A0A077Z247_TRITR Loading...

Intraflagellar transport protein 57

AlphaFold DB , UniProt , Accession A0A077Z247, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 375 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
1M44Very low43.6Very low248 Ų248144.3 Ų144.3100%1.22277%0.771SS**  071.30-73.6-173.5-173.600107.5
2E35.4Very low43.8Very low188 Ų188141.8 Ų141.888%0.87975%0.752SS**  trans-91.1122.2175.8-88.4163.7148.600108.3Y4E2-Y4 PolarHBondContact O-N 2.66Å
3G38.6Very low44Very low77 Ų77141.2 Ų141.279%0.79474%0.739SS**  trans-67.1123.9-174.800000111.4G5G3-G5 PolarHBondContact O-N 2.94Å
4Y38.6Very low43.9Very low236 Ų236141.7 Ų141.793%0.92574%0.736SS**  trans-69.681.6159.7-85.4-93.2000108.8E2 K6E2-Y4 PolarHBondContact O-N 2.66Å; Y4-K6 VanDerWaalsContact C-N 3.35Å; Y4-K6 PolarHBondContact O-N 2.99Å; Y4-K6 VanDerWaalsContact O-N 3.1Å
5G40.9Very low44Very low65 Ų65145.8 Ų145.867%0.6774%0.738SS**  trans-66.897.8156.800000107.7G3 D7G3-G5 PolarHBondContact O-N 2.94Å; G5-D7 VanDerWaalsContact C-N 3.33Å; G5-D7 PolarHBondContact O-N 2.87Å
6K47.4Very low44.1Very low192 Ų192145.1 Ų145.184%0.83573%0.731SS**  trans-69.994.3172.8-144178.3-171.1-176.80106.8Y4 I8Y4-K6 VanDerWaalsContact C-N 3.35Å; Y4-K6 PolarHBondContact O-N 2.99Å; Y4-K6 VanDerWaalsContact O-N 3.1Å; K6-I8 PolarHBondContact O-N 2.92Å
7D41Very low44.5Very low163 Ų163140.9 Ų140.987%0.87272%0.718SS**  trans-62.497.4171.4-87.2-40000108.9G5 S9G5-D7 VanDerWaalsContact C-N 3.33Å; G5-D7 PolarHBondContact O-N 2.87Å; D7-S9 PolarHBondContact O-N 3.43Å
8I49.8Very low45.2Very low90 Ų90134.8 Ų134.846%0.46270%0.696SS.*  trans-68.2117.9173.1-63165.7000107.3K6 E12 K13K6-I8 PolarHBondContact O-N 2.92Å; I8-E12 HydrophobicContact CG2-CB 3.91Å; I8-K13 HydrophobicContact CG2-CG 4.3Å
9S44.9Very low45.9Very low70 Ų70130.6 Ų130.649%0.4968%0.683SS.*  trans-58143.1-178.2-166.90000111.2D7 K11 E12D7-S9 PolarHBondContact O-N 3.43Å; S9-K11 PolarHBondContact O-N 3.31Å; S9-E12 PolarHBondContact O-N 2.98Å
10P52.3Low46.7Very low101 Ų101127.1 Ų127.166%0.65667%0.67SS**Hα-helixtrans-52.7-26.3-177.4-26.632.9000115E14P10-E14 PolarHBondContact O-N 3.48Å
11K46.4Very low47.3Very low157 Ų157125.3 Ų125.368%0.68366%0.659SS**Hα-helixtrans-73.5-23.5-179.8-73.8-172.1172.8-178.30114.9S9 R15S9-K11 PolarHBondContact O-N 3.31Å; K11-R15 WeakPolarHBondContact O-CG 3.45Å
12E46.6Very low48.5Very low115 Ų115116.6 Ų116.654%0.53762%0.618SS.*Hα-helixtrans-81.2-36.7176.4-88.6175.4159.200111.6I8 S9 E14 R15 E16I8-E12 HydrophobicContact CG2-CB 3.91Å; S9-E12 PolarHBondContact O-N 2.98Å; E12-E14 VanDerWaalsContact C-N 3.33Å; E12-E14 PolarHBondContact O-N 2.85Å; E12-R15 PolarHBondContact O-N 3.38Å; E12-E16 PolarHBondContact O-N 2.92Å
13K46Very low50.2Low134 Ų134111.2 Ų111.258%0.58360%0.601SS**Hα-helixtrans-62.9-36174.5-76.9-177.9176.8175.50113.1I8 S17I8-K13 HydrophobicContact CG2-CG 4.3Å; K13-S17 WeakPolarHBondContact O-CB 3.42Å; K13-S17 PolarHBondContact O-N 3.11Å
14E42.9Very low52.1Low148 Ų148112.7 Ų112.769%0.69258%0.582SS**Hα-helixtrans-69.4-36.3175-74.2-178.8164.100112.6P10 E12 G18P10-E14 PolarHBondContact O-N 3.48Å; E12-E14 VanDerWaalsContact C-N 3.33Å; E12-E14 PolarHBondContact O-N 2.85Å; E14-G18 PolarHBondContact O-N 3.23Å
15R45.4Very low53.9Low203 Ų203101.8 Ų101.877%0.76654%0.54SS*.Hα-helixtrans-72.2-40.8177.5-73.4-178.3178.3-173.1-0.9112.5K11 E12 A19K11-R15 WeakPolarHBondContact O-CG 3.45Å; E12-R15 PolarHBondContact O-N 3.38Å; R15-A19 WeakPolarHBondContact O-CB 3.41Å; R15-A19 PolarHBondContact O-N 3.12Å
16E45.2Very low55.7Low135 Ų13599.4 Ų99.463%0.63151%0.514SS*.Hα-helixtrans-67.1-38.2174.4-73.9-176.6162.600111.9E12 A19 S20E12-E16 PolarHBondContact O-N 2.92Å; E16-A19 PolarHBondContact O-N 2.95Å; E16-S20 WeakPolarHBondContact O-CB 3.43Å; E16-S20 PolarHBondContact O-N 3.26Å
17S51.4Low57.4Low73 Ų7395.3 Ų95.351%0.5150%0.5SS..Hα-helixtrans-63.6-44.8175.6-173.70000111.9K13 S20 M21K13-S17 WeakPolarHBondContact O-CB 3.42Å; K13-S17 PolarHBondContact O-N 3.11Å; S17-S20 PolarHBondContact O-N 3.15Å; S17-M21 PolarHBondContact O-N 3.46Å
18G56.2Low59.2Low32 Ų3290.9 Ų90.933%0.3347%0.471SS..Hα-helixtrans-64-41.117500000113.4E14 M21 N22E14-G18 PolarHBondContact O-N 3.23Å; G18-M21 PolarHBondContact O-N 3.38Å; G18-N22 PolarHBondContact O-N 2.96Å; G18-N22 PolarHBondContact O-ND2 2.76Å
19A59.1Low60.8Low54 Ų5486.6 Ų86.645%0.44645%0.449SS..Hα-helixtrans-65.7-40176.200000112.4R15 E16 N22 S23R15-A19 WeakPolarHBondContact O-CB 3.41Å; R15-A19 PolarHBondContact O-N 3.12Å; E16-A19 PolarHBondContact O-N 2.95Å; A19-N22 PolarHBondContact O-N 3.4Å; A19-S23 PolarHBondContact O-N 3.22Å; A19-S23 PolarHBondContact O-OG 3.36Å; A19-S23 VanDerWaalsContact O-OG 3.13Å
20S61Low62.6Low60 Ų6087.2 Ų87.242%0.4244%0.444SS..Hα-helixtrans-64.9-41.4176-175.10000112.4E16 S17 S23 R24E16-S20 WeakPolarHBondContact O-CB 3.43Å; E16-S20 PolarHBondContact O-N 3.26Å; S17-S20 PolarHBondContact O-N 3.15Å; S20-S23 PolarHBondContact O-N 3Å; S20-R24 PolarHBondContact O-N 2.85Å
21M60.7Low64Low90 Ų9086.5 Ų86.544%0.44344%0.435SS..Hα-helixtrans-63.4-42.6176.1-116163.192.600111.8S17 G18 R24 N25S17-M21 PolarHBondContact O-N 3.46Å; G18-M21 PolarHBondContact O-N 3.38Å; M21-R24 PolarHBondContact O-N 2.93Å; M21-N25 VanDerWaalsContact O-CG 3.27Å; M21-N25 PolarHBondContact O-N 3.35Å; M21-N25 PolarHBondContact O-ND2 2.97Å
22N68Low65.8Low65 Ų6579 Ų7935%0.34840%0.402SS..Hα-helixtrans-65-41.1178-69.9-13.9000112.3G18 A19 R24 N25 A26 F62G18-N22 PolarHBondContact O-N 2.96Å; G18-N22 PolarHBondContact O-ND2 2.76Å; A19-N22 PolarHBondContact O-N 3.4Å; N22-R24 PolarHBondContact O-N 3.5Å; N22-N25 PolarHBondContact O-N 2.78Å; N22-A26 PolarHBondContact O-N 2.8Å; N22-F62 HydrophobicContact CB-CE1 3.88Å; N22-F62 HydrophobicContact CB-CZ 4.44Å
23S72.7Confident67.5Low75 Ų7575.6 Ų75.652%0.52439%0.386SS..Hα-helixtrans-63-40.7175.2-64.90000112.2A19 S20 A26 I27A19-S23 PolarHBondContact O-N 3.22Å; A19-S23 PolarHBondContact O-OG 3.36Å; A19-S23 VanDerWaalsContact O-OG 3.13Å; S20-S23 PolarHBondContact O-N 3Å; S23-A26 PolarHBondContact O-N 3.36Å; S23-I27 WeakPolarHBondContact O-CG1 3.3Å; S23-I27 PolarHBondContact O-N 3.04Å; S23-I27 VanDerWaalsContact O-N 3.15Å
24R77Confident69.2Low108 Ų10874.1 Ų74.141%0.40838%0.382SS..Hα-helixtrans-64.7-41.5177-166.9-179.3-59.5112.97.8111.9S20 M21 N22 A26 I27 R28S20-R24 PolarHBondContact O-N 2.85Å; M21-R24 PolarHBondContact O-N 2.93Å; N22-R24 PolarHBondContact O-N 3.5Å; R24-A26 VanDerWaalsContact C-N 3.34Å; R24-I27 PolarHBondContact O-N 2.84Å; R24-R28 PolarHBondContact O-N 2.57Å; R24-R28 VanDerWaalsContact O-N 3.13Å
25N77.5Confident71.1Confident7 Ų769 Ų694%0.03736%0.357CS..Hα-helixtrans-65.1-38.5176.4-69.5-16.9000111.8M21 N22 I27 R28 M29 A61 I132M21-N25 VanDerWaalsContact O-CG 3.27Å; M21-N25 PolarHBondContact O-N 3.35Å; M21-N25 PolarHBondContact O-ND2 2.97Å; N22-N25 PolarHBondContact O-N 2.78Å; N25-I27 PolarHBondContact O-N 3.28Å; N25-R28 PolarHBondContact O-N 3Å; N25-M29 WeakPolarHBondContact O-CB 3.19Å; N25-M29 PolarHBondContact O-N 2.91Å; N25-A61 HydrophobicContact CB-CB 4.17Å; N25-I132 HydrophobicContact CB-CD1 4Å
26A78.5Confident72.8Confident15 Ų1559.6 Ų59.612%0.12432%0.322CS..Hα-helixtrans-62.6-41.2175.900000112.5N22 S23 R24 M29 E30N22-A26 PolarHBondContact O-N 2.8Å; S23-A26 PolarHBondContact O-N 3.36Å; R24-A26 VanDerWaalsContact C-N 3.34Å; A26-M29 PolarHBondContact O-N 3.09Å; A26-E30 PolarHBondContact O-N 2.81Å
27I81.9Confident74.5Confident106 Ų10658.6 Ų58.654%0.54432%0.315SS..Hα-helixtrans-66.3-44.4177.5-63.9165000111.1S23 R24 N25 M29 E30 L31S23-I27 WeakPolarHBondContact O-CG1 3.3Å; S23-I27 PolarHBondContact O-N 3.04Å; S23-I27 VanDerWaalsContact O-N 3.15Å; R24-I27 PolarHBondContact O-N 2.84Å; N25-I27 PolarHBondContact O-N 3.28Å; I27-M29 VanDerWaalsContact C-N 3.3Å; I27-M29 PolarHBondContact O-N 3.03Å; I27-E30 WeakPolarHBondContact O-CB 3.38Å; I27-E30 PolarHBondContact O-N 3.49Å; I27-L31 PolarHBondContact O-N 2.89Å; I27-L31 VanDerWaalsContact O-N 3.12Å
28R80.7Confident75.8Confident70 Ų7058.8 Ų58.826%0.26431%0.31SS..Hα-helixtrans-63.7-37.7176.9-73.1-169.1-177.6156.711.5112.2R24 N25 E30 L31 L32 E129 I132R24-R28 PolarHBondContact O-N 2.57Å; R24-R28 VanDerWaalsContact O-N 3.13Å; N25-R28 PolarHBondContact O-N 3Å; R28-E30 VanDerWaalsContact C-N 3.3Å; R28-E30 PolarHBondContact O-N 3.07Å; R28-L31 PolarHBondContact O-N 2.75Å; R28-L32 PolarHBondContact O-N 3Å; R28-E129 IonicContact CZ-OE1 3.74Å; R28-E129 IonicContact NH1-OE1 2.8Å; R28-E129 PolarHBondContact NH1-OE1 2.75Å; R28-E129 IonicContact NH2-OE1 2.69Å; R28-E129 PolarHBondContact NH2-OE1 2.75Å; R28-I132 HydrophobicContact CB-CG2 3.85Å
29M82Confident76.7Confident0 Ų057.7 Ų57.70%030%0.297CS..Hα-helixtrans-63.7-37.4175.2-172.663.3-154.200112N25 A26 I27 L32 Q33 I55 R57 F60 I132N25-M29 WeakPolarHBondContact O-CB 3.19Å; N25-M29 PolarHBondContact O-N 2.91Å; A26-M29 PolarHBondContact O-N 3.09Å; I27-M29 VanDerWaalsContact C-N 3.3Å; I27-M29 PolarHBondContact O-N 3.03Å; M29-L32 HydrophobicContact CE-CD2 4.36Å; M29-L32 PolarHBondContact O-N 3.35Å; M29-L32 HydrophobicContact SD-CD2 4.02Å; M29-Q33 WeakPolarHBondContact O-CB 3.41Å; M29-Q33 PolarHBondContact O-N 3.16Å; M29-I55 HydrophobicContact CE-CG2 3.38Å; M29-R57 VanDerWaalsContact CG-O 3.22Å; M29-R57 WeakPolarHBondContact CG-O 3.32Å; M29-F60 HydrophobicContact CE-CD2 3.67Å; M29-F60 HydrophobicContact CE-CE2 4.3Å; M29-F60 HydrophobicContact SD-CB 4.01Å; M29-F60 HydrophobicContact SD-CD2 3.8Å; M29-F60 HydrophobicContact SD-CG 4.4Å; M29-I132 HydrophobicContact CB-CD1 4.33Å; M29-I132 HydrophobicContact SD-CG1 4.4Å
30E82.4Confident77.3Confident83 Ų8359.5 Ų59.539%0.38830%0.299SS..Hα-helixtrans-64.6-43.3175.9-171.1171173.900111.8A26 I27 R28 Q33 Q34A26-E30 PolarHBondContact O-N 2.81Å; I27-E30 WeakPolarHBondContact O-CB 3.38Å; I27-E30 PolarHBondContact O-N 3.49Å; R28-E30 VanDerWaalsContact C-N 3.3Å; R28-E30 PolarHBondContact O-N 3.07Å; E30-Q33 PolarHBondContact O-N 3.49Å; E30-Q34 WeakPolarHBondContact O-CG 3.46Å; E30-Q34 PolarHBondContact O-N 2.67Å
31L83.1Confident77.5Confident86 Ų8657.1 Ų57.145%0.4528%0.281SS..Hα-helixtrans-62.2-45.3174-69.6169.3000111.8I27 R28 Q33 Q34 K35I27-L31 PolarHBondContact O-N 2.89Å; I27-L31 VanDerWaalsContact O-N 3.12Å; R28-L31 PolarHBondContact O-N 2.75Å; L31-Q33 VanDerWaalsContact C-N 3.29Å; L31-Q33 PolarHBondContact O-N 3.35Å; L31-Q34 WeakPolarHBondContact O-CB 3.45Å; L31-Q34 PolarHBondContact O-N 2.92Å; L31-K35 WeakPolarHBondContact O-CG 3.05Å; L31-K35 PolarHBondContact O-N 3.25Å
32L84.3Confident77.7Confident0 Ų057.4 Ų57.40%028%0.284CS..Hα-helixtrans-58.3-43.8174.417462.6000110.9R28 M29 Q34 K35 L36 I132 L135 A139R28-L32 PolarHBondContact O-N 3Å; M29-L32 HydrophobicContact CE-CD2 4.36Å; M29-L32 PolarHBondContact O-N 3.35Å; M29-L32 HydrophobicContact SD-CD2 4.02Å; L32-Q34 VanDerWaalsContact C-N 3.29Å; L32-Q34 PolarHBondContact O-N 2.83Å; L32-K35 WeakPolarHBondContact O-CB 3.3Å; L32-K35 PolarHBondContact O-N 3.08Å; L32-L36 HydrophobicContact CD1-CD1 4.11Å; L32-L36 HydrophobicContact CD1-CD2 4.43Å; L32-L36 HydrophobicContact CD1-CG 3.97Å; L32-L36 HydrophobicContact CD2-CD1 4.46Å; L32-L36 HydrophobicContact CG-CD1 3.86Å; L32-L36 HydrophobicContact CG-CG 4.18Å; L32-L36 VanDerWaalsContact O-CB 3.31Å; L32-L36 WeakPolarHBondContact O-CB 3.24Å; L32-L36 VanDerWaalsContact O-CG 3.23Å; L32-L36 WeakPolarHBondContact O-CG 3.44Å; L32-L36 PolarHBondContact O-N 3.36Å; L32-I132 HydrophobicContact CD2-CG2 4.46Å; L32-L135 HydrophobicContact CD1-CB 4.14Å; L32-L135 HydrophobicContact CD2-CB 3.64Å; L32-L135 HydrophobicContact CD2-CD1 4.08Å; L32-A139 HydrophobicContact CD1-CB 3.84Å
33Q82.2Confident77.5Confident44 Ų4460.4 Ų60.421%0.20630%0.301CS..Hα-helixtrans-62.3-37179.2-165.3177.122.800112.2M29 E30 L31 L36 K37 I55M29-Q33 WeakPolarHBondContact O-CB 3.41Å; M29-Q33 PolarHBondContact O-N 3.16Å; E30-Q33 PolarHBondContact O-N 3.49Å; L31-Q33 VanDerWaalsContact C-N 3.29Å; L31-Q33 PolarHBondContact O-N 3.35Å; Q33-L36 PolarHBondContact O-N 3.13Å; Q33-K37 WeakPolarHBondContact O-CG 3.45Å; Q33-K37 PolarHBondContact O-N 2.8Å; Q33-I55 PolarHBondContact NE2-O 3.35Å
34Q81.2Confident77.2Confident103 Ų10360.8 Ų60.848%0.48129%0.294SS..Hα-helixtrans-64.4-46.5173.5-68.2174.74.700111.3E30 L31 L32 L36 K37 L38E30-Q34 WeakPolarHBondContact O-CG 3.46Å; E30-Q34 PolarHBondContact O-N 2.67Å; L31-Q34 WeakPolarHBondContact O-CB 3.45Å; L31-Q34 PolarHBondContact O-N 2.92Å; L32-Q34 VanDerWaalsContact C-N 3.29Å; L32-Q34 PolarHBondContact O-N 2.83Å; Q34-L36 VanDerWaalsContact C-N 3.32Å; Q34-L36 PolarHBondContact O-N 3.29Å; Q34-K37 PolarHBondContact O-N 3.39Å; Q34-L38 WeakPolarHBondContact O-CG 3.38Å; Q34-L38 PolarHBondContact O-N 2.64Å
35K83.1Confident76.5Confident40 Ų4055.7 Ų55.717%0.17428%0.275CS..Hα-helixtrans-59.1-42.9175.5-67.2177.9-174.6-179.90112L31 L32 L38 L39 D136 A139 D140 L143L31-K35 WeakPolarHBondContact O-CG 3.05Å; L31-K35 PolarHBondContact O-N 3.25Å; L32-K35 WeakPolarHBondContact O-CB 3.3Å; L32-K35 PolarHBondContact O-N 3.08Å; K35-L38 WeakPolarHBondContact O-CB 3.35Å; K35-L38 PolarHBondContact O-N 2.67Å; K35-L39 WeakPolarHBondContact O-CG 3.44Å; K35-L39 PolarHBondContact O-N 2.7Å; K35-L39 VanDerWaalsContact O-N 3.1Å; K35-D136 WeakPolarHBondContact CD-OD1 3.49Å; K35-D136 WeakPolarHBondContact CE-OD1 3.45Å; K35-D136 VanDerWaalsContact NZ-CG 3.31Å; K35-D136 IonicContact NZ-OD1 2.64Å; K35-D136 PolarHBondContact NZ-OD1 3.3Å; K35-D136 IonicContact NZ-OD2 3.83Å; K35-D136 PolarHBondContact NZ-OD2 2.93Å; K35-A139 HydrophobicContact CB-CB 4.17Å; K35-A139 HydrophobicContact CD-CB 4.35Å; K35-D140 WeakPolarHBondContact CD-OD1 3.47Å; K35-D140 WeakPolarHBondContact CE-OD1 3.39Å; K35-D140 IonicContact NZ-OD1 3.07Å; K35-D140 PolarHBondContact NZ-OD1 3.12Å; K35-D140 IonicContact NZ-OD2 2.75Å; K35-D140 PolarHBondContact NZ-OD2 3.29Å; K35-L143 HydrophobicContact CB-CD1 3.74Å; K35-L143 HydrophobicContact CD-CD1 4.24Å; K35-L143 HydrophobicContact CG-CD1 3.76Å
36L81.3Confident75.7Confident5 Ų558.1 Ų58.13%0.02629%0.29CS..Hα-helixtrans-62.4-42176.3-77.1-179.5000112.4L32 Q33 Q34 L39 M41 L76 W79 L80L32-L36 HydrophobicContact CD1-CD1 4.11Å; L32-L36 HydrophobicContact CD1-CD2 4.43Å; L32-L36 HydrophobicContact CD1-CG 3.97Å; L32-L36 HydrophobicContact CD2-CD1 4.46Å; L32-L36 HydrophobicContact CG-CD1 3.86Å; L32-L36 HydrophobicContact CG-CG 4.18Å; L32-L36 VanDerWaalsContact O-CB 3.31Å; L32-L36 WeakPolarHBondContact O-CB 3.24Å; L32-L36 VanDerWaalsContact O-CG 3.23Å; L32-L36 WeakPolarHBondContact O-CG 3.44Å; L32-L36 PolarHBondContact O-N 3.36Å; Q33-L36 PolarHBondContact O-N 3.13Å; Q34-L36 VanDerWaalsContact C-N 3.32Å; Q34-L36 PolarHBondContact O-N 3.29Å; L36-L39 PolarHBondContact O-N 3.26Å; L36-L39 VanDerWaalsContact O-N 3.11Å; L36-M41 HydrophobicContact CB-CB 4.35Å; L36-M41 HydrophobicContact CB-CG 3.73Å; L36-M41 HydrophobicContact CD1-CE 4.34Å; L36-M41 HydrophobicContact CD2-CE 4.28Å; L36-M41 HydrophobicContact CD2-CG 3.78Å; L36-M41 HydrophobicContact CD2-SD 3.97Å; L36-M41 HydrophobicContact CG-CG 4.25Å; L36-M41 VanDerWaalsContact O-CB 3.24Å; L36-M41 WeakPolarHBondContact O-CB 3.42Å; L36-M41 WeakPolarHBondContact O-CG 3.07Å; L36-M41 PolarHBondContact O-N 3.03Å; L36-L76 HydrophobicContact CD1-CD1 4.42Å; L36-L76 HydrophobicContact CD1-CD2 4Å; L36-L76 HydrophobicContact CD2-CD1 3.98Å; L36-W79 HydrophobicContact CD2-CZ3 4.37Å; L36-L80 HydrophobicContact CD2-CD1 4.42Å; L36-L80 HydrophobicContact CD2-CD2 3.96Å
37K80.2Confident74.8Confident115 Ų11560.5 Ų60.550%0.532%0.316SS..Hα-helixtrans-64-39.7173.9-77.6-178.8175.8-173.60112.4Q33 Q34 L39 N40Q33-K37 WeakPolarHBondContact O-CG 3.45Å; Q33-K37 PolarHBondContact O-N 2.8Å; Q34-K37 PolarHBondContact O-N 3.39Å; K37-L39 PolarHBondContact O-N 3.31Å; K37-N40 PolarHBondContact O-N 3.21Å; K37-N40 VanDerWaalsContact O-N 3.07Å
38L78.4Confident73.7Confident76 Ų7658.8 Ų58.840%0.39831%0.308SS..Hα-helixtrans-61.8-28.7173.6-66.1171000111.7Q34 K35 N40 L143 F148Q34-L38 WeakPolarHBondContact O-CG 3.38Å; Q34-L38 PolarHBondContact O-N 2.64Å; K35-L38 WeakPolarHBondContact O-CB 3.35Å; K35-L38 PolarHBondContact O-N 2.67Å; L38-N40 VanDerWaalsContact C-N 3.26Å; L38-N40 PolarHBondContact O-N 3.43Å; L38-L143 HydrophobicContact CB-CD2 4.01Å; L38-F148 HydrophobicContact CB-CE2 4.25Å; L38-F148 HydrophobicContact CB-CZ 4.31Å; L38-F148 HydrophobicContact CD2-CE1 3.83Å; L38-F148 HydrophobicContact CD2-CE2 4.45Å; L38-F148 HydrophobicContact CD2-CZ 3.69Å; L38-F148 WeakPolarHBondContact O-CE2 3.38Å
39L74.4Confident72.4Confident9 Ų957.7 Ų57.75%0.04731%0.309CS..THydrogen-bonded Turntrans-83.710176-66.9165.9000114.1K35 L36 K37 M41 W79 L80 A139 A142 L143 T146K35-L39 WeakPolarHBondContact O-CG 3.44Å; K35-L39 PolarHBondContact O-N 2.7Å; K35-L39 VanDerWaalsContact O-N 3.1Å; L36-L39 PolarHBondContact O-N 3.26Å; L36-L39 VanDerWaalsContact O-N 3.11Å; K37-L39 PolarHBondContact O-N 3.31Å; L39-M41 VanDerWaalsContact C-N 3.34Å; L39-M41 PolarHBondContact O-N 3.48Å; L39-W79 HydrophobicContact CB-CH2 3.77Å; L39-W79 HydrophobicContact CB-CZ3 4.2Å; L39-W79 HydrophobicContact CD1-CZ3 4.48Å; L39-W79 WeakPolarHBondContact O-CH2 3.24Å; L39-L80 HydrophobicContact CD1-CD2 3.82Å; L39-A139 HydrophobicContact CD1-CB 4.4Å; L39-A142 HydrophobicContact CD1-CB 3.85Å; L39-A142 HydrophobicContact CD2-CB 4.07Å; L39-L143 HydrophobicContact CD1-CD2 4.44Å; L39-L143 HydrophobicContact CD1-CG 4.16Å; L39-L143 HydrophobicContact CD2-CD2 3.66Å; L39-L143 HydrophobicContact CD2-CG 3.97Å; L39-L143 HydrophobicContact CG-CD2 3.73Å; L39-L143 HydrophobicContact CG-CG 3.98Å; L39-T146 HydrophobicContact CD2-CG2 4.34Å; L39-T146 WeakPolarHBondContact CD2-OG1 3.32Å
40N73.4Confident71.1Confident92 Ų9265.3 Ų65.349%0.49236%0.355SS..THydrogen-bonded Turntrans5543.3-175.8-73.5-6.6000114K37 L38 D42 D43 E44K37-N40 PolarHBondContact O-N 3.21Å; K37-N40 VanDerWaalsContact O-N 3.07Å; L38-N40 VanDerWaalsContact C-N 3.26Å; L38-N40 PolarHBondContact O-N 3.43Å; N40-D42 VanDerWaalsContact C-N 3.28Å; N40-D42 PolarHBondContact O-N 3.29Å; N40-D43 PolarHBondContact O-N 2.9Å; N40-E44 PolarHBondContact O-N 2.83Å
41M65.5Low69.8Low11 Ų1164.1 Ų64.15%0.05435%0.353CS..Hα-helixtrans-56.5-37.8175.5-88.6-82-61.400114.3L36 L39 D43 F45 V46 I55 L76 W79L36-M41 HydrophobicContact CB-CB 4.35Å; L36-M41 HydrophobicContact CB-CG 3.73Å; L36-M41 HydrophobicContact CD1-CE 4.34Å; L36-M41 HydrophobicContact CD2-CE 4.28Å; L36-M41 HydrophobicContact CD2-CG 3.78Å; L36-M41 HydrophobicContact CD2-SD 3.97Å; L36-M41 HydrophobicContact CG-CG 4.25Å; L36-M41 VanDerWaalsContact O-CB 3.24Å; L36-M41 WeakPolarHBondContact O-CB 3.42Å; L36-M41 WeakPolarHBondContact O-CG 3.07Å; L36-M41 PolarHBondContact O-N 3.03Å; L39-M41 VanDerWaalsContact C-N 3.34Å; L39-M41 PolarHBondContact O-N 3.48Å; M41-D43 VanDerWaalsContact C-N 3.28Å; M41-D43 PolarHBondContact O-N 3.14Å; M41-F45 HydrophobicContact CE-CB 3.74Å; M41-F45 HydrophobicContact CE-CD1 3.26Å; M41-F45 HydrophobicContact CE-CD2 4.31Å; M41-F45 HydrophobicContact CE-CE1 3.86Å; M41-F45 HydrophobicContact CE-CG 3.5Å; M41-F45 VanDerWaalsContact O-CB 3.27Å; M41-F45 WeakPolarHBondContact O-CB 3.42Å; M41-F45 PolarHBondContact O-N 3.38Å; M41-F45 HydrophobicContact SD-CB 3.34Å; M41-F45 WeakPolarHBondContact SD-CB 3.01Å; M41-F45 HydrophobicContact SD-CD1 4.02Å; M41-F45 HydrophobicContact SD-CD2 4.15Å; M41-F45 HydrophobicContact SD-CG 3.58Å; M41-F45 VanDerWaalsContact SD-CG 3.58Å; M41-V46 PolarHBondContact O-N 3.11Å; M41-I55 HydrophobicContact CE-CD1 3.87Å; M41-L76 HydrophobicContact CE-CD1 3.24Å; M41-L76 HydrophobicContact SD-CD1 3.58Å; M41-L76 VanDerWaalsContact SD-CD1 3.58Å; M41-W79 HydrophobicContact CB-CH2 4.46Å; M41-W79 HydrophobicContact CG-CE3 4.32Å; M41-W79 HydrophobicContact CG-CH2 3.45Å; M41-W79 VanDerWaalsContact CG-CH2 3.45Å; M41-W79 HydrophobicContact CG-CZ2 4.25Å; M41-W79 HydrophobicContact CG-CZ3 3.51Å; M41-W79 HydrophobicContact SD-CD2 3.85Å; M41-W79 HydrophobicContact SD-CE3 3.32Å; M41-W79 HydrophobicContact SD-CH2 3.46Å; M41-W79 WeakPolarHBondContact SD-CH2 3.32Å; M41-W79 HydrophobicContact SD-CZ2 3.97Å; M41-W79 HydrophobicContact SD-CZ3 3.12Å; M41-W79 WeakPolarHBondContact SD-CZ3 3.28Å
42D63.6Low68.7Low95 Ų9560.4 Ų60.451%0.50833%0.334SS..Hα-helixtrans-65.6-31.6-174.4-67.4-38000112.3N40 V46N40-D42 VanDerWaalsContact C-N 3.28Å; N40-D42 PolarHBondContact O-N 3.29Å; D42-V46 WeakPolarHBondContact O-CB 3.33Å
43D64Low67.7Low129 Ų12966.3 Ų66.369%0.6936%0.36SS*.Hα-helixtrans-89.9-43.1179.3-67.5-31.5000112.3N40 M41N40-D43 PolarHBondContact O-N 2.9Å; M41-D43 VanDerWaalsContact C-N 3.28Å; M41-D43 PolarHBondContact O-N 3.14Å
44E66.3Low66.7Low82 Ų8268.6 Ų68.638%0.38338%0.38SS..Hα-helixtrans-91.4-40.1-171.9-70.4-168.8-151.800113.9N40 L48 W79 K83N40-E44 PolarHBondContact O-N 2.83Å; E44-L48 WeakPolarHBondContact O-CD1 3.32Å; E44-L48 PolarHBondContact O-N 3.46Å; E44-W79 HydrophobicContact CB-CZ2 4.13Å; E44-K83 IonicContact OE1-NZ 2.89Å; E44-K83 PolarHBondContact OE1-NZ 3.43Å; E44-K83 WeakPolarHBondContact OE2-CE 3.44Å; E44-K83 IonicContact OE2-NZ 2.83Å; E44-K83 PolarHBondContact OE2-NZ 2.92Å
45F63.4Low66Low1 Ų164.5 Ų64.50%0.00436%0.362CS..THydrogen-bonded Turntrans-84.6-39.8-173.2179.7-101.6000112.7M41 G47 L48 N52 I55 L76 W79M41-F45 HydrophobicContact CE-CB 3.74Å; M41-F45 HydrophobicContact CE-CD1 3.26Å; M41-F45 HydrophobicContact CE-CD2 4.31Å; M41-F45 HydrophobicContact CE-CE1 3.86Å; M41-F45 HydrophobicContact CE-CG 3.5Å; M41-F45 VanDerWaalsContact O-CB 3.27Å; M41-F45 WeakPolarHBondContact O-CB 3.42Å; M41-F45 PolarHBondContact O-N 3.38Å; M41-F45 HydrophobicContact SD-CB 3.34Å; M41-F45 WeakPolarHBondContact SD-CB 3.01Å; M41-F45 HydrophobicContact SD-CD1 4.02Å; M41-F45 HydrophobicContact SD-CD2 4.15Å; M41-F45 HydrophobicContact SD-CG 3.58Å; M41-F45 VanDerWaalsContact SD-CG 3.58Å; F45-G47 PolarHBondContact O-N 2.82Å; F45-L48 PolarHBondContact O-N 3.16Å; F45-N52 HydrophobicContact CD1-CB 4.21Å; F45-N52 HydrophobicContact CE1-CB 3.94Å; F45-N52 HydrophobicContact CZ-CB 4.45Å; F45-N52 PolarHBondContact O-ND2 2.79Å; F45-I55 HydrophobicContact CE1-CD1 4.28Å; F45-L76 HydrophobicContact CD2-CD1 4.43Å; F45-L76 HydrophobicContact CE1-CD1 4.35Å; F45-L76 HydrophobicContact CE2-CB 4.35Å; F45-L76 HydrophobicContact CE2-CD1 4.16Å; F45-L76 HydrophobicContact CZ-CB 4.05Å; F45-L76 HydrophobicContact CZ-CD1 4.1Å; F45-W79 HydrophobicContact CB-CD2 4.23Å; F45-W79 HydrophobicContact CB-CG 4.39Å; F45-W79 HydrophobicContact CB-CZ2 4.46Å; F45-W79 HydrophobicContact CD2-CB 3.56Å; F45-W79 AromaticContact CD2-CD1 3.86Å; F45-W79 AromaticContact CD2-CD2 3.99Å; F45-W79 HydrophobicContact CD2-CD2 3.99Å; F45-W79 AromaticContact CD2-CG 3.51Å; F45-W79 HydrophobicContact CD2-CG 3.51Å; F45-W79 HydrophobicContact CE2-CB 3.8Å; F45-W79 HydrophobicContact CE2-CG 4.25Å; F45-W79 HydrophobicContact CG-CG 4.4Å
46V60.3Low65.3Low58 Ų5865.7 Ų65.735%0.35238%0.375SS..THydrogen-bonded Turntrans-65.3-31.4176.7-177.90000110.6M41 D42M41-V46 PolarHBondContact O-N 3.11Å; D42-V46 WeakPolarHBondContact O-CB 3.33Å
47G58.7Low64.8Low66 Ų6671.7 Ų71.768%0.6840%0.398SS*.THydrogen-bonded Turntrans-79.1-17.6175.400000115.4F45 T49F45-G47 PolarHBondContact O-N 2.82Å; G47-T49 PolarHBondContact O-N 2.75Å
48L59.2Low64.7Low69 Ų6969.1 Ų69.136%0.36139%0.387SS..THydrogen-bonded Turntrans-73.3-26.8-170.8-126.584.5000113.9E44 F45 L91E44-L48 WeakPolarHBondContact O-CD1 3.32Å; E44-L48 PolarHBondContact O-N 3.46Å; F45-L48 PolarHBondContact O-N 3.16Å; L48-L91 HydrophobicContact CD2-CD1 4.1Å; L48-L91 HydrophobicContact CD2-CD2 4.03Å
49T53.5Low64.6Low47 Ų4767.8 Ų67.829%0.28838%0.377SS..  trans-154.8135.4-176.92.70000110.1G47 T51 N52G47-T49 PolarHBondContact O-N 2.75Å; T49-T51 PolarHBondContact O-N 3.18Å; T49-N52 PolarHBondContact O-N 3.42Å; T49-N52 PolarHBondContact OG1-ND2 2.89Å
50V54.5Low64.9Low161 Ų16167.3 Ų67.398%0.97638%0.375SS*.THydrogen-bonded Turntrans-57.1-19.9-178.5-178.20000112.9
51T55.2Low65Low57 Ų5763.2 Ų63.235%0.3535%0.354SS..THydrogen-bonded Turntrans-85.6-16.5-179.853.70000114.1T49 K53T49-T51 PolarHBondContact O-N 3.18Å; T51-K53 PolarHBondContact O-N 3.34Å
52N61.1Low65.6Low8 Ų867 Ų674%0.04337%0.37CS..  trans-77.5107.5-174.9-75.1-20.2000110.7F45 T49 Q72F45-N52 HydrophobicContact CD1-CB 4.21Å; F45-N52 HydrophobicContact CE1-CB 3.94Å; F45-N52 HydrophobicContact CZ-CB 4.45Å; F45-N52 PolarHBondContact O-ND2 2.79Å; T49-N52 PolarHBondContact O-N 3.42Å; T49-N52 PolarHBondContact OG1-ND2 2.89Å; N52-Q72 PolarHBondContact OD1-NE2 3.36Å
53K62.5Low66.2Low124 Ų12466.9 Ų66.954%0.53938%0.377SS..  trans-88.9155.1173.3-64.6170.7-169.2158.20110.3T51 I55 E68T51-K53 PolarHBondContact O-N 3.34Å; K53-I55 PolarHBondContact O-N 2.87Å; K53-E68 IonicContact NZ-OE1 3.49Å; K53-E68 PolarHBondContact NZ-OE1 2.92Å
54S61.3Low66.8Low92 Ų9266.5 Ų66.564%0.64338%0.379SS*.  trans-56.7124.4169.457.50000109.8S56S54-S56 PolarHBondContact O-N 2.91Å
55I67.1Low67.4Low17 Ų1766.1 Ų66.19%0.08738%0.38CS..  trans-77.6112.9-173.8-58.4173.7000107.9M29 Q33 M41 F45 K53 Y59 F60 L76M29-I55 HydrophobicContact CE-CG2 3.38Å; Q33-I55 PolarHBondContact NE2-O 3.35Å; M41-I55 HydrophobicContact CE-CD1 3.87Å; F45-I55 HydrophobicContact CE1-CD1 4.28Å; K53-I55 PolarHBondContact O-N 2.87Å; I55-Y59 HydrophobicContact CG2-CD1 4.42Å; I55-Y59 HydrophobicContact CG2-CG 4.45Å; I55-F60 HydrophobicContact CD1-CE2 4.29Å; I55-F60 HydrophobicContact CG2-CD2 4.31Å; I55-F60 HydrophobicContact CG2-CE2 3.96Å; I55-L76 HydrophobicContact CD1-CD1 4.17Å; I55-L76 HydrophobicContact CD1-CD2 3.79Å; I55-L76 HydrophobicContact CD1-CG 4.48Å
56S68.3Low68.3Low66 Ų6668.6 Ų68.646%0.46240%0.398SS..  trans-69152.6177.2177.10000111.8S54 H58 Y59S54-S56 PolarHBondContact O-N 2.91Å; S56-H58 PolarHBondContact O-N 2.93Å; S56-Y59 WeakPolarHBondContact O-CB 3.45Å; S56-Y59 PolarHBondContact O-N 2.96Å
57R70.8Confident69.1Low131 Ų13169.2 Ų69.249%0.49441%0.409SS..THydrogen-bonded Turntrans-51-16.7-179.961.9-179.7-67.2-152-0.8115.5M29M29-R57 VanDerWaalsContact CG-O 3.22Å; M29-R57 WeakPolarHBondContact CG-O 3.32Å
58H76.6Confident70.2Confident61 Ų6169.4 Ų69.428%0.28239%0.392SS..THydrogen-bonded Turntrans-123.76.7-177.1-59.6-38.1000113.6S56 F60 A61 F62S56-H58 PolarHBondContact O-N 2.93Å; H58-F60 PolarHBondContact O-N 3.14Å; H58-A61 PolarHBondContact O-N 3.4Å; H58-A61 VanDerWaalsContact O-N 3.11Å; H58-F62 HydrophobicContact CB-CD2 3.9Å; H58-F62 HydrophobicContact CB-CE2 3.85Å
59Y77.3Confident71.4Confident47 Ų4766.1 Ų66.118%0.18437%0.374CS..THydrogen-bonded Turntrans-63.3-39.9-164.1-170.4-99000114.1I55 S56 Q69 Q72I55-Y59 HydrophobicContact CG2-CD1 4.42Å; I55-Y59 HydrophobicContact CG2-CG 4.45Å; S56-Y59 WeakPolarHBondContact O-CB 3.45Å; S56-Y59 PolarHBondContact O-N 2.96Å; Y59-Q69 HydrophobicContact CE1-CG 3.94Å; Y59-Q69 PolarHBondContact O-NE2 3.26Å; Y59-Q72 HydrophobicContact CE1-CB 4.1Å; Y59-Q72 HydrophobicContact CE1-CG 4Å
60F79.5Confident72.9Confident0 Ų065.2 Ų65.20%037%0.367CS..THydrogen-bonded Turntrans-94.6-6.7175.6-63.5-64.7000113.9M29 I55 H58 Q69 Q72 M73 L76 G128 I132 L135M29-F60 HydrophobicContact CE-CD2 3.67Å; M29-F60 HydrophobicContact CE-CE2 4.3Å; M29-F60 HydrophobicContact SD-CB 4.01Å; M29-F60 HydrophobicContact SD-CD2 3.8Å; M29-F60 HydrophobicContact SD-CG 4.4Å; I55-F60 HydrophobicContact CD1-CE2 4.29Å; I55-F60 HydrophobicContact CG2-CD2 4.31Å; I55-F60 HydrophobicContact CG2-CE2 3.96Å; H58-F60 PolarHBondContact O-N 3.14Å; F60-Q69 WeakPolarHBondContact CE1-O 3.35Å; F60-Q72 HydrophobicContact CE1-CB 4.4Å; F60-Q72 HydrophobicContact CZ-CB 4.24Å; F60-Q72 HydrophobicContact CZ-CG 4.11Å; F60-M73 HydrophobicContact CD1-CB 4.46Å; F60-M73 HydrophobicContact CE1-CB 3.75Å; F60-M73 HydrophobicContact CZ-CB 4.18Å; F60-L76 HydrophobicContact CE2-CD2 4.14Å; F60-G128 PolarHBondContact O-N 3.25Å; F60-G128 VanDerWaalsContact O-N 3.15Å; F60-I132 HydrophobicContact CB-CD1 4.5Å; F60-I132 HydrophobicContact CB-CG1 3.97Å; F60-L135 HydrophobicContact CD2-CD1 4.06Å; F60-L135 HydrophobicContact CE2-CD1 3.95Å; F60-L135 HydrophobicContact CZ-CD1 4.42Å
61A76.7Confident74.2Confident6 Ų659.5 Ų59.55%0.0533%0.329CS..THydrogen-bonded Turntrans-77.5-29.3-178.200000112.4N25 H58N25-A61 HydrophobicContact CB-CB 4.17Å; H58-A61 PolarHBondContact O-N 3.4Å; H58-A61 VanDerWaalsContact O-N 3.11Å
62F76.9Confident75.5Confident89 Ų8957 Ų5739%0.3931%0.313SS..SBendtrans-121.8138.2179-56.8-78.7000110.7N22 H58 T64 Q69N22-F62 HydrophobicContact CB-CE1 3.88Å; N22-F62 HydrophobicContact CB-CZ 4.44Å; H58-F62 HydrophobicContact CB-CD2 3.9Å; H58-F62 HydrophobicContact CB-CE2 3.85Å; F62-T64 PolarHBondContact O-N 3.41Å; F62-T64 VanDerWaalsContact O-N 3.16Å; F62-Q69 PolarHBondContact O-NE2 2.98Å
63S77.8Confident76.7Confident93 Ų9356.6 Ų56.665%0.6531%0.311SS*.  trans-70.6109.517261.90000109.5S127S63-S127 WeakPolarHBondContact CA-OG 3.45Å; S63-S127 VanDerWaalsContact CB-OG 3.31Å; S63-S127 WeakPolarHBondContact CB-OG 3.39Å
64T75.9Confident77.8Confident121 Ų12150.9 Ų50.974%0.74229%0.286SS*.SBendtrans-104-64.4173.5-52.50000109.1F62F62-T64 PolarHBondContact O-N 3.41Å; F62-T64 VanDerWaalsContact O-N 3.16Å
65N79.2Confident78.8Confident74 Ų7446.5 Ų46.540%0.39626%0.256SS..  trans-132.1100175.3-179-5.8000108.2A67 E68 Q69N65-A67 PolarHBondContact O-N 3.23Å; N65-A67 PolarHBondContact OD1-N 3.18Å; N65-E68 HydrophobicContact CB-CB 4.07Å; N65-E68 PolarHBondContact ND2-OE2 3.37Å; N65-E68 PolarHBondContact O-N 3.11Å; N65-Q69 VanDerWaalsContact O-CB 3.31Å; N65-Q69 WeakPolarHBondContact O-CB 3.28Å; N65-Q69 WeakPolarHBondContact O-CG 3.26Å; N65-Q69 PolarHBondContact O-N 3.33Å; N65-Q69 PolarHBondContact O-OE1 2.68Å
66S81.1Confident79.6Confident54 Ų5445.7 Ų45.738%0.37825%0.252SS..Hα-helixtrans-55.6-36.9-173.4179.10000113F70 I125S66-F70 WeakPolarHBondContact O-CB 3.47Å; S66-F70 PolarHBondContact O-N 3.25Å; S66-I125 WeakPolarHBondContact CB-O 3.46Å; S66-I125 PolarHBondContact OG-O 3.17Å
67A79Confident80.4Confident71 Ų7142.6 Ų42.659%0.58723%0.23SC*.Hα-helixtrans-72-45.8-179.900000112.6N65 F70 F71N65-A67 PolarHBondContact O-N 3.23Å; N65-A67 PolarHBondContact OD1-N 3.18Å; A67-F70 PolarHBondContact O-N 3.14Å; A67-F71 PolarHBondContact O-N 3.03Å
68E81.6Confident81Confident69 Ų6936.4 Ų36.432%0.32221%0.207SC..Hα-helixtrans-66.8-42.9177.3-173.5-178.6177.100110.8K53 N65 F70 F71 Q72K53-E68 IonicContact NZ-OE1 3.49Å; K53-E68 PolarHBondContact NZ-OE1 2.92Å; N65-E68 HydrophobicContact CB-CB 4.07Å; N65-E68 PolarHBondContact ND2-OE2 3.37Å; N65-E68 PolarHBondContact O-N 3.11Å; E68-F70 VanDerWaalsContact C-N 3.34Å; E68-F70 PolarHBondContact O-N 2.98Å; E68-F71 PolarHBondContact O-N 2.83Å; E68-Q72 WeakPolarHBondContact O-CB 3.35Å; E68-Q72 PolarHBondContact O-N 3.38Å
69Q84.6Confident81.3Confident0 Ų033.8 Ų33.80%020%0.195CC..Hα-helixtrans-64.2-40.1177.3-69.7174.7-48.100111.4Y59 F60 F62 N65 Q72 M73 G126Y59-Q69 HydrophobicContact CE1-CG 3.94Å; Y59-Q69 PolarHBondContact O-NE2 3.26Å; F60-Q69 WeakPolarHBondContact CE1-O 3.35Å; F62-Q69 PolarHBondContact O-NE2 2.98Å; N65-Q69 VanDerWaalsContact O-CB 3.31Å; N65-Q69 WeakPolarHBondContact O-CB 3.28Å; N65-Q69 WeakPolarHBondContact O-CG 3.26Å; N65-Q69 PolarHBondContact O-N 3.33Å; N65-Q69 PolarHBondContact O-OE1 2.68Å; Q69-Q72 PolarHBondContact O-N 3.41Å; Q69-M73 VanDerWaalsContact O-CB 3.23Å; Q69-M73 WeakPolarHBondContact O-CB 3.39Å; Q69-M73 PolarHBondContact O-N 2.75Å; Q69-G126 WeakPolarHBondContact CB-O 3.26Å
70F83.8Confident81.6Confident28 Ų2831.6 Ų31.612%0.12319%0.186CC..Hα-helixtrans-59.9-50.1172.6177.3-99.5000111.3S66 A67 E68 Q72 M73 V74 P98 L102 L123S66-F70 WeakPolarHBondContact O-CB 3.47Å; S66-F70 PolarHBondContact O-N 3.25Å; A67-F70 PolarHBondContact O-N 3.14Å; E68-F70 VanDerWaalsContact C-N 3.34Å; E68-F70 PolarHBondContact O-N 2.98Å; F70-Q72 VanDerWaalsContact C-N 3.32Å; F70-Q72 PolarHBondContact O-N 3.48Å; F70-M73 HydrophobicContact CD2-CE 3.65Å; F70-M73 HydrophobicContact CE2-CE 3.85Å; F70-M73 PolarHBondContact O-N 2.93Å; F70-V74 HydrophobicContact CD1-CG2 4.26Å; F70-V74 HydrophobicContact CD2-CG2 4.12Å; F70-V74 HydrophobicContact CE1-CG2 3.85Å; F70-V74 HydrophobicContact CE2-CG2 3.69Å; F70-V74 HydrophobicContact CG-CG2 4.39Å; F70-V74 HydrophobicContact CZ-CG2 3.55Å; F70-V74 WeakPolarHBondContact O-CG2 3.43Å; F70-V74 PolarHBondContact O-N 3.19Å; F70-P98 HydrophobicContact CD1-CB 4.44Å; F70-P98 HydrophobicContact CE1-CB 3.49Å; F70-P98 VanDerWaalsContact CE1-CB 3.49Å; F70-P98 HydrophobicContact CE2-CB 4.49Å; F70-P98 HydrophobicContact CZ-CB 3.51Å; F70-L102 HydrophobicContact CE2-CD1 3.76Å; F70-L102 HydrophobicContact CE2-CD2 3.94Å; F70-L102 HydrophobicContact CE2-CG 3.78Å; F70-L102 HydrophobicContact CZ-CD1 4.18Å; F70-L102 HydrophobicContact CZ-CD2 4.42Å; F70-L102 HydrophobicContact CZ-CG 3.94Å; F70-L123 WeakPolarHBondContact CD2-O 3.35Å
71F82.3Confident81.8Confident41 Ų4131.7 Ų31.718%0.1819%0.186CC..Hα-helixtrans-59.8-42.6178.9-175.6-99.1000112.3A67 E68 V74 S75 E94A67-F71 PolarHBondContact O-N 3.03Å; E68-F71 PolarHBondContact O-N 2.83Å; F71-V74 PolarHBondContact O-N 3.41Å; F71-S75 VanDerWaalsContact O-CB 3.32Å; F71-S75 WeakPolarHBondContact O-CB 3.37Å; F71-S75 PolarHBondContact O-N 3.36Å; F71-S75 PolarHBondContact O-OG 2.99Å; F71-E94 HydrophobicContact CD2-CG 4.41Å; F71-E94 HydrophobicContact CE2-CG 3.96Å; F71-E94 HydrophobicContact CZ-CG 4.22Å
72Q82.6Confident82.1Confident4 Ų434.7 Ų34.72%0.01920%0.196CC..Hα-helixtrans-67-40.3178.4-164.5636500112.1N52 Y59 F60 E68 Q69 F70 L76N52-Q72 PolarHBondContact OD1-NE2 3.36Å; Y59-Q72 HydrophobicContact CE1-CB 4.1Å; Y59-Q72 HydrophobicContact CE1-CG 4Å; F60-Q72 HydrophobicContact CE1-CB 4.4Å; F60-Q72 HydrophobicContact CZ-CB 4.24Å; F60-Q72 HydrophobicContact CZ-CG 4.11Å; E68-Q72 WeakPolarHBondContact O-CB 3.35Å; E68-Q72 PolarHBondContact O-N 3.38Å; Q69-Q72 PolarHBondContact O-N 3.41Å; F70-Q72 VanDerWaalsContact C-N 3.32Å; F70-Q72 PolarHBondContact O-N 3.48Å; Q72-L76 VanDerWaalsContact O-CB 3.29Å; Q72-L76 WeakPolarHBondContact O-CB 3.45Å; Q72-L76 PolarHBondContact O-N 3.14Å
73M86.1Confident82.1Confident1 Ų133.1 Ų33.11%0.00519%0.189CC..Hα-helixtrans-62.3-47.8175.8176.8-165.267.400110.8F60 Q69 F70 L76 A77 L102 L123 C131 L135F60-M73 HydrophobicContact CD1-CB 4.46Å; F60-M73 HydrophobicContact CE1-CB 3.75Å; F60-M73 HydrophobicContact CZ-CB 4.18Å; Q69-M73 VanDerWaalsContact O-CB 3.23Å; Q69-M73 WeakPolarHBondContact O-CB 3.39Å; Q69-M73 PolarHBondContact O-N 2.75Å; F70-M73 HydrophobicContact CD2-CE 3.65Å; F70-M73 HydrophobicContact CE2-CE 3.85Å; F70-M73 PolarHBondContact O-N 2.93Å; M73-L76 PolarHBondContact O-N 3.3Å; M73-A77 WeakPolarHBondContact O-CB 3.46Å; M73-A77 PolarHBondContact O-N 3.16Å; M73-L102 HydrophobicContact CE-CD2 4.08Å; M73-L123 WeakPolarHBondContact CE-O 2.92Å; M73-L123 HydrophobicContact SD-CD2 4.43Å; M73-C131 HydrophobicContact SD-CB 3.56Å; M73-C131 VanDerWaalsContact SD-CB 3.56Å; M73-L135 HydrophobicContact CG-CD1 4.22Å; M73-L135 HydrophobicContact CG-CG 4.5Å
74V85.1Confident82Confident3 Ų328.8 Ų28.82%0.01816%0.159CC..Hα-helixtrans-67.2-40.2-178.7-179.90000110.5F70 F71 L76 A77 A78 P92 V101 L102 I105F70-V74 HydrophobicContact CD1-CG2 4.26Å; F70-V74 HydrophobicContact CD2-CG2 4.12Å; F70-V74 HydrophobicContact CE1-CG2 3.85Å; F70-V74 HydrophobicContact CE2-CG2 3.69Å; F70-V74 HydrophobicContact CG-CG2 4.39Å; F70-V74 HydrophobicContact CZ-CG2 3.55Å; F70-V74 WeakPolarHBondContact O-CG2 3.43Å; F70-V74 PolarHBondContact O-N 3.19Å; F71-V74 PolarHBondContact O-N 3.41Å; V74-L76 VanDerWaalsContact C-N 3.35Å; V74-L76 PolarHBondContact O-N 3.33Å; V74-A77 PolarHBondContact O-N 3.5Å; V74-A78 WeakPolarHBondContact O-CB 3.12Å; V74-A78 PolarHBondContact O-N 2.92Å; V74-P92 HydrophobicContact CB-CG 4.09Å; V74-P92 HydrophobicContact CG1-CB 3.87Å; V74-P92 HydrophobicContact CG1-CG 3.2Å; V74-V101 HydrophobicContact CG1-CB 4.18Å; V74-V101 HydrophobicContact CG1-CG1 3.29Å; V74-L102 HydrophobicContact CG2-CD2 4.47Å; V74-I105 HydrophobicContact CB-CD1 4.33Å; V74-I105 HydrophobicContact CG1-CD1 3.57Å
75S83Confident81.6Confident1 Ų125.8 Ų25.81%0.00715%0.152CC..Hα-helixtrans-61.9-42.5174.7-61.90000111.9F71 A78 W79F71-S75 VanDerWaalsContact O-CB 3.32Å; F71-S75 WeakPolarHBondContact O-CB 3.37Å; F71-S75 PolarHBondContact O-N 3.36Å; F71-S75 PolarHBondContact O-OG 2.99Å; S75-A78 PolarHBondContact O-N 3.45Å; S75-W79 PolarHBondContact O-N 2.89Å
76L83.6Confident81.1Confident0 Ų024.7 Ų24.70%015%0.146CC..Hα-helixtrans-64.8-45.7176.2-177.563.2000112L36 M41 F45 I55 F60 Q72 M73 V74 A78 W79 L80 L135L36-L76 HydrophobicContact CD1-CD1 4.42Å; L36-L76 HydrophobicContact CD1-CD2 4Å; L36-L76 HydrophobicContact CD2-CD1 3.98Å; M41-L76 HydrophobicContact CE-CD1 3.24Å; M41-L76 HydrophobicContact SD-CD1 3.58Å; M41-L76 VanDerWaalsContact SD-CD1 3.58Å; F45-L76 HydrophobicContact CD2-CD1 4.43Å; F45-L76 HydrophobicContact CE1-CD1 4.35Å; F45-L76 HydrophobicContact CE2-CB 4.35Å; F45-L76 HydrophobicContact CE2-CD1 4.16Å; F45-L76 HydrophobicContact CZ-CB 4.05Å; F45-L76 HydrophobicContact CZ-CD1 4.1Å; I55-L76 HydrophobicContact CD1-CD1 4.17Å; I55-L76 HydrophobicContact CD1-CD2 3.79Å; I55-L76 HydrophobicContact CD1-CG 4.48Å; F60-L76 HydrophobicContact CE2-CD2 4.14Å; Q72-L76 VanDerWaalsContact O-CB 3.29Å; Q72-L76 WeakPolarHBondContact O-CB 3.45Å; Q72-L76 PolarHBondContact O-N 3.14Å; M73-L76 PolarHBondContact O-N 3.3Å; V74-L76 VanDerWaalsContact C-N 3.35Å; V74-L76 PolarHBondContact O-N 3.33Å; L76-A78 VanDerWaalsContact C-N 3.32Å; L76-A78 PolarHBondContact O-N 3.21Å; L76-W79 HydrophobicContact CD1-CE3 4.37Å; L76-W79 PolarHBondContact O-N 3.37Å; L76-L80 HydrophobicContact CG-CD1 4.26Å; L76-L80 WeakPolarHBondContact O-CG 3.12Å; L76-L80 PolarHBondContact O-N 3.23Å; L76-L135 HydrophobicContact CB-CD2 4.08Å; L76-L135 HydrophobicContact CD2-CD1 3.7Å; L76-L135 HydrophobicContact CD2-CD2 3.7Å; L76-L135 HydrophobicContact CD2-CG 4.22Å; L76-L135 HydrophobicContact CG-CD2 3.79Å
77A85Confident80.2Confident1 Ų126.4 Ų26.41%0.00816%0.156CC..Hα-helixtrans-61.5-41.1176.900000111.6M73 V74 W79 L80 L81 I105 L135 L138M73-A77 WeakPolarHBondContact O-CB 3.46Å; M73-A77 PolarHBondContact O-N 3.16Å; V74-A77 PolarHBondContact O-N 3.5Å; A77-W79 VanDerWaalsContact C-N 3.33Å; A77-W79 PolarHBondContact O-N 3.45Å; A77-L80 PolarHBondContact O-N 3.07Å; A77-L81 WeakPolarHBondContact O-CB 3.46Å; A77-L81 WeakPolarHBondContact O-CG 3.46Å; A77-L81 PolarHBondContact O-N 3.11Å; A77-I105 HydrophobicContact CB-CD1 3.96Å; A77-I105 HydrophobicContact CB-CG2 4.21Å; A77-L135 HydrophobicContact CB-CD2 4.05Å; A77-L138 HydrophobicContact CB-CD1 3.86Å
78A83.7Confident79.3Confident0 Ų030 Ų300%017%0.165CC..Hα-helixtrans-61.7-40.8174.400000112.1V74 S75 L76 L81 R82 F89V74-A78 WeakPolarHBondContact O-CB 3.12Å; V74-A78 PolarHBondContact O-N 2.92Å; S75-A78 PolarHBondContact O-N 3.45Å; L76-A78 VanDerWaalsContact C-N 3.32Å; L76-A78 PolarHBondContact O-N 3.21Å; A78-L81 PolarHBondContact O-N 3.1Å; A78-R82 WeakPolarHBondContact O-CG 3.3Å; A78-R82 PolarHBondContact O-N 3.27Å; A78-R82 VanDerWaalsContact O-N 3.14Å; A78-F89 HydrophobicContact CB-CD1 3.71Å; A78-F89 HydrophobicContact CB-CE1 3.85Å
79W83Confident78.7Confident7 Ų727.7 Ų27.73%0.02716%0.155CC..Hα-helixtrans-66.3-44.2175.8179.785.3000112.4L36 L39 M41 E44 F45 S75 L76 A77 L81 R82 K83L36-W79 HydrophobicContact CD2-CZ3 4.37Å; L39-W79 HydrophobicContact CB-CH2 3.77Å; L39-W79 HydrophobicContact CB-CZ3 4.2Å; L39-W79 HydrophobicContact CD1-CZ3 4.48Å; L39-W79 WeakPolarHBondContact O-CH2 3.24Å; M41-W79 HydrophobicContact CB-CH2 4.46Å; M41-W79 HydrophobicContact CG-CE3 4.32Å; M41-W79 HydrophobicContact CG-CH2 3.45Å; M41-W79 VanDerWaalsContact CG-CH2 3.45Å; M41-W79 HydrophobicContact CG-CZ2 4.25Å; M41-W79 HydrophobicContact CG-CZ3 3.51Å; M41-W79 HydrophobicContact SD-CD2 3.85Å; M41-W79 HydrophobicContact SD-CE3 3.32Å; M41-W79 HydrophobicContact SD-CH2 3.46Å; M41-W79 WeakPolarHBondContact SD-CH2 3.32Å; M41-W79 HydrophobicContact SD-CZ2 3.97Å; M41-W79 HydrophobicContact SD-CZ3 3.12Å; M41-W79 WeakPolarHBondContact SD-CZ3 3.28Å; E44-W79 HydrophobicContact CB-CZ2 4.13Å; F45-W79 HydrophobicContact CB-CD2 4.23Å; F45-W79 HydrophobicContact CB-CG 4.39Å; F45-W79 HydrophobicContact CB-CZ2 4.46Å; F45-W79 HydrophobicContact CD2-CB 3.56Å; F45-W79 AromaticContact CD2-CD1 3.86Å; F45-W79 AromaticContact CD2-CD2 3.99Å; F45-W79 HydrophobicContact CD2-CD2 3.99Å; F45-W79 AromaticContact CD2-CG 3.51Å; F45-W79 HydrophobicContact CD2-CG 3.51Å; F45-W79 HydrophobicContact CE2-CB 3.8Å; F45-W79 HydrophobicContact CE2-CG 4.25Å; F45-W79 HydrophobicContact CG-CG 4.4Å; S75-W79 PolarHBondContact O-N 2.89Å; L76-W79 HydrophobicContact CD1-CE3 4.37Å; L76-W79 PolarHBondContact O-N 3.37Å; A77-W79 VanDerWaalsContact C-N 3.33Å; A77-W79 PolarHBondContact O-N 3.45Å; W79-L81 VanDerWaalsContact C-N 3.34Å; W79-L81 PolarHBondContact O-N 3.49Å; W79-R82 WeakPolarHBondContact O-CB 3.41Å; W79-R82 PolarHBondContact O-N 3.07Å; W79-R82 VanDerWaalsContact O-N 3.16Å; W79-K83 HydrophobicContact CD2-CG 4.46Å; W79-K83 HydrophobicContact CH2-CG 4.27Å; W79-K83 HydrophobicContact CZ2-CG 4.18Å; W79-K83 HydrophobicContact CZ3-CG 4.44Å; W79-K83 PolarHBondContact O-N 3.17Å; W79-K83 VanDerWaalsContact O-N 3.14Å
80L83.4Confident77.7Confident0 Ų032.2 Ų32.20%018%0.184CC..Hα-helixtrans-60.9-43.1175.5-71.2171.2000111.5L36 L39 L76 A77 R82 K83 C84 L135 L138 A139 A142L36-L80 HydrophobicContact CD2-CD1 4.42Å; L36-L80 HydrophobicContact CD2-CD2 3.96Å; L39-L80 HydrophobicContact CD1-CD2 3.82Å; L76-L80 HydrophobicContact CG-CD1 4.26Å; L76-L80 WeakPolarHBondContact O-CG 3.12Å; L76-L80 PolarHBondContact O-N 3.23Å; A77-L80 PolarHBondContact O-N 3.07Å; L80-R82 VanDerWaalsContact C-N 3.27Å; L80-R82 PolarHBondContact O-N 3.15Å; L80-K83 CarbonylContact O-C 3.59Å; L80-K83 WeakPolarHBondContact O-CA 3.41Å; L80-K83 WeakPolarHBondContact O-CB 3.36Å; L80-K83 PolarHBondContact O-N 3.4Å; L80-C84 PolarHBondContact O-N 3.44Å; L80-C84 PolarHBondContact O-SG 3.29Å; L80-L135 HydrophobicContact CD1-CD2 4.09Å; L80-L138 HydrophobicContact CB-CB 3.97Å; L80-L138 HydrophobicContact CD1-CB 3.75Å; L80-L138 HydrophobicContact CG-CB 4.46Å; L80-A139 HydrophobicContact CD1-CB 4.43Å; L80-A139 HydrophobicContact CD2-CB 4.29Å; L80-A142 HydrophobicContact CD2-CB 4.21Å
81L83Confident76.9Confident2 Ų233.2 Ų33.21%0.0119%0.19CC..Hα-helixtrans-60.6-34.8175.9-77.2172.6000113.1A77 A78 W79 K83 C84 G85 N86 F89 I105 E108 L112 L138A77-L81 WeakPolarHBondContact O-CB 3.46Å; A77-L81 WeakPolarHBondContact O-CG 3.46Å; A77-L81 PolarHBondContact O-N 3.11Å; A78-L81 PolarHBondContact O-N 3.1Å; W79-L81 VanDerWaalsContact C-N 3.34Å; W79-L81 PolarHBondContact O-N 3.49Å; L81-K83 VanDerWaalsContact C-N 3.33Å; L81-C84 PolarHBondContact O-N 2.86Å; L81-G85 PolarHBondContact O-N 2.89Å; L81-N86 PolarHBondContact O-N 3.21Å; L81-F89 HydrophobicContact CD1-CD1 4.44Å; L81-F89 HydrophobicContact CD1-CD2 4.41Å; L81-F89 HydrophobicContact CD1-CE1 4.3Å; L81-F89 HydrophobicContact CD1-CE2 4.26Å; L81-F89 HydrophobicContact CD1-CG 4.5Å; L81-F89 HydrophobicContact CD1-CZ 4.2Å; L81-I105 HydrophobicContact CD1-CB 4.39Å; L81-I105 HydrophobicContact CD1-CG1 4.24Å; L81-I105 HydrophobicContact CD1-CG2 4.09Å; L81-E108 HydrophobicContact CD1-CB 4.04Å; L81-E108 HydrophobicContact CD1-CG 4.29Å; L81-E108 HydrophobicContact CD2-CB 4.12Å; L81-E108 HydrophobicContact CD2-CG 3.98Å; L81-L112 HydrophobicContact CD2-CD1 3.72Å; L81-L138 HydrophobicContact CD2-CD2 3.65Å; L81-L138 HydrophobicContact CG-CD2 4.08Å
82R83.1Confident76.2Confident70 Ų7032 Ų3226%0.26419%0.186SC..Hα-helixtrans-64.3-40.7173.2-71.1168173.7-150.9-6.3111.5A78 W79 L80 C84 G85 N86 F89 L91A78-R82 WeakPolarHBondContact O-CG 3.3Å; A78-R82 PolarHBondContact O-N 3.27Å; A78-R82 VanDerWaalsContact O-N 3.14Å; W79-R82 WeakPolarHBondContact O-CB 3.41Å; W79-R82 PolarHBondContact O-N 3.07Å; W79-R82 VanDerWaalsContact O-N 3.16Å; L80-R82 VanDerWaalsContact C-N 3.27Å; L80-R82 PolarHBondContact O-N 3.15Å; R82-C84 VanDerWaalsContact C-N 3.33Å; R82-G85 PolarHBondContact O-N 3.41Å; R82-N86 WeakPolarHBondContact CA-O 3.26Å; R82-F89 HydrophobicContact CG-CB 4.35Å; R82-F89 VanDerWaalsContact CZ-O 3.28Å; R82-F89 PolarHBondContact NE-O 3.48Å; R82-F89 PolarHBondContact NH2-O 3.42Å; R82-L91 VanDerWaalsContact CZ-CD1 3.44Å; R82-L91 VanDerWaalsContact NH1-CD1 3.28Å
83K77.4Confident75.4Confident55 Ų5539 Ų3924%0.23922%0.217CC..Hα-helixtrans-66.8-32.4174.5-69.3-69.9-172.7173.10112.7E44 W79 L80 L81 G85 A142E44-K83 IonicContact OE1-NZ 2.89Å; E44-K83 PolarHBondContact OE1-NZ 3.43Å; E44-K83 WeakPolarHBondContact OE2-CE 3.44Å; E44-K83 IonicContact OE2-NZ 2.83Å; E44-K83 PolarHBondContact OE2-NZ 2.92Å; W79-K83 HydrophobicContact CD2-CG 4.46Å; W79-K83 HydrophobicContact CH2-CG 4.27Å; W79-K83 HydrophobicContact CZ2-CG 4.18Å; W79-K83 HydrophobicContact CZ3-CG 4.44Å; W79-K83 PolarHBondContact O-N 3.17Å; W79-K83 VanDerWaalsContact O-N 3.14Å; L80-K83 CarbonylContact O-C 3.59Å; L80-K83 WeakPolarHBondContact O-CA 3.41Å; L80-K83 WeakPolarHBondContact O-CB 3.36Å; L80-K83 PolarHBondContact O-N 3.4Å; L81-K83 VanDerWaalsContact C-N 3.33Å; K83-G85 PolarHBondContact O-N 2.83Å; K83-A142 HydrophobicContact CB-CB 4.09Å
84C74.9Confident74.3Confident2 Ų246.3 Ų46.31%0.01425%0.251CS..THydrogen-bonded Turntrans-73.2-2.6176.4-60.30000114.5L80 L81 R82 L112 A142 R145L80-C84 PolarHBondContact O-N 3.44Å; L80-C84 PolarHBondContact O-SG 3.29Å; L81-C84 PolarHBondContact O-N 2.86Å; R82-C84 VanDerWaalsContact C-N 3.33Å; C84-L112 HydrophobicContact CB-CD1 3.95Å; C84-A142 VanDerWaalsContact SG-CA 3.5Å; C84-A142 PolarHBondContact SG-N 3.49Å; C84-R145 WeakPolarHBondContact O-CD 3.41Å; C84-R145 PolarHBondContact O-NE 3.46Å; C84-R145 PolarHBondContact O-NH1 3.26Å
85G68.3Low73.3Confident58 Ų5853.4 Ų53.460%0.59829%0.289SS*.THydrogen-bonded Turntrans113.515.2172.800000115.8L81 R82 K83 P87L81-G85 PolarHBondContact O-N 2.89Å; R82-G85 PolarHBondContact O-N 3.41Å; K83-G85 PolarHBondContact O-N 2.83Å; G85-P87 WeakPolarHBondContact O-CD 3.49Å
86N67.7Low72.6Confident52 Ų5257.1 Ų57.128%0.27831%0.308SS..  trans-115.580.8170.1-156.2-17000112.2L81 R82 N88 F89 E108L81-N86 PolarHBondContact O-N 3.21Å; R82-N86 WeakPolarHBondContact CA-O 3.26Å; N86-N88 PolarHBondContact O-N 2.84Å; N86-N88 VanDerWaalsContact O-N 3.13Å; N86-F89 PolarHBondContact O-N 3.46Å; N86-E108 VanDerWaalsContact ND2-CD 3.3Å; N86-E108 PolarHBondContact ND2-OE1 2.96Å
87P61.9Low72.3Confident90 Ų9062.9 Ų62.958%0.58434%0.339SS*.THydrogen-bonded Turntrans-65.1-20.2-17124.3-33.2000114.1G85G85-P87 WeakPolarHBondContact O-CD 3.49Å
88N61.2Low71.9Confident145 Ų14565 Ų6578%0.77535%0.352SS*.THydrogen-bonded Turntrans-96.310.6-177-72.6-18.6000114.1N86 P90N86-N88 PolarHBondContact O-N 2.84Å; N86-N88 VanDerWaalsContact O-N 3.13Å; N88-P90 WeakPolarHBondContact O-CD 3.43Å
89F67.9Low71.7Confident22 Ų2267 Ų6710%0.09637%0.367CS..PPolyproline II helixtrans-64121.6176.6-166.2-94.2000110A78 L81 R82 N86 L91 I105 E108A78-F89 HydrophobicContact CB-CD1 3.71Å; A78-F89 HydrophobicContact CB-CE1 3.85Å; L81-F89 HydrophobicContact CD1-CD1 4.44Å; L81-F89 HydrophobicContact CD1-CD2 4.41Å; L81-F89 HydrophobicContact CD1-CE1 4.3Å; L81-F89 HydrophobicContact CD1-CE2 4.26Å; L81-F89 HydrophobicContact CD1-CG 4.5Å; L81-F89 HydrophobicContact CD1-CZ 4.2Å; R82-F89 HydrophobicContact CG-CB 4.35Å; R82-F89 VanDerWaalsContact CZ-O 3.28Å; R82-F89 PolarHBondContact NE-O 3.48Å; R82-F89 PolarHBondContact NH2-O 3.42Å; N86-F89 PolarHBondContact O-N 3.46Å; F89-L91 PolarHBondContact O-N 3.25Å; F89-I105 HydrophobicContact CE1-CG1 4Å; F89-I105 HydrophobicContact CZ-CG1 3.71Å; F89-E108 HydrophobicContact CD2-CG 4.45Å; F89-E108 HydrophobicContact CE2-CB 4.42Å
90P64.9Low71.5Confident94 Ų9470.5 Ų70.561%0.6139%0.393SS*.PPolyproline II helixtrans-65.7135.9-174.325.3-32.2000110.6N88N88-P90 WeakPolarHBondContact O-CD 3.43Å
91L67.2Low71.4Confident50 Ų5071.6 Ų71.626%0.26240%0.399SS..PPolyproline II helixtrans-66.1136.1167.4-79.5119.5000108.4L48 R82 F89 K93L48-L91 HydrophobicContact CD2-CD1 4.1Å; L48-L91 HydrophobicContact CD2-CD2 4.03Å; R82-L91 VanDerWaalsContact CZ-CD1 3.44Å; R82-L91 VanDerWaalsContact NH1-CD1 3.28Å; F89-L91 PolarHBondContact O-N 3.25Å; L91-K93 PolarHBondContact O-N 3Å
92P66.6Low71.3Confident14 Ų1471.6 Ų71.69%0.09140%0.399CS..PPolyproline II helixtrans-62.8135.1177-12.725.7000110.4V74 V101V74-P92 HydrophobicContact CB-CG 4.09Å; V74-P92 HydrophobicContact CG1-CB 3.87Å; V74-P92 HydrophobicContact CG1-CG 3.2Å; P92-V101 HydrophobicContact CB-CG1 4.13Å; P92-V101 HydrophobicContact CG-CG1 4.05Å
93K65.5Low71.2Confident153 Ų15370.7 Ų70.767%0.66540%0.403SS*.PPolyproline II helixtrans-92.7154.9167.5-65.8-179.6179.81790109.7L91 D95 D96L91-K93 PolarHBondContact O-N 3Å; K93-D95 PolarHBondContact O-N 3.05Å; K93-D95 VanDerWaalsContact O-N 3.07Å; K93-D96 PolarHBondContact N-OD2 3.23Å; K93-D96 WeakPolarHBondContact O-CB 3.37Å; K93-D96 PolarHBondContact O-N 3.18Å
94E64.5Low71.4Confident154 Ų15469.3 Ų69.372%0.7241%0.405SS*.THydrogen-bonded Turntrans-57.8-23.7-180-68.2-176.417000113F71F71-E94 HydrophobicContact CD2-CG 4.41Å; F71-E94 HydrophobicContact CE2-CG 3.96Å; F71-E94 HydrophobicContact CZ-CG 4.22Å
95D62.6Low71.8Confident152 Ų15269.2 Ų69.281%0.81340%0.404SS*.THydrogen-bonded Turntrans-89-4.4-179.6-54.5-45.6000114.3K93K93-D95 PolarHBondContact O-N 3.05Å; K93-D95 VanDerWaalsContact O-N 3.07Å
96D69.1Low72.5Confident78 Ų7867.5 Ų67.542%0.41738%0.381SS..SBendtrans-76135.4-175.5-73.9-36.2000111.7K93 P98 V101K93-D96 PolarHBondContact N-OD2 3.23Å; K93-D96 WeakPolarHBondContact O-CB 3.37Å; K93-D96 PolarHBondContact O-N 3.18Å; D96-P98 VanDerWaalsContact O-N 3.16Å; D96-V101 HydrophobicContact CB-CG2 3.54Å
97N77.1Confident73.1Confident122 Ų12269.4 Ų69.465%0.65239%0.391SS*.  trans-58.3120.9179.6-77.2-57.9000110.8S99 S100 V101N97-S99 PolarHBondContact O-N 2.87Å; N97-S100 WeakPolarHBondContact O-CA 3.18Å; N97-S100 WeakPolarHBondContact O-CB 3.06Å; N97-S100 PolarHBondContact O-N 3.42Å; N97-V101 PolarHBondContact O-N 2.9Å; N97-V101 VanDerWaalsContact O-N 3.16Å
98P76.2Confident73.9Confident44 Ų4466.2 Ų66.229%0.28637%0.369SS..Hα-helixtrans-61.7-30.6-169.122-34000112.9F70 D96 L102F70-P98 HydrophobicContact CD1-CB 4.44Å; F70-P98 HydrophobicContact CE1-CB 3.49Å; F70-P98 VanDerWaalsContact CE1-CB 3.49Å; F70-P98 HydrophobicContact CE2-CB 4.49Å; F70-P98 HydrophobicContact CZ-CB 3.51Å; D96-P98 VanDerWaalsContact O-N 3.16Å; P98-L102 WeakPolarHBondContact O-CB 3.41Å; P98-L102 VanDerWaalsContact O-CG 3.28Å; P98-L102 WeakPolarHBondContact O-CG 3.23Å; P98-L102 PolarHBondContact O-N 3.27Å
99S79.4Confident74.7Confident43 Ų4359.6 Ų59.630%0.30133%0.333SS..Hα-helixtrans-74.5-32.5176.7-54.10000112.8N97 S103 R124N97-S99 PolarHBondContact O-N 2.87Å; S99-S103 VanDerWaalsContact O-CB 3.28Å; S99-S103 WeakPolarHBondContact O-CB 3.39Å; S99-S103 PolarHBondContact O-N 2.97Å; S99-S103 PolarHBondContact O-OG 3.44Å; S99-R124 PolarHBondContact OG-NH2 3.34Å
100S79.9Confident75.3Confident81 Ų8164.7 Ų64.757%0.56636%0.355SS*.Hα-helixtrans-70.8-43.2179.8-165.90000110.2N97 S103 G104N97-S100 WeakPolarHBondContact O-CA 3.18Å; N97-S100 WeakPolarHBondContact O-CB 3.06Å; N97-S100 PolarHBondContact O-N 3.42Å; S100-S103 PolarHBondContact O-N 3.41Å; S100-G104 PolarHBondContact O-N 3.36Å
101V81.6Confident76Confident22 Ų2267 Ų6713%0.13336%0.356CS..Hα-helixtrans-67.9-43.5178.1-166.20000111.5V74 P92 D96 N97 S103 G104 I105V74-V101 HydrophobicContact CG1-CB 4.18Å; V74-V101 HydrophobicContact CG1-CG1 3.29Å; P92-V101 HydrophobicContact CB-CG1 4.13Å; P92-V101 HydrophobicContact CG-CG1 4.05Å; D96-V101 HydrophobicContact CB-CG2 3.54Å; N97-V101 PolarHBondContact O-N 2.9Å; N97-V101 VanDerWaalsContact O-N 3.16Å; V101-S103 VanDerWaalsContact C-N 3.32Å; V101-S103 PolarHBondContact O-N 2.93Å; V101-G104 PolarHBondContact O-N 3.15Å; V101-G104 VanDerWaalsContact O-N 3.15Å; V101-I105 HydrophobicContact CG1-CD1 4.27Å; V101-I105 WeakPolarHBondContact O-CG1 3.35Å; V101-I105 PolarHBondContact O-N 3.47Å
102L81.2Confident76.3Confident2 Ų266.3 Ų66.31%0.0135%0.352CS..Hα-helixtrans-59.4-42.4173.1-77.4177.1000112.2F70 M73 V74 P98 G104 I105 L106 L123F70-L102 HydrophobicContact CE2-CD1 3.76Å; F70-L102 HydrophobicContact CE2-CD2 3.94Å; F70-L102 HydrophobicContact CE2-CG 3.78Å; F70-L102 HydrophobicContact CZ-CD1 4.18Å; F70-L102 HydrophobicContact CZ-CD2 4.42Å; F70-L102 HydrophobicContact CZ-CG 3.94Å; M73-L102 HydrophobicContact CE-CD2 4.08Å; V74-L102 HydrophobicContact CG2-CD2 4.47Å; P98-L102 WeakPolarHBondContact O-CB 3.41Å; P98-L102 VanDerWaalsContact O-CG 3.28Å; P98-L102 WeakPolarHBondContact O-CG 3.23Å; P98-L102 PolarHBondContact O-N 3.27Å; L102-G104 VanDerWaalsContact C-N 3.29Å; L102-G104 PolarHBondContact O-N 3.01Å; L102-I105 PolarHBondContact O-N 2.86Å; L102-L106 WeakPolarHBondContact O-CB 3.44Å; L102-L106 VanDerWaalsContact O-CG 3.26Å; L102-L106 WeakPolarHBondContact O-CG 3.46Å; L102-L106 PolarHBondContact O-N 2.86Å; L102-L123 HydrophobicContact CD1-CB 3.87Å; L102-L123 HydrophobicContact CD2-CB 3.85Å; L102-L123 HydrophobicContact CD2-CD1 4.19Å
103S81Confident76.3Confident51 Ų5174.3 Ų74.336%0.35739%0.388SS..Hα-helixtrans-64.9-36.7176.7-580000111.4S99 S100 V101 N107S99-S103 VanDerWaalsContact O-CB 3.28Å; S99-S103 WeakPolarHBondContact O-CB 3.39Å; S99-S103 PolarHBondContact O-N 2.97Å; S99-S103 PolarHBondContact O-OG 3.44Å; S100-S103 PolarHBondContact O-N 3.41Å; V101-S103 VanDerWaalsContact C-N 3.32Å; V101-S103 PolarHBondContact O-N 2.93Å; S103-N107 VanDerWaalsContact O-CB 3.28Å; S103-N107 WeakPolarHBondContact O-CB 3.27Å; S103-N107 PolarHBondContact O-N 2.7Å; S103-N107 PolarHBondContact O-ND2 3.43Å
104G81.3Confident76.2Confident26 Ų2668.4 Ų68.427%0.26836%0.363SS..Hα-helixtrans-61-48.7173.200000112.6S100 V101 L102 N107 E108S100-G104 PolarHBondContact O-N 3.36Å; V101-G104 PolarHBondContact O-N 3.15Å; V101-G104 VanDerWaalsContact O-N 3.15Å; L102-G104 VanDerWaalsContact C-N 3.29Å; L102-G104 PolarHBondContact O-N 3.01Å; G104-N107 PolarHBondContact O-N 3.37Å; G104-E108 PolarHBondContact O-N 3.44Å
105I83Confident75.6Confident1 Ų166 Ų661%0.00537%0.369CS..Hα-helixtrans-62.8-46.7177.3-67.5168.9000110.8V74 A77 L81 F89 V101 L102 N107 E108 M109V74-I105 HydrophobicContact CB-CD1 4.33Å; V74-I105 HydrophobicContact CG1-CD1 3.57Å; A77-I105 HydrophobicContact CB-CD1 3.96Å; A77-I105 HydrophobicContact CB-CG2 4.21Å; L81-I105 HydrophobicContact CD1-CB 4.39Å; L81-I105 HydrophobicContact CD1-CG1 4.24Å; L81-I105 HydrophobicContact CD1-CG2 4.09Å; F89-I105 HydrophobicContact CE1-CG1 4Å; F89-I105 HydrophobicContact CZ-CG1 3.71Å; V101-I105 HydrophobicContact CG1-CD1 4.27Å; V101-I105 WeakPolarHBondContact O-CG1 3.35Å; V101-I105 PolarHBondContact O-N 3.47Å; L102-I105 PolarHBondContact O-N 2.86Å; I105-N107 VanDerWaalsContact C-N 3.35Å; I105-N107 PolarHBondContact O-N 2.89Å; I105-E108 PolarHBondContact O-N 3.4Å; I105-E108 VanDerWaalsContact O-N 3.15Å; I105-M109 HydrophobicContact CG2-SD 4.39Å; I105-M109 WeakPolarHBondContact O-CG 3.09Å; I105-M109 PolarHBondContact O-N 3.35Å
106L82.2Confident75.6Confident22 Ų2261.1 Ų61.112%0.11535%0.345CS..Hα-helixtrans-64.7-37.7179.8-71.7171.6000112.4L102 E108 M109 K110 Y118 T120 L123 L134L102-L106 WeakPolarHBondContact O-CB 3.44Å; L102-L106 VanDerWaalsContact O-CG 3.26Å; L102-L106 WeakPolarHBondContact O-CG 3.46Å; L102-L106 PolarHBondContact O-N 2.86Å; L106-E108 VanDerWaalsContact C-N 3.3Å; L106-M109 PolarHBondContact O-N 3.47Å; L106-K110 WeakPolarHBondContact O-CG 3.43Å; L106-K110 PolarHBondContact O-N 2.69Å; L106-Y118 HydrophobicContact CD2-CD2 4.01Å; L106-T120 HydrophobicContact CD1-CG2 3.82Å; L106-L123 HydrophobicContact CD1-CD1 4.46Å; L106-L123 HydrophobicContact CD2-CD1 4.39Å; L106-L134 HydrophobicContact CD2-CD1 4.26Å
107N81.3Confident75.3Confident91 Ų9164.9 Ų64.949%0.48737%0.365SS..Hα-helixtrans-65.3-36.9174.3-75.7-18.8000111.6S103 G104 I105 K110 K111S103-N107 VanDerWaalsContact O-CB 3.28Å; S103-N107 WeakPolarHBondContact O-CB 3.27Å; S103-N107 PolarHBondContact O-N 2.7Å; S103-N107 PolarHBondContact O-ND2 3.43Å; G104-N107 PolarHBondContact O-N 3.37Å; I105-N107 VanDerWaalsContact C-N 3.35Å; I105-N107 PolarHBondContact O-N 2.89Å; N107-K110 PolarHBondContact O-N 3.09Å; N107-K111 WeakPolarHBondContact O-CG 3.33Å; N107-K111 PolarHBondContact O-N 3.22Å; N107-K111 VanDerWaalsContact O-N 3.17Å
108E78.3Confident75.1Confident24 Ų2460.5 Ų60.511%0.11234%0.34CS..Hα-helixtrans-71.2-37.1176.9-152.658.7-150.900111.9L81 N86 F89 G104 I105 L106 K110 K111 L112L81-E108 HydrophobicContact CD1-CB 4.04Å; L81-E108 HydrophobicContact CD1-CG 4.29Å; L81-E108 HydrophobicContact CD2-CB 4.12Å; L81-E108 HydrophobicContact CD2-CG 3.98Å; N86-E108 VanDerWaalsContact ND2-CD 3.3Å; N86-E108 PolarHBondContact ND2-OE1 2.96Å; F89-E108 HydrophobicContact CD2-CG 4.45Å; F89-E108 HydrophobicContact CE2-CB 4.42Å; G104-E108 PolarHBondContact O-N 3.44Å; I105-E108 PolarHBondContact O-N 3.4Å; I105-E108 VanDerWaalsContact O-N 3.15Å; L106-E108 VanDerWaalsContact C-N 3.3Å; E108-K110 VanDerWaalsContact C-N 3.33Å; E108-K110 PolarHBondContact O-N 3.48Å; E108-K111 WeakPolarHBondContact O-CB 3.35Å; E108-K111 PolarHBondContact O-N 2.9Å; E108-K111 IonicContact OE1-NZ 2.85Å; E108-K111 IonicContact OE2-NZ 2.8Å; E108-K111 PolarHBondContact OE2-NZ 3.43Å; E108-L112 PolarHBondContact O-N 3.41Å; E108-L112 VanDerWaalsContact O-N 3.16Å
109M78.7Confident74.9Confident5 Ų561.2 Ų61.23%0.02535%0.346CS..Hα-helixtrans-63.2-38.2171.3-72.6-173.478.200112.7I105 L106 K111 L112 M114 L134 L138I105-M109 HydrophobicContact CG2-SD 4.39Å; I105-M109 WeakPolarHBondContact O-CG 3.09Å; I105-M109 PolarHBondContact O-N 3.35Å; L106-M109 PolarHBondContact O-N 3.47Å; M109-K111 VanDerWaalsContact C-N 3.28Å; M109-K111 PolarHBondContact O-N 3Å; M109-L112 PolarHBondContact O-N 2.9Å; M109-L112 VanDerWaalsContact O-N 3.14Å; M109-M114 HydrophobicContact CE-CB 4.44Å; M109-M114 HydrophobicContact CE-CE 3.64Å; M109-M114 HydrophobicContact CE-SD 4.02Å; M109-M114 PolarHBondContact O-N 3.38Å; M109-L134 HydrophobicContact CE-CD1 3.89Å; M109-L134 HydrophobicContact SD-CD1 3.23Å; M109-L134 WeakPolarHBondContact SD-CD1 3.34Å; M109-L134 HydrophobicContact SD-CG 4.04Å; M109-L138 HydrophobicContact CE-CD2 4Å; M109-L138 HydrophobicContact CE-CG 3.81Å; M109-L138 HydrophobicContact CG-CD2 3.77Å; M109-L138 HydrophobicContact CG-CG 4.37Å; M109-L138 HydrophobicContact SD-CD1 4.08Å; M109-L138 HydrophobicContact SD-CD2 4.04Å; M109-L138 HydrophobicContact SD-CG 3.97Å
110K80.7Confident74.6Confident130 Ų13061.6 Ų61.657%0.56535%0.346SS*.Hα-helixtrans-62.2-36.2173.9-76.7-179.9-179.6-173.40112.3L106 N107 E108 L112 E113L106-K110 WeakPolarHBondContact O-CG 3.43Å; L106-K110 PolarHBondContact O-N 2.69Å; N107-K110 PolarHBondContact O-N 3.09Å; E108-K110 VanDerWaalsContact C-N 3.33Å; E108-K110 PolarHBondContact O-N 3.48Å; K110-L112 VanDerWaalsContact C-N 3.29Å; K110-E113 PolarHBondContact O-N 3.44Å
111K79.7Confident74.3Confident143 Ų14361.1 Ų61.162%0.62234%0.343SS*.Hα-helixtrans-68.8-29175.3-68.5175.9-166.4163.80112.8N107 E108 M109 E113N107-K111 WeakPolarHBondContact O-CG 3.33Å; N107-K111 PolarHBondContact O-N 3.22Å; N107-K111 VanDerWaalsContact O-N 3.17Å; E108-K111 WeakPolarHBondContact O-CB 3.35Å; E108-K111 PolarHBondContact O-N 2.9Å; E108-K111 IonicContact OE1-NZ 2.85Å; E108-K111 IonicContact OE2-NZ 2.8Å; E108-K111 PolarHBondContact OE2-NZ 3.43Å; M109-K111 VanDerWaalsContact C-N 3.28Å; M109-K111 PolarHBondContact O-N 3Å; K111-E113 PolarHBondContact O-N 3.18Å
112L71.7Confident74.2Confident34 Ų3466.8 Ų66.818%0.17836%0.362CS..THydrogen-bonded Turntrans-80.413.4174.1-66170.6000112.8L81 C84 E108 M109 K110 M114L81-L112 HydrophobicContact CD2-CD1 3.72Å; C84-L112 HydrophobicContact CB-CD1 3.95Å; E108-L112 PolarHBondContact O-N 3.41Å; E108-L112 VanDerWaalsContact O-N 3.16Å; M109-L112 PolarHBondContact O-N 2.9Å; M109-L112 VanDerWaalsContact O-N 3.14Å; K110-L112 VanDerWaalsContact C-N 3.29Å; L112-M114 HydrophobicContact CB-CG 4.2Å; L112-M114 HydrophobicContact CB-SD 4.25Å; L112-M114 PolarHBondContact O-N 2.88Å
113E68Low74Confident183 Ų18366.7 Ų66.786%0.85536%0.361SS*.THydrogen-bonded Turntrans58.722.4-178.5-60.6-173.2162.200114.5K110 K111 A115K110-E113 PolarHBondContact O-N 3.44Å; K111-E113 PolarHBondContact O-N 3.18Å; E113-A115 PolarHBondContact O-N 3.49Å
114M62.7Low73.9Confident29 Ų2970 Ų7014%0.14337%0.366CS..  trans-87.8102.3177.5-59.9176.571.700109.9M109 L112 V116 C137 L138 E141M109-M114 HydrophobicContact CE-CB 4.44Å; M109-M114 HydrophobicContact CE-CE 3.64Å; M109-M114 HydrophobicContact CE-SD 4.02Å; M109-M114 PolarHBondContact O-N 3.38Å; L112-M114 HydrophobicContact CB-CG 4.2Å; L112-M114 HydrophobicContact CB-SD 4.25Å; L112-M114 PolarHBondContact O-N 2.88Å; M114-V116 PolarHBondContact O-N 3.46Å; M114-V116 VanDerWaalsContact O-N 3.09Å; M114-C137 HydrophobicContact CE-CB 3.26Å; M114-C137 WeakPolarHBondContact CE-O 3.42Å; M114-L138 HydrophobicContact SD-CD2 4.41Å; M114-E141 HydrophobicContact CE-CB 4.48Å; M114-E141 HydrophobicContact SD-CB 4.07Å; M114-E141 HydrophobicContact SD-CG 4.24Å
115A52.9Low73.8Confident102 Ų10272.9 Ų72.984%0.84338%0.375SS*.  trans-79.589.4-179.900000111.2E113E113-A115 PolarHBondContact O-N 3.49Å
116V61.5Low73.3Confident50 Ų5072.9 Ų72.930%0.30337%0.374SS..  trans-138112.1168.1-151.90000112.8M114 Y118M114-V116 PolarHBondContact O-N 3.46Å; M114-V116 VanDerWaalsContact O-N 3.09Å; V116-Y118 HydrophobicContact CB-CD2 3.8Å; V116-Y118 HydrophobicContact CB-CE1 4.37Å; V116-Y118 HydrophobicContact CB-CE2 3.28Å; V116-Y118 HydrophobicContact CG1-CD1 3.96Å; V116-Y118 HydrophobicContact CG1-CD2 3.83Å; V116-Y118 HydrophobicContact CG1-CE1 3.43Å; V116-Y118 VanDerWaalsContact CG1-CE1 3.43Å; V116-Y118 HydrophobicContact CG1-CE2 3.31Å; V116-Y118 HydrophobicContact CG1-CG 4.15Å; V116-Y118 WeakPolarHBondContact CG1-OH 3.29Å; V116-Y118 HydrophobicContact CG2-CE2 3.95Å; V116-Y118 PolarHBondContact O-N 3.15Å; V116-Y118 VanDerWaalsContact O-N 3.11Å
117D63.4Low73.1Confident158 Ų15872.6 Ų72.685%0.84537%0.374SS*.  trans-8378.4177.1-73.6-37.9000110.6
118Y71.6Confident73.1Confident30 Ų3069 Ų6912%0.11836%0.358CS..  trans-82.5134.2172.8-59.5-69.5000111.3L106 V116 T120 L123 E130 Q133 L134L106-Y118 HydrophobicContact CD2-CD2 4.01Å; V116-Y118 HydrophobicContact CB-CD2 3.8Å; V116-Y118 HydrophobicContact CB-CE1 4.37Å; V116-Y118 HydrophobicContact CB-CE2 3.28Å; V116-Y118 HydrophobicContact CG1-CD1 3.96Å; V116-Y118 HydrophobicContact CG1-CD2 3.83Å; V116-Y118 HydrophobicContact CG1-CE1 3.43Å; V116-Y118 VanDerWaalsContact CG1-CE1 3.43Å; V116-Y118 HydrophobicContact CG1-CE2 3.31Å; V116-Y118 HydrophobicContact CG1-CG 4.15Å; V116-Y118 WeakPolarHBondContact CG1-OH 3.29Å; V116-Y118 HydrophobicContact CG2-CE2 3.95Å; V116-Y118 PolarHBondContact O-N 3.15Å; V116-Y118 VanDerWaalsContact O-N 3.11Å; Y118-T120 PolarHBondContact O-N 3.34Å; Y118-L123 HydrophobicContact CG-CD1 4.35Å; Y118-E130 HydrophobicContact CD1-CB 4.16Å; Y118-E130 HydrophobicContact CE1-CB 4.47Å; Y118-Q133 HydrophobicContact CE1-CB 4.31Å; Y118-Q133 WeakPolarHBondContact OH-CG 3.38Å; Y118-L134 HydrophobicContact CD2-CD1 3.55Å; Y118-L134 HydrophobicContact CE2-CB 4.13Å; Y118-L134 HydrophobicContact CE2-CD1 3.4Å; Y118-L134 HydrophobicContact CE2-CG 4.4Å; Y118-L134 PolarHBondContact OH-N 3.5Å
119S72.8Confident73.4Confident58 Ų5870.6 Ų70.641%0.40637%0.366SS..  trans-70.7121.7170.3-175.10000110.2S121 R122 L123S119-S121 PolarHBondContact O-N 2.89Å; S119-S121 VanDerWaalsContact O-N 3.08Å; S119-S121 PolarHBondContact OG-OG 3.42Å; S119-R122 PolarHBondContact O-N 2.9Å; S119-L123 PolarHBondContact O-N 2.94Å
120T73.4Confident73.6Confident52 Ų5273 Ų7332%0.31938%0.377SS..Hα-helixtrans-57.6-24.4176.755.50000112.9L106 Y118 R124L106-T120 HydrophobicContact CD1-CG2 3.82Å; Y118-T120 PolarHBondContact O-N 3.34Å; T120-R124 PolarHBondContact O-N 2.95Å
121S74.2Confident73.7Confident71 Ų7166.8 Ų66.850%0.49735%0.35SS..Hα-helixtrans-69.6-34.3174.560.50000113.4S119S119-S121 PolarHBondContact O-N 2.89Å; S119-S121 VanDerWaalsContact O-N 3.08Å; S119-S121 PolarHBondContact OG-OG 3.42Å
122R77.9Confident73.9Confident140 Ų14060 Ų6053%0.52832%0.321SS..Hα-helixtrans-80-37.7-179.5-64.4-168.2-175.5-1590.3111.8S119 R124 I125 E130S119-R122 PolarHBondContact O-N 2.9Å; R122-R124 PolarHBondContact O-N 2.95Å; R122-I125 WeakPolarHBondContact O-CB 3.28Å; R122-I125 PolarHBondContact O-N 3.06Å; R122-E130 WeakPolarHBondContact CD-OE1 3.39Å; R122-E130 IonicContact CZ-OE1 2.7Å; R122-E130 IonicContact NE-OE1 2.89Å; R122-E130 IonicContact NH1-OE1 3.37Å; R122-E130 PolarHBondContact NH1-OE1 3.35Å
123L78Confident74.6Confident0 Ų061.4 Ų61.40%033%0.326CS..Hα-helixtrans-65.7-25.9174.6-70.2171.4000112.7F70 M73 L102 L106 Y118 S119 I125 G126 E130 L134F70-L123 WeakPolarHBondContact CD2-O 3.35Å; M73-L123 WeakPolarHBondContact CE-O 2.92Å; M73-L123 HydrophobicContact SD-CD2 4.43Å; L102-L123 HydrophobicContact CD1-CB 3.87Å; L102-L123 HydrophobicContact CD2-CB 3.85Å; L102-L123 HydrophobicContact CD2-CD1 4.19Å; L106-L123 HydrophobicContact CD1-CD1 4.46Å; L106-L123 HydrophobicContact CD2-CD1 4.39Å; Y118-L123 HydrophobicContact CG-CD1 4.35Å; S119-L123 PolarHBondContact O-N 2.94Å; L123-I125 PolarHBondContact O-N 2.88Å; L123-G126 PolarHBondContact O-N 3.36Å; L123-E130 HydrophobicContact CD2-CB 4.49Å; L123-L134 HydrophobicContact CD2-CB 4.47Å; L123-L134 HydrophobicContact CD2-CD2 4.06Å
124R78.4Confident75.4Confident120 Ų12052.8 Ų52.845%0.45329%0.286SS..THydrogen-bonded Turntrans-65.7-20.9177-159.5-176.1-62.3-1696.2113.3S99 T120 R122 G126S99-R124 PolarHBondContact OG-NH2 3.34Å; T120-R124 PolarHBondContact O-N 2.95Å; R122-R124 PolarHBondContact O-N 2.95Å; R124-G126 PolarHBondContact O-N 3.2Å
125I80.2Confident76.6Confident88 Ų8851.4 Ų51.445%0.45128%0.279SS..THydrogen-bonded Turntrans-68.6-23.5179.1-57.8169.5000110.4S66 R122 L123 S127S66-I125 WeakPolarHBondContact CB-O 3.46Å; S66-I125 PolarHBondContact OG-O 3.17Å; R122-I125 WeakPolarHBondContact O-CB 3.28Å; R122-I125 PolarHBondContact O-N 3.06Å; L123-I125 PolarHBondContact O-N 2.88Å; I125-S127 PolarHBondContact O-N 3.4Å
126G72.8Confident78.2Confident0 Ų047.7 Ų47.70%025%0.246CC..SBendtrans75.7-4.5175.300000114.8Q69 L123 R124Q69-G126 WeakPolarHBondContact CB-O 3.26Å; L123-G126 PolarHBondContact O-N 3.36Å; R124-G126 PolarHBondContact O-N 3.2Å
127S77.6Confident79.3Confident16 Ų1646.7 Ų46.711%0.11224%0.24CC..  trans-146.6139.8177.863.20000110.1S63 I125S63-S127 WeakPolarHBondContact CA-OG 3.45Å; S63-S127 VanDerWaalsContact CB-OG 3.31Å; S63-S127 WeakPolarHBondContact CB-OG 3.39Å; I125-S127 PolarHBondContact O-N 3.4Å
128G81.8Confident80.3Confident15 Ų1539.2 Ų39.216%0.15520%0.2CC..SBendtrans141.4177.3179.300000113.8F60 E130 C131 I132F60-G128 PolarHBondContact O-N 3.25Å; F60-G128 VanDerWaalsContact O-N 3.15Å; G128-E130 VanDerWaalsContact C-N 3.33Å; G128-E130 PolarHBondContact O-N 3.46Å; G128-C131 PolarHBondContact O-N 2.96Å; G128-I132 WeakPolarHBondContact O-CG1 3.38Å; G128-I132 PolarHBondContact O-N 2.82Å; G128-I132 VanDerWaalsContact O-N 3.16Å
129E83.6Confident81Confident58 Ų5837.8 Ų37.827%0.27120%0.195SC..Hα-helixtrans-60.3-43.3-177.5-176.2170.5-176.600111.4R28 C131 I132 Q133R28-E129 IonicContact CZ-OE1 3.74Å; R28-E129 IonicContact NH1-OE1 2.8Å; R28-E129 PolarHBondContact NH1-OE1 2.75Å; R28-E129 IonicContact NH2-OE1 2.69Å; R28-E129 PolarHBondContact NH2-OE1 2.75Å; E129-C131 VanDerWaalsContact C-N 3.31Å; E129-C131 PolarHBondContact O-N 3.31Å; E129-I132 PolarHBondContact O-N 3.2Å; E129-Q133 VanDerWaalsContact O-CB 3.32Å; E129-Q133 WeakPolarHBondContact O-CB 3.23Å; E129-Q133 PolarHBondContact O-N 3.43Å
130E82Confident81.6Confident56 Ų5638.4 Ų38.426%0.26219%0.193SC..Hα-helixtrans-65.8-33.8-178.6-61.390.2156.200112.5Y118 R122 L123 G128 L134Y118-E130 HydrophobicContact CD1-CB 4.16Å; Y118-E130 HydrophobicContact CE1-CB 4.47Å; R122-E130 WeakPolarHBondContact CD-OE1 3.39Å; R122-E130 IonicContact CZ-OE1 2.7Å; R122-E130 IonicContact NE-OE1 2.89Å; R122-E130 IonicContact NH1-OE1 3.37Å; R122-E130 PolarHBondContact NH1-OE1 3.35Å; L123-E130 HydrophobicContact CD2-CB 4.49Å; G128-E130 VanDerWaalsContact C-N 3.33Å; G128-E130 PolarHBondContact O-N 3.46Å; E130-L134 WeakPolarHBondContact O-CB 3.31Å; E130-L134 PolarHBondContact O-N 2.84Å; E130-L134 VanDerWaalsContact O-N 3.08Å
131C83.2Confident82Confident0 Ų038.1 Ų38.10%019%0.188CC..Hα-helixtrans-71-43.3177.5-60.20000111M73 G128 E129 L135M73-C131 HydrophobicContact SD-CB 3.56Å; M73-C131 VanDerWaalsContact SD-CB 3.56Å; G128-C131 PolarHBondContact O-N 2.96Å; E129-C131 VanDerWaalsContact C-N 3.31Å; E129-C131 PolarHBondContact O-N 3.31Å; C131-L135 WeakPolarHBondContact O-CG 3.49Å; C131-L135 PolarHBondContact O-N 2.89Å
132I85.2Confident82.5Confident1 Ų134.7 Ų34.71%0.00517%0.165CC..Hα-helixtrans-66.5-43.7177.6-62.9166.8000109.9N25 R28 M29 L32 F60 G128 E129 L134 L135 D136N25-I132 HydrophobicContact CB-CD1 4Å; R28-I132 HydrophobicContact CB-CG2 3.85Å; M29-I132 HydrophobicContact CB-CD1 4.33Å; M29-I132 HydrophobicContact SD-CG1 4.4Å; L32-I132 HydrophobicContact CD2-CG2 4.46Å; F60-I132 HydrophobicContact CB-CD1 4.5Å; F60-I132 HydrophobicContact CB-CG1 3.97Å; G128-I132 WeakPolarHBondContact O-CG1 3.38Å; G128-I132 PolarHBondContact O-N 2.82Å; G128-I132 VanDerWaalsContact O-N 3.16Å; E129-I132 PolarHBondContact O-N 3.2Å; I132-L134 VanDerWaalsContact C-N 3.34Å; I132-L134 PolarHBondContact O-N 3.32Å; I132-L135 PolarHBondContact O-N 3.08Å; I132-D136 WeakPolarHBondContact O-CB 3.47Å; I132-D136 PolarHBondContact O-N 3.43Å
133Q84.8Confident82.7Confident62 Ų6229.8 Ų29.829%0.2915%0.149SC..Hα-helixtrans-61-42.8179.3-160.780.722.300111.7Y118 E129 L135 D136 C137Y118-Q133 HydrophobicContact CE1-CB 4.31Å; Y118-Q133 WeakPolarHBondContact OH-CG 3.38Å; E129-Q133 VanDerWaalsContact O-CB 3.32Å; E129-Q133 WeakPolarHBondContact O-CB 3.23Å; E129-Q133 PolarHBondContact O-N 3.43Å; Q133-L135 VanDerWaalsContact C-N 3.33Å; Q133-L135 PolarHBondContact O-N 3.38Å; Q133-D136 PolarHBondContact O-N 3.32Å; Q133-C137 PolarHBondContact O-N 2.84Å; Q133-C137 PolarHBondContact O-SG 3.39Å
134L86.1Confident82.9Confident2 Ų233.3 Ų33.31%0.0117%0.174CC..Hα-helixtrans-55.8-49.5176.1-177.182.8000111.2L106 M109 Y118 L123 E130 I132 L138L106-L134 HydrophobicContact CD2-CD1 4.26Å; M109-L134 HydrophobicContact CE-CD1 3.89Å; M109-L134 HydrophobicContact SD-CD1 3.23Å; M109-L134 WeakPolarHBondContact SD-CD1 3.34Å; M109-L134 HydrophobicContact SD-CG 4.04Å; Y118-L134 HydrophobicContact CD2-CD1 3.55Å; Y118-L134 HydrophobicContact CE2-CB 4.13Å; Y118-L134 HydrophobicContact CE2-CD1 3.4Å; Y118-L134 HydrophobicContact CE2-CG 4.4Å; Y118-L134 PolarHBondContact OH-N 3.5Å; L123-L134 HydrophobicContact CD2-CB 4.47Å; L123-L134 HydrophobicContact CD2-CD2 4.06Å; E130-L134 WeakPolarHBondContact O-CB 3.31Å; E130-L134 PolarHBondContact O-N 2.84Å; E130-L134 VanDerWaalsContact O-N 3.08Å; I132-L134 VanDerWaalsContact C-N 3.34Å; I132-L134 PolarHBondContact O-N 3.32Å; L134-L138 WeakPolarHBondContact O-CG 3.43Å; L134-L138 PolarHBondContact O-N 3.44Å; L134-L138 VanDerWaalsContact O-N 3.15Å
135L86.4Confident82.8Confident0 Ų033.6 Ų33.60%018%0.175CC..Hα-helixtrans-68.7-37.8-179.4-67.9170.7000112.2L32 F60 M73 L76 A77 L80 C131 I132 Q133 L138 A139L32-L135 HydrophobicContact CD1-CB 4.14Å; L32-L135 HydrophobicContact CD2-CB 3.64Å; L32-L135 HydrophobicContact CD2-CD1 4.08Å; F60-L135 HydrophobicContact CD2-CD1 4.06Å; F60-L135 HydrophobicContact CE2-CD1 3.95Å; F60-L135 HydrophobicContact CZ-CD1 4.42Å; M73-L135 HydrophobicContact CG-CD1 4.22Å; M73-L135 HydrophobicContact CG-CG 4.5Å; L76-L135 HydrophobicContact CB-CD2 4.08Å; L76-L135 HydrophobicContact CD2-CD1 3.7Å; L76-L135 HydrophobicContact CD2-CD2 3.7Å; L76-L135 HydrophobicContact CD2-CG 4.22Å; L76-L135 HydrophobicContact CG-CD2 3.79Å; A77-L135 HydrophobicContact CB-CD2 4.05Å; L80-L135 HydrophobicContact CD1-CD2 4.09Å; C131-L135 WeakPolarHBondContact O-CG 3.49Å; C131-L135 PolarHBondContact O-N 2.89Å; I132-L135 PolarHBondContact O-N 3.08Å; Q133-L135 VanDerWaalsContact C-N 3.33Å; Q133-L135 PolarHBondContact O-N 3.38Å; L135-L138 PolarHBondContact O-N 3.26Å; L135-A139 VanDerWaalsContact O-CB 3.3Å; L135-A139 WeakPolarHBondContact O-CB 3.42Å; L135-A139 PolarHBondContact O-N 2.95Å
136D86.7Confident82.3Confident25 Ų2531.6 Ų31.613%0.13417%0.166CC..Hα-helixtrans-63.8-46.5178.8-165.447.4000111.5K35 I132 Q133 L138 A139 D140K35-D136 WeakPolarHBondContact CD-OD1 3.49Å; K35-D136 WeakPolarHBondContact CE-OD1 3.45Å; K35-D136 VanDerWaalsContact NZ-CG 3.31Å; K35-D136 IonicContact NZ-OD1 2.64Å; K35-D136 PolarHBondContact NZ-OD1 3.3Å; K35-D136 IonicContact NZ-OD2 3.83Å; K35-D136 PolarHBondContact NZ-OD2 2.93Å; I132-D136 WeakPolarHBondContact O-CB 3.47Å; I132-D136 PolarHBondContact O-N 3.43Å; Q133-D136 PolarHBondContact O-N 3.32Å; D136-L138 VanDerWaalsContact C-N 3.34Å; D136-L138 PolarHBondContact O-N 3.26Å; D136-A139 PolarHBondContact O-N 3.41Å; D136-D140 PolarHBondContact O-N 3.47Å
137C85.5Confident81.6Confident29 Ų2940.6 Ų40.620%0.19621%0.209CC..Hα-helixtrans-64.3-40.2176.5-61.40000111.6M114 Q133 A139 D140 E141M114-C137 HydrophobicContact CE-CB 3.26Å; M114-C137 WeakPolarHBondContact CE-O 3.42Å; Q133-C137 PolarHBondContact O-N 2.84Å; Q133-C137 PolarHBondContact O-SG 3.39Å; C137-A139 VanDerWaalsContact C-N 3.34Å; C137-D140 PolarHBondContact O-N 3.35Å; C137-E141 PolarHBondContact O-N 3.11Å; C137-E141 VanDerWaalsContact O-N 3.11Å
138L84.4Confident80.4Confident0 Ų044.7 Ų44.70%022%0.224CC..Hα-helixtrans-64.6-38.2175-78.9174.5000112.2A77 L80 L81 M109 M114 L134 L135 D136 E141 A142A77-L138 HydrophobicContact CB-CD1 3.86Å; L80-L138 HydrophobicContact CB-CB 3.97Å; L80-L138 HydrophobicContact CD1-CB 3.75Å; L80-L138 HydrophobicContact CG-CB 4.46Å; L81-L138 HydrophobicContact CD2-CD2 3.65Å; L81-L138 HydrophobicContact CG-CD2 4.08Å; M109-L138 HydrophobicContact CE-CD2 4Å; M109-L138 HydrophobicContact CE-CG 3.81Å; M109-L138 HydrophobicContact CG-CD2 3.77Å; M109-L138 HydrophobicContact CG-CG 4.37Å; M109-L138 HydrophobicContact SD-CD1 4.08Å; M109-L138 HydrophobicContact SD-CD2 4.04Å; M109-L138 HydrophobicContact SD-CG 3.97Å; M114-L138 HydrophobicContact SD-CD2 4.41Å; L134-L138 WeakPolarHBondContact O-CG 3.43Å; L134-L138 PolarHBondContact O-N 3.44Å; L134-L138 VanDerWaalsContact O-N 3.15Å; L135-L138 PolarHBondContact O-N 3.26Å; D136-L138 VanDerWaalsContact C-N 3.34Å; D136-L138 PolarHBondContact O-N 3.26Å; L138-E141 PolarHBondContact O-N 3.24Å; L138-A142 WeakPolarHBondContact O-CB 3.32Å; L138-A142 PolarHBondContact O-N 2.97Å
139A85.9Confident78.6Confident0 Ų052.6 Ų52.60%026%0.255CS..Hα-helixtrans-67.5-38.2177.200000111.8L32 K35 L39 L80 L135 D136 C137 A142 L143L32-A139 HydrophobicContact CD1-CB 3.84Å; K35-A139 HydrophobicContact CB-CB 4.17Å; K35-A139 HydrophobicContact CD-CB 4.35Å; L39-A139 HydrophobicContact CD1-CB 4.4Å; L80-A139 HydrophobicContact CD1-CB 4.43Å; L80-A139 HydrophobicContact CD2-CB 4.29Å; L135-A139 VanDerWaalsContact O-CB 3.3Å; L135-A139 WeakPolarHBondContact O-CB 3.42Å; L135-A139 PolarHBondContact O-N 2.95Å; D136-A139 PolarHBondContact O-N 3.41Å; C137-A139 VanDerWaalsContact C-N 3.34Å; A139-A142 PolarHBondContact O-N 2.98Å; A139-L143 WeakPolarHBondContact O-CB 3.49Å; A139-L143 VanDerWaalsContact O-CG 3.28Å; A139-L143 WeakPolarHBondContact O-CG 3.44Å; A139-L143 PolarHBondContact O-N 2.83Å
140D85.1Confident76.8Confident71 Ų7158.3 Ų58.338%0.3828%0.279SS..Hα-helixtrans-64-42.5174.4-75.5-27.7000112.2K35 D136 C137 A142 L143 S144K35-D140 WeakPolarHBondContact CD-OD1 3.47Å; K35-D140 WeakPolarHBondContact CE-OD1 3.39Å; K35-D140 IonicContact NZ-OD1 3.07Å; K35-D140 PolarHBondContact NZ-OD1 3.12Å; K35-D140 IonicContact NZ-OD2 2.75Å; K35-D140 PolarHBondContact NZ-OD2 3.29Å; D136-D140 PolarHBondContact O-N 3.47Å; C137-D140 PolarHBondContact O-N 3.35Å; D140-A142 VanDerWaalsContact C-N 3.34Å; D140-L143 PolarHBondContact O-N 2.98Å; D140-S144 PolarHBondContact O-N 2.81Å
141E82.6Confident74.9Confident46 Ų4663.5 Ų63.522%0.21530%0.303CS..Hα-helixtrans-70.9-31.3176.7-171.658.4-15900112.2M114 C137 L138 S144 R145M114-E141 HydrophobicContact CE-CB 4.48Å; M114-E141 HydrophobicContact SD-CB 4.07Å; M114-E141 HydrophobicContact SD-CG 4.24Å; C137-E141 PolarHBondContact O-N 3.11Å; C137-E141 VanDerWaalsContact O-N 3.11Å; L138-E141 PolarHBondContact O-N 3.24Å; E141-S144 PolarHBondContact O-OG 2.88Å; E141-R145 WeakPolarHBondContact O-CG 3.37Å; E141-R145 PolarHBondContact O-N 3.16Å; E141-R145 IonicContact OE1-CZ 3.88Å; E141-R145 VanDerWaalsContact OE1-CZ 3.32Å; E141-R145 IonicContact OE1-NE 3.32Å; E141-R145 PolarHBondContact OE1-NE 2.94Å; E141-R145 IonicContact OE1-NH2 2.87Å; E141-R145 PolarHBondContact OE1-NH2 2.85Å
142A83.6Confident72.6Confident0 Ų073.7 Ų73.70%034%0.342CS..Hα-helixtrans-65.9-47.8171.500000110.2L39 L80 K83 C84 L138 A139 D140 S144 R145 T146L39-A142 HydrophobicContact CD1-CB 3.85Å; L39-A142 HydrophobicContact CD2-CB 4.07Å; L80-A142 HydrophobicContact CD2-CB 4.21Å; K83-A142 HydrophobicContact CB-CB 4.09Å; C84-A142 VanDerWaalsContact SG-CA 3.5Å; C84-A142 PolarHBondContact SG-N 3.49Å; L138-A142 WeakPolarHBondContact O-CB 3.32Å; L138-A142 PolarHBondContact O-N 2.97Å; A139-A142 PolarHBondContact O-N 2.98Å; D140-A142 VanDerWaalsContact C-N 3.34Å; A142-S144 VanDerWaalsContact C-N 3.33Å; A142-S144 PolarHBondContact O-N 2.9Å; A142-R145 PolarHBondContact O-N 3.07Å; A142-R145 VanDerWaalsContact O-N 3.16Å; A142-T146 PolarHBondContact O-N 2.93Å; A142-T146 PolarHBondContact O-OG1 3.21Å
143L82.3Confident70.4Confident36 Ų3682 Ų8219%0.18838%0.381CS..Hα-helixtrans-62-37179-78.6171.3000112.8K35 L38 L39 A139 D140 R145 T146K35-L143 HydrophobicContact CB-CD1 3.74Å; K35-L143 HydrophobicContact CD-CD1 4.24Å; K35-L143 HydrophobicContact CG-CD1 3.76Å; L38-L143 HydrophobicContact CB-CD2 4.01Å; L39-L143 HydrophobicContact CD1-CD2 4.44Å; L39-L143 HydrophobicContact CD1-CG 4.16Å; L39-L143 HydrophobicContact CD2-CD2 3.66Å; L39-L143 HydrophobicContact CD2-CG 3.97Å; L39-L143 HydrophobicContact CG-CD2 3.73Å; L39-L143 HydrophobicContact CG-CG 3.98Å; A139-L143 WeakPolarHBondContact O-CB 3.49Å; A139-L143 VanDerWaalsContact O-CG 3.28Å; A139-L143 WeakPolarHBondContact O-CG 3.44Å; A139-L143 PolarHBondContact O-N 2.83Å; D140-L143 PolarHBondContact O-N 2.98Å; L143-R145 PolarHBondContact O-N 2.88Å; L143-T146 WeakPolarHBondContact CA-OG1 3.49Å
144S81.9Confident68Low75 Ų7584.5 Ų84.552%0.52440%0.4SS..Hα-helixtrans-63.9-31.4177.873.90000112.1D140 E141 A142D140-S144 PolarHBondContact O-N 2.81Å; E141-S144 PolarHBondContact O-OG 2.88Å; A142-S144 VanDerWaalsContact C-N 3.33Å; A142-S144 PolarHBondContact O-N 2.9Å
145R76.6Confident65.8Low125 Ų12589.5 Ų89.547%0.47243%0.434SS..Hα-helixtrans-90.7-37.1-177.7-67.4175.3-176.7-113.7-8.6113.4C84 E141 A142 L143 Q147C84-R145 WeakPolarHBondContact O-CD 3.41Å; C84-R145 PolarHBondContact O-NE 3.46Å; C84-R145 PolarHBondContact O-NH1 3.26Å; E141-R145 WeakPolarHBondContact O-CG 3.37Å; E141-R145 PolarHBondContact O-N 3.16Å; E141-R145 IonicContact OE1-CZ 3.88Å; E141-R145 VanDerWaalsContact OE1-CZ 3.32Å; E141-R145 IonicContact OE1-NE 3.32Å; E141-R145 PolarHBondContact OE1-NE 2.94Å; E141-R145 IonicContact OE1-NH2 2.87Å; E141-R145 PolarHBondContact OE1-NH2 2.85Å; A142-R145 PolarHBondContact O-N 3.07Å; A142-R145 VanDerWaalsContact O-N 3.16Å; L143-R145 PolarHBondContact O-N 2.88Å; R145-Q147 PolarHBondContact O-N 2.93Å
146T71Confident63.4Low46 Ų4697.8 Ų97.828%0.28247%0.47SS..SBendtrans-74.492.6166.6420000107.9L39 A142 L143 F148L39-T146 HydrophobicContact CD2-CG2 4.34Å; L39-T146 WeakPolarHBondContact CD2-OG1 3.32Å; A142-T146 PolarHBondContact O-N 2.93Å; A142-T146 PolarHBondContact O-OG1 3.21Å; L143-T146 WeakPolarHBondContact CA-OG1 3.49Å; T146-F148 VanDerWaalsContact C-N 3.26Å; T146-F148 PolarHBondContact O-N 3.33Å
147Q56.6Low61.3Low189 Ų189104.3 Ų104.388%0.88350%0.504SS*.  trans-52.690.4174.7-71.6-169.1-23.800110.5R145 K149R145-Q147 PolarHBondContact O-N 2.93Å; Q147-K149 PolarHBondContact O-N 2.67Å; Q147-K149 VanDerWaalsContact O-N 3.07Å
148F54.1Low59.3Low102 Ų102109.1 Ų109.145%0.44753%0.527SS..  trans-78.5103.4-172.4-161.1-95.7000108L38 T146 F150L38-F148 HydrophobicContact CB-CE2 4.25Å; L38-F148 HydrophobicContact CB-CZ 4.31Å; L38-F148 HydrophobicContact CD2-CE1 3.83Å; L38-F148 HydrophobicContact CD2-CE2 4.45Å; L38-F148 HydrophobicContact CD2-CZ 3.69Å; L38-F148 WeakPolarHBondContact O-CE2 3.38Å; T146-F148 VanDerWaalsContact C-N 3.26Å; T146-F148 PolarHBondContact O-N 3.33Å; F148-F150 PolarHBondContact O-N 2.8Å
149K43.8Very low57.2Low181 Ų181114.3 Ų114.379%0.78755%0.554SS**  trans-79.1113.7171.2-150.2177.5-173.9-176.40106.4Q147 E151Q147-K149 PolarHBondContact O-N 2.67Å; Q147-K149 VanDerWaalsContact O-N 3.07Å; K149-E151 PolarHBondContact O-N 3.19Å
150F45.6Very low55Low178 Ų178117.9 Ų117.978%0.78158%0.578SS**  trans-64.488.2175.3-149.8-86.8000108.1F148 R152F148-F150 PolarHBondContact O-N 2.8Å; F150-R152 VanDerWaalsContact C-N 3.29Å; F150-R152 PolarHBondContact O-N 3.47Å
151E42Very low53.1Low166 Ų166121.5 Ų121.578%0.77659%0.593SS**  trans-67.597.1170.7-164.6102.9-146.100105.3K149 Q153K149-E151 PolarHBondContact O-N 3.19Å; E151-Q153 VanDerWaalsContact C-N 3.29Å; E151-Q153 PolarHBondContact O-N 3.25Å
152R34.8Very low51.2Low213 Ų213124.6 Ų124.680%0.80461%0.61SS**  trans-58.299.9174.8-166.2179.1-163.9175.84.2105.9F150 V154F150-R152 VanDerWaalsContact C-N 3.29Å; F150-R152 PolarHBondContact O-N 3.47Å; R152-V154 PolarHBondContact O-N 2.95Å
153Q38.6Very low49.5Very low177 Ų177131.5 Ų131.583%0.82764%0.643SS**  trans-61.894.6171.6-74.9-173.7-700106.5E151 C155E151-Q153 VanDerWaalsContact C-N 3.29Å; E151-Q153 PolarHBondContact O-N 3.25Å; Q153-C155 PolarHBondContact O-N 2.98Å; Q153-C155 VanDerWaalsContact O-N 3.11Å
154V34.7Very low47.7Very low113 Ų113138 Ų13869%0.68567%0.672SS**  trans-60.8111.7156.8-173.70000103.3R152 K156R152-V154 PolarHBondContact O-N 2.95Å; V154-K156 PolarHBondContact O-N 2.89Å
155C39.3Very low45.8Very low107 Ų107140.1 Ų140.172%0.72368%0.677SS**  trans-52.189.5176.2-64.60000109.5Q153 L157Q153-C155 PolarHBondContact O-N 2.98Å; Q153-C155 VanDerWaalsContact O-N 3.11Å; C155-L157 PolarHBondContact O-N 3.45Å
156K36.8Very low44.2Very low174 Ų174141.6 Ų141.676%0.75769%0.689SS**THydrogen-bonded Turntrans-79.86.9171.5-87.7-176.3174.7178.60111.9V154 L158V154-K156 PolarHBondContact O-N 2.89Å; K156-L158 VanDerWaalsContact C-N 3.31Å; K156-L158 PolarHBondContact O-N 3.23Å
157L42.6Very low42.8Very low163 Ų163147.4 Ų147.485%0.85372%0.719SS**THydrogen-bonded Turntrans-83.74.4-177.3-88.5166.8000114.7C155C155-L157 PolarHBondContact O-N 3.45Å
158L42.6Very low42.4Very low130 Ų130141.7 Ų141.768%0.68170%0.704SS**THydrogen-bonded Turntrans-132.71.3-179.8-135.483.7000116.3K156 L162K156-L158 VanDerWaalsContact C-N 3.31Å; K156-L158 PolarHBondContact O-N 3.23Å; L158-L162 WeakPolarHBondContact O-CD1 3.5Å
159I41.9Very low42Very low109 Ų109148 Ų14856%0.55973%0.726SS**THydrogen-bonded Turntrans-99.4-34.4-176.9-59.2175.7000111.7H161 L162I159-H161 VanDerWaalsContact C-N 3.32Å; I159-H161 PolarHBondContact O-N 3.39Å; I159-L162 PolarHBondContact O-N 2.9Å
160S39.4Very low41.9Very low75 Ų75145 Ų14552%0.52473%0.728SS.*THydrogen-bonded Turntrans-72.6-19.7-178.737.50000114.6
161H45Very low41.5Very low146 Ų146144.1 Ų144.168%0.67673%0.732SS**THydrogen-bonded Turntrans-91.7-6.2174.9-88.965.2000114.1I159 N165I159-H161 VanDerWaalsContact C-N 3.32Å; I159-H161 PolarHBondContact O-N 3.39Å; H161-N165 PolarHBondContact O-ND2 3.28Å
162L43Very low41.5Very low112 Ų112138.9 Ų138.959%0.58672%0.723SS**THydrogen-bonded Turntrans-95.4-24.4176.8-80.8168000112.7L158 I159L158-L162 WeakPolarHBondContact O-CD1 3.5Å; I159-L162 PolarHBondContact O-N 2.9Å
163E46.2Very low41.8Very low145 Ų145138.1 Ų138.168%0.67873%0.728SS**SBendtrans-74.9-25.1178.3-74.7-179.9164.300113.2
164E44.6Very low41.9Very low172 Ų172139.1 Ų139.180%0.80473%0.73SS**THydrogen-bonded Turntrans-86.3-9.1179.1-79.3-176.4163.900114.6
165N43.7Very low42.4Very low119 Ų119141.2 Ų141.264%0.63674%0.738SS**THydrogen-bonded Turntrans-109.914.5-178.2-75.9-53.5000114H161 D167H161-N165 PolarHBondContact O-ND2 3.28Å; N165-D167 VanDerWaalsContact C-N 3.31Å; N165-D167 PolarHBondContact O-N 3.38Å
166Q41.6Very low42.6Very low156 Ų156144.5 Ų144.573%0.72974%0.742SS**THydrogen-bonded Turntrans-82.6-1.4-171.7-139.8171.521.800115
167D42.7Very low43.1Very low168 Ų168145.1 Ų145.190%0.89875%0.748SS**THydrogen-bonded Turntrans-106.512.1-174.1-71.4-23.5000115.3N165N165-D167 VanDerWaalsContact C-N 3.31Å; N165-D167 PolarHBondContact O-N 3.38Å
168A48.1Very low43Very low70 Ų70144.5 Ų144.558%0.57974%0.743SS**SBendtrans-112.20.2-169.100000117.6
169Y45.1Very low43.3Very low233 Ų233144.7 Ų144.791%0.91474%0.743SS**  trans-135.372.5179-65.1-78.4000112.1
170S41.4Very low43.6Very low118 Ų118145.3 Ų145.383%0.82575%0.748SS**  trans-105.7133.7157.8-1770000108.3
171D37.4Very low43.9Very low160 Ų160149.2 Ų149.286%0.85676%0.762SS**  trans90.267169.1-137.228.4000117
172G42.8Very low43.7Very low57 Ų57146.3 Ų146.359%0.58876%0.758SS**  trans-120.397.1156.200000108.9F174G172-F174 PolarHBondContact O-N 3.16Å
173E39.8Very low43.8Very low197 Ų197144.6 Ų144.692%0.92176%0.76SS**  trans-56.498.1168-162.2175.3-149.600108.3
174F41.5Very low43.7Very low198 Ų198143.3 Ų143.387%0.86877%0.765SS**  trans-124.7131.7176.2-90.9-84.8000111.4G172 Q176G172-F174 PolarHBondContact O-N 3.16Å; F174-Q176 PolarHBondContact O-N 2.93Å
175D44.8Very low43.4Very low156 Ų156141.7 Ų141.783%0.83477%0.766SS**  trans-52.9130.4-169.9-78.9-45.8000113.1E177D175-E177 VanDerWaalsContact C-N 3.33Å; D175-E177 PolarHBondContact O-N 3.33Å
176Q43.9Very low43.3Very low177 Ų177142.6 Ų142.683%0.82777%0.771SS**  trans-59.288.9169.7177.6101.159.300109.8F174 M178F174-Q176 PolarHBondContact O-N 2.93Å; Q176-M178 PolarHBondContact O-N 3.41Å; Q176-M178 VanDerWaalsContact O-N 3.14Å
177E46.4Very low43.2Very low186 Ų186142 Ų14287%0.86977%0.773SS**  trans-65.4113.1168.1-83.4-168.7165.200109.9D175 L179D175-E177 VanDerWaalsContact C-N 3.33Å; D175-E177 PolarHBondContact O-N 3.33Å; E177-L179 PolarHBondContact O-N 3.44Å
178M41.8Very low43.1Very low151 Ų151142.3 Ų142.374%0.74477%0.774SS**  trans-76.4111.4172.4-178.5172.16800108.6Q176 D180Q176-M178 PolarHBondContact O-N 3.41Å; Q176-M178 VanDerWaalsContact O-N 3.14Å; M178-D180 PolarHBondContact O-N 3.05Å
179L48.7Very low42.8Very low133 Ų133147.3 Ų147.370%0.69679%0.785SS**  trans-64101173-157.587000109.4E177 L181 I220E177-L179 PolarHBondContact O-N 3.44Å; L179-L181 PolarHBondContact O-N 3.2Å; L179-I220 HydrophobicContact CD2-CD1 4.38Å
180D47.1Very low42.5Very low122 Ų122143.5 Ų143.565%0.65278%0.781SS**  trans-79.2107.3174.4-171.428.3000109.7M178 S182M178-D180 PolarHBondContact O-N 3.05Å; D180-S182 PolarHBondContact O-N 3.33Å; D180-S182 PolarHBondContact OD1-OG 2.73Å; D180-S182 WeakPolarHBondContact OD2-CB 3.32Å; D180-S182 PolarHBondContact OD2-OG 2.95Å
181L46.1Very low42.4Very low157 Ų157143.3 Ų143.382%0.82278%0.779SS**  trans-78.743.9175.9-88.2154.8000111.6L179 A183L179-L181 PolarHBondContact O-N 3.2Å; L181-A183 VanDerWaalsContact C-N 3.28Å; L181-A183 PolarHBondContact O-N 3.42Å
182S41.6Very low42.5Very low85 Ų85144.1 Ų144.159%0.59478%0.778SS**  trans-72.385.4168.4-70.40000108.9D180D180-S182 PolarHBondContact O-N 3.33Å; D180-S182 PolarHBondContact OD1-OG 2.73Å; D180-S182 WeakPolarHBondContact OD2-CB 3.32Å; D180-S182 PolarHBondContact OD2-OG 2.95Å
183A45.3Very low42.6Very low76 Ų76148.3 Ų148.363%0.62879%0.787SS**  trans-59.9136.2169.400000109.6L181 T185L181-A183 VanDerWaalsContact C-N 3.28Å; L181-A183 PolarHBondContact O-N 3.42Å; A183-T185 PolarHBondContact O-N 3.49Å
184P43.7Very low42.8Very low119 Ų119148.6 Ų148.677%0.77379%0.785SS**  trans-71.4104.5173.211.2-1.8000108.7N186P184-N186 PolarHBondContact O-N 3.42Å
185T39.1Very low43.2Very low137 Ų137145.6 Ų145.684%0.8478%0.777SS**  trans-71.673.7172.6-37.30000109.9A183A183-T185 PolarHBondContact O-N 3.49Å
186N39.7Very low43.3Very low138 Ų138143.4 Ų143.474%0.73877%0.771SS**  trans-104.4112.7164.1-89.1-14.1000108.6P184P184-N186 PolarHBondContact O-N 3.42Å
187N40.7Very low43.2Very low145 Ų145141.1 Ų141.178%0.77577%0.774SS**  trans67.167.3157.7-63.3-28.3000119
188L40.4Very low43.1Very low174 Ų174137.3 Ų137.391%0.91177%0.768SS**  trans-120.270.4144.8-94.592.3000110.3
189Q40.8Very low43.5Very low174 Ų174135 Ų13581%0.81377%0.773SS**  trans-84.6137.9145.9-74.2-177.8-12.900106.8
190N39.3Very low43.9Very low153 Ų153133.3 Ų133.382%0.81877%0.768SS**SBendtrans94.379174.1-50.1-27.7000116.3
191S40.2Very low44.9Very low114 Ų114133 Ų13380%0.79777%0.766SS**  163.872.7124.357.30000109.2D193S191-D193 PolarHBondContact O-N 3.13Å
192H40.1Very low46.1Very low177 Ų177133 Ų13382%0.81976%0.762SS**  trans-83.297.2168-133-63.5000107.5K194H192-K194 PolarHBondContact O-N 3.37Å
193D43.9Very low47.8Very low145 Ų145136 Ų13678%0.77576%0.762SS**  trans-58.4133.6158.4-95.8-34.8000108.2S191 I195S191-D193 PolarHBondContact O-N 3.13Å; D193-I195 VanDerWaalsContact C-N 3.32Å; D193-I195 PolarHBondContact O-N 3.15Å
194K43.2Very low49.3Very low204 Ų204134.7 Ų134.789%0.88775%0.751SS**  trans-64.987.1-178.6-74.4170.7174.2174.90110H192H192-K194 PolarHBondContact O-N 3.37Å
195I51.7Low50.8Low135 Ų135134 Ų13469%0.69274%0.74SS**  trans-70.6124.9157.1-57.6171.1000105.9D193 S197D193-I195 VanDerWaalsContact C-N 3.32Å; D193-I195 PolarHBondContact O-N 3.15Å; I195-S197 PolarHBondContact O-N 2.69Å
196P45.3Very low52.8Low109 Ų109132.6 Ų132.671%0.70872%0.724SS**  trans-66.8108.3-176.327.6-32.5000109.3S198P196-S198 PolarHBondContact O-N 3.04Å
197S41.9Very low54.8Low130 Ų130130.6 Ų130.691%0.90971%0.71SS**  trans-77.436.8178.847.80000113.3I195I195-S197 PolarHBondContact O-N 2.69Å
198S44.1Very low56.6Low105 Ų105127.9 Ų127.973%0.73469%0.693SS**SBendtrans-123.1117.9179179.20000108.6P196P196-S198 PolarHBondContact O-N 3.04Å
199A50.5Low58.6Low102 Ų102125.2 Ų125.284%0.84368%0.679SS**SBendtrans89.927-17900000118.4
200V57.8Low60.6Low98 Ų98123.6 Ų123.659%0.59467%0.671SS**  trans-117.3110.3159.7-171.60000108.9Q202 L205V200-Q202 PolarHBondContact O-N 3.07Å; V200-L205 HydrophobicContact CB-CD1 4.41Å; V200-L205 HydrophobicContact CG1-CD1 3.45Å; V200-L205 VanDerWaalsContact CG1-CD1 3.45Å; V200-L205 HydrophobicContact CG1-CD2 4.01Å; V200-L205 HydrophobicContact CG1-CG 3.47Å; V200-L205 VanDerWaalsContact CG1-CG 3.47Å
201D68.3Low62.8Low115 Ų115122.8 Ų122.862%0.61566%0.656SS**  trans-64.6117.2179.8-160.2-7.2000109.2Y203 A204 L205D201-Y203 PolarHBondContact O-N 3.2Å; D201-Y203 VanDerWaalsContact O-N 3.15Å; D201-A204 HydrophobicContact CB-CB 3.97Å; D201-A204 WeakPolarHBondContact O-CB 3.37Å; D201-A204 PolarHBondContact O-N 3.37Å; D201-L205 PolarHBondContact O-N 2.86Å; D201-L205 VanDerWaalsContact O-N 3.12Å
202Q70.8Confident64.8Low158 Ų158119.4 Ų119.474%0.73863%0.631SS**Hα-helixtrans-59.1-30.7-174.1-170.8172.6-1000111.3V200 Q206V200-Q202 PolarHBondContact O-N 3.07Å; Q202-Q206 PolarHBondContact O-N 3.42Å; Q202-Q206 VanDerWaalsContact O-N 3.11Å
203Y78Confident66.6Low149 Ų149114.8 Ų114.858%0.58462%0.615SS**Hα-helixtrans-71.1-37.8175-169-109000112.6D201 Q206 Q207D201-Y203 PolarHBondContact O-N 3.2Å; D201-Y203 VanDerWaalsContact O-N 3.15Å; Y203-Q206 PolarHBondContact O-N 3.24Å; Y203-Q207 HydrophobicContact CD1-CG 4.48Å; Y203-Q207 HydrophobicContact CE1-CG 4.23Å; Y203-Q207 WeakPolarHBondContact O-CG 3.4Å; Y203-Q207 PolarHBondContact O-N 3.01Å
204A76.2Confident68.1Low48 Ų48112 Ų11240%0.39761%0.605SS.*Hα-helixtrans-67.7-36.6176.300000112D201 E208D201-A204 HydrophobicContact CB-CB 3.97Å; D201-A204 WeakPolarHBondContact O-CB 3.37Å; D201-A204 PolarHBondContact O-N 3.37Å; A204-E208 WeakPolarHBondContact O-CB 3.23Å; A204-E208 PolarHBondContact O-N 2.73Å
205L74.8Confident69.4Low104 Ų104108.1 Ų108.155%0.54559%0.594SS.*Hα-helixtrans-65.7-38.9171.1-79.4174000112.2V200 D201 E208 L209V200-L205 HydrophobicContact CB-CD1 4.41Å; V200-L205 HydrophobicContact CG1-CD1 3.45Å; V200-L205 VanDerWaalsContact CG1-CD1 3.45Å; V200-L205 HydrophobicContact CG1-CD2 4.01Å; V200-L205 HydrophobicContact CG1-CG 3.47Å; V200-L205 VanDerWaalsContact CG1-CG 3.47Å; D201-L205 PolarHBondContact O-N 2.86Å; D201-L205 VanDerWaalsContact O-N 3.12Å; L205-E208 PolarHBondContact O-N 3.35Å; L205-L209 VanDerWaalsContact O-CB 3.3Å; L205-L209 WeakPolarHBondContact O-CB 3.41Å; L205-L209 PolarHBondContact O-N 2.97Å
206Q82.1Confident70.2Confident107 Ų107107.5 Ų107.550%0.559%0.591SS.*Hα-helixtrans-66.3-41.4177.8-126171.2-14.900111.6Q202 Y203 E208 L209 E210Q202-Q206 PolarHBondContact O-N 3.42Å; Q202-Q206 VanDerWaalsContact O-N 3.11Å; Y203-Q206 PolarHBondContact O-N 3.24Å; Q206-E208 VanDerWaalsContact C-N 3.32Å; Q206-E208 PolarHBondContact O-N 2.92Å; Q206-L209 PolarHBondContact O-N 3.48Å; Q206-E210 WeakPolarHBondContact O-CB 3.33Å; Q206-E210 WeakPolarHBondContact O-CG 3.28Å; Q206-E210 PolarHBondContact O-N 3.11Å
207Q81.6Confident71.2Confident96 Ų96109.2 Ų109.245%0.44959%0.587SS.*Hα-helixtrans-62.7-40172.6-74.7-173.6-12.600112Y203 E210 R211Y203-Q207 HydrophobicContact CD1-CG 4.48Å; Y203-Q207 HydrophobicContact CE1-CG 4.23Å; Y203-Q207 WeakPolarHBondContact O-CG 3.4Å; Y203-Q207 PolarHBondContact O-N 3.01Å; Q207-E210 PolarHBondContact O-N 3.46Å; Q207-R211 VanDerWaalsContact O-CB 3.3Å; Q207-R211 WeakPolarHBondContact O-CB 3.44Å; Q207-R211 PolarHBondContact O-N 3.25Å
208E76.8Confident72.3Confident89 Ų89109.7 Ų109.742%0.41658%0.578SS.*Hα-helixtrans-73.2-32.7178.9-160.861.8-177.400112.2A204 L205 Q206 R211 V212A204-E208 WeakPolarHBondContact O-CB 3.23Å; A204-E208 PolarHBondContact O-N 2.73Å; L205-E208 PolarHBondContact O-N 3.35Å; Q206-E208 VanDerWaalsContact C-N 3.32Å; Q206-E208 PolarHBondContact O-N 2.92Å; E208-R211 PolarHBondContact O-N 3.33Å; E208-R211 IonicContact OE1-CZ 2.66Å; E208-R211 IonicContact OE1-NE 3.9Å; E208-R211 PolarHBondContact OE1-NE 2.95Å; E208-R211 IonicContact OE1-NH2 2.8Å; E208-R211 PolarHBondContact OE1-NH2 2.85Å; E208-R211 WeakPolarHBondContact OE2-CD 3.44Å; E208-R211 IonicContact OE2-CZ 2.94Å; E208-R211 IonicContact OE2-NE 3.19Å; E208-R211 PolarHBondContact OE2-NE 2.89Å; E208-V212 HydrophobicContact CG-CG2 4.5Å; E208-V212 VanDerWaalsContact O-CB 3.32Å; E208-V212 WeakPolarHBondContact O-CB 3.42Å; E208-V212 WeakPolarHBondContact O-CG2 3.4Å; E208-V212 PolarHBondContact O-N 2.77Å
209L83Confident73.2Confident118 Ų118112.4 Ų112.462%0.61858%0.576SS**Hα-helixtrans-63.9-48.7169.3-163.397.1000110.2L205 Q206 R211 V212 T213L205-L209 VanDerWaalsContact O-CB 3.3Å; L205-L209 WeakPolarHBondContact O-CB 3.41Å; L205-L209 PolarHBondContact O-N 2.97Å; Q206-L209 PolarHBondContact O-N 3.48Å; L209-R211 VanDerWaalsContact C-N 3.27Å; L209-R211 PolarHBondContact O-N 3.34Å; L209-V212 PolarHBondContact O-N 2.84Å; L209-T213 VanDerWaalsContact O-CB 3.24Å; L209-T213 WeakPolarHBondContact O-CB 3.33Å; L209-T213 PolarHBondContact O-N 3.08Å; L209-T213 PolarHBondContact O-OG1 2.86Å
210E83.5Confident73.7Confident140 Ų140111.6 Ų111.665%0.65456%0.557SS**Hα-helixtrans-61.2-35.9176.8-78-178.1174.800112.1Q206 Q207 P214Q206-E210 WeakPolarHBondContact O-CB 3.33Å; Q206-E210 WeakPolarHBondContact O-CG 3.28Å; Q206-E210 PolarHBondContact O-N 3.11Å; Q207-E210 PolarHBondContact O-N 3.46Å; E210-P214 WeakPolarHBondContact O-CD 3.37Å
211R85.2Confident73.7Confident135 Ų135117.3 Ų117.351%0.50957%0.568SS.*Hα-helixtrans-69-39.4175.4-167-170.473.677.61112.8Q207 E208 L209 P214Q207-R211 VanDerWaalsContact O-CB 3.3Å; Q207-R211 WeakPolarHBondContact O-CB 3.44Å; Q207-R211 PolarHBondContact O-N 3.25Å; E208-R211 PolarHBondContact O-N 3.33Å; E208-R211 IonicContact OE1-CZ 2.66Å; E208-R211 IonicContact OE1-NE 3.9Å; E208-R211 PolarHBondContact OE1-NE 2.95Å; E208-R211 IonicContact OE1-NH2 2.8Å; E208-R211 PolarHBondContact OE1-NH2 2.85Å; E208-R211 WeakPolarHBondContact OE2-CD 3.44Å; E208-R211 IonicContact OE2-CZ 2.94Å; E208-R211 IonicContact OE2-NE 3.19Å; E208-R211 PolarHBondContact OE2-NE 2.89Å; L209-R211 VanDerWaalsContact C-N 3.27Å; L209-R211 PolarHBondContact O-N 3.34Å; R211-P214 WeakPolarHBondContact O-CD 3.33Å; R211-P214 WeakPolarHBondContact O-CG 3.22Å
212V81.1Confident73.3Confident44 Ų44119.9 Ų119.927%0.26758%0.576SS.*Hα-helixtrans-91-22.8-174.7179.80000112.6E208 L209 L215 L216E208-V212 HydrophobicContact CG-CG2 4.5Å; E208-V212 VanDerWaalsContact O-CB 3.32Å; E208-V212 WeakPolarHBondContact O-CB 3.42Å; E208-V212 WeakPolarHBondContact O-CG2 3.4Å; E208-V212 PolarHBondContact O-N 2.77Å; L209-V212 PolarHBondContact O-N 2.84Å; V212-L215 CarbonylContact O-C 3.56Å; V212-L215 WeakPolarHBondContact O-CA 3.25Å; V212-L215 WeakPolarHBondContact O-CB 3.46Å; V212-L215 PolarHBondContact O-N 3.24Å; V212-L216 HydrophobicContact CG1-CD1 3.73Å; V212-L216 HydrophobicContact CG1-CG 3.97Å; V212-L216 PolarHBondContact O-N 3.33Å
213T78.9Confident72.7Confident79 Ų79116.3 Ų116.349%0.48556%0.562SS.*THydrogen-bonded Turntrans-50.4-47.8174.7-64.70000113.3L209 L215 L216 K217L209-T213 VanDerWaalsContact O-CB 3.24Å; L209-T213 WeakPolarHBondContact O-CB 3.33Å; L209-T213 PolarHBondContact O-N 3.08Å; L209-T213 PolarHBondContact O-OG1 2.86Å; T213-L215 VanDerWaalsContact C-N 3.29Å; T213-L215 PolarHBondContact O-N 3.23Å; T213-L216 PolarHBondContact O-N 3.2Å; T213-K217 PolarHBondContact O-N 3.3Å
214P76.2Confident71.9Confident86 Ų86114.8 Ų114.856%0.55857%0.568SS**THydrogen-bonded Turntrans-69.7-25176.827.1-35.3000113.3E210 R211 K217E210-P214 WeakPolarHBondContact O-CD 3.37Å; R211-P214 WeakPolarHBondContact O-CD 3.33Å; R211-P214 WeakPolarHBondContact O-CG 3.22Å; P214-K217 WeakPolarHBondContact O-CB 3.21Å; P214-K217 PolarHBondContact O-N 3.31Å
215L69.9Low71.5Confident124 Ų124121.1 Ų121.165%0.64959%0.587SS**THydrogen-bonded Turntrans-78.3-27.7177.2-64.5170000112.3V212 T213 K217V212-L215 CarbonylContact O-C 3.56Å; V212-L215 WeakPolarHBondContact O-CA 3.25Å; V212-L215 WeakPolarHBondContact O-CB 3.46Å; V212-L215 PolarHBondContact O-N 3.24Å; T213-L215 VanDerWaalsContact C-N 3.29Å; T213-L215 PolarHBondContact O-N 3.23Å; L215-K217 VanDerWaalsContact C-N 3.29Å
216L68.4Low71.5Confident121 Ų121118 Ų11863%0.63457%0.571SS**SBendtrans-82.3-5.4173.7-75.8165.2000113.2V212 T213 I218V212-L216 HydrophobicContact CG1-CD1 3.73Å; V212-L216 HydrophobicContact CG1-CG 3.97Å; V212-L216 PolarHBondContact O-N 3.33Å; T213-L216 PolarHBondContact O-N 3.2Å; L216-I218 PolarHBondContact O-N 3.2Å
217K66.5Low71.4Confident146 Ų146120.2 Ų120.264%0.63557%0.574SS**  trans-73.778.1175-161.2166.8-172.6169.60109.4T213 P214 L215 K219T213-K217 PolarHBondContact O-N 3.3Å; P214-K217 WeakPolarHBondContact O-CB 3.21Å; P214-K217 PolarHBondContact O-N 3.31Å; L215-K217 VanDerWaalsContact C-N 3.29Å; K217-K219 PolarHBondContact O-N 3.15Å
218I65.6Low71.4Confident139 Ų139122.3 Ų122.371%0.71358%0.578SS**  trans-66.899.8175.2-59.6168.3000107.2L216 I220L216-I218 PolarHBondContact O-N 3.2Å; I218-I220 HydrophobicContact CG2-CG1 4.11Å; I218-I220 PolarHBondContact O-N 3.41Å; I218-I220 VanDerWaalsContact O-N 3.08Å
219K61.6Low71.6Confident162 Ų162122 Ų12270%0.70458%0.577SS**  trans-73.395.6165-68-171179.7-171.90107.3K217 R221K217-K219 PolarHBondContact O-N 3.15Å; K219-R221 PolarHBondContact O-N 3.11Å
220I62.1Low71.5Confident86 Ų86119.6 Ų119.644%0.44157%0.569SS.*  trans-62.9104.3166.4-55.4172.3000105.4L179 I218 H222L179-I220 HydrophobicContact CD2-CD1 4.38Å; I218-I220 HydrophobicContact CG2-CG1 4.11Å; I218-I220 PolarHBondContact O-N 3.41Å; I218-I220 VanDerWaalsContact O-N 3.08Å; I220-H222 PolarHBondContact O-N 2.96Å
221R57.4Low71.7Confident217 Ų217116.8 Ų116.882%0.81956%0.558SS**  trans-75.1122.9170.2-71.5-173.3-179-179.7-0.2105.9K219 D223K219-R221 PolarHBondContact O-N 3.11Å; R221-D223 VanDerWaalsContact C-N 3.27Å; R221-D223 PolarHBondContact O-N 3.33Å
222H59.5Low71.8Confident170 Ų170116.4 Ų116.479%0.78756%0.562SS**  trans-58.793.7169.3-87-69.8000109I220I220-H222 PolarHBondContact O-N 2.96Å
223D59.2Low72.2Confident82 Ų82120.2 Ų120.244%0.43958%0.577SS.*  trans-95.4141.2168.9-171.1-14.2000107.1R221 K225 D226R221-D223 VanDerWaalsContact C-N 3.27Å; R221-D223 PolarHBondContact O-N 3.33Å; D223-K225 PolarHBondContact O-N 3.02Å; D223-K225 PolarHBondContact OD1-N 3.49Å; D223-K225 VanDerWaalsContact OD1-N 3.09Å; D223-D226 VanDerWaalsContact O-CB 3.32Å; D223-D226 WeakPolarHBondContact O-CB 3.16Å; D223-D226 PolarHBondContact O-N 3.36Å
224V61.5Low72.7Confident118 Ų118120 Ų12072%0.71558%0.575SS**THydrogen-bonded Turntrans-59.7-16.7172.7-158.70000110.9
225K66.9Low73.5Confident181 Ų181122 Ų12279%0.78758%0.575SS**THydrogen-bonded Turntrans-82.4-5.3171.6-60.3-178.1-176.7-179.60114.6D223 W227D223-K225 PolarHBondContact O-N 3.02Å; D223-K225 PolarHBondContact OD1-N 3.49Å; D223-K225 VanDerWaalsContact OD1-N 3.09Å; K225-W227 PolarHBondContact O-N 2.8Å
226D73.7Confident74.6Confident38 Ų38119.6 Ų119.620%0.20357%0.569CS.*  trans-68.8120.1172.2-93.3-36.2000109.5D223 R228 H229 C230D223-D226 VanDerWaalsContact O-CB 3.32Å; D223-D226 WeakPolarHBondContact O-CB 3.16Å; D223-D226 PolarHBondContact O-N 3.36Å; D226-R228 PolarHBondContact O-N 3.43Å; D226-H229 PolarHBondContact O-N 3.3Å; D226-C230 PolarHBondContact O-N 3.07Å
227W80.6Confident75.6Confident153 Ų153117 Ų11758%0.5856%0.561SS**Hα-helixtrans-53.8-22.3174.762.3-90.1000112.7K225 L231K225-W227 PolarHBondContact O-N 2.8Å; W227-L231 HydrophobicContact CZ3-CD2 4.29Å; W227-L231 VanDerWaalsContact O-CB 3.26Å; W227-L231 WeakPolarHBondContact O-CB 3.45Å; W227-L231 PolarHBondContact O-N 3.44Å
228R81.9Confident76.9Confident141 Ų141115.9 Ų115.953%0.53256%0.558SS.*Hα-helixtrans-66.7-44.6173.4-72.8-173.9158.592.8-0.2112.7D226 C230 L231 E232D226-R228 PolarHBondContact O-N 3.43Å; R228-C230 VanDerWaalsContact C-N 3.35Å; R228-L231 PolarHBondContact O-N 3.13Å; R228-E232 WeakPolarHBondContact O-CB 3.32Å; R228-E232 PolarHBondContact O-N 2.85Å
229H81.8Confident78.3Confident82 Ų82114.3 Ų114.338%0.3855%0.547SS..Hα-helixtrans-67.6-39.6176.9-167.770.5000110.7D226 L231 E232 Q233D226-H229 PolarHBondContact O-N 3.3Å; H229-L231 PolarHBondContact O-N 3.05Å; H229-E232 PolarHBondContact O-N 2.87Å; H229-Q233 VanDerWaalsContact O-CB 3.32Å; H229-Q233 WeakPolarHBondContact O-CB 3.2Å; H229-Q233 PolarHBondContact O-N 3.44Å
230C79.8Confident79.9Confident68 Ų68110.8 Ų110.846%0.45954%0.539SS..Hα-helixtrans-61.6-41.6172.1-172.60000111.9D226 R228 Q233 V234D226-C230 PolarHBondContact O-N 3.07Å; R228-C230 VanDerWaalsContact C-N 3.35Å; C230-Q233 PolarHBondContact O-N 3.03Å; C230-V234 WeakPolarHBondContact O-CB 3.37Å; C230-V234 VanDerWaalsContact O-CG2 3.26Å; C230-V234 WeakPolarHBondContact O-CG2 3.17Å; C230-V234 PolarHBondContact O-N 3.06Å
231L87.9Confident81.3Confident81 Ų81109.5 Ų109.542%0.42454%0.542SS..Hα-helixtrans-65.3-41.5176.6-179.565.6000112.2W227 R228 H229 V234 K235W227-L231 HydrophobicContact CZ3-CD2 4.29Å; W227-L231 VanDerWaalsContact O-CB 3.26Å; W227-L231 WeakPolarHBondContact O-CB 3.45Å; W227-L231 PolarHBondContact O-N 3.44Å; R228-L231 PolarHBondContact O-N 3.13Å; H229-L231 PolarHBondContact O-N 3.05Å; L231-V234 PolarHBondContact O-N 3.41Å; L231-K235 WeakPolarHBondContact O-CG 3.31Å; L231-K235 PolarHBondContact O-N 3.16Å
232E88Confident83Confident127 Ų127102.4 Ų102.459%0.59352%0.522SS*.Hα-helixtrans-66.2-41.4176.7-168.6167.2-152.600111.4R228 H229 V234 K235 S236R228-E232 WeakPolarHBondContact O-CB 3.32Å; R228-E232 PolarHBondContact O-N 2.85Å; H229-E232 PolarHBondContact O-N 2.87Å; E232-V234 PolarHBondContact O-N 3.19Å; E232-K235 PolarHBondContact O-N 3.46Å; E232-S236 WeakPolarHBondContact O-CB 3.36Å; E232-S236 PolarHBondContact O-N 2.86Å
233Q88Confident84.6Confident123 Ų12397.6 Ų97.658%0.57550%0.502SS*.Hα-helixtrans-61.9-42.7172.6-171.7176.725.300112H229 C230 S236 S237H229-Q233 VanDerWaalsContact O-CB 3.32Å; H229-Q233 WeakPolarHBondContact O-CB 3.2Å; H229-Q233 PolarHBondContact O-N 3.44Å; C230-Q233 PolarHBondContact O-N 3.03Å; Q233-S236 PolarHBondContact O-N 3.23Å; Q233-S237 WeakPolarHBondContact O-CB 3.22Å; Q233-S237 PolarHBondContact O-N 3.44Å; Q233-S237 PolarHBondContact O-OG 2.9Å
234V89.6Confident86.1Confident75 Ų7599.4 Ų99.446%0.45551%0.509SS..Hα-helixtrans-61.9-46.2175.8168.50000110.6C230 L231 E232 S236 S237 E238C230-V234 WeakPolarHBondContact O-CB 3.37Å; C230-V234 VanDerWaalsContact O-CG2 3.26Å; C230-V234 WeakPolarHBondContact O-CG2 3.17Å; C230-V234 PolarHBondContact O-N 3.06Å; L231-V234 PolarHBondContact O-N 3.41Å; E232-V234 PolarHBondContact O-N 3.19Å; V234-S236 VanDerWaalsContact C-N 3.33Å; V234-S236 PolarHBondContact O-N 2.66Å; V234-S237 WeakPolarHBondContact CA-OG 3.4Å; V234-S237 PolarHBondContact O-N 3.42Å; V234-S237 PolarHBondContact O-OG 2.94Å; V234-E238 WeakPolarHBondContact O-CB 3.41Å; V234-E238 PolarHBondContact O-N 2.75Å
235K93.4Very high87.5Confident127 Ų12799.8 Ų99.855%0.55250%0.502SS*.Hα-helixtrans-60.8-41.3176.1-75178.9176.9-176.70112.5L231 E232 E238 Q239L231-K235 WeakPolarHBondContact O-CG 3.31Å; L231-K235 PolarHBondContact O-N 3.16Å; E232-K235 PolarHBondContact O-N 3.46Å; K235-E238 PolarHBondContact O-N 3.33Å; K235-Q239 PolarHBondContact O-N 2.81Å
236S93.5Very high88.6Confident74 Ų7494.7 Ų94.752%0.51749%0.486SS..Hα-helixtrans-63.5-44.3174.8176.90000111.4E232 Q233 V234 E238 Q239 V240E232-S236 WeakPolarHBondContact O-CB 3.36Å; E232-S236 PolarHBondContact O-N 2.86Å; Q233-S236 PolarHBondContact O-N 3.23Å; V234-S236 VanDerWaalsContact C-N 3.33Å; V234-S236 PolarHBondContact O-N 2.66Å; S236-E238 VanDerWaalsContact C-N 3.33Å; S236-E238 PolarHBondContact O-N 3.32Å; S236-Q239 PolarHBondContact O-N 3.23Å; S236-V240 WeakPolarHBondContact O-CG2 3.22Å; S236-V240 PolarHBondContact O-N 3.37Å
237S90Very high89.4Confident66 Ų6698.5 Ų98.546%0.46251%0.506SS..Hα-helixtrans-65.6-34.9176.975.50000112.9Q233 V234 V240 A241Q233-S237 WeakPolarHBondContact O-CB 3.22Å; Q233-S237 PolarHBondContact O-N 3.44Å; Q233-S237 PolarHBondContact O-OG 2.9Å; V234-S237 WeakPolarHBondContact CA-OG 3.4Å; V234-S237 PolarHBondContact O-N 3.42Å; V234-S237 PolarHBondContact O-OG 2.94Å; S237-V240 PolarHBondContact O-N 3.4Å; S237-A241 WeakPolarHBondContact O-CB 3.36Å; S237-A241 PolarHBondContact O-N 3.16Å
238E94Very high90Very high124 Ų12496 Ų9658%0.57950%0.504SS*.Hα-helixtrans-64.5-45174-177.7178.7-17000110.3V234 K235 S236 A241 V242V234-E238 WeakPolarHBondContact O-CB 3.41Å; V234-E238 PolarHBondContact O-N 2.75Å; K235-E238 PolarHBondContact O-N 3.33Å; S236-E238 VanDerWaalsContact C-N 3.33Å; S236-E238 PolarHBondContact O-N 3.32Å; E238-A241 PolarHBondContact O-N 3.21Å; E238-V242 WeakPolarHBondContact O-CG2 3.43Å; E238-V242 PolarHBondContact O-N 3.07Å
239Q94.1Very high90.5Very high105 Ų10594.6 Ų94.649%0.49150%0.502SS..Hα-helixtrans-61.6-46.6176-170.560.350.900111.4K235 S236 A241 V242 D243K235-Q239 PolarHBondContact O-N 2.81Å; S236-Q239 PolarHBondContact O-N 3.23Å; Q239-A241 VanDerWaalsContact C-N 3.28Å; Q239-A241 PolarHBondContact O-N 3Å; Q239-V242 PolarHBondContact O-N 3.03Å; Q239-V242 VanDerWaalsContact O-N 3.11Å; Q239-D243 PolarHBondContact NE2-OD1 3.44Å; Q239-D243 PolarHBondContact O-N 3.01Å
240V94.2Very high90.8Very high89 Ų8996.6 Ų96.654%0.53952%0.515SS..Hα-helixtrans-60.2-39176173.30000111.5S236 S237 D243 M244S236-V240 WeakPolarHBondContact O-CG2 3.22Å; S236-V240 PolarHBondContact O-N 3.37Å; S237-V240 PolarHBondContact O-N 3.4Å; V240-D243 PolarHBondContact O-N 3.39Å; V240-M244 VanDerWaalsContact O-CB 3.25Å; V240-M244 WeakPolarHBondContact O-CB 3.27Å; V240-M244 PolarHBondContact O-N 2.92Å
241A91.7Very high91.5Very high59 Ų5997.1 Ų97.149%0.48852%0.517SS..Hα-helixtrans-68-36176.500000112.4S237 E238 Q239 K245S237-A241 WeakPolarHBondContact O-CB 3.36Å; S237-A241 PolarHBondContact O-N 3.16Å; E238-A241 PolarHBondContact O-N 3.21Å; Q239-A241 VanDerWaalsContact C-N 3.28Å; Q239-A241 PolarHBondContact O-N 3Å; A241-K245 WeakPolarHBondContact O-CB 3.36Å; A241-K245 PolarHBondContact O-N 3.42Å
242V93.8Very high91.7Very high67 Ų6798 Ų9841%0.40652%0.522SS..Hα-helixtrans-67.4-45.5174.4170.70000110.6E238 Q239 K245 T246E238-V242 WeakPolarHBondContact O-CG2 3.43Å; E238-V242 PolarHBondContact O-N 3.07Å; Q239-V242 PolarHBondContact O-N 3.03Å; Q239-V242 VanDerWaalsContact O-N 3.11Å; V242-K245 WeakPolarHBondContact O-CB 3.38Å; V242-K245 PolarHBondContact O-N 3.4Å; V242-T246 PolarHBondContact O-N 3.35Å; V242-T246 PolarHBondContact O-OG1 3.21Å
243D92.4Very high92Very high70 Ų7095.9 Ų95.937%0.37452%0.518SS..Hα-helixtrans-64.3-46179.2-62.6-17.4000110.7Q239 V240 K245 T246 D247Q239-D243 PolarHBondContact NE2-OD1 3.44Å; Q239-D243 PolarHBondContact O-N 3.01Å; V240-D243 PolarHBondContact O-N 3.39Å; D243-K245 VanDerWaalsContact C-N 3.26Å; D243-K245 PolarHBondContact O-N 2.87Å; D243-T246 WeakPolarHBondContact CA-OG1 3.36Å; D243-T246 PolarHBondContact O-N 2.95Å; D243-T246 VanDerWaalsContact O-N 3.16Å; D243-T246 PolarHBondContact O-OG1 3.46Å; D243-D247 WeakPolarHBondContact O-CB 3.41Å; D243-D247 VanDerWaalsContact O-CG 3.23Å; D243-D247 PolarHBondContact O-N 3.4Å
244M92.2Very high92.4Very high119 Ų11995.3 Ų95.359%0.58652%0.515SS*.Hα-helixtrans-62.5-35.6175.5-168.7179.3-169.900111.8V240 L248V240-M244 VanDerWaalsContact O-CB 3.25Å; V240-M244 WeakPolarHBondContact O-CB 3.27Å; V240-M244 PolarHBondContact O-N 2.92Å; M244-L248 HydrophobicContact CE-CD1 4.2Å; M244-L248 HydrophobicContact CG-CD1 3.97Å; M244-L248 HydrophobicContact CG-CG 4.49Å; M244-L248 WeakPolarHBondContact O-CB 3.2Å; M244-L248 VanDerWaalsContact O-CG 3.22Å; M244-L248 WeakPolarHBondContact O-CG 3.23Å; M244-L248 PolarHBondContact O-N 3.1Å
245K90.5Very high92.7Very high127 Ų12796.1 Ų96.155%0.55252%0.517SS*.Hα-helixtrans-64.5-48.5173.9-179.8-176.2175.3-176.60110.4A241 V242 D243 D247 L248 F249A241-K245 WeakPolarHBondContact O-CB 3.36Å; A241-K245 PolarHBondContact O-N 3.42Å; V242-K245 WeakPolarHBondContact O-CB 3.38Å; V242-K245 PolarHBondContact O-N 3.4Å; D243-K245 VanDerWaalsContact C-N 3.26Å; D243-K245 PolarHBondContact O-N 2.87Å; K245-D247 VanDerWaalsContact C-N 3.32Å; K245-D247 PolarHBondContact O-N 2.76Å; K245-L248 PolarHBondContact O-N 2.68Å; K245-F249 HydrophobicContact CD-CD2 4.42Å; K245-F249 HydrophobicContact CD-CE2 4.16Å; K245-F249 HydrophobicContact CG-CD2 3.47Å; K245-F249 VanDerWaalsContact CG-CD2 3.47Å; K245-F249 HydrophobicContact CG-CE2 3.59Å; K245-F249 WeakPolarHBondContact O-CB 3.4Å; K245-F249 VanDerWaalsContact O-CD2 3.27Å; K245-F249 WeakPolarHBondContact O-CD2 3.31Å; K245-F249 PolarHBondContact O-N 3.4Å
246T90Very high92.8Very high74 Ų7494.3 Ų94.345%0.45452%0.516SS..Hα-helixtrans-62.8-40.9178.947.10000111.7V242 D243 L248 F249V242-T246 PolarHBondContact O-N 3.35Å; V242-T246 PolarHBondContact O-OG1 3.21Å; D243-T246 WeakPolarHBondContact CA-OG1 3.36Å; D243-T246 PolarHBondContact O-N 2.95Å; D243-T246 VanDerWaalsContact O-N 3.16Å; D243-T246 PolarHBondContact O-OG1 3.46Å; T246-L248 VanDerWaalsContact C-N 3.3Å; T246-L248 PolarHBondContact O-N 3.33Å; T246-F249 PolarHBondContact O-N 3.3Å
247D90.9Very high93Very high117 Ų11793.5 Ų93.563%0.62651%0.511SS*.Hα-helixtrans-65.4-31.1179.1-71.8-7.3000113D243 K245 P251D243-D247 WeakPolarHBondContact O-CB 3.41Å; D243-D247 VanDerWaalsContact O-CG 3.23Å; D243-D247 PolarHBondContact O-N 3.4Å; K245-D247 VanDerWaalsContact C-N 3.32Å; K245-D247 PolarHBondContact O-N 2.76Å; D247-P251 WeakPolarHBondContact O-CD 3.19Å; D247-P251 WeakPolarHBondContact O-CG 3.49Å
248L93Very high93.3Very high101 Ų10193.6 Ų93.653%0.52951%0.506SS..Hα-helixtrans-89-29.4178.8-70.1173.4000113.5M244 K245 T246 P251 L252M244-L248 HydrophobicContact CE-CD1 4.2Å; M244-L248 HydrophobicContact CG-CD1 3.97Å; M244-L248 HydrophobicContact CG-CG 4.49Å; M244-L248 WeakPolarHBondContact O-CB 3.2Å; M244-L248 VanDerWaalsContact O-CG 3.22Å; M244-L248 WeakPolarHBondContact O-CG 3.23Å; M244-L248 PolarHBondContact O-N 3.1Å; K245-L248 PolarHBondContact O-N 2.68Å; T246-L248 VanDerWaalsContact C-N 3.3Å; T246-L248 PolarHBondContact O-N 3.33Å; L248-P251 WeakPolarHBondContact O-CD 2.96Å; L248-L252 VanDerWaalsContact O-CB 3.23Å; L248-L252 WeakPolarHBondContact O-CB 3.49Å; L248-L252 PolarHBondContact O-N 2.87Å; L248-L252 VanDerWaalsContact O-N 3.1Å
249F92.5Very high93.5Very high112 Ų11291.5 Ų91.549%0.49150%0.498SS..Hα-helixtrans-68.4-39.6-176.5-103.9-92.3000112.5K245 T246 L252 T253K245-F249 HydrophobicContact CD-CD2 4.42Å; K245-F249 HydrophobicContact CD-CE2 4.16Å; K245-F249 HydrophobicContact CG-CD2 3.47Å; K245-F249 VanDerWaalsContact CG-CD2 3.47Å; K245-F249 HydrophobicContact CG-CE2 3.59Å; K245-F249 WeakPolarHBondContact O-CB 3.4Å; K245-F249 VanDerWaalsContact O-CD2 3.27Å; K245-F249 WeakPolarHBondContact O-CD2 3.31Å; K245-F249 PolarHBondContact O-N 3.4Å; T246-F249 PolarHBondContact O-N 3.3Å; F249-L252 PolarHBondContact O-N 3.45Å; F249-T253 VanDerWaalsContact O-CB 3.26Å; F249-T253 WeakPolarHBondContact O-CB 3.26Å; F249-T253 PolarHBondContact O-N 2.92Å; F249-T253 PolarHBondContact O-OG1 3.5Å
250D87.9Confident93.6Very high124 Ų12488.1 Ų88.166%0.66349%0.491SS*.Hα-helixtrans-65.5-50.6-180-73.8-15.1000112L252 T253 Q254D250-L252 VanDerWaalsContact C-N 3.34Å; D250-L252 PolarHBondContact O-N 2.93Å; D250-T253 PolarHBondContact O-N 2.94Å; D250-Q254 WeakPolarHBondContact O-CB 3.3Å; D250-Q254 PolarHBondContact O-N 2.94Å
251P93.2Very high93.8Very high78 Ų7888.4 Ų88.451%0.50649%0.486SS..Hα-helixtrans-60.2-39.7173.7-23.833.2000113.5D247 L248 Q254 L255D247-P251 WeakPolarHBondContact O-CD 3.19Å; D247-P251 WeakPolarHBondContact O-CG 3.49Å; L248-P251 WeakPolarHBondContact O-CD 2.96Å; P251-Q254 PolarHBondContact O-N 3.04Å; P251-L255 VanDerWaalsContact O-CB 3.3Å; P251-L255 WeakPolarHBondContact O-CB 3.47Å; P251-L255 PolarHBondContact O-N 3.3Å
252L93.5Very high94Very high99 Ų9988.9 Ų88.952%0.51848%0.484SS..Hα-helixtrans-68.5-38180-173.867.8000111.7L248 F249 D250 L255 T256L248-L252 VanDerWaalsContact O-CB 3.23Å; L248-L252 WeakPolarHBondContact O-CB 3.49Å; L248-L252 PolarHBondContact O-N 2.87Å; L248-L252 VanDerWaalsContact O-N 3.1Å; F249-L252 PolarHBondContact O-N 3.45Å; D250-L252 VanDerWaalsContact C-N 3.34Å; D250-L252 PolarHBondContact O-N 2.93Å; L252-L255 PolarHBondContact O-N 2.93Å; L252-T256 WeakPolarHBondContact O-CB 3.46Å; L252-T256 PolarHBondContact O-N 2.97Å; L252-T256 PolarHBondContact O-OG1 3.42Å
253T94Very high94.2Very high84 Ų8490.3 Ų90.352%0.51549%0.488SS..Hα-helixtrans-68.1-42.4176.6-55.90000110.4F249 D250 T256 S257F249-T253 VanDerWaalsContact O-CB 3.26Å; F249-T253 WeakPolarHBondContact O-CB 3.26Å; F249-T253 PolarHBondContact O-N 2.92Å; F249-T253 PolarHBondContact O-OG1 3.5Å; D250-T253 PolarHBondContact O-N 2.94Å; T253-T256 PolarHBondContact O-N 3.1Å; T253-S257 PolarHBondContact O-N 3.32Å
254Q95.1Very high94.3Very high110 Ų11090.2 Ų90.251%0.51449%0.493SS..Hα-helixtrans-61.5-47.9174.2-172.860.538.500111.3D250 P251 T256 S257 D258D250-Q254 WeakPolarHBondContact O-CB 3.3Å; D250-Q254 PolarHBondContact O-N 2.94Å; P251-Q254 PolarHBondContact O-N 3.04Å; Q254-T256 VanDerWaalsContact C-N 3.28Å; Q254-T256 PolarHBondContact O-N 2.92Å; Q254-S257 WeakPolarHBondContact O-CB 3.38Å; Q254-S257 PolarHBondContact O-N 2.89Å; Q254-S257 VanDerWaalsContact O-N 3.1Å; Q254-D258 PolarHBondContact NE2-OD1 2.88Å; Q254-D258 VanDerWaalsContact O-CG 3.25Å; Q254-D258 PolarHBondContact O-N 3.42Å
255L96.4Very high94.6Very high93 Ų9390.5 Ų90.549%0.48749%0.491SS..Hα-helixtrans-59.1-41177.1-179.364.3000111.6P251 L252 S257 D258 I259P251-L255 VanDerWaalsContact O-CB 3.3Å; P251-L255 WeakPolarHBondContact O-CB 3.47Å; P251-L255 PolarHBondContact O-N 3.3Å; L252-L255 PolarHBondContact O-N 2.93Å; L255-S257 VanDerWaalsContact C-N 3.34Å; L255-D258 PolarHBondContact O-N 3.07Å; L255-I259 HydrophobicContact CD1-CD1 4Å; L255-I259 HydrophobicContact CD1-CG1 4.28Å; L255-I259 HydrophobicContact CD2-CD1 4.43Å; L255-I259 HydrophobicContact CG-CD1 3.78Å; L255-I259 HydrophobicContact CG-CG1 4.44Å; L255-I259 WeakPolarHBondContact O-CB 3.18Å; L255-I259 WeakPolarHBondContact O-CD1 3.43Å; L255-I259 WeakPolarHBondContact O-CG1 3.26Å; L255-I259 PolarHBondContact O-N 3.38Å
256T96.4Very high94.9Very high88 Ų8889.7 Ų89.754%0.5449%0.491SS..Hα-helixtrans-64.9-40177.1-57.90000111.4L252 T253 Q254 G260L252-T256 WeakPolarHBondContact O-CB 3.46Å; L252-T256 PolarHBondContact O-N 2.97Å; L252-T256 PolarHBondContact O-OG1 3.42Å; T253-T256 PolarHBondContact O-N 3.1Å; Q254-T256 VanDerWaalsContact C-N 3.28Å; Q254-T256 PolarHBondContact O-N 2.92Å; T256-G260 PolarHBondContact O-N 3.1Å
257S96.6Very high95.2Very high58 Ų5889.6 Ų89.641%0.40649%0.488SS..Hα-helixtrans-63.1-48174.2-171.40000111.4T253 Q254 L255 I259 G260 E261T253-S257 PolarHBondContact O-N 3.32Å; Q254-S257 WeakPolarHBondContact O-CB 3.38Å; Q254-S257 PolarHBondContact O-N 2.89Å; Q254-S257 VanDerWaalsContact O-N 3.1Å; L255-S257 VanDerWaalsContact C-N 3.34Å; S257-I259 VanDerWaalsContact C-N 3.35Å; S257-I259 PolarHBondContact O-N 2.92Å; S257-G260 CarbonylContact O-C 3.58Å; S257-G260 WeakPolarHBondContact O-CA 3.45Å; S257-G260 PolarHBondContact O-N 2.89Å; S257-G260 VanDerWaalsContact O-N 3.07Å; S257-E261 PolarHBondContact O-N 3.29Å
258D97.2Very high95.5Very high68 Ų6889.6 Ų89.636%0.36449%0.487SS..Hα-helixtrans-63.2-41180-65-13.6000111.5Q254 L255 E261 T262Q254-D258 PolarHBondContact NE2-OD1 2.88Å; Q254-D258 VanDerWaalsContact O-CG 3.25Å; Q254-D258 PolarHBondContact O-N 3.42Å; L255-D258 PolarHBondContact O-N 3.07Å; D258-E261 PolarHBondContact O-N 2.88Å; D258-T262 WeakPolarHBondContact O-CG2 3.35Å; D258-T262 PolarHBondContact O-N 3.43Å; D258-T262 PolarHBondContact O-OG1 3.49Å; D258-T262 VanDerWaalsContact O-OG1 3.08Å
259I97.3Very high95.7Very high80 Ų8092 Ų9241%0.4149%0.489SS..Hα-helixtrans-62.8-43.7172.3-69.8167.4000110.3L255 S257 E261 T262 I263L255-I259 HydrophobicContact CD1-CD1 4Å; L255-I259 HydrophobicContact CD1-CG1 4.28Å; L255-I259 HydrophobicContact CD2-CD1 4.43Å; L255-I259 HydrophobicContact CG-CD1 3.78Å; L255-I259 HydrophobicContact CG-CG1 4.44Å; L255-I259 WeakPolarHBondContact O-CB 3.18Å; L255-I259 WeakPolarHBondContact O-CD1 3.43Å; L255-I259 WeakPolarHBondContact O-CG1 3.26Å; L255-I259 PolarHBondContact O-N 3.38Å; S257-I259 VanDerWaalsContact C-N 3.35Å; S257-I259 PolarHBondContact O-N 2.92Å; I259-E261 VanDerWaalsContact C-N 3.33Å; I259-E261 PolarHBondContact O-N 3.39Å; I259-T262 WeakPolarHBondContact CA-OG1 3.33Å; I259-T262 PolarHBondContact O-N 2.87Å; I259-T262 PolarHBondContact O-OG1 3.43Å; I259-I263 HydrophobicContact CG2-CD1 3.63Å; I259-I263 HydrophobicContact CG2-CG1 4.26Å; I259-I263 WeakPolarHBondContact O-CB 3.47Å; I259-I263 VanDerWaalsContact O-CG1 3.26Å; I259-I263 WeakPolarHBondContact O-CG1 3.29Å; I259-I263 PolarHBondContact O-N 2.86Å
260G97.1Very high95.9Very high33 Ų3391.8 Ų91.834%0.3449%0.49SS..Hα-helixtrans-59.6-41.9176.200000112.9T256 S257 S264T256-G260 PolarHBondContact O-N 3.1Å; S257-G260 CarbonylContact O-C 3.58Å; S257-G260 WeakPolarHBondContact O-CA 3.45Å; S257-G260 PolarHBondContact O-N 2.89Å; S257-G260 VanDerWaalsContact O-N 3.07Å; G260-S264 WeakPolarHBondContact O-CB 3.35Å; G260-S264 PolarHBondContact O-N 3.25Å; G260-S264 PolarHBondContact O-OG 2.91Å
261E97.2Very high96.3Very high95 Ų9592.1 Ų92.144%0.44449%0.485SS..Hα-helixtrans-66-45175-74.4-166.9-167.300112.6S257 D258 I259 S264 K265S257-E261 PolarHBondContact O-N 3.29Å; D258-E261 PolarHBondContact O-N 2.88Å; I259-E261 VanDerWaalsContact C-N 3.33Å; I259-E261 PolarHBondContact O-N 3.39Å; E261-S264 PolarHBondContact O-N 2.83Å; E261-K265 WeakPolarHBondContact O-CB 3.39Å; E261-K265 VanDerWaalsContact O-CG 3.29Å; E261-K265 WeakPolarHBondContact O-CG 3.23Å; E261-K265 PolarHBondContact O-N 3.08Å; E261-K265 IonicContact OE2-NZ 3.2Å; E261-K265 PolarHBondContact OE2-NZ 2.86Å; E261-K265 VanDerWaalsContact OE2-NZ 3.07Å
262T96.9Very high96.5Very high70 Ų7094 Ų9443%0.42948%0.483SS..Hα-helixtrans-65.8-41.6-18052.90000111.3D258 I259 S264 K265 I266D258-T262 WeakPolarHBondContact O-CG2 3.35Å; D258-T262 PolarHBondContact O-N 3.43Å; D258-T262 PolarHBondContact O-OG1 3.49Å; D258-T262 VanDerWaalsContact O-OG1 3.08Å; I259-T262 WeakPolarHBondContact CA-OG1 3.33Å; I259-T262 PolarHBondContact O-N 2.87Å; I259-T262 PolarHBondContact O-OG1 3.43Å; T262-S264 VanDerWaalsContact C-N 3.31Å; T262-S264 PolarHBondContact O-N 2.87Å; T262-K265 PolarHBondContact O-N 3.41Å; T262-I266 WeakPolarHBondContact O-CB 3.39Å; T262-I266 VanDerWaalsContact O-CG1 3.23Å; T262-I266 WeakPolarHBondContact O-CG1 3.28Å; T262-I266 PolarHBondContact O-N 3.29Å
263I97.6Very high96.7Very high97 Ų9792.9 Ų92.950%0.49748%0.477SS..Hα-helixtrans-59.6-43.5172.3-69.6169.8000110.7I259 K265 I266 N267I259-I263 HydrophobicContact CG2-CD1 3.63Å; I259-I263 HydrophobicContact CG2-CG1 4.26Å; I259-I263 WeakPolarHBondContact O-CB 3.47Å; I259-I263 VanDerWaalsContact O-CG1 3.26Å; I259-I263 WeakPolarHBondContact O-CG1 3.29Å; I259-I263 PolarHBondContact O-N 2.86Å; I263-K265 PolarHBondContact O-N 3.25Å; I263-I266 PolarHBondContact O-N 3.01Å; I263-N267 WeakPolarHBondContact O-CB 3.35Å; I263-N267 PolarHBondContact O-N 2.81Å
264S95.9Very high96.8Very high68 Ų6892.5 Ų92.548%0.47647%0.472SS..Hα-helixtrans-63-42.6177.6-61.80000111.7G260 E261 T262 N267 L268G260-S264 WeakPolarHBondContact O-CB 3.35Å; G260-S264 PolarHBondContact O-N 3.25Å; G260-S264 PolarHBondContact O-OG 2.91Å; E261-S264 PolarHBondContact O-N 2.83Å; T262-S264 VanDerWaalsContact C-N 3.31Å; T262-S264 PolarHBondContact O-N 2.87Å; S264-N267 PolarHBondContact O-N 3.07Å; S264-L268 VanDerWaalsContact O-CG 3.3Å; S264-L268 WeakPolarHBondContact O-CG 3.49Å; S264-L268 PolarHBondContact O-N 3.48Å
265K97.3Very high96.8Very high125 Ų12590.3 Ų90.354%0.54347%0.469SS..Hα-helixtrans-62.9-42.6174.5-71.2165.9-170.3159.50111.5E261 T262 I263 L268 R269E261-K265 WeakPolarHBondContact O-CB 3.39Å; E261-K265 VanDerWaalsContact O-CG 3.29Å; E261-K265 WeakPolarHBondContact O-CG 3.23Å; E261-K265 PolarHBondContact O-N 3.08Å; E261-K265 IonicContact OE2-NZ 3.2Å; E261-K265 PolarHBondContact OE2-NZ 2.86Å; E261-K265 VanDerWaalsContact OE2-NZ 3.07Å; T262-K265 PolarHBondContact O-N 3.41Å; I263-K265 PolarHBondContact O-N 3.25Å; K265-L268 PolarHBondContact O-N 3.49Å; K265-R269 WeakPolarHBondContact O-CB 3.45Å; K265-R269 PolarHBondContact O-N 3.17Å
266I97.1Very high96.8Very high110 Ų11090.6 Ų90.656%0.56447%0.468SS*.Hα-helixtrans-62.2-47.6176.2-70.3164.2000110.4T262 I263 L268 R269 E270T262-I266 WeakPolarHBondContact O-CB 3.39Å; T262-I266 VanDerWaalsContact O-CG1 3.23Å; T262-I266 WeakPolarHBondContact O-CG1 3.28Å; T262-I266 PolarHBondContact O-N 3.29Å; I263-I266 PolarHBondContact O-N 3.01Å; I266-L268 PolarHBondContact O-N 2.92Å; I266-R269 CarbonylContact O-C 3.58Å; I266-R269 WeakPolarHBondContact O-CB 3.33Å; I266-R269 PolarHBondContact O-N 3.31Å; I266-R269 VanDerWaalsContact O-N 3.1Å; I266-E270 WeakPolarHBondContact O-CB 3.45Å; I266-E270 PolarHBondContact O-N 3.41Å
267N97Very high96.8Very high71 Ų7190.8 Ų90.838%0.3847%0.465SS..Hα-helixtrans-63.7-39.9-179.9-166.5-20.7000111.7I263 S264 R269 E270 K271I263-N267 WeakPolarHBondContact O-CB 3.35Å; I263-N267 PolarHBondContact O-N 2.81Å; S264-N267 PolarHBondContact O-N 3.07Å; N267-R269 VanDerWaalsContact C-N 3.35Å; N267-R269 PolarHBondContact O-N 2.81Å; N267-E270 PolarHBondContact O-N 2.8Å; N267-K271 WeakPolarHBondContact O-CB 3.5Å; N267-K271 WeakPolarHBondContact O-CG 3.45Å; N267-K271 PolarHBondContact O-N 3.43Å; N267-K271 VanDerWaalsContact OD1-CE 3.28Å; N267-K271 WeakPolarHBondContact OD1-CE 3.39Å
268L96.9Very high96.8Very high118 Ų11894 Ų9462%0.61847%0.473SS*.Hα-helixtrans-62.5-41.5172.1-72.3170.7000112S264 K265 I266 K271 Y272S264-L268 VanDerWaalsContact O-CG 3.3Å; S264-L268 WeakPolarHBondContact O-CG 3.49Å; S264-L268 PolarHBondContact O-N 3.48Å; K265-L268 PolarHBondContact O-N 3.49Å; I266-L268 PolarHBondContact O-N 2.92Å; L268-K271 PolarHBondContact O-N 3.45Å; L268-Y272 WeakPolarHBondContact O-CB 3.32Å; L268-Y272 PolarHBondContact O-N 2.97Å
269R97.2Very high96.7Very high150 Ų15094.2 Ų94.257%0.56648%0.478SS*.Hα-helixtrans-67.1-40.3177.4-173.258.9174.8177.90.7112K265 I266 N267 Y272 I273K265-R269 WeakPolarHBondContact O-CB 3.45Å; K265-R269 PolarHBondContact O-N 3.17Å; I266-R269 CarbonylContact O-C 3.58Å; I266-R269 WeakPolarHBondContact O-CB 3.33Å; I266-R269 PolarHBondContact O-N 3.31Å; I266-R269 VanDerWaalsContact O-N 3.1Å; N267-R269 VanDerWaalsContact C-N 3.35Å; N267-R269 PolarHBondContact O-N 2.81Å; R269-Y272 PolarHBondContact O-N 2.93Å; R269-I273 HydrophobicContact CG-CD1 4.03Å; R269-I273 VanDerWaalsContact O-CG1 3.32Å; R269-I273 WeakPolarHBondContact O-CG1 3.47Å; R269-I273 PolarHBondContact O-N 2.93Å
270E96.3Very high96.6Very high108 Ų10894.8 Ų94.851%0.50548%0.481SS..Hα-helixtrans-61.7-49174.8-171.8-171.4162.100110.8I266 N267 Y272 I273 N274I266-E270 WeakPolarHBondContact O-CB 3.45Å; I266-E270 PolarHBondContact O-N 3.41Å; N267-E270 PolarHBondContact O-N 2.8Å; E270-Y272 VanDerWaalsContact C-N 3.27Å; E270-Y272 PolarHBondContact O-N 3.5Å; E270-I273 PolarHBondContact O-N 3.1Å; E270-I273 VanDerWaalsContact O-N 3.17Å; E270-N274 WeakPolarHBondContact O-CB 3.3Å; E270-N274 VanDerWaalsContact O-CG 3.27Å; E270-N274 PolarHBondContact O-N 2.95Å; E270-N274 PolarHBondContact O-ND2 2.87Å
271K97.1Very high96.6Very high131 Ų13196.9 Ų96.957%0.5748%0.484SS*.Hα-helixtrans-56.5-42.1174.4-75.6175.4-179.8175.40112.1N267 L268 S275N267-K271 WeakPolarHBondContact O-CB 3.5Å; N267-K271 WeakPolarHBondContact O-CG 3.45Å; N267-K271 PolarHBondContact O-N 3.43Å; N267-K271 VanDerWaalsContact OD1-CE 3.28Å; N267-K271 WeakPolarHBondContact OD1-CE 3.39Å; L268-K271 PolarHBondContact O-N 3.45Å; K271-S275 WeakPolarHBondContact O-CB 3.4Å; K271-S275 PolarHBondContact O-N 2.67Å
272Y97.1Very high96.6Very high119 Ų11996.2 Ų96.247%0.46748%0.484SS..Hα-helixtrans-64.3-47.5176.3179.2-96.3000111.7L268 R269 E270 N274 S275 Q276L268-Y272 WeakPolarHBondContact O-CB 3.32Å; L268-Y272 PolarHBondContact O-N 2.97Å; R269-Y272 PolarHBondContact O-N 2.93Å; E270-Y272 VanDerWaalsContact C-N 3.27Å; E270-Y272 PolarHBondContact O-N 3.5Å; Y272-N274 PolarHBondContact O-N 3.47Å; Y272-S275 PolarHBondContact O-N 3.08Å; Y272-S275 PolarHBondContact O-OG 3.38Å; Y272-Q276 HydrophobicContact CD1-CG 4.38Å; Y272-Q276 HydrophobicContact CE1-CG 4.02Å; Y272-Q276 WeakPolarHBondContact O-CG 3.07Å; Y272-Q276 PolarHBondContact O-N 3.22Å; Y272-Q276 VanDerWaalsContact O-N 3.08Å
273I97.3Very high96.6Very high75 Ų7599 Ų9939%0.38549%0.492SS..Hα-helixtrans-61-46177.6-70167.4000110.3R269 E270 S275 Q276 L277R269-I273 HydrophobicContact CG-CD1 4.03Å; R269-I273 VanDerWaalsContact O-CG1 3.32Å; R269-I273 WeakPolarHBondContact O-CG1 3.47Å; R269-I273 PolarHBondContact O-N 2.93Å; E270-I273 PolarHBondContact O-N 3.1Å; E270-I273 VanDerWaalsContact O-N 3.17Å; I273-S275 VanDerWaalsContact C-N 3.31Å; I273-S275 PolarHBondContact O-N 3.3Å; I273-Q276 CarbonylContact O-C 3.59Å; I273-Q276 WeakPolarHBondContact O-CA 3.41Å; I273-Q276 WeakPolarHBondContact O-CB 3.49Å; I273-Q276 PolarHBondContact O-N 3.19Å; I273-L277 HydrophobicContact CG2-CD1 3.69Å; I273-L277 HydrophobicContact CG2-CG 4.13Å; I273-L277 WeakPolarHBondContact O-CG 3.35Å; I273-L277 PolarHBondContact O-N 3.28Å
274N95.7Very high96.5Very high75 Ų7599 Ų9940%0.40149%0.492SS..Hα-helixtrans-59.7-41.9177-70-16000111.3E270 Y272 Q276 L277 E278E270-N274 WeakPolarHBondContact O-CB 3.3Å; E270-N274 VanDerWaalsContact O-CG 3.27Å; E270-N274 PolarHBondContact O-N 2.95Å; E270-N274 PolarHBondContact O-ND2 2.87Å; Y272-N274 PolarHBondContact O-N 3.47Å; N274-Q276 PolarHBondContact O-N 2.87Å; N274-L277 PolarHBondContact O-N 3.01Å; N274-E278 WeakPolarHBondContact O-CB 3.49Å; N274-E278 PolarHBondContact O-N 2.98Å
275S96Very high96.5Very high65 Ų65101.3 Ų101.346%0.45549%0.491SS..Hα-helixtrans-63.8-28.1175.2750000113.8K271 Y272 I273 P279K271-S275 WeakPolarHBondContact O-CB 3.4Å; K271-S275 PolarHBondContact O-N 2.67Å; Y272-S275 PolarHBondContact O-N 3.08Å; Y272-S275 PolarHBondContact O-OG 3.38Å; I273-S275 VanDerWaalsContact C-N 3.31Å; I273-S275 PolarHBondContact O-N 3.3Å; S275-P279 WeakPolarHBondContact O-CD 3.44Å
276Q95.6Very high96.5Very high99 Ų99101.8 Ų101.846%0.46349%0.493SS..Hα-helixtrans-81.9-31.1175.8-64.4-65.3-2300112Y272 I273 N274 P279Y272-Q276 HydrophobicContact CD1-CG 4.38Å; Y272-Q276 HydrophobicContact CE1-CG 4.02Å; Y272-Q276 WeakPolarHBondContact O-CG 3.07Å; Y272-Q276 PolarHBondContact O-N 3.22Å; Y272-Q276 VanDerWaalsContact O-N 3.08Å; I273-Q276 CarbonylContact O-C 3.59Å; I273-Q276 WeakPolarHBondContact O-CA 3.41Å; I273-Q276 WeakPolarHBondContact O-CB 3.49Å; I273-Q276 PolarHBondContact O-N 3.19Å; N274-Q276 PolarHBondContact O-N 2.87Å; Q276-P279 WeakPolarHBondContact O-CD 3.46Å; Q276-P279 VanDerWaalsContact O-CG 3.29Å; Q276-P279 WeakPolarHBondContact O-CG 3.47Å
277L96.3Very high96.5Very high91 Ų91100.4 Ų100.448%0.47649%0.49SS..Hα-helixtrans-79.3-33.1179.1-70.6176.5000112.8I273 N274 I280 L281I273-L277 HydrophobicContact CG2-CD1 3.69Å; I273-L277 HydrophobicContact CG2-CG 4.13Å; I273-L277 WeakPolarHBondContact O-CG 3.35Å; I273-L277 PolarHBondContact O-N 3.28Å; N274-L277 PolarHBondContact O-N 3.01Å; L277-I280 PolarHBondContact O-N 3.43Å; L277-I280 VanDerWaalsContact O-N 3.15Å; L277-L281 WeakPolarHBondContact O-CB 3.32Å; L277-L281 PolarHBondContact O-N 2.91Å
278E96.2Very high96.5Very high125 Ų125104.8 Ų104.858%0.58450%0.501SS*.Hα-helixtrans-50.9-49.1178.7-157.472.1-143.500114N274 I280 L281 N282N274-E278 WeakPolarHBondContact O-CB 3.49Å; N274-E278 PolarHBondContact O-N 2.98Å; E278-I280 PolarHBondContact O-N 3.14Å; E278-L281 PolarHBondContact O-N 3.41Å; E278-N282 WeakPolarHBondContact O-CB 3.4Å; E278-N282 PolarHBondContact O-N 2.93Å
279P96.3Very high96.5Very high73 Ų73103.7 Ų103.747%0.47450%0.496SS..Hα-helixtrans-65.2-38.9178.325-34.8000112.6S275 Q276 N282 E283S275-P279 WeakPolarHBondContact O-CD 3.44Å; Q276-P279 WeakPolarHBondContact O-CD 3.46Å; Q276-P279 VanDerWaalsContact O-CG 3.29Å; Q276-P279 WeakPolarHBondContact O-CG 3.47Å; P279-N282 PolarHBondContact O-N 2.91Å; P279-E283 PolarHBondContact O-N 3.26Å
280I95.9Very high96.5Very high92 Ų92100 Ų10047%0.47249%0.492SS..Hα-helixtrans-64.8-43.9177.7-60.3172.1000109.8L277 E278 N282 E283 I284L277-I280 PolarHBondContact O-N 3.43Å; L277-I280 VanDerWaalsContact O-N 3.15Å; E278-I280 PolarHBondContact O-N 3.14Å; I280-N282 VanDerWaalsContact C-N 3.31Å; I280-N282 PolarHBondContact O-N 2.97Å; I280-E283 WeakPolarHBondContact O-CB 3.38Å; I280-E283 PolarHBondContact O-N 3.39Å; I280-I284 HydrophobicContact CG2-CD1 4.11Å; I280-I284 WeakPolarHBondContact O-CG1 3.37Å; I280-I284 PolarHBondContact O-N 3.43Å
281L96.7Very high96.4Very high77 Ų7799.2 Ų99.240%0.40349%0.491SS..Hα-helixtrans-61-43176.9-160.684.7000110.9L277 E278 E283 I284 Y285L277-L281 WeakPolarHBondContact O-CB 3.32Å; L277-L281 PolarHBondContact O-N 2.91Å; E278-L281 PolarHBondContact O-N 3.41Å; L281-E283 VanDerWaalsContact C-N 3.34Å; L281-E283 PolarHBondContact O-N 3.21Å; L281-I284 PolarHBondContact O-N 3.46Å; L281-Y285 HydrophobicContact CD1-CE2 4.48Å; L281-Y285 HydrophobicContact CD2-CD2 4.38Å; L281-Y285 HydrophobicContact CD2-CE2 3.52Å; L281-Y285 HydrophobicContact CG-CD2 4.1Å; L281-Y285 HydrophobicContact CG-CE2 3.54Å; L281-Y285 WeakPolarHBondContact O-CD2 3.5Å; L281-Y285 PolarHBondContact O-N 2.92Å
282N96.2Very high96.4Very high82 Ų8295.6 Ų95.644%0.43949%0.485SS..Hα-helixtrans-64.5-38.2176.6-164.412000112E278 P279 I280 Y285 K286E278-N282 WeakPolarHBondContact O-CB 3.4Å; E278-N282 PolarHBondContact O-N 2.93Å; P279-N282 PolarHBondContact O-N 2.91Å; I280-N282 VanDerWaalsContact C-N 3.31Å; I280-N282 PolarHBondContact O-N 2.97Å; N282-Y285 PolarHBondContact O-N 3.25Å; N282-K286 VanDerWaalsContact O-CG 3.31Å; N282-K286 WeakPolarHBondContact O-CG 3.21Å; N282-K286 PolarHBondContact O-N 3.42Å
283E96.7Very high96.4Very high128 Ų12895.9 Ų95.960%0.59849%0.491SS*.Hα-helixtrans-64.5-42.4173.2-169.5175.5-175.800112P279 I280 L281 Y285 K286 T287P279-E283 PolarHBondContact O-N 3.26Å; I280-E283 WeakPolarHBondContact O-CB 3.38Å; I280-E283 PolarHBondContact O-N 3.39Å; L281-E283 VanDerWaalsContact C-N 3.34Å; L281-E283 PolarHBondContact O-N 3.21Å; E283-Y285 VanDerWaalsContact C-N 3.31Å; E283-Y285 PolarHBondContact O-N 2.9Å; E283-K286 PolarHBondContact O-N 3.3Å; E283-T287 WeakPolarHBondContact O-CG2 3.48Å; E283-T287 PolarHBondContact O-N 2.9Å; E283-T287 PolarHBondContact O-OG1 3.32Å
284I96.5Very high96.4Very high96 Ų9696.5 Ų96.549%0.49250%0.498SS..Hα-helixtrans-60.1-41.4172.9-68.3168.9000110.7I280 L281 T287 R288I280-I284 HydrophobicContact CG2-CD1 4.11Å; I280-I284 WeakPolarHBondContact O-CG1 3.37Å; I280-I284 PolarHBondContact O-N 3.43Å; L281-I284 PolarHBondContact O-N 3.46Å; I284-T287 WeakPolarHBondContact CA-OG1 3.36Å; I284-T287 PolarHBondContact O-OG1 3.31Å; I284-R288 WeakPolarHBondContact O-CB 3.49Å; I284-R288 PolarHBondContact O-N 2.95Å
285Y96.4Very high96.4Very high118 Ų11898.3 Ų98.346%0.46350%0.502SS..Hα-helixtrans-66.1-42.2175.9-74.2-56.6000112.7L281 N282 E283 R288 N289L281-Y285 HydrophobicContact CD1-CE2 4.48Å; L281-Y285 HydrophobicContact CD2-CD2 4.38Å; L281-Y285 HydrophobicContact CD2-CE2 3.52Å; L281-Y285 HydrophobicContact CG-CD2 4.1Å; L281-Y285 HydrophobicContact CG-CE2 3.54Å; L281-Y285 WeakPolarHBondContact O-CD2 3.5Å; L281-Y285 PolarHBondContact O-N 2.92Å; N282-Y285 PolarHBondContact O-N 3.25Å; E283-Y285 VanDerWaalsContact C-N 3.31Å; E283-Y285 PolarHBondContact O-N 2.9Å; Y285-R288 PolarHBondContact O-N 3.37Å; Y285-N289 WeakPolarHBondContact O-CB 3.46Å; Y285-N289 PolarHBondContact O-N 3.47Å; Y285-N289 PolarHBondContact O-ND2 3.24Å
286K97Very high96.4Very high135 Ų13597 Ų9759%0.58750%0.496SS*.Hα-helixtrans-62.1-47.4176.4-73.6172.7-175.5177.60111.7N282 E283 N289 C290N282-K286 VanDerWaalsContact O-CG 3.31Å; N282-K286 WeakPolarHBondContact O-CG 3.21Å; N282-K286 PolarHBondContact O-N 3.42Å; E283-K286 PolarHBondContact O-N 3.3Å; K286-N289 PolarHBondContact O-N 3.15Å; K286-C290 WeakPolarHBondContact O-CB 3.41Å; K286-C290 PolarHBondContact O-N 3.47Å
287T96.2Very high96.5Very high81 Ų8196.7 Ų96.750%0.49750%0.497SS..Hα-helixtrans-64.5-40.217852.90000111.5E283 I284 N289 C290 L291E283-T287 WeakPolarHBondContact O-CG2 3.48Å; E283-T287 PolarHBondContact O-N 2.9Å; E283-T287 PolarHBondContact O-OG1 3.32Å; I284-T287 WeakPolarHBondContact CA-OG1 3.36Å; I284-T287 PolarHBondContact O-OG1 3.31Å; T287-N289 PolarHBondContact O-N 3.48Å; T287-C290 PolarHBondContact O-N 2.94Å; T287-L291 WeakPolarHBondContact O-CB 3.43Å; T287-L291 PolarHBondContact O-N 2.73Å
288R97.4Very high96.4Very high162 Ų162100.5 Ų100.561%0.61151%0.507SS*.Hα-helixtrans-60.7-44.6173.8-170.2-177.11011331.9112.3I284 Y285 L291 A292I284-R288 WeakPolarHBondContact O-CB 3.49Å; I284-R288 PolarHBondContact O-N 2.95Å; Y285-R288 PolarHBondContact O-N 3.37Å; R288-L291 PolarHBondContact O-N 2.85Å; R288-A292 PolarHBondContact O-N 3.19Å
289N96.4Very high96.5Very high95 Ų95102.1 Ų102.151%0.50851%0.507SS..Hα-helixtrans-67.6-42.8179.5-70.9-12000111.5Y285 K286 T287 L291 A292 E293Y285-N289 WeakPolarHBondContact O-CB 3.46Å; Y285-N289 PolarHBondContact O-N 3.47Å; Y285-N289 PolarHBondContact O-ND2 3.24Å; K286-N289 PolarHBondContact O-N 3.15Å; T287-N289 PolarHBondContact O-N 3.48Å; N289-L291 VanDerWaalsContact C-N 3.32Å; N289-L291 PolarHBondContact O-N 2.92Å; N289-A292 WeakPolarHBondContact O-CB 3.35Å; N289-A292 PolarHBondContact O-N 2.94Å; N289-A292 VanDerWaalsContact O-N 3.14Å; N289-E293 PolarHBondContact O-N 2.98Å
290C97.3Very high96.4Very high72 Ų72103.4 Ų103.449%0.48651%0.51SS..Hα-helixtrans-58.5-43.9173.5-177.60000111.4K286 T287 A292 E293 V294K286-C290 WeakPolarHBondContact O-CB 3.41Å; K286-C290 PolarHBondContact O-N 3.47Å; T287-C290 PolarHBondContact O-N 2.94Å; C290-A292 VanDerWaalsContact C-N 3.34Å; C290-A292 PolarHBondContact O-N 3.49Å; C290-E293 PolarHBondContact O-N 2.89Å; C290-V294 WeakPolarHBondContact O-CG2 3.31Å; C290-V294 PolarHBondContact O-N 2.92Å
291L95.2Very high96.5Very high93 Ų93102 Ų10249%0.48751%0.512SS..Hα-helixtrans-64-37.2175.8179.3142.5000112.6T287 R288 N289 K295T287-L291 WeakPolarHBondContact O-CB 3.43Å; T287-L291 PolarHBondContact O-N 2.73Å; R288-L291 PolarHBondContact O-N 2.85Å; N289-L291 VanDerWaalsContact C-N 3.32Å; N289-L291 PolarHBondContact O-N 2.92Å; L291-K295 HydrophobicContact CD2-CD 3.84Å; L291-K295 WeakPolarHBondContact O-CB 3.18Å; L291-K295 WeakPolarHBondContact O-CG 3.29Å; L291-K295 PolarHBondContact O-N 3.37Å
292A96.7Very high96.5Very high54 Ų54101.4 Ų101.445%0.44651%0.512SS..Hα-helixtrans-65.7-41.7175.200000111.7R288 N289 C290 K295 A296R288-A292 PolarHBondContact O-N 3.19Å; N289-A292 WeakPolarHBondContact O-CB 3.35Å; N289-A292 PolarHBondContact O-N 2.94Å; N289-A292 VanDerWaalsContact O-N 3.14Å; C290-A292 VanDerWaalsContact C-N 3.34Å; C290-A292 PolarHBondContact O-N 3.49Å; A292-K295 PolarHBondContact O-N 2.87Å; A292-A296 WeakPolarHBondContact O-CB 3.46Å; A292-A296 PolarHBondContact O-N 3.15Å
293E96.9Very high96.4Very high125 Ų125101.1 Ų101.158%0.58451%0.513SS*.Hα-helixtrans-63.2-48.1176.2-171.8179.4175.600111.6N289 C290 K295 A296 N297N289-E293 PolarHBondContact O-N 2.98Å; C290-E293 PolarHBondContact O-N 2.89Å; E293-K295 VanDerWaalsContact C-N 3.31Å; E293-K295 PolarHBondContact O-N 3.34Å; E293-A296 WeakPolarHBondContact O-CB 3.44Å; E293-A296 PolarHBondContact O-N 2.89Å; E293-A296 VanDerWaalsContact O-N 3.12Å; E293-N297 VanDerWaalsContact O-CG 3.32Å; E293-N297 PolarHBondContact O-N 3.4Å
294V95.9Very high96.3Very high89 Ų8997.3 Ų97.354%0.53950%0.501SS..Hα-helixtrans-60.2-41.7176.1173.10000111.2C290 A296 N297 Y298C290-V294 WeakPolarHBondContact O-CG2 3.31Å; C290-V294 PolarHBondContact O-N 2.92Å; V294-A296 PolarHBondContact O-N 3.46Å; V294-N297 PolarHBondContact O-N 3.32Å; V294-Y298 WeakPolarHBondContact O-CB 3.42Å; V294-Y298 PolarHBondContact O-N 2.88Å
295K97Very high96.2Very high112 Ų11298.5 Ų98.549%0.48751%0.507SS..Hα-helixtrans-64.1-38.2175.3-78.6-178.2177.6-179.10112.4L291 A292 E293 R299L291-K295 HydrophobicContact CD2-CD 3.84Å; L291-K295 WeakPolarHBondContact O-CB 3.18Å; L291-K295 WeakPolarHBondContact O-CG 3.29Å; L291-K295 PolarHBondContact O-N 3.37Å; A292-K295 PolarHBondContact O-N 2.87Å; E293-K295 VanDerWaalsContact C-N 3.31Å; E293-K295 PolarHBondContact O-N 3.34Å; K295-R299 WeakPolarHBondContact O-CG 3.44Å; K295-R299 PolarHBondContact O-N 3.35Å
296A95.9Very high96.2Very high39 Ų3995.2 Ų95.232%0.32251%0.505SS..Hα-helixtrans-66-45.8175.800000111.1A292 E293 V294 Y298 R299 N300A292-A296 WeakPolarHBondContact O-CB 3.46Å; A292-A296 PolarHBondContact O-N 3.15Å; E293-A296 WeakPolarHBondContact O-CB 3.44Å; E293-A296 PolarHBondContact O-N 2.89Å; E293-A296 VanDerWaalsContact O-N 3.12Å; V294-A296 PolarHBondContact O-N 3.46Å; A296-Y298 VanDerWaalsContact C-N 3.35Å; A296-Y298 PolarHBondContact O-N 2.93Å; A296-R299 PolarHBondContact O-N 3.22Å; A296-N300 VanDerWaalsContact O-CG 3.28Å; A296-N300 PolarHBondContact O-N 3.05Å
297N96.7Very high96.1Very high91 Ų9194 Ų9449%0.48750%0.501SS..Hα-helixtrans-61.8-41.9177.1-68.8-17.5000111.9E293 V294 N300 A301E293-N297 VanDerWaalsContact O-CG 3.32Å; E293-N297 PolarHBondContact O-N 3.4Å; V294-N297 PolarHBondContact O-N 3.32Å; N297-N300 PolarHBondContact O-N 2.88Å; N297-A301 WeakPolarHBondContact O-CB 3.37Å; N297-A301 PolarHBondContact O-N 3.44Å
298Y95.7Very high96.1Very high172 Ų17296.8 Ų96.868%0.67551%0.507SS*.Hα-helixtrans-63.7-42175.4-174.9-94.4000112.3V294 A296 A301 T302V294-Y298 WeakPolarHBondContact O-CB 3.42Å; V294-Y298 PolarHBondContact O-N 2.88Å; A296-Y298 VanDerWaalsContact C-N 3.35Å; A296-Y298 PolarHBondContact O-N 2.93Å; Y298-A301 PolarHBondContact O-N 3.49Å; Y298-T302 WeakPolarHBondContact O-CB 3.39Å; Y298-T302 PolarHBondContact O-N 2.92Å; Y298-T302 PolarHBondContact O-OG1 3.37Å
299R96.7Very high96Very high159 Ų15992.4 Ų92.460%0.650%0.501SS*.Hα-helixtrans-61-46.6174.2-76.5-175.6-171.9112.9-5.6111.5K295 A296 A301 T302 T303K295-R299 WeakPolarHBondContact O-CG 3.44Å; K295-R299 PolarHBondContact O-N 3.35Å; A296-R299 PolarHBondContact O-N 3.22Å; R299-A301 VanDerWaalsContact C-N 3.35Å; R299-A301 PolarHBondContact O-N 3.12Å; R299-T302 WeakPolarHBondContact O-CB 3.38Å; R299-T302 PolarHBondContact O-N 3.38Å; R299-T302 VanDerWaalsContact O-N 3.15Å; R299-T303 WeakPolarHBondContact O-CG2 3.35Å; R299-T303 PolarHBondContact O-N 3.38Å; R299-T303 PolarHBondContact O-OG1 2.91Å
300N96Very high95.9Very high100 Ų10093.3 Ų93.354%0.53551%0.506SS..Hα-helixtrans-63.5-39.4178.6-67.5-12.9000112.2A296 N297 T302 T303 S304A296-N300 VanDerWaalsContact O-CG 3.28Å; A296-N300 PolarHBondContact O-N 3.05Å; N297-N300 PolarHBondContact O-N 2.88Å; N300-T302 VanDerWaalsContact C-N 3.33Å; N300-T303 WeakPolarHBondContact CA-OG1 3.37Å; N300-T303 PolarHBondContact O-OG1 3.42Å; N300-S304 WeakPolarHBondContact O-CB 3.35Å; N300-S304 PolarHBondContact O-N 3.27Å
301A96.3Very high95.8Very high61 Ų6196 Ų9650%0.50451%0.509SS..Hα-helixtrans-65.3-39.1173.900000111.5N297 Y298 R299 S304 L305N297-A301 WeakPolarHBondContact O-CB 3.37Å; N297-A301 PolarHBondContact O-N 3.44Å; Y298-A301 PolarHBondContact O-N 3.49Å; R299-A301 VanDerWaalsContact C-N 3.35Å; R299-A301 PolarHBondContact O-N 3.12Å; A301-S304 PolarHBondContact O-N 3.44Å; A301-L305 VanDerWaalsContact O-CB 3.32Å; A301-L305 WeakPolarHBondContact O-CB 3.36Å; A301-L305 PolarHBondContact O-N 3.5Å
302T96.3Very high95.8Very high65 Ų6597.3 Ų97.340%0.39952%0.516SS..Hα-helixtrans-66.1-43.8177.4-56.10000111.6Y298 R299 N300 L305 A306Y298-T302 WeakPolarHBondContact O-CB 3.39Å; Y298-T302 PolarHBondContact O-N 2.92Å; Y298-T302 PolarHBondContact O-OG1 3.37Å; R299-T302 WeakPolarHBondContact O-CB 3.38Å; R299-T302 PolarHBondContact O-N 3.38Å; R299-T302 VanDerWaalsContact O-N 3.15Å; N300-T302 VanDerWaalsContact C-N 3.33Å; T302-L305 PolarHBondContact O-N 3.01Å; T302-A306 PolarHBondContact O-N 2.88Å
303T95.2Very high95.7Very high77 Ų7799.3 Ų99.347%0.47252%0.516SS..Hα-helixtrans-65.4-43.9176.254.70000111.2R299 N300 L305 A306 E307R299-T303 WeakPolarHBondContact O-CG2 3.35Å; R299-T303 PolarHBondContact O-N 3.38Å; R299-T303 PolarHBondContact O-OG1 2.91Å; N300-T303 WeakPolarHBondContact CA-OG1 3.37Å; N300-T303 PolarHBondContact O-OG1 3.42Å; T303-L305 VanDerWaalsContact C-N 3.29Å; T303-L305 PolarHBondContact O-N 2.93Å; T303-A306 PolarHBondContact O-N 2.94Å; T303-E307 WeakPolarHBondContact O-CG 3.41Å; T303-E307 PolarHBondContact O-N 3.32Å
304S94.6Very high95.7Very high48 Ų4898.5 Ų98.534%0.33651%0.512SS..Hα-helixtrans-62.3-36.2175.6-172.30000112.6N300 A301 K308N300-S304 WeakPolarHBondContact O-CB 3.35Å; N300-S304 PolarHBondContact O-N 3.27Å; A301-S304 PolarHBondContact O-N 3.44Å; S304-K308 WeakPolarHBondContact O-CG 3.29Å; S304-K308 PolarHBondContact O-N 2.89Å
305L95.1Very high95.7Very high120 Ų12098.6 Ų98.663%0.62851%0.513SS*.Hα-helixtrans-67-42.7174.4-175.864.2000111.6A301 T302 T303 K308 S309A301-L305 VanDerWaalsContact O-CB 3.32Å; A301-L305 WeakPolarHBondContact O-CB 3.36Å; A301-L305 PolarHBondContact O-N 3.5Å; T302-L305 PolarHBondContact O-N 3.01Å; T303-L305 VanDerWaalsContact C-N 3.29Å; T303-L305 PolarHBondContact O-N 2.93Å; L305-K308 PolarHBondContact O-N 2.96Å; L305-S309 WeakPolarHBondContact O-CB 3.48Å; L305-S309 PolarHBondContact O-N 2.82Å
306A95.4Very high95.6Very high50 Ų5097.3 Ų97.341%0.41351%0.507SS..Hα-helixtrans-61.8-43175.700000111.7T302 T303 K308 S309 N310T302-A306 PolarHBondContact O-N 2.88Å; T303-A306 PolarHBondContact O-N 2.94Å; A306-K308 PolarHBondContact O-N 2.92Å; A306-S309 WeakPolarHBondContact O-CB 3.4Å; A306-S309 PolarHBondContact O-N 2.88Å; A306-N310 VanDerWaalsContact O-CG 3.31Å; A306-N310 PolarHBondContact O-N 2.8Å
307E95.5Very high95.5Very high109 Ų109101.8 Ų101.851%0.50952%0.521SS..Hα-helixtrans-60.6-43.6174.2-72.9173.1-169.600112.4T303 S309 N310 K311T303-E307 WeakPolarHBondContact O-CG 3.41Å; T303-E307 PolarHBondContact O-N 3.32Å; E307-S309 VanDerWaalsContact C-N 3.35Å; E307-N310 PolarHBondContact O-N 3.13Å; E307-K311 WeakPolarHBondContact O-CG 3.29Å; E307-K311 PolarHBondContact O-N 3.3Å
308K95.2Very high95.4Very high140 Ų140102.2 Ų102.261%0.60952%0.52SS*.Hα-helixtrans-65.5-38.5175.7-74179.9-175177.10111.8S304 L305 A306 K311 L312S304-K308 WeakPolarHBondContact O-CG 3.29Å; S304-K308 PolarHBondContact O-N 2.89Å; L305-K308 PolarHBondContact O-N 2.96Å; A306-K308 PolarHBondContact O-N 2.92Å; K308-K311 PolarHBondContact O-N 2.79Å; K308-L312 WeakPolarHBondContact O-CB 3.48Å; K308-L312 PolarHBondContact O-N 3.43Å
309S95.3Very high95.3Very high70 Ų7098.7 Ų98.749%0.4951%0.513SS..Hα-helixtrans-62.3-44.7175.3-167.10000111.2L305 A306 E307 L312 E313L305-S309 WeakPolarHBondContact O-CB 3.48Å; L305-S309 PolarHBondContact O-N 2.82Å; A306-S309 WeakPolarHBondContact O-CB 3.4Å; A306-S309 PolarHBondContact O-N 2.88Å; E307-S309 VanDerWaalsContact C-N 3.35Å; S309-L312 PolarHBondContact O-N 2.9Å; S309-E313 PolarHBondContact O-N 2.92Å
310N95Very high95.1Very high114 Ų11495.9 Ų95.961%0.6151%0.506SS*.Hα-helixtrans-64-43.1177.5-70.5-9.9000111.8A306 E307 L312 E313 E314A306-N310 VanDerWaalsContact O-CG 3.31Å; A306-N310 PolarHBondContact O-N 2.8Å; E307-N310 PolarHBondContact O-N 3.13Å; N310-L312 VanDerWaalsContact C-N 3.28Å; N310-L312 PolarHBondContact O-N 3.35Å; N310-E313 PolarHBondContact O-N 3.48Å; N310-E314 WeakPolarHBondContact O-CB 3.49Å; N310-E314 PolarHBondContact O-N 2.86Å
311K95.6Very high94.8Very high128 Ų12897.3 Ų97.356%0.55751%0.51SS*.Hα-helixtrans-62.4-36.3174.3-72.4174.9-176.6176.90112.3E307 K308 E314 V315E307-K311 WeakPolarHBondContact O-CG 3.29Å; E307-K311 PolarHBondContact O-N 3.3Å; K308-K311 PolarHBondContact O-N 2.79Å; K311-E314 PolarHBondContact O-N 3.48Å; K311-V315 WeakPolarHBondContact O-CB 3.32Å; K311-V315 VanDerWaalsContact O-CG2 3.27Å; K311-V315 WeakPolarHBondContact O-CG2 3.42Å; K311-V315 PolarHBondContact O-N 3.25Å
312L95.5Very high94.3Very high121 Ų121103.6 Ų103.663%0.63452%0.521SS*.Hα-helixtrans-68.9-38.9177-166.8125.4000111.1K308 S309 N310 V315 K316K308-L312 WeakPolarHBondContact O-CB 3.48Å; K308-L312 PolarHBondContact O-N 3.43Å; S309-L312 PolarHBondContact O-N 2.9Å; N310-L312 VanDerWaalsContact C-N 3.28Å; N310-L312 PolarHBondContact O-N 3.35Å; L312-V315 PolarHBondContact O-N 3.19Å; L312-K316 VanDerWaalsContact O-CB 3.29Å; L312-K316 WeakPolarHBondContact O-CB 3.46Å; L312-K316 PolarHBondContact O-N 2.92Å
313E94.9Very high93.8Very high96 Ų96105 Ų10545%0.44952%0.524SS..Hα-helixtrans-67-40.2173.6-159.763.5-152.700111.4S309 N310 K316 E317S309-E313 PolarHBondContact O-N 2.92Å; N310-E313 PolarHBondContact O-N 3.48Å; E313-K316 CarbonylContact O-C 3.57Å; E313-K316 WeakPolarHBondContact O-CB 3.32Å; E313-K316 PolarHBondContact O-N 3.41Å; E313-K316 IonicContact OE1-NZ 2.69Å; E313-K316 PolarHBondContact OE1-NZ 3.21Å; E313-K316 IonicContact OE2-NZ 3.49Å; E313-E317 WeakPolarHBondContact O-CB 3.48Å; E313-E317 PolarHBondContact O-N 2.86Å
314E95.7Very high93.3Very high107 Ų107103.9 Ų103.950%0.552%0.522SS..Hα-helixtrans-62.5-44.5174.5-174.3-177.317800111.8N310 K311 K316 E317 Q318N310-E314 WeakPolarHBondContact O-CB 3.49Å; N310-E314 PolarHBondContact O-N 2.86Å; K311-E314 PolarHBondContact O-N 3.48Å; E314-K316 VanDerWaalsContact C-N 3.28Å; E314-K316 PolarHBondContact O-N 3.41Å; E314-E317 PolarHBondContact O-N 3.28Å; E314-Q318 VanDerWaalsContact O-CG 3.32Å; E314-Q318 WeakPolarHBondContact O-CG 3.27Å; E314-Q318 PolarHBondContact O-N 3.43Å
315V96.1Very high92.6Very high91 Ų91104.9 Ų104.955%0.55253%0.528SS*.Hα-helixtrans-63.4-37.3174.7168.90000111K311 L312 L319K311-V315 WeakPolarHBondContact O-CB 3.32Å; K311-V315 VanDerWaalsContact O-CG2 3.27Å; K311-V315 WeakPolarHBondContact O-CG2 3.42Å; K311-V315 PolarHBondContact O-N 3.25Å; L312-V315 PolarHBondContact O-N 3.19Å; V315-L319 WeakPolarHBondContact O-CB 3.41Å; V315-L319 PolarHBondContact O-N 3Å
316K95.1Very high91.8Very high86 Ų86105.2 Ų105.237%0.37453%0.53SS..Hα-helixtrans-67-42.2175.8179.8-176.7155.5-137.70111.4L312 E313 E314 L319 E320L312-K316 VanDerWaalsContact O-CB 3.29Å; L312-K316 WeakPolarHBondContact O-CB 3.46Å; L312-K316 PolarHBondContact O-N 2.92Å; E313-K316 CarbonylContact O-C 3.57Å; E313-K316 WeakPolarHBondContact O-CB 3.32Å; E313-K316 PolarHBondContact O-N 3.41Å; E313-K316 IonicContact OE1-NZ 2.69Å; E313-K316 PolarHBondContact OE1-NZ 3.21Å; E313-K316 IonicContact OE2-NZ 3.49Å; E314-K316 VanDerWaalsContact C-N 3.28Å; E314-K316 PolarHBondContact O-N 3.41Å; K316-L319 WeakPolarHBondContact O-CB 3.44Å; K316-L319 PolarHBondContact O-N 3.05Å; K316-E320 VanDerWaalsContact CE-OE1 3.29Å; K316-E320 WeakPolarHBondContact CE-OE1 3.22Å; K316-E320 WeakPolarHBondContact O-CG 3.19Å; K316-E320 PolarHBondContact O-N 2.89Å
317E93.8Very high91.1Very high133 Ų133106.8 Ų106.862%0.62154%0.543SS*.Hα-helixtrans-63.3-45175.1-174.1175.1-172.600111.2E313 E314 L319 E320 E321E313-E317 WeakPolarHBondContact O-CB 3.48Å; E313-E317 PolarHBondContact O-N 2.86Å; E314-E317 PolarHBondContact O-N 3.28Å; E317-L319 VanDerWaalsContact C-N 3.27Å; E317-L319 PolarHBondContact O-N 2.93Å; E317-E320 PolarHBondContact O-N 2.92Å; E317-E320 VanDerWaalsContact O-N 3.13Å; E317-E321 PolarHBondContact O-N 3.3Å
318Q94.5Very high90Very high99 Ų99107.7 Ų107.746%0.46355%0.551SS.*Hα-helixtrans-60.9-37.2173.6-71.4176.516.400112.2E314 R322E314-Q318 VanDerWaalsContact O-CG 3.32Å; E314-Q318 WeakPolarHBondContact O-CG 3.27Å; E314-Q318 PolarHBondContact O-N 3.43Å; Q318-R322 WeakPolarHBondContact O-CB 3.43Å; Q318-R322 WeakPolarHBondContact O-CG 3.36Å; Q318-R322 PolarHBondContact O-N 2.81Å
319L92.6Very high89.2Confident99 Ų99102.2 Ų102.252%0.51854%0.535SS..Hα-helixtrans-65.5-45.1174.1-171.5101.8000110.5V315 K316 E317 R322 M323V315-L319 WeakPolarHBondContact O-CB 3.41Å; V315-L319 PolarHBondContact O-N 3Å; K316-L319 WeakPolarHBondContact O-CB 3.44Å; K316-L319 PolarHBondContact O-N 3.05Å; E317-L319 VanDerWaalsContact C-N 3.27Å; E317-L319 PolarHBondContact O-N 2.93Å; L319-R322 PolarHBondContact O-N 3.16Å; L319-M323 HydrophobicContact CD2-CE 3.77Å; L319-M323 HydrophobicContact CD2-SD 4.11Å; L319-M323 HydrophobicContact CG-CE 4.25Å; L319-M323 HydrophobicContact CG-CG 4.5Å; L319-M323 HydrophobicContact CG-SD 4.45Å; L319-M323 WeakPolarHBondContact O-CB 3.42Å; L319-M323 VanDerWaalsContact O-CG 3.22Å; L319-M323 WeakPolarHBondContact O-CG 3.26Å; L319-M323 PolarHBondContact O-N 2.79Å
320E92.7Very high88.4Confident99 Ų99101.3 Ų101.346%0.46353%0.531SS..Hα-helixtrans-62.5-42.6176.6-74.9179.5-170.600112K316 E317 M323 A324K316-E320 VanDerWaalsContact CE-OE1 3.29Å; K316-E320 WeakPolarHBondContact CE-OE1 3.22Å; K316-E320 WeakPolarHBondContact O-CG 3.19Å; K316-E320 PolarHBondContact O-N 2.89Å; E317-E320 PolarHBondContact O-N 2.92Å; E317-E320 VanDerWaalsContact O-N 3.13Å; E320-M323 HydrophobicContact CB-CE 4.36Å; E320-M323 HydrophobicContact CG-CE 3.82Å; E320-M323 PolarHBondContact O-N 2.94Å; E320-A324 WeakPolarHBondContact O-CB 3.41Å; E320-A324 PolarHBondContact O-N 3.32Å
321E89.5Confident87.7Confident130 Ų13098.8 Ų98.861%0.60752%0.521SS*.Hα-helixtrans-63.5-43.6174.8-171.4-175.7-173.600111.7E317 M323 A324 C325E317-E321 PolarHBondContact O-N 3.3Å; E321-M323 VanDerWaalsContact C-N 3.35Å; E321-A324 PolarHBondContact O-N 2.8Å; E321-C325 WeakPolarHBondContact O-CB 3.32Å; E321-C325 PolarHBondContact O-N 2.73Å; E321-C325 PolarHBondContact O-SG 2.87Å
322R87.3Confident87Confident194 Ų19498.9 Ų98.973%0.73253%0.527SS*.Hα-helixtrans-63.4-41.3173.7-75.6-112.5-177.7137.42111.7Q318 L319 C325 L326Q318-R322 WeakPolarHBondContact O-CB 3.43Å; Q318-R322 WeakPolarHBondContact O-CG 3.36Å; Q318-R322 PolarHBondContact O-N 2.81Å; L319-R322 PolarHBondContact O-N 3.16Å; R322-C325 PolarHBondContact O-N 3.26Å; R322-L326 WeakPolarHBondContact O-CB 3.36Å; R322-L326 VanDerWaalsContact O-CG 3.26Å; R322-L326 WeakPolarHBondContact O-CG 3.47Å; R322-L326 PolarHBondContact O-N 3.37Å
323M85.6Confident86.5Confident95 Ų9595.8 Ų95.847%0.46852%0.519SS..Hα-helixtrans-64.2-42.3176.2-77.4-170.7-55.900110.8L319 E320 E321 L326 A327L319-M323 HydrophobicContact CD2-CE 3.77Å; L319-M323 HydrophobicContact CD2-SD 4.11Å; L319-M323 HydrophobicContact CG-CE 4.25Å; L319-M323 HydrophobicContact CG-CG 4.5Å; L319-M323 HydrophobicContact CG-SD 4.45Å; L319-M323 WeakPolarHBondContact O-CB 3.42Å; L319-M323 VanDerWaalsContact O-CG 3.22Å; L319-M323 WeakPolarHBondContact O-CG 3.26Å; L319-M323 PolarHBondContact O-N 2.79Å; E320-M323 HydrophobicContact CB-CE 4.36Å; E320-M323 HydrophobicContact CG-CE 3.82Å; E320-M323 PolarHBondContact O-N 2.94Å; E321-M323 VanDerWaalsContact C-N 3.35Å; M323-L326 PolarHBondContact O-N 3.33Å; M323-A327 WeakPolarHBondContact O-CB 3.32Å; M323-A327 PolarHBondContact O-N 2.93Å
324A85Confident86Confident52 Ų5298.9 Ų98.943%0.4353%0.531SS..Hα-helixtrans-61.6-47174.100000111.4E320 E321 L326 A327 D328E320-A324 WeakPolarHBondContact O-CB 3.41Å; E320-A324 PolarHBondContact O-N 3.32Å; E321-A324 PolarHBondContact O-N 2.8Å; A324-L326 VanDerWaalsContact C-N 3.3Å; A324-L326 PolarHBondContact O-N 3.34Å; A324-A327 PolarHBondContact O-N 3.41Å; A324-A327 VanDerWaalsContact O-N 3.16Å; A324-D328 WeakPolarHBondContact O-CB 3.37Å; A324-D328 PolarHBondContact O-N 2.78Å
325C80Confident85.7Confident69 Ų6997.7 Ų97.747%0.46653%0.531SS..Hα-helixtrans-62.4-34.4176.7-72.60000113.3E321 R322 P331E321-C325 WeakPolarHBondContact O-CB 3.32Å; E321-C325 PolarHBondContact O-N 2.73Å; E321-C325 PolarHBondContact O-SG 2.87Å; R322-C325 PolarHBondContact O-N 3.26Å; C325-P331 WeakPolarHBondContact O-CD 3.31Å
326L78.4Confident85.4Confident128 Ų128101 Ų10167%0.6754%0.538SS*.Hα-helixtrans-74.5-39.1174.5-72.4171.5000111.5R322 M323 A324 G329R322-L326 WeakPolarHBondContact O-CB 3.36Å; R322-L326 VanDerWaalsContact O-CG 3.26Å; R322-L326 WeakPolarHBondContact O-CG 3.47Å; R322-L326 PolarHBondContact O-N 3.37Å; M323-L326 PolarHBondContact O-N 3.33Å; A324-L326 VanDerWaalsContact C-N 3.3Å; A324-L326 PolarHBondContact O-N 3.34Å; L326-G329 PolarHBondContact O-N 2.96Å
327A80.8Confident85.2Confident83 Ų83101.1 Ų101.169%0.68654%0.54SS*.Hα-helixtrans-66.8-35.6177.100000112.3M323 A324 G329M323-A327 WeakPolarHBondContact O-CB 3.32Å; M323-A327 PolarHBondContact O-N 2.93Å; A324-A327 PolarHBondContact O-N 3.41Å; A324-A327 VanDerWaalsContact O-N 3.16Å; A327-G329 PolarHBondContact O-N 2.83Å
328D71.2Confident85.2Confident128 Ų12897.2 Ų97.268%0.68453%0.531SS*.THydrogen-bonded Turntrans-59.8-11.6176.6-86.2-14000112.8A324 A330A324-D328 WeakPolarHBondContact O-CB 3.37Å; A324-D328 PolarHBondContact O-N 2.78Å; D328-A330 PolarHBondContact O-N 3.36Å
329G79.3Confident85.2Confident25 Ų2596.5 Ų96.526%0.25853%0.529SS..  trans63.2-3173.300000113.5L326 A327 L332 A333L326-G329 PolarHBondContact O-N 2.96Å; A327-G329 PolarHBondContact O-N 2.83Å; G329-L332 CarbonylContact O-C 3.52Å; G329-L332 WeakPolarHBondContact O-CB 3.33Å; G329-L332 PolarHBondContact O-N 3.21Å; G329-L332 VanDerWaalsContact O-N 3.11Å; G329-A333 WeakPolarHBondContact O-CB 3.25Å; G329-A333 PolarHBondContact O-N 3.08Å
330A78.7Confident85.3Confident50 Ų5096.9 Ų96.941%0.41353%0.526SS..Hα-helixtrans-56.2-45.3178.500000112.8D328 A333 K334D328-A330 PolarHBondContact O-N 3.36Å; A330-A333 PolarHBondContact O-N 2.91Å; A330-K334 WeakPolarHBondContact O-CB 3.18Å; A330-K334 WeakPolarHBondContact O-CG 3.36Å; A330-K334 PolarHBondContact O-N 3.2Å
331P78.7Confident85.4Confident61 Ų6195 Ų9540%0.39652%0.52SS..Hα-helixtrans-65.2-40174.222.8-30.9000111.7C325 A333 K334 V335C325-P331 WeakPolarHBondContact O-CD 3.31Å; P331-A333 VanDerWaalsContact C-N 3.33Å; P331-A333 PolarHBondContact O-N 2.82Å; P331-K334 PolarHBondContact O-N 3.3Å; P331-V335 WeakPolarHBondContact O-CG2 3.33Å; P331-V335 PolarHBondContact O-N 3.33Å
332L81.4Confident85.7Confident130 Ų13094.4 Ų94.468%0.68152%0.52SS*.Hα-helixtrans-65-38.6176.5-174.765.5000111.6G329 V335 K336G329-L332 CarbonylContact O-C 3.52Å; G329-L332 WeakPolarHBondContact O-CB 3.33Å; G329-L332 PolarHBondContact O-N 3.21Å; G329-L332 VanDerWaalsContact O-N 3.11Å; L332-V335 PolarHBondContact O-N 2.88Å; L332-K336 VanDerWaalsContact O-CB 3.25Å; L332-K336 WeakPolarHBondContact O-CB 3.44Å; L332-K336 PolarHBondContact O-N 2.82Å
333A84.2Confident86.2Confident57 Ų5791.9 Ų91.947%0.47151%0.514SS..Hα-helixtrans-66.2-41.9175.300000111.3G329 A330 P331 K336 Q337G329-A333 WeakPolarHBondContact O-CB 3.25Å; G329-A333 PolarHBondContact O-N 3.08Å; A330-A333 PolarHBondContact O-N 2.91Å; P331-A333 VanDerWaalsContact C-N 3.33Å; P331-A333 PolarHBondContact O-N 2.82Å; A333-K336 PolarHBondContact O-N 3.42Å; A333-Q337 VanDerWaalsContact O-CB 3.31Å; A333-Q337 WeakPolarHBondContact O-CB 3.46Å; A333-Q337 PolarHBondContact O-N 3.46Å
334K86.1Confident86.6Confident160 Ų16093.3 Ų93.370%0.69651%0.514SS*.Hα-helixtrans-61.4-46172.8-76.7179.4-178.8178.60111.6A330 P331 Q337 A338A330-K334 WeakPolarHBondContact O-CB 3.18Å; A330-K334 WeakPolarHBondContact O-CG 3.36Å; A330-K334 PolarHBondContact O-N 3.2Å; P331-K334 PolarHBondContact O-N 3.3Å; K334-Q337 PolarHBondContact O-N 3.43Å; K334-A338 WeakPolarHBondContact O-CB 3.33Å; K334-A338 PolarHBondContact O-N 3.36Å
335V88.3Confident87.2Confident83 Ų8394.8 Ų94.850%0.50352%0.515SS..Hα-helixtrans-61.5-45175.2171.20000110.6P331 L332 Q337 A338 I339P331-V335 WeakPolarHBondContact O-CG2 3.33Å; P331-V335 PolarHBondContact O-N 3.33Å; L332-V335 PolarHBondContact O-N 2.88Å; V335-Q337 VanDerWaalsContact C-N 3.32Å; V335-Q337 PolarHBondContact O-N 3.11Å; V335-A338 PolarHBondContact O-N 3.01Å; V335-I339 HydrophobicContact CG1-CD1 3.88Å; V335-I339 VanDerWaalsContact O-CG1 3.28Å; V335-I339 WeakPolarHBondContact O-CG1 3.49Å; V335-I339 PolarHBondContact O-N 2.89Å
336K90.3Very high87.8Confident159 Ų15997.1 Ų97.169%0.69152%0.522SS*.Hα-helixtrans-62.4-38.8177.3-172.9177.4-179.9179.60112.2L332 A333 I339 K340L332-K336 VanDerWaalsContact O-CB 3.25Å; L332-K336 WeakPolarHBondContact O-CB 3.44Å; L332-K336 PolarHBondContact O-N 2.82Å; A333-K336 PolarHBondContact O-N 3.42Å; K336-I339 PolarHBondContact O-N 3.3Å; K336-K340 PolarHBondContact O-N 2.73Å
337Q91.6Very high88.6Confident89 Ų8996.6 Ų96.642%0.41652%0.52SS..Hα-helixtrans-67.2-46.3175.9-177.356.333.200111.1A333 K334 V335 I339 K340 D341A333-Q337 VanDerWaalsContact O-CB 3.31Å; A333-Q337 WeakPolarHBondContact O-CB 3.46Å; A333-Q337 PolarHBondContact O-N 3.46Å; K334-Q337 PolarHBondContact O-N 3.43Å; V335-Q337 VanDerWaalsContact C-N 3.32Å; V335-Q337 PolarHBondContact O-N 3.11Å; Q337-I339 VanDerWaalsContact C-N 3.3Å; Q337-I339 PolarHBondContact O-N 3.34Å; Q337-K340 WeakPolarHBondContact O-CA 3.47Å; Q337-K340 WeakPolarHBondContact O-CB 3.32Å; Q337-K340 PolarHBondContact O-N 2.93Å; Q337-D341 VanDerWaalsContact NE2-CG 3.32Å; Q337-D341 PolarHBondContact NE2-OD1 2.89Å; Q337-D341 VanDerWaalsContact NE2-OD1 3.08Å; Q337-D341 PolarHBondContact NE2-OD2 3.31Å; Q337-D341 PolarHBondContact O-N 3.01Å
338A93.9Very high89.2Confident52 Ų5296.2 Ų96.243%0.4351%0.509SS..Hα-helixtrans-58.5-41.3174.500000112.1K334 V335 K340 D341 L342K334-A338 WeakPolarHBondContact O-CB 3.33Å; K334-A338 PolarHBondContact O-N 3.36Å; V335-A338 PolarHBondContact O-N 3.01Å; A338-K340 VanDerWaalsContact C-N 3.32Å; A338-K340 PolarHBondContact O-N 3.5Å; A338-D341 PolarHBondContact O-N 2.96Å; A338-L342 WeakPolarHBondContact O-CB 3.35Å; A338-L342 WeakPolarHBondContact O-CG 3.39Å; A338-L342 PolarHBondContact O-N 3.25Å
339I94.4Very high90.4Very high83 Ų8396.3 Ų96.343%0.42650%0.503SS..Hα-helixtrans-62.1-39.9173.6-69.8166.8000111.2V335 K336 Q337 K343V335-I339 HydrophobicContact CG1-CD1 3.88Å; V335-I339 VanDerWaalsContact O-CG1 3.28Å; V335-I339 WeakPolarHBondContact O-CG1 3.49Å; V335-I339 PolarHBondContact O-N 2.89Å; K336-I339 PolarHBondContact O-N 3.3Å; Q337-I339 VanDerWaalsContact C-N 3.3Å; Q337-I339 PolarHBondContact O-N 3.34Å; I339-K343 HydrophobicContact CG2-CD 4.4Å; I339-K343 WeakPolarHBondContact O-CB 3.38Å; I339-K343 WeakPolarHBondContact O-CG 3.47Å; I339-K343 PolarHBondContact O-N 3.43Å
340K94.9Very high91.1Very high107 Ų10799.3 Ų99.347%0.46551%0.513SS..Hα-helixtrans-66.3-39.1178.6-172-179.3-179.4179.20111.8K336 Q337 A338 K343 R344K336-K340 PolarHBondContact O-N 2.73Å; Q337-K340 WeakPolarHBondContact O-CA 3.47Å; Q337-K340 WeakPolarHBondContact O-CB 3.32Å; Q337-K340 PolarHBondContact O-N 2.93Å; A338-K340 VanDerWaalsContact C-N 3.32Å; A338-K340 PolarHBondContact O-N 3.5Å; K340-K343 PolarHBondContact O-N 3Å; K340-R344 PolarHBondContact O-N 3.45Å; K340-R344 VanDerWaalsContact O-N 3.14Å
341D94.6Very high91.9Very high61 Ų61101.2 Ų101.233%0.32652%0.52SS..Hα-helixtrans-72.6-42.9178.9-64.1-26.8000110.9Q337 A338 K343 R344 D345Q337-D341 VanDerWaalsContact NE2-CG 3.32Å; Q337-D341 PolarHBondContact NE2-OD1 2.89Å; Q337-D341 VanDerWaalsContact NE2-OD1 3.08Å; Q337-D341 PolarHBondContact NE2-OD2 3.31Å; Q337-D341 PolarHBondContact O-N 3.01Å; A338-D341 PolarHBondContact O-N 2.96Å; D341-K343 VanDerWaalsContact C-N 3.26Å; D341-K343 PolarHBondContact O-N 2.91Å; D341-R344 WeakPolarHBondContact O-CA 3.46Å; D341-R344 WeakPolarHBondContact O-CB 3.44Å; D341-R344 PolarHBondContact O-N 2.91Å; D341-R344 IonicContact OD1-NH1 3.75Å; D341-R344 PolarHBondContact OD1-NH1 3.21Å; D341-D345 PolarHBondContact O-N 3.14Å
342L95.7Very high92.6Very high116 Ų116103.3 Ų103.361%0.60752%0.524SS*.Hα-helixtrans-56.3-39170.2-75.7174.7000112.6A338 R344 D345 L346A338-L342 WeakPolarHBondContact O-CB 3.35Å; A338-L342 WeakPolarHBondContact O-CG 3.39Å; A338-L342 PolarHBondContact O-N 3.25Å; L342-R344 VanDerWaalsContact C-N 3.34Å; L342-D345 PolarHBondContact O-N 2.95Å; L342-L346 WeakPolarHBondContact O-CB 3.28Å; L342-L346 PolarHBondContact O-N 3.48Å
343K96.1Very high93.2Very high141 Ų141101.2 Ų101.261%0.61351%0.513SS*.Hα-helixtrans-64.9-35.9174.7-78.5179.3178-173.10112.6I339 K340 D341 L347I339-K343 HydrophobicContact CG2-CD 4.4Å; I339-K343 WeakPolarHBondContact O-CB 3.38Å; I339-K343 WeakPolarHBondContact O-CG 3.47Å; I339-K343 PolarHBondContact O-N 3.43Å; K340-K343 PolarHBondContact O-N 3Å; D341-K343 VanDerWaalsContact C-N 3.26Å; D341-K343 PolarHBondContact O-N 2.91Å; K343-L347 WeakPolarHBondContact O-CG 3.49Å; K343-L347 PolarHBondContact O-N 2.9Å
344R95.7Very high93.8Very high126 Ų126101.8 Ų101.848%0.47551%0.511SS..Hα-helixtrans-67.8-45.5174.1-77.1-170.5178.8109.1-11.3111.3K340 D341 L342 L346 L347 V348K340-R344 PolarHBondContact O-N 3.45Å; K340-R344 VanDerWaalsContact O-N 3.14Å; D341-R344 WeakPolarHBondContact O-CA 3.46Å; D341-R344 WeakPolarHBondContact O-CB 3.44Å; D341-R344 PolarHBondContact O-N 2.91Å; D341-R344 IonicContact OD1-NH1 3.75Å; D341-R344 PolarHBondContact OD1-NH1 3.21Å; L342-R344 VanDerWaalsContact C-N 3.34Å; R344-L346 PolarHBondContact O-N 2.8Å; R344-L347 WeakPolarHBondContact O-CB 3.41Å; R344-L347 PolarHBondContact O-N 3.49Å; R344-L347 VanDerWaalsContact O-N 3.12Å; R344-V348 WeakPolarHBondContact O-CG2 3.42Å; R344-V348 PolarHBondContact O-N 3.4Å
345D95.9Very high94.2Very high83 Ų8397.4 Ų97.444%0.44450%0.497SS..Hα-helixtrans-60-39.2178.3-69.1-10.1000110.8D341 L342 L347 V348 F349D341-D345 PolarHBondContact O-N 3.14Å; L342-D345 PolarHBondContact O-N 2.95Å; D345-L347 PolarHBondContact O-N 3.35Å; D345-V348 PolarHBondContact O-N 3.12Å; D345-F349 HydrophobicContact CB-CD2 4.46Å; D345-F349 HydrophobicContact CB-CE2 4.17Å; D345-F349 WeakPolarHBondContact O-CB 3.45Å; D345-F349 WeakPolarHBondContact O-CD2 3.31Å; D345-F349 VanDerWaalsContact O-CG 3.31Å; D345-F349 WeakPolarHBondContact O-CG 3.16Å; D345-F349 PolarHBondContact O-N 2.95Å
346L94Very high94.4Very high118 Ų11897.1 Ų97.162%0.61850%0.496SS*.Hα-helixtrans-62.4-42.7175.5-150.3159.5000111.9L342 R344 V348 F349 D350L342-L346 WeakPolarHBondContact O-CB 3.28Å; L342-L346 PolarHBondContact O-N 3.48Å; R344-L346 PolarHBondContact O-N 2.8Å; L346-V348 PolarHBondContact O-N 3.21Å; L346-F349 PolarHBondContact O-N 3.44Å; L346-D350 WeakPolarHBondContact O-CB 3.39Å; L346-D350 PolarHBondContact O-N 2.99Å
347L94.4Very high94.6Very high117 Ų11793.8 Ų93.861%0.61348%0.483SS*.Hα-helixtrans-63.3-40.1173.8-71.4173000112.3K343 R344 D345 D350 V351K343-L347 WeakPolarHBondContact O-CG 3.49Å; K343-L347 PolarHBondContact O-N 2.9Å; R344-L347 WeakPolarHBondContact O-CB 3.41Å; R344-L347 PolarHBondContact O-N 3.49Å; R344-L347 VanDerWaalsContact O-N 3.12Å; D345-L347 PolarHBondContact O-N 3.35Å; L347-D350 PolarHBondContact O-N 3.31Å; L347-V351 WeakPolarHBondContact O-CG2 3.37Å; L347-V351 PolarHBondContact O-N 3.42Å
348V94.8Very high94.6Very high75 Ų7594.5 Ų94.546%0.45549%0.486SS..Hα-helixtrans-64.9-44.8176.3173.50000110.4R344 D345 L346 D350 V351 Q352R344-V348 WeakPolarHBondContact O-CG2 3.42Å; R344-V348 PolarHBondContact O-N 3.4Å; D345-V348 PolarHBondContact O-N 3.12Å; L346-V348 PolarHBondContact O-N 3.21Å; V348-D350 VanDerWaalsContact C-N 3.29Å; V348-D350 PolarHBondContact O-N 3.05Å; V348-V351 PolarHBondContact O-N 3.35Å; V348-Q352 HydrophobicContact CG1-CG 4.45Å; V348-Q352 VanDerWaalsContact O-CG 3.32Å; V348-Q352 WeakPolarHBondContact O-CG 3.47Å; V348-Q352 PolarHBondContact O-N 2.88Å
349F95Very high94.5Very high129 Ų12998.9 Ų98.957%0.56650%0.496SS*.Hα-helixtrans-62.9-35.3176-69.9-41.5000112.2D345 L346 Q352 L353D345-F349 HydrophobicContact CB-CD2 4.46Å; D345-F349 HydrophobicContact CB-CE2 4.17Å; D345-F349 WeakPolarHBondContact O-CB 3.45Å; D345-F349 WeakPolarHBondContact O-CD2 3.31Å; D345-F349 VanDerWaalsContact O-CG 3.31Å; D345-F349 WeakPolarHBondContact O-CG 3.16Å; D345-F349 PolarHBondContact O-N 2.95Å; L346-F349 PolarHBondContact O-N 3.44Å; F349-Q352 PolarHBondContact O-N 3.32Å; F349-L353 VanDerWaalsContact O-CB 3.26Å; F349-L353 WeakPolarHBondContact O-CB 3.29Å; F349-L353 PolarHBondContact O-N 2.89Å
350D95.5Very high94.4Very high88 Ų88100 Ų10047%0.47150%0.502SS..Hα-helixtrans-68.8-40.1176.8-157.230.5000111.9L346 L347 V348 L353 T354L346-D350 WeakPolarHBondContact O-CB 3.39Å; L346-D350 PolarHBondContact O-N 2.99Å; L347-D350 PolarHBondContact O-N 3.31Å; V348-D350 VanDerWaalsContact C-N 3.29Å; V348-D350 PolarHBondContact O-N 3.05Å; D350-L353 PolarHBondContact O-N 3.32Å; D350-T354 WeakPolarHBondContact O-CG2 3.4Å; D350-T354 PolarHBondContact O-N 3.1Å; D350-T354 PolarHBondContact O-OG1 2.9Å; D350-T354 VanDerWaalsContact O-OG1 3.1Å
351V93.6Very high94.3Very high91 Ų91100.4 Ų100.455%0.55250%0.504SS*.Hα-helixtrans-64.7-41.5171.5174.50000111.3L347 V348 L353 T354 V355L347-V351 WeakPolarHBondContact O-CG2 3.37Å; L347-V351 PolarHBondContact O-N 3.42Å; V348-V351 PolarHBondContact O-N 3.35Å; V351-L353 VanDerWaalsContact C-N 3.34Å; V351-T354 WeakPolarHBondContact CA-OG1 3.42Å; V351-T354 PolarHBondContact O-N 2.9Å; V351-T354 PolarHBondContact O-OG1 3.35Å; V351-V355 VanDerWaalsContact O-CG2 3.29Å; V351-V355 WeakPolarHBondContact O-CG2 3.32Å; V351-V355 PolarHBondContact O-N 2.89Å
352Q95Very high94.1Very high104 Ų104103.5 Ų103.549%0.48651%0.514SS..Hα-helixtrans-64.8-40.1175.5-72.1177.3-2.100111.4V348 F349 V355 T356V348-Q352 HydrophobicContact CG1-CG 4.45Å; V348-Q352 VanDerWaalsContact O-CG 3.32Å; V348-Q352 WeakPolarHBondContact O-CG 3.47Å; V348-Q352 PolarHBondContact O-N 2.88Å; F349-Q352 PolarHBondContact O-N 3.32Å; Q352-V355 PolarHBondContact O-N 2.85Å; Q352-T356 WeakPolarHBondContact O-CB 3.49Å; Q352-T356 VanDerWaalsContact O-CG2 3.31Å; Q352-T356 WeakPolarHBondContact O-CG2 3.31Å; Q352-T356 PolarHBondContact O-N 2.87Å; Q352-T356 PolarHBondContact O-OG1 2.89Å
353L94.1Very high93.8Very high86 Ų86100.2 Ų100.245%0.4550%0.504SS..Hα-helixtrans-61.8-47.2175.8-174.469.1000111.1F349 D350 V351 V355 T356 Q357F349-L353 VanDerWaalsContact O-CB 3.26Å; F349-L353 WeakPolarHBondContact O-CB 3.29Å; F349-L353 PolarHBondContact O-N 2.89Å; D350-L353 PolarHBondContact O-N 3.32Å; V351-L353 VanDerWaalsContact C-N 3.34Å; L353-V355 PolarHBondContact O-N 2.78Å; L353-T356 VanDerWaalsContact CA-OG1 3.31Å; L353-T356 WeakPolarHBondContact CA-OG1 3.42Å; L353-T356 PolarHBondContact O-N 3.46Å; L353-T356 PolarHBondContact O-OG1 3.36Å; L353-Q357 WeakPolarHBondContact O-CB 3.38Å; L353-Q357 VanDerWaalsContact O-CG 3.22Å; L353-Q357 WeakPolarHBondContact O-CG 3.35Å; L353-Q357 PolarHBondContact O-N 3.42Å
354T95.3Very high93.5Very high70 Ų7098.4 Ų98.443%0.42950%0.498SS..Hα-helixtrans-64.5-40.3177.651.70000112.5D350 V351 Q357 Q358D350-T354 WeakPolarHBondContact O-CG2 3.4Å; D350-T354 PolarHBondContact O-N 3.1Å; D350-T354 PolarHBondContact O-OG1 2.9Å; D350-T354 VanDerWaalsContact O-OG1 3.1Å; V351-T354 WeakPolarHBondContact CA-OG1 3.42Å; V351-T354 PolarHBondContact O-N 2.9Å; V351-T354 PolarHBondContact O-OG1 3.35Å; T354-Q357 PolarHBondContact O-N 3.48Å; T354-Q358 WeakPolarHBondContact O-CB 3.34Å; T354-Q358 PolarHBondContact O-N 2.83Å
355V94.6Very high93Very high67 Ų67101.9 Ų101.941%0.40651%0.511SS..Hα-helixtrans-65.6-42.6175.7170.60000111.6V351 Q352 L353 Q358 K359V351-V355 VanDerWaalsContact O-CG2 3.29Å; V351-V355 WeakPolarHBondContact O-CG2 3.32Å; V351-V355 PolarHBondContact O-N 2.89Å; Q352-V355 PolarHBondContact O-N 2.85Å; L353-V355 PolarHBondContact O-N 2.78Å; V355-Q358 PolarHBondContact O-N 3.34Å; V355-K359 HydrophobicContact CG1-CD 4.32Å; V355-K359 WeakPolarHBondContact O-CB 3.31Å; V355-K359 WeakPolarHBondContact O-CG 3.26Å; V355-K359 PolarHBondContact O-N 3.48Å
356T93.7Very high92.5Very high78 Ų78102 Ų10248%0.47951%0.511SS..Hα-helixtrans-65.8-41.9176.949.80000111.6Q352 L353 Q358 K359 L360Q352-T356 WeakPolarHBondContact O-CB 3.49Å; Q352-T356 VanDerWaalsContact O-CG2 3.31Å; Q352-T356 WeakPolarHBondContact O-CG2 3.31Å; Q352-T356 PolarHBondContact O-N 2.87Å; Q352-T356 PolarHBondContact O-OG1 2.89Å; L353-T356 VanDerWaalsContact CA-OG1 3.31Å; L353-T356 WeakPolarHBondContact CA-OG1 3.42Å; L353-T356 PolarHBondContact O-N 3.46Å; L353-T356 PolarHBondContact O-OG1 3.36Å; T356-Q358 PolarHBondContact O-N 3.45Å; T356-K359 PolarHBondContact O-N 3.21Å; T356-L360 WeakPolarHBondContact O-CB 3.48Å; T356-L360 PolarHBondContact O-N 2.89Å
357Q93.7Very high92.1Very high89 Ų89100.7 Ų100.742%0.41650%0.504SS..Hα-helixtrans-58.6-45.4170.8-74.6174-6.400111.5L353 T354 K359 L360 F361L353-Q357 WeakPolarHBondContact O-CB 3.38Å; L353-Q357 VanDerWaalsContact O-CG 3.22Å; L353-Q357 WeakPolarHBondContact O-CG 3.35Å; L353-Q357 PolarHBondContact O-N 3.42Å; T354-Q357 PolarHBondContact O-N 3.48Å; Q357-K359 PolarHBondContact O-N 2.9Å; Q357-L360 PolarHBondContact O-N 3.3Å; Q357-F361 HydrophobicContact CB-CE2 4.39Å; Q357-F361 WeakPolarHBondContact O-CD2 3.37Å; Q357-F361 WeakPolarHBondContact O-CG 3.22Å; Q357-F361 PolarHBondContact O-N 2.85Å
358Q92Very high91.5Very high103 Ų103100 Ų10048%0.48150%0.498SS..Hα-helixtrans-63.7-40.1177.6-175.862.850.500112.5T354 V355 T356 K362T354-Q358 WeakPolarHBondContact O-CB 3.34Å; T354-Q358 PolarHBondContact O-N 2.83Å; V355-Q358 PolarHBondContact O-N 3.34Å; T356-Q358 PolarHBondContact O-N 3.45Å; Q358-K362 WeakPolarHBondContact O-CB 3.16Å; Q358-K362 WeakPolarHBondContact O-CG 3.44Å; Q358-K362 PolarHBondContact O-N 3.35Å
359K92.4Very high90.5Very high145 Ų145104 Ų10463%0.6351%0.505SS*.Hα-helixtrans-63.9-42.4174.2-76.1179.6178.5-178.40111.1V355 T356 Q357 K362 A363V355-K359 HydrophobicContact CG1-CD 4.32Å; V355-K359 WeakPolarHBondContact O-CB 3.31Å; V355-K359 WeakPolarHBondContact O-CG 3.26Å; V355-K359 PolarHBondContact O-N 3.48Å; T356-K359 PolarHBondContact O-N 3.21Å; Q357-K359 PolarHBondContact O-N 2.9Å; K359-K362 PolarHBondContact O-N 3Å; K359-A363 WeakPolarHBondContact O-CB 3.46Å; K359-A363 PolarHBondContact O-N 2.85Å
360L91.3Very high89.7Confident106 Ų106103.8 Ų103.856%0.55551%0.506SS*.Hα-helixtrans-64.6-45.8177-175.8135.6000111.7T356 Q357 K362 A363 Q364T356-L360 WeakPolarHBondContact O-CB 3.48Å; T356-L360 PolarHBondContact O-N 2.89Å; Q357-L360 PolarHBondContact O-N 3.3Å; L360-K362 VanDerWaalsContact C-N 3.31Å; L360-K362 PolarHBondContact O-N 3.24Å; L360-A363 PolarHBondContact O-N 2.93Å; L360-Q364 WeakPolarHBondContact O-CB 3.5Å; L360-Q364 PolarHBondContact O-N 3.49Å
361F93.1Very high88.5Confident116 Ų116107.3 Ų107.351%0.50951%0.512SS..Hα-helixtrans-62.1-37.9175.2-74.5-51.2000112.6Q357 R365Q357-F361 HydrophobicContact CB-CE2 4.39Å; Q357-F361 WeakPolarHBondContact O-CD2 3.37Å; Q357-F361 WeakPolarHBondContact O-CG 3.22Å; Q357-F361 PolarHBondContact O-N 2.85Å; F361-R365 WeakPolarHBondContact O-CB 3.34Å; F361-R365 PolarHBondContact O-N 3.39Å
362K91.2Very high87.3Confident125 Ų125107.4 Ų107.454%0.54351%0.513SS..Hα-helixtrans-64.3-46173.2-77.6178.4178.1-176.80111.6Q358 K359 L360 Q364 R365 N366Q358-K362 WeakPolarHBondContact O-CB 3.16Å; Q358-K362 WeakPolarHBondContact O-CG 3.44Å; Q358-K362 PolarHBondContact O-N 3.35Å; K359-K362 PolarHBondContact O-N 3Å; L360-K362 VanDerWaalsContact C-N 3.31Å; L360-K362 PolarHBondContact O-N 3.24Å; K362-Q364 PolarHBondContact O-N 2.87Å; K362-R365 PolarHBondContact O-N 3.46Å; K362-N366 PolarHBondContact O-N 3.3Å; K362-N366 PolarHBondContact O-OD1 3.28Å
363A88.6Confident85.7Confident48 Ų48109.4 Ų109.440%0.39752%0.522SS..Hα-helixtrans-61.2-44176.400000111.6K359 L360 R365 N366 I367K359-A363 WeakPolarHBondContact O-CB 3.46Å; K359-A363 PolarHBondContact O-N 2.85Å; L360-A363 PolarHBondContact O-N 2.93Å; A363-R365 PolarHBondContact O-N 2.82Å; A363-N366 PolarHBondContact O-N 2.86Å; A363-I367 WeakPolarHBondContact O-CG1 3.38Å; A363-I367 PolarHBondContact O-N 3.01Å
364Q90.3Very high84Confident102 Ų102109.4 Ų109.448%0.47754%0.535SS..Hα-helixtrans-63.3-40.6176.9-169.2175.9-1.200111.9L360 K362 I367 Q368L360-Q364 WeakPolarHBondContact O-CB 3.5Å; L360-Q364 PolarHBondContact O-N 3.49Å; K362-Q364 PolarHBondContact O-N 2.87Å; Q364-I367 PolarHBondContact O-N 3.5Å; Q364-Q368 VanDerWaalsContact O-CG 3.26Å; Q364-Q368 WeakPolarHBondContact O-CG 3.47Å; Q364-Q368 PolarHBondContact O-N 3.22Å
365R85.3Confident81.7Confident200 Ų200117.7 Ų117.776%0.75557%0.566SS**Hα-helixtrans-65.2-39.6172.8-83.4-172173.9173.2-0.2112.8F361 K362 A363 Q368 R369F361-R365 WeakPolarHBondContact O-CB 3.34Å; F361-R365 PolarHBondContact O-N 3.39Å; K362-R365 PolarHBondContact O-N 3.46Å; A363-R365 PolarHBondContact O-N 2.82Å; R365-Q368 PolarHBondContact O-N 3.1Å; R365-R369 WeakPolarHBondContact O-CB 3.41Å; R365-R369 PolarHBondContact O-N 3.44Å
366N85.5Confident81Confident85 Ų85120.3 Ų120.346%0.45557%0.574SS.*Hα-helixtrans-63.4-45.2176.5-74.6-0.5000111K362 A363 Q368 R369 E370K362-N366 PolarHBondContact O-N 3.3Å; K362-N366 PolarHBondContact O-OD1 3.28Å; A363-N366 PolarHBondContact O-N 2.86Å; N366-Q368 VanDerWaalsContact C-N 3.29Å; N366-Q368 PolarHBondContact O-N 2.85Å; N366-R369 PolarHBondContact O-N 3.04Å; N366-R369 VanDerWaalsContact O-N 3.1Å; N366-E370 WeakPolarHBondContact O-CG 3.44Å; N366-E370 PolarHBondContact O-N 3.36Å
367I84.7Confident80.4Confident90 Ų90122.5 Ų122.546%0.46258%0.579SS.*Hα-helixtrans-59.8-40.1174.7-66.8164.9000111.2A363 Q364 R371A363-I367 WeakPolarHBondContact O-CG1 3.38Å; A363-I367 PolarHBondContact O-N 3.01Å; Q364-I367 PolarHBondContact O-N 3.5Å; I367-R371 WeakPolarHBondContact O-CG 3.26Å; I367-R371 PolarHBondContact O-N 2.94Å
368Q80.9Confident79.6Confident103 Ų103124.3 Ų124.348%0.48159%0.588SS.*Hα-helixtrans-65.9-39.9175-71.3-71.8-11.500112Q364 R365 N366 R371 T372Q364-Q368 VanDerWaalsContact O-CG 3.26Å; Q364-Q368 WeakPolarHBondContact O-CG 3.47Å; Q364-Q368 PolarHBondContact O-N 3.22Å; R365-Q368 PolarHBondContact O-N 3.1Å; N366-Q368 VanDerWaalsContact C-N 3.29Å; N366-Q368 PolarHBondContact O-N 2.85Å; Q368-R371 WeakPolarHBondContact O-CB 3.32Å; Q368-R371 PolarHBondContact O-N 3.47Å; Q368-T372 PolarHBondContact O-N 3.17Å; Q368-T372 PolarHBondContact O-OG1 2.92Å
369R75.1Confident78.9Confident158 Ų158125.6 Ų125.660%0.59659%0.594SS**Hα-helixtrans-66.7-44.4177.7-171.9-178.5-90.3159.9-12.6111.7R365 N366 R371 T372 E373R365-R369 WeakPolarHBondContact O-CB 3.41Å; R365-R369 PolarHBondContact O-N 3.44Å; N366-R369 PolarHBondContact O-N 3.04Å; N366-R369 VanDerWaalsContact O-N 3.1Å; R369-R371 VanDerWaalsContact C-N 3.25Å; R369-R371 PolarHBondContact O-N 3Å; R369-T372 WeakPolarHBondContact CA-OG1 3.43Å; R369-T372 PolarHBondContact O-N 3.31Å; R369-T372 PolarHBondContact O-OG1 3.04Å; R369-E373 PolarHBondContact O-N 3.36Å
370E77.2Confident78.1Confident126 Ų126124.4 Ų124.459%0.58959%0.592SS**Hα-helixtrans-59-38.2173.4-73.9172.5-175.800111.4N366 E373 A374N366-E370 WeakPolarHBondContact O-CG 3.44Å; N366-E370 PolarHBondContact O-N 3.36Å; E370-E373 PolarHBondContact O-N 3.35Å; E370-A374 WeakPolarHBondContact O-CB 3.47Å; E370-A374 PolarHBondContact O-N 2.76Å
371R71.1Confident77.2Confident161 Ų161125.6 Ų125.661%0.60859%0.594SS**Hα-helixtrans-65.8-36.5173-80.2-179173.2-173-2.1113.1I367 Q368 R369 F375I367-R371 WeakPolarHBondContact O-CG 3.26Å; I367-R371 PolarHBondContact O-N 2.94Å; Q368-R371 WeakPolarHBondContact O-CB 3.32Å; Q368-R371 PolarHBondContact O-N 3.47Å; R369-R371 VanDerWaalsContact C-N 3.25Å; R369-R371 PolarHBondContact O-N 3Å; R371-F375 WeakPolarHBondContact O-CD2 3.44Å
372T69Low76Confident94 Ų94126.3 Ų126.358%0.57760%0.6SS**Hα-helixtrans-77-24177.251.80000113.7Q368 R369Q368-T372 PolarHBondContact O-N 3.17Å; Q368-T372 PolarHBondContact O-OG1 2.92Å; R369-T372 WeakPolarHBondContact CA-OG1 3.43Å; R369-T372 PolarHBondContact O-N 3.31Å; R369-T372 PolarHBondContact O-OG1 3.04Å
373E60.9Low74.9Confident145 Ų145126.4 Ų126.468%0.67860%0.604SS**Hα-helixtrans-83.9-12.9174.8-72174.1-171.200112.7R369 E370R369-E373 PolarHBondContact O-N 3.36Å; E370-E373 PolarHBondContact O-N 3.35Å
374A58.1Low73.7Confident86 Ų86132.9 Ų132.971%0.71162%0.622SS**THydrogen-bonded Turntrans-89.91.8174.800000114.2E370E370-A374 WeakPolarHBondContact O-CB 3.47Å; E370-A374 PolarHBondContact O-N 2.76Å
375F46.8Very low72.2Confident245 Ų245135.7 Ų135.7100%1.07564%0.635SS**  trans-113.50170.5-85.2-83.3000109.5R371R371-F375 WeakPolarHBondContact O-CD2 3.44Å

Retrieved 375 of 375 residues in 85.1 ms (Link to these results)