-151.4161.7175.6-102.6-179.6169.200110.6
576G34.1Very low39.9Very low61 Ų61132.7 Ų132.763%0.62983%0.83SS**  trans-155.1-150.8-177.300000112.9
577L38.4Very low39.9Very low188 Ų188132.2 Ų132.298%0.98483%0.827SS**  trans74.3148.6-162.4-66.371.7000112.8
578G33.1Very low40.9Very low67 Ų67131.9 Ų131.969%0.69182%0.822SS**  cis-159.6146-4.700000109.8
579M39.3Very low40.6Very low177 Ų177133.6 Ų133.687%0.87282%0.817SS**  71.1100.579.7-175.2-176.2175.200114.6
580M42.2Very low40.5Very low198 Ų198135 Ų13598%0.97582%0.817SS**  trans-150158.9150.7-73.3-155.5177.500110.6
581Q35.1Very low40.2Very low183 Ų183129.4 Ų129.486%0.85581%0.807SS**  trans-156.5136.8-163.7171.8-168.18.900110.7
582A32.4Very low40.1Very low96 Ų96134.9 Ų134.979%0.79382%0.822SS**  trans168.8157.8145.500000114
583S35.4Very low39.3Very low115 Ų115134.1 Ų134.180%0.80482%0.82SS**  trans-128.8-155.1166-31.20000107.5
584P65.2Low39.7Very low115 Ų115133.6 Ų133.675%0.74782%0.816SS**  cis-129161-48.636.4-22.5000113.4
585M35.5Very low39.6Very low202 Ų202138.7 Ų138.7100%0.99582%0.822SS**  trans-179.8162.3159.1-103.8158.8-167.900111.1
586G31.8Very low39Very low64 Ų64131.4 Ų131.466%0.6680%0.799SS**  cis157.560.5-9.900000119.1
587M38.2Very low40.1Very low187 Ų187134.4 Ų134.492%0.92181%0.808SS**  trans64.7178.3165.6-61.3-69.7-171.200116.9
588P58.1Low41Very low108 Ų108131.3 Ų131.370%0.70180%0.799SS**  cis-131.8-162.5-29.322.63.2000114.2
589F32.3Very low40.9Very low188 Ų188131.5 Ų131.583%0.82580%0.801SS**  trans100.395.8153.5-98.4-100.9000123.3
590S35.3Very low40.6Very low100 Ų100129.3 Ų129.370%0.69980%0.803SS**  54.6110119-48.70000124.5
591G32.2Very low40.2Very low72 Ų72124.2 Ų124.274%0.74279%0.792SS**  94.7142102.100000121.4
592L35.4Very low40Very low176 Ų176123 Ų12392%0.92179%0.791SS**  trans178.8157.9136.4-98.9166.4000112.6
593S38.1Very low40.2Very low110 Ų110126.1 Ų126.177%0.76979%0.794SS**  trans-152.7157.1177.3-50.30000112.6
594P60Low39.9Very low120 Ų120123.7 Ų123.778%0.77979%0.787SS**  trans-133.9171.3142.441.2-28.8000110.5
595M34.4Very low39.2Very low181 Ų181124.8 Ų124.889%0.89279%0.793SS**  cis-157.2-178.5-2.5-134.9169.564.100110.6
596G31.8Very low39.1Very low51 Ų51118.7 Ų118.753%0.52678%0.782SS.*  trans-133.4-154.315900000109.4
597P58.9Low39.1Very low124 Ų124121 Ų12181%0.80580%0.796SS**  cis-133.5-143.60.344.8-25000110.3
598P55.5Low38.9Very low124 Ų124120.5 Ų120.581%0.80579%0.793SS**  cis-136.1169-17.338.9-20.9000117.8
599G31.9Very low38.5Very low71 Ų71120.7 Ų120.773%0.73279%0.794SS**  trans97143.1154.300000116.6
600S33Very low39.9Very low130 Ų130117.4 Ų117.491%0.90979%0.792SS**  cis-152.9162.8-6.2-75.80000109.8
601A32.7Very low40.6Very low92 Ų92118.4 Ų118.476%0.7680%0.796SS**  trans-109.7163.2-169.100000114.8
602L31.6Very low40.7Very low158 Ų158122.5 Ų122.583%0.82780%0.796SS**  trans-168.8145.5139.5-126.672.6000114.5
603L37Very low40.7Very low161 Ų161121.4 Ų121.484%0.84379%0.786SS**  trans62129.5156.2-62.5173.1000123.4
604G28.9Very low40.4Very low64 Ų64122.6 Ų122.666%0.6678%0.782SS**  trans-120.3-147.8145.200000108.8
605P51.3Low39.1Very low137 Ų137125.1 Ų125.189%0.8979%0.788SS**  cis-136.5-174.7-3.443.4-26.9000114.9
606G33.4Very low39Very low74 Ų74120.1 Ų120.176%0.76378%0.783SS**  trans136112.3139.900000122.6
607A32.1Very low39Very low114 Ų114121.3 Ų121.394%0.94280%0.795SS**  trans79.4165.9138.300000123.9
608M33Very low38.8Very low176 Ų176121.4 Ų121.487%0.86780%0.796SS**  trans-143.9-176.6-163.3-115.1-163.8-64.400109.1
609P50.7Low38Very low112 Ų112120.4 Ų120.473%0.72780%0.798SS**  cis-130.9-176-641.4-23.4000115.6
610P61.2Low38.1Very low118 Ų118120.6 Ų120.677%0.76680%0.8SS**  trans-116.2145.1-173.239.5-32.9000119.5
611P49.4Very low38.3Very low122 Ų122120 Ų12079%0.79280%0.803SS**  trans-119.4-163.7166.741.4-30.8000114.2
612Q34.3Very low38.3Very low158 Ų158119.4 Ų119.474%0.73881%0.806SS**  -167.3152.5-85-106.7-77-76.300113.8
613Q35Very low38.5Very low152 Ų152115.8 Ų115.871%0.7181%0.807SS**  trans67.3166.7157.9-63.4-159.314.700121.9
614I32Very low38.6Very low136 Ų136115.9 Ų115.970%0.69781%0.805SS**  cis-171.4158.2-42.8-156.2161000111.4
615L33.1Very low39Very low173 Ų173121.2 Ų121.291%0.90682%0.815SS**  trans71.4146.8155.1-151.773.6000121.5
616G31.3Very low38.2Very low76 Ų76118.5 Ų118.578%0.78481%0.812SS**  trans146.9115.7152.200000119.5
617G33.8Very low38.6Very low75 Ų75120.2 Ų120.277%0.77382%0.819SS**  trans-125-162.6151.200000109.1
618P53.1Low38.8Very low126 Ų126118.6 Ų118.682%0.81881%0.814SS**  cis-140.5-174.54.344-25.3000116.1
619A38.3Very low38.9Very low104 Ų104114.1 Ų114.186%0.8681%0.813SS**  trans38.8141.4145.200000124.9
620G35.6Very low38.3Very low75 Ų75114.9 Ų114.977%0.77382%0.82SS**  trans147.895139.600000121.7
621A36.8Very low37.3Very low116 Ų116118 Ų11896%0.95983%0.827SS**  trans40.6143.1141.600000125.7
622G33.3Very low36.6Very low80 Ų80116.3 Ų116.383%0.82583%0.832SS**  134.980.7123.400000123.7
623G35.4Very low36.6Very low83 Ų83112.9 Ų112.986%0.85684%0.839SS**  trans70.6178.2148.700000120.1
624M37.9Very low36.7Very low163 Ų163109.8 Ų109.880%0.80385%0.848SS**  cis-170.8155.6-21.9174.6157.5163.400111.8
625M38.1Very low36.8Very low175 Ų175107.2 Ų107.286%0.86286%0.855SS**  trans75.2145.4161.9-92.9172.9170.800121
626G34.9Very low37.1Very low81 Ų81105.5 Ų105.584%0.83585%0.852SS**  trans146.5118173.200000113.2
627A40.6Very low37.5Very low109 Ų109107 Ų10790%0.90186%0.857SS**  trans-145.1159.9-14400000115
628G36.2Very low37.6Very low81 Ų81107.4 Ų107.484%0.83586%0.86SS**  trans107.3141.5172.800000113.8
629G36.9Very low37.1Very low82 Ų82106.3 Ų106.385%0.84586%0.862SS**  cis136.2111-12.300000114.4
630S37.4Very low37.1Very low127 Ų127107 Ų10789%0.88886%0.86SS**  trans-161.4168.2155-162.80000110.9
631M40.3Very low37.7Very low185 Ų185109.3 Ų109.391%0.91186%0.86SS**  trans-135.4155.6-164.5-67.2159.755.700113.5
632G34.4Very low37.9Very low86 Ų86111.1 Ų111.189%0.88785%0.853SS**  trans110155.5138.500000118
633G33.8Very low39.2Very low86 Ų86111.4 Ų111.489%0.88784%0.841SS**  trans119.894.2168.900000114.8
634G38.3Very low39.6Very low87 Ų87116.8 Ų116.890%0.89784%0.841SS**  trans-108.3146.316000000109.9
635G34.4Very low40.1Very low82 Ų82115.5 Ų115.585%0.84584%0.837SS**  trans-162118.7-174.900000113.5
636T38.7Very low40.5Very low137 Ų137118.8 Ų118.884%0.8486%0.856SS**  trans-63.9148.9-17948.10000115.8
637A40Very low40.8Very low108 Ų108120.7 Ų120.789%0.89386%0.858SS**  trans60127.1141.600000120.6
638G36.1Very low40.8Very low82 Ų82121.3 Ų121.385%0.84586%0.855SS**  trans-162.9111.4163.500000110.2
639A40.9Very low41.1Very low104 Ų104123.6 Ų123.686%0.8686%0.856SS**  trans-92144.117600000110.5
640S39.2Very low41.3Very low117 Ų117126 Ų12682%0.81886%0.857SS**  trans-148.396.3165.3-167.20000110.5
641T48.8Very low41.6Very low125 Ų125125.9 Ų125.977%0.76786%0.855SS**  trans-81.1139.4161.6-57.40000108
642N40.7Very low41.7Very low153 Ų153122 Ų12282%0.81885%0.851SS**  trans-152.1140145.5-104.5-37.7000112.2
643P59.6Low42.2Very low86 Ų86124.6 Ų124.656%0.55885%0.849SS**  trans-101.6167.5178.740.3-34.8000112.4
644F44.3Very low42.8Very low196 Ų196127.5 Ų127.586%0.8685%0.846SS**  trans-164.8115.7134.4-107.3-80.8000105.7
645L48.7Very low43.2Very low137 Ų137130.9 Ų130.972%0.71784%0.842SS**  60.795.366.4-79.6168.1000114
646L47.3Very low44Very low244 Ų244135.4 Ų135.4100%1.27784%0.841SS**  -1500107-109.3162.9000110.4

Retrieved 646 of 646 residues in 366.6 ms (Link to these results)