A0A087X002_HUMAN Loading...

NBPF member 10

AlphaFold DB , UniProt , Accession A0A087X002, Species HUMAN (Homo sapiens, Human), Gene NBPF10, Length 750 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
1M39.1Very low40.9Very low228 Ų228130.3 Ų130.3100%1.12376%0.763SS**  0131.40-73.5152.561.700107.8
2V35.1Very low41.2Very low138 Ų138132.8 Ų132.884%0.83676%0.757SS**  trans-92.5124164.1176.70000106.2
3V37Very low41.8Very low126 Ų126126.6 Ų126.676%0.76473%0.733SS**  trans-92.3103.3174.71790000107.4A5V3-A5 PolarHBondContact O-N 3.39Å
4S37Very low42.4Very low108 Ų108125.1 Ų125.176%0.75572%0.716SS**  trans-69.6114.4173-58.20000109.5G6S4-G6 PolarHBondContact O-N 3.32Å
5A39.3Very low42.8Very low99 Ų99125.9 Ų125.982%0.81871%0.713SS**  trans-69.4111.2164.600000108.2V3V3-A5 PolarHBondContact O-N 3.39Å
6G38.3Very low43.3Very low58 Ų58123.3 Ų123.360%0.59870%0.696SS**PPolyproline II helixtrans-66.4147.4172.500000110.9S4 W8S4-G6 PolarHBondContact O-N 3.32Å; G6-W8 PolarHBondContact O-N 3.44Å
7P40.6Very low43.7Very low129 Ų129121.8 Ų121.884%0.83869%0.685SS**PPolyproline II helixtrans-64.1130.417727.4-33.8000110.3S9P7-S9 PolarHBondContact O-N 3.16Å
8W42Very low44.3Very low257 Ų257122 Ų12297%0.97368%0.683SS**PPolyproline II helixtrans-64.7128.8160.9-80.2-10.4000108.4G6 S10G6-W8 PolarHBondContact O-N 3.44Å; W8-S10 PolarHBondContact O-N 3.07Å
9S45.9Very low44.7Very low67 Ų67121.9 Ų121.947%0.46968%0.677SS.*PPolyproline II helixtrans-65.7120.5176.646.70000110.1P7 E11 K12P7-S9 PolarHBondContact O-N 3.16Å; S9-E11 PolarHBondContact O-N 3.06Å; S9-K12 PolarHBondContact O-N 3.06Å; S9-K12 VanDerWaalsContact O-N 3.1Å
10S52Low45.1Very low76 Ų76119.8 Ų119.853%0.53166%0.663SS.*Hα-helixtrans-59.3-40.3-178.5710000111.1W8 K12 A13 E14W8-S10 PolarHBondContact O-N 3.07Å; S10-K12 PolarHBondContact O-N 3.32Å; S10-K12 VanDerWaalsContact O-N 3.12Å; S10-A13 CarbonylContact O-C 3.5Å; S10-A13 WeakPolarHBondContact O-CA 3.49Å; S10-A13 WeakPolarHBondContact O-CB 3.38Å; S10-A13 PolarHBondContact O-N 3.38Å; S10-E14 WeakPolarHBondContact CB-OE1 3.45Å; S10-E14 WeakPolarHBondContact O-CG 3.35Å; S10-E14 PolarHBondContact O-N 3Å; S10-E14 PolarHBondContact OG-OE1 2.94Å
11E44Very low45.6Very low147 Ų147117.6 Ų117.669%0.68765%0.651SS**Hα-helixtrans-43.3-42.4171-168.4174.2-130.700113.8S9 M15S9-E11 PolarHBondContact O-N 3.06Å; E11-M15 VanDerWaalsContact O-CB 3.24Å; E11-M15 WeakPolarHBondContact O-CB 3.25Å; E11-M15 PolarHBondContact O-N 3.39Å
12K44.8Very low46.5Very low160 Ų160114 Ų11470%0.69663%0.631SS**Hα-helixtrans-77.9-23.3178.5-170.7167.1-176.1171.70113.4S9 S10 N16S9-K12 PolarHBondContact O-N 3.06Å; S9-K12 VanDerWaalsContact O-N 3.1Å; S10-K12 PolarHBondContact O-N 3.32Å; S10-K12 VanDerWaalsContact O-N 3.12Å; K12-N16 WeakPolarHBondContact O-CB 3.48Å
13A48.4Very low47.5Very low53 Ų53110.9 Ų110.944%0.43861%0.612SS.*Hα-helixtrans-80.2-39.9169.800000111.3S10 N16 I17S10-A13 CarbonylContact O-C 3.5Å; S10-A13 WeakPolarHBondContact O-CA 3.49Å; S10-A13 WeakPolarHBondContact O-CB 3.38Å; S10-A13 PolarHBondContact O-N 3.38Å; A13-N16 PolarHBondContact O-N 3.11Å; A13-I17 WeakPolarHBondContact O-CB 3.26Å; A13-I17 WeakPolarHBondContact O-CD1 3.31Å; A13-I17 VanDerWaalsContact O-CG1 3.24Å; A13-I17 WeakPolarHBondContact O-CG1 3.36Å; A13-I17 PolarHBondContact O-N 2.61Å
14E50.1Low48.2Very low106 Ų106109.1 Ų109.150%0.49560%0.599SS.*Hα-helixtrans-65.2-45.7178.8-71.1164.5-135.700111.9S10 N16 I17 L18S10-E14 WeakPolarHBondContact CB-OE1 3.45Å; S10-E14 WeakPolarHBondContact O-CG 3.35Å; S10-E14 PolarHBondContact O-N 3Å; S10-E14 PolarHBondContact OG-OE1 2.94Å; E14-N16 VanDerWaalsContact C-N 3.3Å; E14-N16 PolarHBondContact O-N 3.24Å; E14-I17 PolarHBondContact O-N 3.3Å; E14-L18 PolarHBondContact O-N 2.85Å
15M47.9Very low48.8Very low137 Ų137112.8 Ų112.868%0.67560%0.596SS**Hα-helixtrans-58.2-41.8173.7-176.5175.6172.400111.9E11 L18 E19E11-M15 VanDerWaalsContact O-CB 3.24Å; E11-M15 WeakPolarHBondContact O-CB 3.25Å; E11-M15 PolarHBondContact O-N 3.39Å; M15-L18 PolarHBondContact O-N 3.08Å; M15-E19 WeakPolarHBondContact O-CB 3.17Å; M15-E19 PolarHBondContact O-N 3.37Å
16N51.5Low49.3Very low83 Ų83112 Ų11244%0.44458%0.582SS.*Hα-helixtrans-69.3-38.1176.5-162.8-14000111.6K12 A13 E14 L18 E19 I20K12-N16 WeakPolarHBondContact O-CB 3.48Å; A13-N16 PolarHBondContact O-N 3.11Å; E14-N16 VanDerWaalsContact C-N 3.3Å; E14-N16 PolarHBondContact O-N 3.24Å; N16-L18 VanDerWaalsContact C-N 3.33Å; N16-L18 PolarHBondContact O-N 3.41Å; N16-E19 PolarHBondContact O-N 3.46Å; N16-I20 VanDerWaalsContact O-CB 3.25Å; N16-I20 WeakPolarHBondContact O-CB 3.33Å; N16-I20 WeakPolarHBondContact O-CD1 3.23Å; N16-I20 WeakPolarHBondContact O-CG1 3.5Å; N16-I20 PolarHBondContact O-N 2.89Å; N16-I20 VanDerWaalsContact OD1-CD1 3.24Å; N16-I20 WeakPolarHBondContact OD1-CD1 3.29Å
17I50.6Low49.5Very low98 Ų98114.1 Ų114.150%0.50358%0.577SS.*Hα-helixtrans-65.1-35.9173.1-72.2163.5000111.4A13 E14 N21A13-I17 WeakPolarHBondContact O-CB 3.26Å; A13-I17 WeakPolarHBondContact O-CD1 3.31Å; A13-I17 VanDerWaalsContact O-CG1 3.24Å; A13-I17 WeakPolarHBondContact O-CG1 3.36Å; A13-I17 PolarHBondContact O-N 2.61Å; E14-I17 PolarHBondContact O-N 3.3Å; I17-N21 WeakPolarHBondContact O-CB 3.14Å; I17-N21 PolarHBondContact O-N 3.12Å; I17-N21 PolarHBondContact O-ND2 2.69Å
18L53.3Low49.9Very low126 Ų126112.8 Ų112.866%0.6656%0.562SS**Hα-helixtrans-65.8-51.4173.5-93.9162.5000111.6E14 M15 N16 I20 N21 E22E14-L18 PolarHBondContact O-N 2.85Å; M15-L18 PolarHBondContact O-N 3.08Å; N16-L18 VanDerWaalsContact C-N 3.33Å; N16-L18 PolarHBondContact O-N 3.41Å; L18-I20 VanDerWaalsContact C-N 3.34Å; L18-I20 PolarHBondContact O-N 3.36Å; L18-N21 PolarHBondContact O-N 2.85Å; L18-E22 WeakPolarHBondContact O-CB 3.46Å; L18-E22 PolarHBondContact O-N 2.91Å
19E51.8Low50.4Low120 Ų120102.8 Ų102.856%0.56153%0.534SS*.Hα-helixtrans-59.7-41.2177.8-172.6175.4-166.400112.1M15 N16 E22 T23M15-E19 WeakPolarHBondContact O-CB 3.17Å; M15-E19 PolarHBondContact O-N 3.37Å; N16-E19 PolarHBondContact O-N 3.46Å; E19-E22 PolarHBondContact O-N 2.92Å; E19-T23 WeakPolarHBondContact O-CB 3.42Å; E19-T23 WeakPolarHBondContact O-CG2 3.24Å; E19-T23 PolarHBondContact O-N 2.8Å; E19-T23 PolarHBondContact O-OG1 3.35Å
20I54Low50.6Low79 Ų79104.6 Ų104.641%0.40554%0.535SS..Hα-helixtrans-65.2-40172.7-71.9169.3000111.4N16 L18 T23 L24N16-I20 VanDerWaalsContact O-CB 3.25Å; N16-I20 WeakPolarHBondContact O-CB 3.33Å; N16-I20 WeakPolarHBondContact O-CD1 3.23Å; N16-I20 WeakPolarHBondContact O-CG1 3.5Å; N16-I20 PolarHBondContact O-N 2.89Å; N16-I20 VanDerWaalsContact OD1-CD1 3.24Å; N16-I20 WeakPolarHBondContact OD1-CD1 3.29Å; L18-I20 VanDerWaalsContact C-N 3.34Å; L18-I20 PolarHBondContact O-N 3.36Å; I20-T23 WeakPolarHBondContact CA-OG1 3.47Å; I20-T23 PolarHBondContact O-OG1 2.87Å; I20-L24 HydrophobicContact CG2-CD1 3.56Å; I20-L24 HydrophobicContact CG2-CG 4.16Å; I20-L24 WeakPolarHBondContact O-CB 3.25Å; I20-L24 WeakPolarHBondContact O-CG 3.28Å; I20-L24 PolarHBondContact O-N 2.88Å
21N55.4Low50.4Low75 Ų75106.9 Ų106.940%0.40154%0.535SS..Hα-helixtrans-68.4-38.1176.2-90.6-78.1000112.6I17 L18 R25I17-N21 WeakPolarHBondContact O-CB 3.14Å; I17-N21 PolarHBondContact O-N 3.12Å; I17-N21 PolarHBondContact O-ND2 2.69Å; L18-N21 PolarHBondContact O-N 2.85Å; N21-R25 VanDerWaalsContact O-CB 3.27Å; N21-R25 WeakPolarHBondContact O-CB 3.34Å; N21-R25 VanDerWaalsContact O-CG 3.23Å; N21-R25 WeakPolarHBondContact O-CG 3.22Å; N21-R25 PolarHBondContact O-N 2.9Å
22E57.3Low50.7Low152 Ų152104.9 Ų104.971%0.7152%0.524SS*.Hα-helixtrans-69.4-37.7178.8-173160.5-132.700111.8L18 E19 P26L18-E22 WeakPolarHBondContact O-CB 3.46Å; L18-E22 PolarHBondContact O-N 2.91Å; E19-E22 PolarHBondContact O-N 2.92Å; E22-P26 WeakPolarHBondContact O-CD 3.39Å; E22-P26 WeakPolarHBondContact O-CG 3.15Å
23T55.5Low50.8Low72 Ų72103.3 Ų103.344%0.44252%0.52SS..Hα-helixtrans-78.1-33.3175.1530000113.8E19 I20 Q27E19-T23 WeakPolarHBondContact O-CB 3.42Å; E19-T23 WeakPolarHBondContact O-CG2 3.24Å; E19-T23 PolarHBondContact O-N 2.8Å; E19-T23 PolarHBondContact O-OG1 3.35Å; I20-T23 WeakPolarHBondContact CA-OG1 3.47Å; I20-T23 PolarHBondContact O-OG1 2.87Å; T23-Q27 WeakPolarHBondContact O-CG 3.36Å; T23-Q27 PolarHBondContact O-NE2 3.43Å
24L52.2Low50.3Low90 Ų90104.4 Ų104.447%0.47152%0.515SS..Hα-helixtrans-82.6-27.7178.8-70.1179.8000114.3I20 Q27 L28I20-L24 HydrophobicContact CG2-CD1 3.56Å; I20-L24 HydrophobicContact CG2-CG 4.16Å; I20-L24 WeakPolarHBondContact O-CB 3.25Å; I20-L24 WeakPolarHBondContact O-CG 3.28Å; I20-L24 PolarHBondContact O-N 2.88Å; L24-Q27 PolarHBondContact O-N 2.69Å; L24-L28 VanDerWaalsContact O-CB 3.32Å; L24-L28 WeakPolarHBondContact O-CB 3.19Å; L24-L28 PolarHBondContact O-N 2.83Å
25R50.9Low50Low185 Ų185105.8 Ų105.870%0.69852%0.52SS*.Hα-helixtrans-58.4-49.2178.1-87.2174.7178.6-174.12.9113N21 L28 A29N21-R25 VanDerWaalsContact O-CB 3.27Å; N21-R25 WeakPolarHBondContact O-CB 3.34Å; N21-R25 VanDerWaalsContact O-CG 3.23Å; N21-R25 WeakPolarHBondContact O-CG 3.22Å; N21-R25 PolarHBondContact O-N 2.9Å; R25-L28 PolarHBondContact O-N 3.45Å; R25-A29 WeakPolarHBondContact O-CB 3.15Å; R25-A29 PolarHBondContact O-N 3.3Å
26P49.2Very low49.9Very low81 Ų81102.3 Ų102.353%0.52650%0.499SS..Hα-helixtrans-59.6-45.3173.6-24.334.3000112.1E22 L28 A29 E30E22-P26 WeakPolarHBondContact O-CD 3.39Å; E22-P26 WeakPolarHBondContact O-CG 3.15Å; P26-L28 PolarHBondContact O-N 3.26Å; P26-A29 PolarHBondContact O-N 3.18Å; P26-E30 WeakPolarHBondContact O-CB 3.41Å; P26-E30 PolarHBondContact O-N 3.45Å
27Q41.4Very low49.4Very low104 Ų104100 Ų10049%0.48649%0.49SS..Hα-helixtrans-63.9-39-180-66.3179.252.900112.2T23 L24 E30 K31T23-Q27 WeakPolarHBondContact O-CG 3.36Å; T23-Q27 PolarHBondContact O-NE2 3.43Å; L24-Q27 PolarHBondContact O-N 2.69Å; Q27-E30 PolarHBondContact O-N 2.84Å; Q27-K31 VanDerWaalsContact O-CB 3.32Å; Q27-K31 WeakPolarHBondContact O-CB 3.33Å; Q27-K31 WeakPolarHBondContact O-CG 3.47Å; Q27-K31 PolarHBondContact O-N 3.28Å
28L50.6Low49.1Very low100 Ų100100.9 Ų100.952%0.52450%0.495SS..Hα-helixtrans-69.5-39.7176.2-17960.9000111.7L24 R25 P26 K32L24-L28 VanDerWaalsContact O-CB 3.32Å; L24-L28 WeakPolarHBondContact O-CB 3.19Å; L24-L28 PolarHBondContact O-N 2.83Å; R25-L28 PolarHBondContact O-N 3.45Å; P26-L28 PolarHBondContact O-N 3.26Å; L28-K32 HydrophobicContact CD1-CG 4.43Å; L28-K32 HydrophobicContact CG-CD 4.36Å; L28-K32 WeakPolarHBondContact O-CB 3.41Å; L28-K32 VanDerWaalsContact O-CG 3.26Å; L28-K32 WeakPolarHBondContact O-CG 3.26Å; L28-K32 PolarHBondContact O-N 2.87Å
29A51.3Low48.8Very low47 Ų4798.6 Ų98.639%0.38848%0.48SS..Hα-helixtrans-62.4-46173.100000110.9R25 P26 K32 Q33R25-A29 WeakPolarHBondContact O-CB 3.15Å; R25-A29 PolarHBondContact O-N 3.3Å; P26-A29 PolarHBondContact O-N 3.18Å; A29-K32 PolarHBondContact O-N 2.87Å; A29-Q33 WeakPolarHBondContact O-CB 3.3Å; A29-Q33 PolarHBondContact O-N 2.89Å
30E50.7Low48.6Very low105 Ų10596.2 Ų96.249%0.49147%0.469SS..Hα-helixtrans-62.4-46.7176.3-158.6-152.6162.700111.3P26 Q27 K32 Q33 Q34P26-E30 WeakPolarHBondContact O-CB 3.41Å; P26-E30 PolarHBondContact O-N 3.45Å; Q27-E30 PolarHBondContact O-N 2.84Å; E30-K32 PolarHBondContact O-N 3.48Å; E30-Q33 CarbonylContact O-C 3.5Å; E30-Q33 WeakPolarHBondContact O-CA 3.35Å; E30-Q33 WeakPolarHBondContact O-CB 3.48Å; E30-Q33 PolarHBondContact O-N 3.2Å; E30-Q34 VanDerWaalsContact CD-NE2 3.26Å; E30-Q34 HydrophobicContact CG-CG 4.49Å; E30-Q34 WeakPolarHBondContact O-CB 3.24Å; E30-Q34 WeakPolarHBondContact O-CG 3.38Å; E30-Q34 PolarHBondContact O-N 2.8Å; E30-Q34 PolarHBondContact OE1-NE2 3.32Å
31K46.4Very low48.4Very low124 Ų12498.3 Ų98.354%0.53948%0.475SS..Hα-helixtrans-63.5-40.2177.6-71.3-73163-1620112.2Q27 Q33 Q34 F35Q27-K31 VanDerWaalsContact O-CB 3.32Å; Q27-K31 WeakPolarHBondContact O-CB 3.33Å; Q27-K31 WeakPolarHBondContact O-CG 3.47Å; Q27-K31 PolarHBondContact O-N 3.28Å; K31-Q33 VanDerWaalsContact C-N 3.32Å; K31-Q33 PolarHBondContact O-N 2.95Å; K31-Q34 PolarHBondContact O-N 3.42Å; K31-F35 VanDerWaalsContact O-CB 3.32Å; K31-F35 WeakPolarHBondContact O-CB 3.25Å; K31-F35 PolarHBondContact O-N 3.01Å
32K50.6Low47.8Very low106 Ų10697.7 Ų97.746%0.46148%0.476SS..Hα-helixtrans-61.2-39.5170.3-75.6175.2177.8-176.30111.5L28 A29 E30 R36L28-K32 HydrophobicContact CD1-CG 4.43Å; L28-K32 HydrophobicContact CG-CD 4.36Å; L28-K32 WeakPolarHBondContact O-CB 3.41Å; L28-K32 VanDerWaalsContact O-CG 3.26Å; L28-K32 WeakPolarHBondContact O-CG 3.26Å; L28-K32 PolarHBondContact O-N 2.87Å; A29-K32 PolarHBondContact O-N 2.87Å; E30-K32 PolarHBondContact O-N 3.48Å; K32-R36 WeakPolarHBondContact O-CB 3.3Å; K32-R36 VanDerWaalsContact O-CG 3.26Å; K32-R36 WeakPolarHBondContact O-CG 3.45Å; K32-R36 PolarHBondContact O-N 2.95Å; K32-R36 PolarHBondContact O-NE 3.34Å
33Q47.4Very low47.3Very low127 Ų12794.1 Ų94.159%0.59346%0.458SS*.Hα-helixtrans-72.2-39177.2-173.5167.3-17.100112.9A29 E30 K31 R36 S37A29-Q33 WeakPolarHBondContact O-CB 3.3Å; A29-Q33 PolarHBondContact O-N 2.89Å; E30-Q33 CarbonylContact O-C 3.5Å; E30-Q33 WeakPolarHBondContact O-CA 3.35Å; E30-Q33 WeakPolarHBondContact O-CB 3.48Å; E30-Q33 PolarHBondContact O-N 3.2Å; K31-Q33 VanDerWaalsContact C-N 3.32Å; K31-Q33 PolarHBondContact O-N 2.95Å; Q33-R36 PolarHBondContact O-N 3.16Å; Q33-S37 PolarHBondContact O-N 3.04Å
34Q38.8Very low47.3Very low75 Ų7593.5 Ų93.535%0.3545%0.451SS..Hα-helixtrans-59.6-49.4171.8-73177.96.800110.1E30 K31 S37 L38E30-Q34 VanDerWaalsContact CD-NE2 3.26Å; E30-Q34 HydrophobicContact CG-CG 4.49Å; E30-Q34 WeakPolarHBondContact O-CB 3.24Å; E30-Q34 WeakPolarHBondContact O-CG 3.38Å; E30-Q34 PolarHBondContact O-N 2.8Å; E30-Q34 PolarHBondContact OE1-NE2 3.32Å; K31-Q34 PolarHBondContact O-N 3.42Å; Q34-S37 PolarHBondContact O-N 3.28Å; Q34-S37 PolarHBondContact O-OG 3.03Å; Q34-L38 WeakPolarHBondContact O-CB 3.23Å; Q34-L38 PolarHBondContact O-N 2.6Å
35F42.9Very low47.2Very low135 Ų13593.9 Ų93.959%0.59246%0.458SS*.Hα-helixtrans-62.3-43.8176.4-174.4-102.1000112.4K31 S37 L38 K39K31-F35 VanDerWaalsContact O-CB 3.32Å; K31-F35 WeakPolarHBondContact O-CB 3.25Å; K31-F35 PolarHBondContact O-N 3.01Å; F35-S37 PolarHBondContact O-N 2.95Å; F35-L38 PolarHBondContact O-N 3.47Å; F35-K39 HydrophobicContact CE1-CD 4.48Å; F35-K39 VanDerWaalsContact O-CB 3.31Å; F35-K39 WeakPolarHBondContact O-CB 3.29Å; F35-K39 PolarHBondContact O-N 2.83Å
36R45.7Very low47Very low64 Ų6490.2 Ų90.224%0.24245%0.449CS..Hα-helixtrans-58.8-45.6172.4-78-177.2-77.8-141.86.2111.6K32 Q33 L38 K39 E40 E351K32-R36 WeakPolarHBondContact O-CB 3.3Å; K32-R36 VanDerWaalsContact O-CG 3.26Å; K32-R36 WeakPolarHBondContact O-CG 3.45Å; K32-R36 PolarHBondContact O-N 2.95Å; K32-R36 PolarHBondContact O-NE 3.34Å; Q33-R36 PolarHBondContact O-N 3.16Å; R36-L38 VanDerWaalsContact C-N 3.34Å; R36-L38 PolarHBondContact O-N 3.42Å; R36-K39 PolarHBondContact O-N 2.83Å; R36-E40 PolarHBondContact O-N 3.33Å; R36-E351 IonicContact CZ-OE1 3.84Å; R36-E351 IonicContact CZ-OE2 3.87Å; R36-E351 IonicContact NH1-OE1 2.79Å; R36-E351 PolarHBondContact NH1-OE1 2.72Å; R36-E351 IonicContact NH1-OE2 2.64Å; R36-E351 PolarHBondContact NH1-OE2 2.77Å
37S42.2Very low47.1Very low36 Ų3689.5 Ų89.525%0.25244%0.44SS..Hα-helixtrans-65.3-35.7176.2101.40000112.6Q33 Q34 F35 K41Q33-S37 PolarHBondContact O-N 3.04Å; Q34-S37 PolarHBondContact O-N 3.28Å; Q34-S37 PolarHBondContact O-OG 3.03Å; F35-S37 PolarHBondContact O-N 2.95Å; S37-K41 VanDerWaalsContact O-CB 3.29Å; S37-K41 WeakPolarHBondContact O-CB 3.38Å; S37-K41 VanDerWaalsContact O-CD 3.3Å; S37-K41 WeakPolarHBondContact O-CD 3.42Å; S37-K41 WeakPolarHBondContact O-CG 3.39Å; S37-K41 PolarHBondContact O-N 3.44Å; S37-K41 PolarHBondContact OG-NZ 3.05Å
38L43.4Very low47.7Very low115 Ų11587 Ų8760%0.60244%0.437SS*.Hα-helixtrans-69.9-39.6178.1-170.166.6000110.9Q34 F35 R36 K41 C42Q34-L38 WeakPolarHBondContact O-CB 3.23Å; Q34-L38 PolarHBondContact O-N 2.6Å; F35-L38 PolarHBondContact O-N 3.47Å; R36-L38 VanDerWaalsContact C-N 3.34Å; R36-L38 PolarHBondContact O-N 3.42Å; L38-K41 PolarHBondContact O-N 3.43Å; L38-C42 VanDerWaalsContact O-CB 3.27Å; L38-C42 WeakPolarHBondContact O-CB 3.5Å; L38-C42 PolarHBondContact O-N 2.92Å
39K47Very low47.8Very low79 Ų7983.8 Ų83.834%0.34343%0.428SS..Hα-helixtrans-64.2-45.8173.8-171.8170177.6-175.30111.2F35 R36 C42 F43 N344F35-K39 HydrophobicContact CE1-CD 4.48Å; F35-K39 VanDerWaalsContact O-CB 3.31Å; F35-K39 WeakPolarHBondContact O-CB 3.29Å; F35-K39 PolarHBondContact O-N 2.83Å; R36-K39 PolarHBondContact O-N 2.83Å; K39-C42 PolarHBondContact O-N 2.89Å; K39-F43 HydrophobicContact CD-CE2 4.23Å; K39-F43 HydrophobicContact CG-CD2 4.08Å; K39-F43 HydrophobicContact CG-CE2 3.48Å; K39-F43 VanDerWaalsContact CG-CE2 3.48Å; K39-F43 HydrophobicContact CG-CZ 4.19Å; K39-F43 WeakPolarHBondContact O-CD2 3.31Å; K39-F43 PolarHBondContact O-N 2.86Å; K39-N344 PolarHBondContact NZ-OD1 3.07Å
40E47.8Very low48.2Very low70 Ų7087 Ų8733%0.32743%0.434SS..Hα-helixtrans-58.5-50.3170.8-74.7-165.8142.300112.3R36 C42 F43 L44 K78R36-E40 PolarHBondContact O-N 3.33Å; E40-C42 VanDerWaalsContact C-N 3.3Å; E40-C42 PolarHBondContact O-N 2.73Å; E40-F43 PolarHBondContact O-N 3.02Å; E40-L44 WeakPolarHBondContact O-CB 3.45Å; E40-L44 WeakPolarHBondContact O-CG 3.15Å; E40-L44 PolarHBondContact O-N 2.9Å; E40-K78 WeakPolarHBondContact OE1-CE 3.18Å; E40-K78 IonicContact OE1-NZ 3.92Å; E40-K78 PolarHBondContact OE1-NZ 3.05Å; E40-K78 IonicContact OE2-NZ 3.97Å; E40-K78 PolarHBondContact OE2-NZ 3.36Å
41K48.8Very low48.5Very low122 Ų12284.3 Ų84.353%0.5342%0.422SS..Hα-helixtrans-60.3-39.4179.3-75161.9-174.5159.10111.8S37 L38 T45S37-K41 VanDerWaalsContact O-CB 3.29Å; S37-K41 WeakPolarHBondContact O-CB 3.38Å; S37-K41 VanDerWaalsContact O-CD 3.3Å; S37-K41 WeakPolarHBondContact O-CD 3.42Å; S37-K41 WeakPolarHBondContact O-CG 3.39Å; S37-K41 PolarHBondContact O-N 3.44Å; S37-K41 PolarHBondContact OG-NZ 3.05Å; L38-K41 PolarHBondContact O-N 3.43Å; K41-T45 VanDerWaalsContact O-CB 3.28Å; K41-T45 WeakPolarHBondContact O-CB 3.33Å; K41-T45 PolarHBondContact O-N 3.32Å; K41-T45 PolarHBondContact O-OG1 2.84Å
42C42.7Very low48.9Very low62 Ų6280.4 Ų80.442%0.41941%0.413SS..Hα-helixtrans-62.8-49.5175.8-169.40000111.1L38 K39 E40 T45 Q46L38-C42 VanDerWaalsContact O-CB 3.27Å; L38-C42 WeakPolarHBondContact O-CB 3.5Å; L38-C42 PolarHBondContact O-N 2.92Å; K39-C42 PolarHBondContact O-N 2.89Å; E40-C42 VanDerWaalsContact C-N 3.3Å; E40-C42 PolarHBondContact O-N 2.73Å; C42-T45 PolarHBondContact O-N 2.7Å; C42-Q46 WeakPolarHBondContact O-CG 3.23Å; C42-Q46 PolarHBondContact O-N 3.37Å
43F48.4Very low49Very low78 Ų7880.8 Ų80.834%0.34242%0.42SS..Hα-helixtrans-65.8-40.3177.6-66.4-45.8000113.2K39 E40 T45 Q46 L47 F340K39-F43 HydrophobicContact CD-CE2 4.23Å; K39-F43 HydrophobicContact CG-CD2 4.08Å; K39-F43 HydrophobicContact CG-CE2 3.48Å; K39-F43 VanDerWaalsContact CG-CE2 3.48Å; K39-F43 HydrophobicContact CG-CZ 4.19Å; K39-F43 WeakPolarHBondContact O-CD2 3.31Å; K39-F43 PolarHBondContact O-N 2.86Å; E40-F43 PolarHBondContact O-N 3.02Å; F43-T45 VanDerWaalsContact C-N 3.28Å; F43-T45 PolarHBondContact O-N 3.28Å; F43-Q46 PolarHBondContact O-N 3.43Å; F43-L47 VanDerWaalsContact O-CB 3.31Å; F43-L47 WeakPolarHBondContact O-CB 3.07Å; F43-L47 PolarHBondContact O-N 3.09Å; F43-F340 HydrophobicContact CE1-CE1 4.39Å; F43-F340 AromaticContact CZ-CE1 3.83Å; F43-F340 HydrophobicContact CZ-CE1 3.83Å
44L54.2Low49.3Very low58 Ų5879.4 Ų79.430%0.30441%0.41SS..Hα-helixtrans-61.3-37172.7-76.7168.4000111.7E40 A48 L71E40-L44 WeakPolarHBondContact O-CB 3.45Å; E40-L44 WeakPolarHBondContact O-CG 3.15Å; E40-L44 PolarHBondContact O-N 2.9Å; L44-A48 WeakPolarHBondContact O-CB 3.09Å; L44-A48 PolarHBondContact O-N 3.48Å; L44-L71 HydrophobicContact CD2-CD2 4.19Å
45T51.4Low49.8Very low98 Ų9879.7 Ų79.760%0.60141%0.411SS*.Hα-helixtrans-70.6-40.7176.1-56.50000111.8K41 C42 F43 G49K41-T45 VanDerWaalsContact O-CB 3.28Å; K41-T45 WeakPolarHBondContact O-CB 3.33Å; K41-T45 PolarHBondContact O-N 3.32Å; K41-T45 PolarHBondContact O-OG1 2.84Å; C42-T45 PolarHBondContact O-N 2.7Å; F43-T45 VanDerWaalsContact C-N 3.28Å; F43-T45 PolarHBondContact O-N 3.28Å; T45-G49 PolarHBondContact O-N 3.01Å
46Q47Very low50.4Low109 Ų10982 Ų8251%0.50942%0.421SS..Hα-helixtrans-64-45.1174.1-71.8174.91.300111.5C42 F43 G49 F50C42-Q46 WeakPolarHBondContact O-CG 3.23Å; C42-Q46 PolarHBondContact O-N 3.37Å; F43-Q46 PolarHBondContact O-N 3.43Å; Q46-G49 PolarHBondContact O-N 3.42Å; Q46-F50 WeakPolarHBondContact O-CB 3.33Å; Q46-F50 PolarHBondContact O-N 3.44Å
47L50.5Low50.5Low66 Ų6686.9 Ų86.935%0.34644%0.444SS..Hα-helixtrans-63.8-45.8177.1-16281.8000111.1F43 G49 F50 L51 M70F43-L47 VanDerWaalsContact O-CB 3.31Å; F43-L47 WeakPolarHBondContact O-CB 3.07Å; F43-L47 PolarHBondContact O-N 3.09Å; L47-G49 VanDerWaalsContact C-N 3.35Å; L47-G49 PolarHBondContact O-N 2.82Å; L47-F50 PolarHBondContact O-N 3.43Å; L47-L51 HydrophobicContact CD2-CD1 4.32Å; L47-L51 HydrophobicContact CG-CD1 3.99Å; L47-L51 WeakPolarHBondContact O-CB 3.37Å; L47-L51 WeakPolarHBondContact O-CD1 3.47Å; L47-L51 VanDerWaalsContact O-CG 3.22Å; L47-L51 WeakPolarHBondContact O-CG 3.39Å; L47-L51 PolarHBondContact O-N 2.93Å; L47-M70 HydrophobicContact CD2-CE 4.3Å
48A54.4Low51Low51 Ų5192.5 Ų92.542%0.42146%0.46SS..Hα-helixtrans-62.3-39.917500000112.1L44 L51 A52L44-A48 WeakPolarHBondContact O-CB 3.09Å; L44-A48 PolarHBondContact O-N 3.48Å; A48-L51 PolarHBondContact O-N 3.23Å; A48-A52 WeakPolarHBondContact O-CB 3.48Å; A48-A52 PolarHBondContact O-N 2.81Å
49G52.5Low51.2Low33 Ų3397.2 Ų97.234%0.3448%0.476SS..Hα-helixtrans-64-44.7175.300000113T45 Q46 L47 A52 N53T45-G49 PolarHBondContact O-N 3.01Å; Q46-G49 PolarHBondContact O-N 3.42Å; L47-G49 VanDerWaalsContact C-N 3.35Å; L47-G49 PolarHBondContact O-N 2.82Å; G49-A52 PolarHBondContact O-N 2.88Å; G49-N53 WeakPolarHBondContact O-CB 3.22Å; G49-N53 PolarHBondContact O-N 2.84Å
50F59.2Low51.4Low115 Ų11599.8 Ų99.850%0.50449%0.485SS..Hα-helixtrans-60.5-45.1174.7-177.9-95.3000111.8Q46 L47 R54Q46-F50 WeakPolarHBondContact O-CB 3.33Å; Q46-F50 PolarHBondContact O-N 3.44Å; L47-F50 PolarHBondContact O-N 3.43Å; F50-R54 PolarHBondContact O-N 3.33Å; F50-R54 VanDerWaalsContact O-N 3.11Å
51L56.4Low51.7Low47 Ų47101.7 Ų101.725%0.24649%0.493CS..Hα-helixtrans-71.5-39.2180-67.9167.7000112.4L47 A48 R54 Q55 I67L47-L51 HydrophobicContact CD2-CD1 4.32Å; L47-L51 HydrophobicContact CG-CD1 3.99Å; L47-L51 WeakPolarHBondContact O-CB 3.37Å; L47-L51 WeakPolarHBondContact O-CD1 3.47Å; L47-L51 VanDerWaalsContact O-CG 3.22Å; L47-L51 WeakPolarHBondContact O-CG 3.39Å; L47-L51 PolarHBondContact O-N 2.93Å; A48-L51 PolarHBondContact O-N 3.23Å; L51-R54 PolarHBondContact O-N 2.84Å; L51-Q55 WeakPolarHBondContact O-CB 3.48Å; L51-Q55 PolarHBondContact O-N 3.25Å; L51-I67 HydrophobicContact CB-CD1 3.71Å; L51-I67 HydrophobicContact CD1-CD1 3.71Å; L51-I67 HydrophobicContact CD1-CG1 3.81Å; L51-I67 HydrophobicContact CG-CD1 4.19Å
52A55.2Low51.9Low42 Ų42102.9 Ų102.935%0.34750%0.501SS..Hα-helixtrans-65.6-37.7174.300000112.3A48 G49 R54 Q55 K56A48-A52 WeakPolarHBondContact O-CB 3.48Å; A48-A52 PolarHBondContact O-N 2.81Å; G49-A52 PolarHBondContact O-N 2.88Å; A52-R54 VanDerWaalsContact C-N 3.32Å; A52-R54 PolarHBondContact O-N 3.18Å; A52-Q55 PolarHBondContact O-N 3Å; A52-K56 PolarHBondContact O-N 3.25Å
53N54.2Low52Low114 Ų114102 Ų10261%0.6150%0.495SS*.Hα-helixtrans-64.9-34.6171.8-90.1-19.5000112.3G49 K57G49-N53 WeakPolarHBondContact O-CB 3.22Å; G49-N53 PolarHBondContact O-N 2.84Å; N53-K57 PolarHBondContact O-N 3.49Å
54R52.5Low52.3Low99 Ų99103 Ų10337%0.37450%0.499SS..Hα-helixtrans-68.9-40.3169.6-83.5-170.9164.5-144.6-5.2112.6F50 L51 A52 K56 K57 Y58F50-R54 PolarHBondContact O-N 3.33Å; F50-R54 VanDerWaalsContact O-N 3.11Å; L51-R54 PolarHBondContact O-N 2.84Å; A52-R54 VanDerWaalsContact C-N 3.32Å; A52-R54 PolarHBondContact O-N 3.18Å; R54-K56 VanDerWaalsContact C-N 3.29Å; R54-K56 PolarHBondContact O-N 2.91Å; R54-K57 WeakPolarHBondContact O-CA 3.38Å; R54-K57 PolarHBondContact O-N 3.37Å; R54-Y58 PolarHBondContact O-N 3.49Å
55Q50.1Low52.4Low81 Ų81104.2 Ų104.238%0.37951%0.506SS..Hα-helixtrans-64.1-31.6178.9-165.217539.500112.9L51 A52 K57L51-Q55 WeakPolarHBondContact O-CB 3.48Å; L51-Q55 PolarHBondContact O-N 3.25Å; A52-Q55 PolarHBondContact O-N 3Å; Q55-K57 VanDerWaalsContact C-N 3.31Å
56K54.6Low52.5Low184 Ų184103.3 Ų103.380%0.850%0.497SS*.Hα-helixtrans-70.3-22.4169-74-178.6177.8179.30113.9A52 R54A52-K56 PolarHBondContact O-N 3.25Å; R54-K56 VanDerWaalsContact C-N 3.29Å; R54-K56 PolarHBondContact O-N 2.91Å
57K48.6Very low53Low165 Ų165100.1 Ų100.172%0.71748%0.483SS*.Hα-helixtrans-98.6-27.2-173.5-163.9169.3-174.8173.30113.7N53 R54 Q55N53-K57 PolarHBondContact O-N 3.49Å; R54-K57 WeakPolarHBondContact O-CA 3.38Å; R54-K57 PolarHBondContact O-N 3.37Å; Q55-K57 VanDerWaalsContact C-N 3.31Å
58Y52.1Low53.8Low154 Ų154103.6 Ų103.660%0.60450%0.495SS*.SBendtrans-140.5132.7173.6-66.9-86.1000110.3R54 Y60R54-Y58 PolarHBondContact O-N 3.49Å; Y58-Y60 VanDerWaalsContact C-N 3.28Å; Y58-Y60 PolarHBondContact O-N 2.7Å
59K47Very low54Low214 Ų214105.3 Ų105.393%0.9349%0.493SS*.  trans-7179.9173.4-73.4-174.9175.6-178.60110.8
60Y52.5Low54Low134 Ų134107.4 Ų107.453%0.52550%0.495SS..  trans-111.3100.3172.6-102.8-98.1000110Y58Y58-Y60 VanDerWaalsContact C-N 3.28Å; Y58-Y60 PolarHBondContact O-N 2.7Å
61E53.8Low53.9Low110 Ų110106 Ų10651%0.51449%0.493SS..SBendtrans-74.9-29.9179.6-156.169.5174.200111.3C63 K64 D65E61-C63 VanDerWaalsContact C-N 3.27Å; E61-C63 PolarHBondContact O-N 2.96Å; E61-K64 VanDerWaalsContact CD-CD 3.49Å; E61-K64 HydrophobicContact CG-CD 4.37Å; E61-K64 WeakPolarHBondContact O-CA 3.32Å; E61-K64 WeakPolarHBondContact O-CB 3.47Å; E61-K64 PolarHBondContact O-N 3.11Å; E61-K64 VanDerWaalsContact OE1-CD 3.24Å; E61-K64 WeakPolarHBondContact OE1-CD 3.42Å; E61-K64 WeakPolarHBondContact OE1-CE 3.35Å; E61-K64 IonicContact OE1-NZ 2.7Å; E61-K64 PolarHBondContact OE1-NZ 2.69Å; E61-K64 IonicContact OE2-NZ 3.25Å; E61-D65 PolarHBondContact O-N 2.96Å
62E52Low54.1Low147 Ų147112.3 Ų112.369%0.68751%0.513SS*.Hα-helixtrans-56.1-37.7175.2-58.8176.3145.300113K64 D65 L66E62-K64 PolarHBondContact O-N 3.44Å; E62-D65 PolarHBondContact O-N 3.07Å; E62-L66 WeakPolarHBondContact O-CB 3.44Å; E62-L66 PolarHBondContact O-N 2.88Å
63C45.1Very low53.9Low44 Ų44112.1 Ų112.130%0.29751%0.507SS..Hα-helixtrans-63.9-30.5176.3-65.70000112.3E61 I67E61-C63 VanDerWaalsContact C-N 3.27Å; E61-C63 PolarHBondContact O-N 2.96Å; C63-I67 VanDerWaalsContact O-CD1 3.23Å; C63-I67 WeakPolarHBondContact O-CD1 3.43Å; C63-I67 WeakPolarHBondContact O-CG1 3.32Å; C63-I67 PolarHBondContact O-N 3.49Å; C63-I67 VanDerWaalsContact O-N 3.09Å
64K54.9Low54.1Low98 Ų98109.5 Ų109.543%0.42649%0.491SS..Hα-helixtrans-68-46.8-179.4-165.8-179179.3176.60110.7E61 E62 K68E61-K64 VanDerWaalsContact CD-CD 3.49Å; E61-K64 HydrophobicContact CG-CD 4.37Å; E61-K64 WeakPolarHBondContact O-CA 3.32Å; E61-K64 WeakPolarHBondContact O-CB 3.47Å; E61-K64 PolarHBondContact O-N 3.11Å; E61-K64 VanDerWaalsContact OE1-CD 3.24Å; E61-K64 WeakPolarHBondContact OE1-CD 3.42Å; E61-K64 WeakPolarHBondContact OE1-CE 3.35Å; E61-K64 IonicContact OE1-NZ 2.7Å; E61-K64 PolarHBondContact OE1-NZ 2.69Å; E61-K64 IonicContact OE2-NZ 3.25Å; E62-K64 PolarHBondContact O-N 3.44Å; K64-K68 VanDerWaalsContact O-CB 3.26Å; K64-K68 WeakPolarHBondContact O-CB 3.23Å; K64-K68 PolarHBondContact O-N 3.48Å
65D56.4Low54.1Low83 Ų83113.7 Ų113.744%0.44451%0.506SS..Hα-helixtrans-74.8-32.6178.4-75.8-47.5000112.2E61 E62 K68 F69E61-D65 PolarHBondContact O-N 2.96Å; E62-D65 PolarHBondContact O-N 3.07Å; D65-K68 PolarHBondContact O-N 3.34Å; D65-K68 IonicContact OD1-NZ 3.66Å; D65-K68 PolarHBondContact OD1-NZ 3.25Å; D65-F69 WeakPolarHBondContact O-CB 3.37Å; D65-F69 PolarHBondContact O-N 3.35Å
66L53Low54Low80 Ų80115 Ų11542%0.41951%0.512SS..Hα-helixtrans-58.7-47.3170.1-179.460.7000111.9E62 F69 M70E62-L66 WeakPolarHBondContact O-CB 3.44Å; E62-L66 PolarHBondContact O-N 2.88Å; L66-F69 PolarHBondContact O-N 3.43Å; L66-M70 HydrophobicContact CD1-CG 4.5Å; L66-M70 HydrophobicContact CG-SD 4.24Å; L66-M70 WeakPolarHBondContact O-CB 3.37Å; L66-M70 VanDerWaalsContact O-CG 3.31Å; L66-M70 WeakPolarHBondContact O-CG 3.12Å; L66-M70 PolarHBondContact O-N 3.18Å
67I58.4Low54.1Low42 Ų42110.9 Ų110.922%0.21550%0.495CS..Hα-helixtrans-63.6-47.6177.5-68.5161.7000111.2L51 C63 F69 M70 L71L51-I67 HydrophobicContact CB-CD1 3.71Å; L51-I67 HydrophobicContact CD1-CD1 3.71Å; L51-I67 HydrophobicContact CD1-CG1 3.81Å; L51-I67 HydrophobicContact CG-CD1 4.19Å; C63-I67 VanDerWaalsContact O-CD1 3.23Å; C63-I67 WeakPolarHBondContact O-CD1 3.43Å; C63-I67 WeakPolarHBondContact O-CG1 3.32Å; C63-I67 PolarHBondContact O-N 3.49Å; C63-I67 VanDerWaalsContact O-N 3.09Å; I67-F69 VanDerWaalsContact C-N 3.26Å; I67-F69 PolarHBondContact O-N 2.99Å; I67-M70 PolarHBondContact O-N 2.77Å; I67-L71 HydrophobicContact CG2-CD1 3.85Å; I67-L71 HydrophobicContact CG2-CG 4.47Å; I67-L71 WeakPolarHBondContact O-CG 3.19Å; I67-L71 PolarHBondContact O-N 2.87Å
68K66.9Low55Low138 Ų138106.1 Ų106.160%0.647%0.474SS*.Hα-helixtrans-60.8-36.4178.3-177.1-178.3172.8-167.20111.8K64 D65 R72K64-K68 VanDerWaalsContact O-CB 3.26Å; K64-K68 WeakPolarHBondContact O-CB 3.23Å; K64-K68 PolarHBondContact O-N 3.48Å; D65-K68 PolarHBondContact O-N 3.34Å; D65-K68 IonicContact OD1-NZ 3.66Å; D65-K68 PolarHBondContact OD1-NZ 3.25Å; K68-R72 WeakPolarHBondContact O-CB 3.26Å; K68-R72 PolarHBondContact O-N 2.87Å
69F59.6Low55.5Low87 Ų87104.9 Ų104.938%0.38247%0.474SS..Hα-helixtrans-72.5-45.4174.8177.1-100.1000111.9D65 L66 I67 L71 R72 N73 F314D65-F69 WeakPolarHBondContact O-CB 3.37Å; D65-F69 PolarHBondContact O-N 3.35Å; L66-F69 PolarHBondContact O-N 3.43Å; I67-F69 VanDerWaalsContact C-N 3.26Å; I67-F69 PolarHBondContact O-N 2.99Å; F69-L71 PolarHBondContact O-N 3.27Å; F69-R72 PolarHBondContact O-N 3.3Å; F69-N73 WeakPolarHBondContact CD1-ND2 3.44Å; F69-N73 WeakPolarHBondContact CD2-ND2 3.47Å; F69-N73 VanDerWaalsContact CE1-ND2 3.33Å; F69-N73 WeakPolarHBondContact CE1-ND2 2.91Å; F69-N73 VanDerWaalsContact CE2-ND2 3.3Å; F69-N73 WeakPolarHBondContact CE2-ND2 3.29Å; F69-N73 WeakPolarHBondContact CG-ND2 3.33Å; F69-N73 VanDerWaalsContact CZ-ND2 3.29Å; F69-N73 WeakPolarHBondContact CZ-ND2 3.21Å; F69-N73 PolarHBondContact O-N 2.83Å; F69-N73 PolarHBondContact O-ND2 3.39Å; F69-F314 AromaticContact CE1-CE1 3.93Å; F69-F314 HydrophobicContact CE1-CE1 3.93Å; F69-F314 HydrophobicContact CE1-CE2 4.23Å; F69-F314 AromaticContact CE1-CZ 3.47Å; F69-F314 HydrophobicContact CE1-CZ 3.47Å; F69-F314 VanDerWaalsContact CE1-CZ 3.47Å; F69-F314 HydrophobicContact CZ-CZ 4.04Å
70M52.2Low56.5Low78 Ų7899.6 Ų99.638%0.38445%0.452SS..Hα-helixtrans-53.4-56173.5-76.5169.759.300111.2L47 L66 I67 R72 N73 E74L47-M70 HydrophobicContact CD2-CE 4.3Å; L66-M70 HydrophobicContact CD1-CG 4.5Å; L66-M70 HydrophobicContact CG-SD 4.24Å; L66-M70 WeakPolarHBondContact O-CB 3.37Å; L66-M70 VanDerWaalsContact O-CG 3.31Å; L66-M70 WeakPolarHBondContact O-CG 3.12Å; L66-M70 PolarHBondContact O-N 3.18Å; I67-M70 PolarHBondContact O-N 2.77Å; M70-R72 PolarHBondContact O-N 3.44Å; M70-N73 PolarHBondContact O-N 2.87Å; M70-E74 WeakPolarHBondContact O-CB 3.29Å; M70-E74 PolarHBondContact O-N 3.47Å
71L55.9Low57.6Low86 Ų8695.7 Ų95.745%0.4544%0.438SS..Hα-helixtrans-60.8-30.3-179.1-67.5169.9000113.1L44 I67 F69 R75L44-L71 HydrophobicContact CD2-CD2 4.19Å; I67-L71 HydrophobicContact CG2-CD1 3.85Å; I67-L71 HydrophobicContact CG2-CG 4.47Å; I67-L71 WeakPolarHBondContact O-CG 3.19Å; I67-L71 PolarHBondContact O-N 2.87Å; F69-L71 PolarHBondContact O-N 3.27Å; L71-R75 WeakPolarHBondContact O-CB 3.36Å; L71-R75 PolarHBondContact O-N 3.48Å
72R61.9Low58.5Low178 Ų17895.3 Ų95.367%0.67244%0.439SS*.Hα-helixtrans-73.8-47.3176.1-164.6179.1-160.4179.36111.8K68 F69 M70 Q76K68-R72 WeakPolarHBondContact O-CB 3.26Å; K68-R72 PolarHBondContact O-N 2.87Å; F69-R72 PolarHBondContact O-N 3.3Å; M70-R72 PolarHBondContact O-N 3.44Å; R72-Q76 WeakPolarHBondContact O-CG 3.26Å; R72-Q76 PolarHBondContact O-N 3.4Å; R72-Q76 VanDerWaalsContact O-N 3.09Å
73N50.7Low59.4Low39 Ų3991.3 Ų91.321%0.20943%0.431CS..Hα-helixtrans-64.9-42.2177.4-73.6-87.6000111.5F69 M70 R75 Q76 F77 K310F69-N73 WeakPolarHBondContact CD1-ND2 3.44Å; F69-N73 WeakPolarHBondContact CD2-ND2 3.47Å; F69-N73 VanDerWaalsContact CE1-ND2 3.33Å; F69-N73 WeakPolarHBondContact CE1-ND2 2.91Å; F69-N73 VanDerWaalsContact CE2-ND2 3.3Å; F69-N73 WeakPolarHBondContact CE2-ND2 3.29Å; F69-N73 WeakPolarHBondContact CG-ND2 3.33Å; F69-N73 VanDerWaalsContact CZ-ND2 3.29Å; F69-N73 WeakPolarHBondContact CZ-ND2 3.21Å; F69-N73 PolarHBondContact O-N 2.83Å; F69-N73 PolarHBondContact O-ND2 3.39Å; M70-N73 PolarHBondContact O-N 2.87Å; N73-R75 PolarHBondContact O-N 3.47Å; N73-Q76 PolarHBondContact O-N 2.58Å; N73-F77 WeakPolarHBondContact O-CB 3.4Å; N73-F77 PolarHBondContact O-N 3.45Å; N73-K310 PolarHBondContact OD1-NZ 2.84Å
74E57.3Low61Low59 Ų5994.4 Ų94.428%0.27644%0.441SS..Hα-helixtrans-62.3-43.5179.5-167-162.9145.700111.4M70 F77 K78M70-E74 WeakPolarHBondContact O-CB 3.29Å; M70-E74 PolarHBondContact O-N 3.47Å; E74-F77 PolarHBondContact O-N 3.42Å; E74-K78 HydrophobicContact CG-CD 4.31Å; E74-K78 WeakPolarHBondContact O-CB 3.36Å; E74-K78 WeakPolarHBondContact O-CG 3.47Å; E74-K78 PolarHBondContact O-N 3.42Å; E74-K78 WeakPolarHBondContact OE1-CE 3.47Å; E74-K78 IonicContact OE1-NZ 2.85Å; E74-K78 PolarHBondContact OE1-NZ 3.38Å
75R52.4Low62.1Low186 Ų18691.2 Ų91.270%0.70243%0.428SS*.Hα-helixtrans-59.8-50.9173.8-174.5-177.5-62.3-165.2-1.2111.4L71 N73 F77 K78 E79L71-R75 WeakPolarHBondContact O-CB 3.36Å; L71-R75 PolarHBondContact O-N 3.48Å; N73-R75 PolarHBondContact O-N 3.47Å; R75-F77 VanDerWaalsContact C-N 3.32Å; R75-F77 PolarHBondContact O-N 2.83Å; R75-K78 PolarHBondContact O-N 3.39Å; R75-E79 WeakPolarHBondContact O-CB 3.34Å; R75-E79 PolarHBondContact O-N 2.87Å
76Q49.1Very low63.2Low108 Ų10893.1 Ų93.151%0.50544%0.437SS..Hα-helixtrans-63.5-36.5-178.6-71.3179.6-58.500112.5R72 N73 E79 E80R72-Q76 WeakPolarHBondContact O-CG 3.26Å; R72-Q76 PolarHBondContact O-N 3.4Å; R72-Q76 VanDerWaalsContact O-N 3.09Å; N73-Q76 PolarHBondContact O-N 2.58Å; Q76-E79 PolarHBondContact O-N 3.45Å; Q76-E80 WeakPolarHBondContact O-CB 3.44Å; Q76-E80 PolarHBondContact O-N 2.97Å
77F56.4Low64.7Low98 Ų9896.5 Ų96.543%0.4345%0.449SS..Hα-helixtrans-68.2-39.4174.7179-107.5000112.4N73 E74 R75 E79 K81N73-F77 WeakPolarHBondContact O-CB 3.4Å; N73-F77 PolarHBondContact O-N 3.45Å; E74-F77 PolarHBondContact O-N 3.42Å; R75-F77 VanDerWaalsContact C-N 3.32Å; R75-F77 PolarHBondContact O-N 2.83Å; F77-E79 VanDerWaalsContact C-N 3.34Å; F77-K81 VanDerWaalsContact O-CB 3.27Å; F77-K81 WeakPolarHBondContact O-CB 3.39Å; F77-K81 PolarHBondContact O-N 3.5Å; F77-K81 VanDerWaalsContact O-N 3.07Å
78K66.4Low65.8Low66 Ų6697.7 Ų97.729%0.28745%0.453SS..Hα-helixtrans-66.3-36.5173.5-74.6175.6173.8178.50111.7E40 E74 R75 L82E40-K78 WeakPolarHBondContact OE1-CE 3.18Å; E40-K78 IonicContact OE1-NZ 3.92Å; E40-K78 PolarHBondContact OE1-NZ 3.05Å; E40-K78 IonicContact OE2-NZ 3.97Å; E40-K78 PolarHBondContact OE2-NZ 3.36Å; E74-K78 HydrophobicContact CG-CD 4.31Å; E74-K78 WeakPolarHBondContact O-CB 3.36Å; E74-K78 WeakPolarHBondContact O-CG 3.47Å; E74-K78 PolarHBondContact O-N 3.42Å; E74-K78 WeakPolarHBondContact OE1-CE 3.47Å; E74-K78 IonicContact OE1-NZ 2.85Å; E74-K78 PolarHBondContact OE1-NZ 3.38Å; R75-K78 PolarHBondContact O-N 3.39Å; K78-L82 WeakPolarHBondContact O-CB 3.44Å; K78-L82 WeakPolarHBondContact O-CD1 3.15Å; K78-L82 WeakPolarHBondContact O-CG 3.31Å; K78-L82 PolarHBondContact O-N 3.22Å
79E64.4Low66.4Low127 Ų12793.9 Ų93.959%0.59345%0.447SS*.Hα-helixtrans-69.7-50.6177.3-169.5171.6-171.900112.5R75 Q76 F77 K81 L82 A83R75-E79 WeakPolarHBondContact O-CB 3.34Å; R75-E79 PolarHBondContact O-N 2.87Å; Q76-E79 PolarHBondContact O-N 3.45Å; F77-E79 VanDerWaalsContact C-N 3.34Å; E79-K81 VanDerWaalsContact C-N 3.33Å; E79-K81 PolarHBondContact O-N 2.8Å; E79-L82 PolarHBondContact O-N 2.97Å; E79-A83 PolarHBondContact O-N 3.21Å
80E67.6Low67.8Low103 Ų10392.9 Ų92.948%0.48144%0.444SS..Hα-helixtrans-57.6-45.2174.9-171.1-176.5-17200111Q76 L82 A83 E84 R307Q76-E80 WeakPolarHBondContact O-CB 3.44Å; Q76-E80 PolarHBondContact O-N 2.97Å; E80-L82 PolarHBondContact O-N 2.85Å; E80-A83 PolarHBondContact O-N 2.96Å; E80-E84 PolarHBondContact O-N 3.23Å; E80-R307 IonicContact OE1-CZ 2.69Å; E80-R307 IonicContact OE1-NH1 3.38Å; E80-R307 PolarHBondContact OE1-NH1 3.11Å; E80-R307 IonicContact OE2-CZ 2.7Å; E80-R307 IonicContact OE2-NH1 2.58Å; E80-R307 PolarHBondContact OE2-NH1 2.97Å
81K75.3Confident69.6Low53 Ų5391.4 Ų91.423%0.2344%0.436CS..Hα-helixtrans-72.4-27.2-179.3-168.4158.6-168.2175.30113.7F77 E79 Q85F77-K81 VanDerWaalsContact O-CB 3.27Å; F77-K81 WeakPolarHBondContact O-CB 3.39Å; F77-K81 PolarHBondContact O-N 3.5Å; F77-K81 VanDerWaalsContact O-N 3.07Å; E79-K81 VanDerWaalsContact C-N 3.33Å; E79-K81 PolarHBondContact O-N 2.8Å; K81-Q85 WeakPolarHBondContact O-CG 3.36Å; K81-Q85 PolarHBondContact O-N 3.04Å
82L71.6Confident71.2Confident102 Ų10288.3 Ų88.353%0.53442%0.42SS..Hα-helixtrans-71.7-40.5171.8-80.5168.8000111.6K78 E79 E80 E84 Q85 L86K78-L82 WeakPolarHBondContact O-CB 3.44Å; K78-L82 WeakPolarHBondContact O-CD1 3.15Å; K78-L82 WeakPolarHBondContact O-CG 3.31Å; K78-L82 PolarHBondContact O-N 3.22Å; E79-L82 PolarHBondContact O-N 2.97Å; E80-L82 PolarHBondContact O-N 2.85Å; L82-E84 VanDerWaalsContact C-N 3.33Å; L82-E84 PolarHBondContact O-N 3.49Å; L82-Q85 PolarHBondContact O-N 2.73Å; L82-L86 WeakPolarHBondContact O-CB 3.35Å; L82-L86 PolarHBondContact O-N 2.75Å
83A72.5Confident72.5Confident63 Ų6387 Ų8752%0.52142%0.415SS..Hα-helixtrans-61.9-40.2176.800000112.3E79 E80 L86 K87E79-A83 PolarHBondContact O-N 3.21Å; E80-A83 PolarHBondContact O-N 2.96Å; A83-L86 PolarHBondContact O-N 3.27Å; A83-K87 PolarHBondContact O-N 2.97Å
84E78.3Confident74.5Confident109 Ų10990.5 Ų90.551%0.50943%0.43SS..Hα-helixtrans-64.1-45.3175.3-173.8172.1-128.200112.3E80 L82 K87 Q88E80-E84 PolarHBondContact O-N 3.23Å; L82-E84 VanDerWaalsContact C-N 3.33Å; L82-E84 PolarHBondContact O-N 3.49Å; E84-K87 PolarHBondContact O-N 3.36Å; E84-Q88 WeakPolarHBondContact O-CG 3.26Å; E84-Q88 PolarHBondContact O-N 3.22Å
85Q77.8Confident76.2Confident31 Ų3189.7 Ų89.715%0.14543%0.425CS..Hα-helixtrans-66.1-37.1176.4-71.7-170.5-87.800112.8K81 L82 Q88 A89K81-Q85 WeakPolarHBondContact O-CG 3.36Å; K81-Q85 PolarHBondContact O-N 3.04Å; L82-Q85 PolarHBondContact O-N 2.73Å; Q85-Q88 PolarHBondContact O-N 3.38Å; Q85-A89 WeakPolarHBondContact O-CB 3.25Å; Q85-A89 PolarHBondContact O-N 3.48Å
86L78.6Confident78.1Confident122 Ų12284.1 Ų84.164%0.63941%0.405SS*.Hα-helixtrans-65.3-41.9176.8-159.1165.5000110.4L82 A83 Q88 A89 E90L82-L86 WeakPolarHBondContact O-CB 3.35Å; L82-L86 PolarHBondContact O-N 2.75Å; A83-L86 PolarHBondContact O-N 3.27Å; L86-Q88 PolarHBondContact O-N 2.9Å; L86-A89 PolarHBondContact O-N 3.32Å; L86-E90 PolarHBondContact O-N 2.88Å
87K85.4Confident80.2Confident151 Ų15183.6 Ų83.666%0.65741%0.409SS*.Hα-helixtrans-59.4-46.3173.3-168.6-166.1173.9-159.50111.9A83 E84 A89 E90 E91A83-K87 PolarHBondContact O-N 2.97Å; E84-K87 PolarHBondContact O-N 3.36Å; K87-A89 VanDerWaalsContact C-N 3.34Å; K87-A89 PolarHBondContact O-N 2.88Å; K87-E90 PolarHBondContact O-N 2.81Å; K87-E91 WeakPolarHBondContact O-CB 3.38Å; K87-E91 PolarHBondContact O-N 3.49Å
88Q81.4Confident82Confident68 Ų6881.7 Ų81.732%0.31840%0.404SS..Hα-helixtrans-63.1-38.5178.1-72.4173.4-16.500112.4E84 Q85 L86 L92E84-Q88 WeakPolarHBondContact O-CG 3.26Å; E84-Q88 PolarHBondContact O-N 3.22Å; Q85-Q88 PolarHBondContact O-N 3.38Å; L86-Q88 PolarHBondContact O-N 2.9Å; Q88-L92 WeakPolarHBondContact O-CB 3.26Å; Q88-L92 PolarHBondContact O-N 3.15Å
89A80.3Confident83.4Confident57 Ų5779 Ų7947%0.47139%0.392SS..Hα-helixtrans-68.5-39.1176.900000112.8Q85 L86 K87 L92 R93Q85-A89 WeakPolarHBondContact O-CB 3.25Å; Q85-A89 PolarHBondContact O-N 3.48Å; L86-A89 PolarHBondContact O-N 3.32Å; K87-A89 VanDerWaalsContact C-N 3.34Å; K87-A89 PolarHBondContact O-N 2.88Å; A89-L92 PolarHBondContact O-N 3.07Å; A89-R93 WeakPolarHBondContact O-CB 3.35Å; A89-R93 PolarHBondContact O-N 3.48Å
90E88.1Confident84.6Confident67 Ų6777.3 Ų77.331%0.31338%0.384SS..Hα-helixtrans-71-36.7176.2-175.159.5-153.100111.8L86 K87 R93 Q94L86-E90 PolarHBondContact O-N 2.88Å; K87-E90 PolarHBondContact O-N 2.81Å; E90-R93 VanDerWaalsContact CD-NH1 3.3Å; E90-R93 WeakPolarHBondContact O-CB 3.17Å; E90-R93 PolarHBondContact O-N 2.84Å; E90-R93 IonicContact OE1-CZ 2.79Å; E90-R93 IonicContact OE1-NH1 2.64Å; E90-R93 PolarHBondContact OE1-NH1 2.84Å; E90-R93 WeakPolarHBondContact OE2-CD 3.35Å; E90-R93 IonicContact OE2-CZ 3.21Å; E90-R93 IonicContact OE2-NE 2.77Å; E90-R93 IonicContact OE2-NH1 2.72Å; E90-R93 PolarHBondContact OE2-NH1 3.11Å; E90-Q94 VanDerWaalsContact O-CG 3.29Å; E90-Q94 WeakPolarHBondContact O-CG 3.44Å; E90-Q94 PolarHBondContact O-N 2.86Å; E90-Q94 PolarHBondContact OE1-NE2 3.24Å
91E90.8Very high85.7Confident47 Ų4775.3 Ų75.322%0.2238%0.382CS..Hα-helixtrans-60.2-49.1171-170-178.9153.200110.9K87 R93 Q94 Y95 L363 K367K87-E91 WeakPolarHBondContact O-CB 3.38Å; K87-E91 PolarHBondContact O-N 3.49Å; E91-R93 VanDerWaalsContact C-N 3.3Å; E91-R93 PolarHBondContact O-N 3.41Å; E91-Q94 PolarHBondContact O-N 3.37Å; E91-Y95 HydrophobicContact CG-CD2 4.09Å; E91-Y95 HydrophobicContact CG-CE2 3.97Å; E91-Y95 VanDerWaalsContact O-CD2 3.31Å; E91-Y95 WeakPolarHBondContact O-CD2 3.26Å; E91-Y95 PolarHBondContact O-N 3.12Å; E91-L363 HydrophobicContact CG-CD1 4.18Å; E91-K367 WeakPolarHBondContact OE1-CE 3.45Å; E91-K367 IonicContact OE1-NZ 3.14Å; E91-K367 PolarHBondContact OE1-NZ 2.99Å
92L88.1Confident86.6Confident21 Ų2173.5 Ų73.511%0.1137%0.374CS..Hα-helixtrans-60.4-37.4175.618063.4000112.7Q88 A89 K96 E362 L363 Y366Q88-L92 WeakPolarHBondContact O-CB 3.26Å; Q88-L92 PolarHBondContact O-N 3.15Å; A89-L92 PolarHBondContact O-N 3.07Å; L92-K96 HydrophobicContact CG-CD 4.49Å; L92-K96 WeakPolarHBondContact O-CG 3.34Å; L92-K96 PolarHBondContact O-N 3.43Å; L92-E362 HydrophobicContact CD1-CG 4.14Å; L92-E362 HydrophobicContact CD2-CG 4.49Å; L92-L363 HydrophobicContact CB-CD1 4.34Å; L92-L363 HydrophobicContact CD1-CB 4.28Å; L92-L363 HydrophobicContact CD1-CD1 4.31Å; L92-Y366 HydrophobicContact CD1-CD2 3.6Å; L92-Y366 HydrophobicContact CD1-CE2 4.12Å; L92-Y366 HydrophobicContact CD1-CG 4.44Å
93R90.6Very high87.5Confident151 Ų15173.3 Ų73.357%0.5737%0.371SS*.Hα-helixtrans-64.9-42.4174.7179-172.7171.2-137.8-3.8111.8A89 E90 E91 K96 V97A89-R93 WeakPolarHBondContact O-CB 3.35Å; A89-R93 PolarHBondContact O-N 3.48Å; E90-R93 VanDerWaalsContact CD-NH1 3.3Å; E90-R93 WeakPolarHBondContact O-CB 3.17Å; E90-R93 PolarHBondContact O-N 2.84Å; E90-R93 IonicContact OE1-CZ 2.79Å; E90-R93 IonicContact OE1-NH1 2.64Å; E90-R93 PolarHBondContact OE1-NH1 2.84Å; E90-R93 WeakPolarHBondContact OE2-CD 3.35Å; E90-R93 IonicContact OE2-CZ 3.21Å; E90-R93 IonicContact OE2-NE 2.77Å; E90-R93 IonicContact OE2-NH1 2.72Å; E90-R93 PolarHBondContact OE2-NH1 3.11Å; E91-R93 VanDerWaalsContact C-N 3.3Å; E91-R93 PolarHBondContact O-N 3.41Å; R93-K96 PolarHBondContact O-N 3.3Å; R93-V97 WeakPolarHBondContact O-CG2 3.1Å; R93-V97 PolarHBondContact O-N 2.86Å
94Q92.8Very high88.5Confident111 Ų11177.8 Ų77.852%0.51937%0.374SS..Hα-helixtrans-63.3-45.9177-72.4167.511.200111.2E90 E91 K96 V97 L98E90-Q94 VanDerWaalsContact O-CG 3.29Å; E90-Q94 WeakPolarHBondContact O-CG 3.44Å; E90-Q94 PolarHBondContact O-N 2.86Å; E90-Q94 PolarHBondContact OE1-NE2 3.24Å; E91-Q94 PolarHBondContact O-N 3.37Å; Q94-K96 VanDerWaalsContact C-N 3.33Å; Q94-K96 PolarHBondContact O-N 3.01Å; Q94-V97 PolarHBondContact O-N 3.44Å; Q94-L98 WeakPolarHBondContact O-CB 3.42Å; Q94-L98 PolarHBondContact O-N 2.88Å
95Y91.9Very high89.2Confident43 Ų4375.5 Ų75.517%0.16936%0.364CS..Hα-helixtrans-59.7-40.3173.6-85.8-73.6000112.9E91 L98 V99 L363 K367 V370E91-Y95 HydrophobicContact CG-CD2 4.09Å; E91-Y95 HydrophobicContact CG-CE2 3.97Å; E91-Y95 VanDerWaalsContact O-CD2 3.31Å; E91-Y95 WeakPolarHBondContact O-CD2 3.26Å; E91-Y95 PolarHBondContact O-N 3.12Å; Y95-L98 PolarHBondContact O-N 3.07Å; Y95-V99 PolarHBondContact O-N 2.62Å; Y95-L363 HydrophobicContact CD2-CD1 3.61Å; Y95-L363 HydrophobicContact CE2-CD1 4.14Å; Y95-L363 HydrophobicContact CG-CD1 4.35Å; Y95-K367 HydrophobicContact CD1-CG 4.12Å; Y95-K367 HydrophobicContact CD2-CG 4.45Å; Y95-K367 HydrophobicContact CE1-CG 3.6Å; Y95-K367 HydrophobicContact CE2-CD 4.28Å; Y95-K367 HydrophobicContact CE2-CG 3.97Å; Y95-K367 VanDerWaalsContact CZ-CE 3.41Å; Y95-K367 WeakPolarHBondContact OH-CE 3.45Å; Y95-V370 HydrophobicContact CD1-CB 4.47Å; Y95-V370 HydrophobicContact CD1-CG2 3.88Å; Y95-V370 HydrophobicContact CE1-CG2 4.38Å
96K92.8Very high89.9Confident68 Ų6874.2 Ų74.230%0.29636%0.357SS..Hα-helixtrans-61.7-43.7174.5-78.5175.6179.8-174.80112.6L92 R93 Q94 H100 E362 Y366L92-K96 HydrophobicContact CG-CD 4.49Å; L92-K96 WeakPolarHBondContact O-CG 3.34Å; L92-K96 PolarHBondContact O-N 3.43Å; R93-K96 PolarHBondContact O-N 3.3Å; Q94-K96 VanDerWaalsContact C-N 3.33Å; Q94-K96 PolarHBondContact O-N 3.01Å; K96-H100 PolarHBondContact O-N 3.46Å; K96-H100 PolarHBondContact O-ND1 2.88Å; K96-E362 VanDerWaalsContact CE-OE1 3.26Å; K96-E362 WeakPolarHBondContact CE-OE1 3.49Å; K96-E362 IonicContact NZ-OE1 2.72Å; K96-E362 PolarHBondContact NZ-OE1 3.18Å; K96-Y366 HydrophobicContact CD-CE2 4.22Å; K96-Y366 VanDerWaalsContact CE-CZ 3.49Å; K96-Y366 WeakPolarHBondContact CE-OH 3.29Å; K96-Y366 HydrophobicContact CG-CD1 4.23Å; K96-Y366 HydrophobicContact CG-CD2 4.34Å; K96-Y366 HydrophobicContact CG-CE1 3.73Å; K96-Y366 HydrophobicContact CG-CE2 3.84Å
97V93.8Very high90.5Very high97 Ų9771.8 Ų71.859%0.58835%0.348SS*.Hα-helixtrans-65.1-40.3176.4172.70000111.2R93 Q94 H100 S101R93-V97 WeakPolarHBondContact O-CG2 3.1Å; R93-V97 PolarHBondContact O-N 2.86Å; Q94-V97 PolarHBondContact O-N 3.44Å; V97-H100 PolarHBondContact O-N 3.42Å; V97-S101 PolarHBondContact O-N 3.34Å
98L94.3Very high90.8Very high59 Ų5970.5 Ų70.531%0.30934%0.344SS..Hα-helixtrans-62.2-48.2178.3-177.956.7000112Q94 Y95 H100 S101 Q102 V370Q94-L98 WeakPolarHBondContact O-CB 3.42Å; Q94-L98 PolarHBondContact O-N 2.88Å; Y95-L98 PolarHBondContact O-N 3.07Å; L98-H100 PolarHBondContact O-N 2.83Å; L98-S101 WeakPolarHBondContact O-CA 3.48Å; L98-S101 WeakPolarHBondContact O-CB 3.19Å; L98-S101 PolarHBondContact O-N 3.07Å; L98-Q102 HydrophobicContact CD1-CG 4.05Å; L98-Q102 HydrophobicContact CG-CG 4.43Å; L98-Q102 WeakPolarHBondContact O-CG 3.35Å; L98-Q102 PolarHBondContact O-N 2.92Å; L98-V370 HydrophobicContact CD2-CG1 3.78Å; L98-V370 HydrophobicContact CD2-CG2 4.01Å; L98-V370 HydrophobicContact CG-CG1 4.42Å; L98-V370 HydrophobicContact CG-CG2 4.12Å
99V93.9Very high91.4Very high8 Ų868.4 Ų68.45%0.04834%0.335CS..Hα-helixtrans-57.2-45.9176.2166.20000111.9Y95 S101 Q102 E103 Y366 L369 V370Y95-V99 PolarHBondContact O-N 2.62Å; V99-S101 PolarHBondContact O-N 3.32Å; V99-Q102 PolarHBondContact O-N 3.5Å; V99-E103 VanDerWaalsContact O-CB 3.23Å; V99-E103 WeakPolarHBondContact O-CB 3.43Å; V99-E103 PolarHBondContact O-N 2.82Å; V99-Y366 HydrophobicContact CB-CD1 4.49Å; V99-Y366 HydrophobicContact CG2-CD1 3.87Å; V99-Y366 HydrophobicContact CG2-CE1 4.41Å; V99-L369 HydrophobicContact CG1-CD2 3.72Å; V99-L369 HydrophobicContact CG1-CG 4.3Å; V99-L369 HydrophobicContact CG2-CD2 4.08Å; V99-L369 HydrophobicContact CG2-CG 4.14Å; V99-V370 HydrophobicContact CG2-CG2 3.46Å; V99-V370 VanDerWaalsContact CG2-CG2 3.46Å
100H90.1Very high92Very high92 Ų9271 Ų7143%0.42633%0.333SS..Hα-helixtrans-69.1-16.3177-71.278.7000113.3K96 V97 L98 R104K96-H100 PolarHBondContact O-N 3.46Å; K96-H100 PolarHBondContact O-ND1 2.88Å; V97-H100 PolarHBondContact O-N 3.42Å; L98-H100 PolarHBondContact O-N 2.83Å; H100-R104 WeakPolarHBondContact O-CD 3.33Å; H100-R104 WeakPolarHBondContact O-CG 3.44Å; H100-R104 VanDerWaalsContact O-CZ 3.29Å; H100-R104 PolarHBondContact O-NE 3.03Å; H100-R104 PolarHBondContact O-NH1 3.18Å; H100-R104 VanDerWaalsContact O-NH1 3.14Å
101S91.8Very high92.2Very high62 Ų6273.1 Ų73.143%0.43434%0.343SS..Hα-helixtrans-82.9-49.5172.3-158.60000110.5V97 L98 V99 E103 R104 E105V97-S101 PolarHBondContact O-N 3.34Å; L98-S101 WeakPolarHBondContact O-CA 3.48Å; L98-S101 WeakPolarHBondContact O-CB 3.19Å; L98-S101 PolarHBondContact O-N 3.07Å; V99-S101 PolarHBondContact O-N 3.32Å; S101-E103 VanDerWaalsContact C-N 3.32Å; S101-E103 PolarHBondContact O-N 3.42Å; S101-R104 PolarHBondContact O-N 2.97Å; S101-E105 PolarHBondContact O-N 3.39Å; S101-E105 VanDerWaalsContact O-N 3.1Å
102Q92.9Very high92.2Very high14 Ų1472.5 Ų72.57%0.06534%0.339CS..Hα-helixtrans-63.1-36.5178.6-69.3175.9-3100111.7L98 V99 R104 E105 L106 Q373 E374 L377L98-Q102 HydrophobicContact CD1-CG 4.05Å; L98-Q102 HydrophobicContact CG-CG 4.43Å; L98-Q102 WeakPolarHBondContact O-CG 3.35Å; L98-Q102 PolarHBondContact O-N 2.92Å; V99-Q102 PolarHBondContact O-N 3.5Å; Q102-R104 PolarHBondContact O-N 3.46Å; Q102-E105 PolarHBondContact O-N 3.32Å; Q102-L106 WeakPolarHBondContact O-CB 3.43Å; Q102-L106 VanDerWaalsContact O-CG 3.24Å; Q102-L106 WeakPolarHBondContact O-CG 3.42Å; Q102-L106 PolarHBondContact O-N 2.85Å; Q102-Q373 HydrophobicContact CB-CB 4.05Å; Q102-E374 VanDerWaalsContact NE2-CG 3.33Å; Q102-L377 HydrophobicContact CB-CD1 3.92Å; Q102-L377 HydrophobicContact CG-CD1 3.79Å
103E92.2Very high92.4Very high99 Ų9972 Ų7246%0.46334%0.336SS..Hα-helixtrans-63.5-37.5175.1-174.8173.6-156.800113.3V99 S101 T107V99-E103 VanDerWaalsContact O-CB 3.23Å; V99-E103 WeakPolarHBondContact O-CB 3.43Å; V99-E103 PolarHBondContact O-N 2.82Å; S101-E103 VanDerWaalsContact C-N 3.32Å; S101-E103 PolarHBondContact O-N 3.42Å; E103-T107 WeakPolarHBondContact O-CB 3.37Å; E103-T107 PolarHBondContact O-N 3.4Å; E103-T107 PolarHBondContact O-OG1 3.09Å
104R91.6Very high92.5Very high157 Ų15772 Ų7259%0.59234%0.337SS*.Hα-helixtrans-69.3-44.2174.4-68.6175.4-165.7121.43.5111.4H100 S101 Q102 T107 Q108H100-R104 WeakPolarHBondContact O-CD 3.33Å; H100-R104 WeakPolarHBondContact O-CG 3.44Å; H100-R104 VanDerWaalsContact O-CZ 3.29Å; H100-R104 PolarHBondContact O-NE 3.03Å; H100-R104 PolarHBondContact O-NH1 3.18Å; H100-R104 VanDerWaalsContact O-NH1 3.14Å; S101-R104 PolarHBondContact O-N 2.97Å; Q102-R104 PolarHBondContact O-N 3.46Å; R104-T107 WeakPolarHBondContact O-CB 3.27Å; R104-T107 PolarHBondContact O-N 2.84Å; R104-Q108 WeakPolarHBondContact O-CG 3.35Å; R104-Q108 PolarHBondContact O-N 3.12Å
105E93.9Very high92.4Very high61 Ų6170.6 Ų70.629%0.28533%0.33SS..Hα-helixtrans-62.6-46.1177.4-169.3-177171.900111S101 Q102 T107 Q108 L109 L377 K381S101-E105 PolarHBondContact O-N 3.39Å; S101-E105 VanDerWaalsContact O-N 3.1Å; Q102-E105 PolarHBondContact O-N 3.32Å; E105-T107 VanDerWaalsContact C-N 3.29Å; E105-T107 PolarHBondContact O-N 2.78Å; E105-Q108 PolarHBondContact O-N 2.99Å; E105-L109 HydrophobicContact CG-CD1 4.12Å; E105-L109 VanDerWaalsContact O-CG 3.28Å; E105-L109 WeakPolarHBondContact O-CG 3.44Å; E105-L109 PolarHBondContact O-N 2.89Å; E105-L377 HydrophobicContact CB-CD2 3.93Å; E105-L377 HydrophobicContact CG-CD2 3.64Å; E105-K381 WeakPolarHBondContact OE1-CE 3.31Å; E105-K381 IonicContact OE1-NZ 3.88Å; E105-K381 PolarHBondContact OE1-NZ 3.3Å
106L92.1Very high92.5Very high3 Ų368.5 Ų68.52%0.01632%0.322CS..Hα-helixtrans-55.4-43.7171.4-76.5171.9000111.7Q102 L109 R110 Q373 E376 L377 L380Q102-L106 WeakPolarHBondContact O-CB 3.43Å; Q102-L106 VanDerWaalsContact O-CG 3.24Å; Q102-L106 WeakPolarHBondContact O-CG 3.42Å; Q102-L106 PolarHBondContact O-N 2.85Å; L106-L109 PolarHBondContact O-N 3.4Å; L106-R110 VanDerWaalsContact O-CB 3.28Å; L106-R110 WeakPolarHBondContact O-CB 3.45Å; L106-R110 WeakPolarHBondContact O-CD 3.31Å; L106-R110 WeakPolarHBondContact O-CG 3.42Å; L106-R110 PolarHBondContact O-N 3.4Å; L106-Q373 HydrophobicContact CD1-CB 3.94Å; L106-Q373 HydrophobicContact CD1-CG 3.83Å; L106-E376 HydrophobicContact CD2-CB 3.85Å; L106-E376 HydrophobicContact CD2-CG 3.73Å; L106-L377 HydrophobicContact CD2-CB 4.42Å; L106-L377 HydrophobicContact CD2-CD2 3.67Å; L106-L377 HydrophobicContact CD2-CG 3.7Å; L106-L377 HydrophobicContact CG-CD2 3.76Å; L106-L377 HydrophobicContact CG-CG 3.88Å; L106-L380 HydrophobicContact CD2-CD1 3.74Å
107T92.1Very high92.5Very high72 Ų7267.7 Ų67.744%0.44232%0.317SS..Hα-helixtrans-61.3-47.1177.9-58.20000111.3E103 R104 E105 R110 E111E103-T107 WeakPolarHBondContact O-CB 3.37Å; E103-T107 PolarHBondContact O-N 3.4Å; E103-T107 PolarHBondContact O-OG1 3.09Å; R104-T107 WeakPolarHBondContact O-CB 3.27Å; R104-T107 PolarHBondContact O-N 2.84Å; E105-T107 VanDerWaalsContact C-N 3.29Å; E105-T107 PolarHBondContact O-N 2.78Å; T107-R110 PolarHBondContact O-N 3.47Å; T107-E111 WeakPolarHBondContact O-CB 3.4Å; T107-E111 PolarHBondContact O-N 2.87Å
108Q92.4Very high92.4Very high123 Ų12365.9 Ų65.958%0.57530%0.304SS*.Hα-helixtrans-63.7-40.5178-70.6170.4-30.500112.9R104 E105 E111 K112R104-Q108 WeakPolarHBondContact O-CG 3.35Å; R104-Q108 PolarHBondContact O-N 3.12Å; E105-Q108 PolarHBondContact O-N 2.99Å; Q108-E111 PolarHBondContact O-N 3.32Å; Q108-K112 PolarHBondContact O-N 3.21Å
109L92.1Very high92.3Very high25 Ų2564.5 Ų64.513%0.13130%0.301CS..Hα-helixtrans-72.4-39178.8-61.9171.8000111.9E105 L106 E111 K112 L113 L377 L380 K381 L384E105-L109 HydrophobicContact CG-CD1 4.12Å; E105-L109 VanDerWaalsContact O-CG 3.28Å; E105-L109 WeakPolarHBondContact O-CG 3.44Å; E105-L109 PolarHBondContact O-N 2.89Å; L106-L109 PolarHBondContact O-N 3.4Å; L109-E111 VanDerWaalsContact C-N 3.28Å; L109-E111 PolarHBondContact O-N 3.07Å; L109-K112 PolarHBondContact O-N 3.21Å; L109-L113 WeakPolarHBondContact O-CB 3.5Å; L109-L113 WeakPolarHBondContact O-CG 3.44Å; L109-L113 PolarHBondContact O-N 2.98Å; L109-L377 HydrophobicContact CD1-CD2 3.7Å; L109-L380 HydrophobicContact CB-CB 4.29Å; L109-L380 HydrophobicContact CB-CD1 4.4Å; L109-K381 HydrophobicContact CD1-CD 4.5Å; L109-K381 HydrophobicContact CD1-CG 3.88Å; L109-L384 HydrophobicContact CB-CD1 4.02Å; L109-L384 HydrophobicContact CD2-CD1 3.45Å; L109-L384 VanDerWaalsContact CD2-CD1 3.45Å; L109-L384 HydrophobicContact CG-CD1 4.28Å
110R93Very high92.3Very high110 Ų11064.1 Ų64.142%0.41530%0.298SS..Hα-helixtrans-62.9-34.4171.5-70.5167.4-177.4169.6-4111.9L106 T107 R114 E376 L380L106-R110 VanDerWaalsContact O-CB 3.28Å; L106-R110 WeakPolarHBondContact O-CB 3.45Å; L106-R110 WeakPolarHBondContact O-CD 3.31Å; L106-R110 WeakPolarHBondContact O-CG 3.42Å; L106-R110 PolarHBondContact O-N 3.4Å; T107-R110 PolarHBondContact O-N 3.47Å; R110-R114 WeakPolarHBondContact O-CB 3.28Å; R110-R114 PolarHBondContact O-N 2.72Å; R110-R114 VanDerWaalsContact O-N 3.16Å; R110-E376 IonicContact CZ-OE1 2.83Å; R110-E376 IonicContact CZ-OE2 3.95Å; R110-E376 IonicContact NE-OE1 2.71Å; R110-E376 PolarHBondContact NE-OE1 3.23Å; R110-E376 IonicContact NH2-OE1 2.66Å; R110-E376 PolarHBondContact NH2-OE1 3.28Å; R110-E376 IonicContact NH2-OE2 3.25Å; R110-E376 PolarHBondContact NH2-OE2 3.17Å; R110-L380 HydrophobicContact CG-CD1 3.64Å
111E92.2Very high92.5Very high112 Ų11264.2 Ų64.252%0.52330%0.295SS..Hα-helixtrans-68-53174-173.2160.8-130.700111T107 Q108 L109 L113 R114 E115T107-E111 WeakPolarHBondContact O-CB 3.4Å; T107-E111 PolarHBondContact O-N 2.87Å; Q108-E111 PolarHBondContact O-N 3.32Å; L109-E111 VanDerWaalsContact C-N 3.28Å; L109-E111 PolarHBondContact O-N 3.07Å; E111-L113 VanDerWaalsContact C-N 3.31Å; E111-L113 PolarHBondContact O-N 2.76Å; E111-R114 WeakPolarHBondContact O-CB 3.31Å; E111-R114 PolarHBondContact O-N 2.7Å; E111-E115 WeakPolarHBondContact O-CG 3.33Å; E111-E115 PolarHBondContact O-N 2.87Å
112K92Very high92.6Very high34 Ų3464.2 Ų64.215%0.14830%0.295CS..Hα-helixtrans-55.5-40.4174.2-84.1-176.4171.4-93.80113.5Q108 L109 E115 G116 L384 K432 S434 E436Q108-K112 PolarHBondContact O-N 3.21Å; L109-K112 PolarHBondContact O-N 3.21Å; K112-E115 PolarHBondContact O-N 2.88Å; K112-G116 PolarHBondContact O-N 3.49Å; K112-L384 HydrophobicContact CB-CD2 4Å; K112-K432 PolarHBondContact NZ-O 3.26Å; K112-S434 PolarHBondContact NZ-O 3.02Å; K112-E436 WeakPolarHBondContact CE-OE2 3.36Å; K112-E436 IonicContact NZ-OE2 3.76Å; K112-E436 PolarHBondContact NZ-OE2 2.97Å
113L92.4Very high92.6Very high10 Ų1063.6 Ų63.65%0.05229%0.292CS..Hα-helixtrans-63.7-39.9175.6-79.6167000112.4L109 E111 R117 L162 L380 K383 L384L109-L113 WeakPolarHBondContact O-CB 3.5Å; L109-L113 WeakPolarHBondContact O-CG 3.44Å; L109-L113 PolarHBondContact O-N 2.98Å; E111-L113 VanDerWaalsContact C-N 3.31Å; E111-L113 PolarHBondContact O-N 2.76Å; L113-R117 WeakPolarHBondContact O-CB 3.46Å; L113-R117 PolarHBondContact O-N 3.41Å; L113-L162 HydrophobicContact CD2-CD2 3.68Å; L113-L380 HydrophobicContact CD1-CB 3.95Å; L113-L380 HydrophobicContact CD1-CD2 3.51Å; L113-L380 HydrophobicContact CD1-CG 4.21Å; L113-K383 HydrophobicContact CD2-CB 3.97Å; L113-L384 HydrophobicContact CD1-CG 4.41Å; L113-L384 HydrophobicContact CD2-CD2 3.68Å; L113-L384 HydrophobicContact CD2-CG 3.7Å; L113-L384 HydrophobicContact CG-CD1 4.37Å; L113-L384 HydrophobicContact CG-CD2 3.73Å; L113-L384 HydrophobicContact CG-CG 3.73Å
114R92Very high92.6Very high152 Ų15261.4 Ų61.457%0.57428%0.28SS*.Hα-helixtrans-65.9-50.9175.4-174.3-171.7-53.91793.7110.9R110 E111 G116 R117 D118R110-R114 WeakPolarHBondContact O-CB 3.28Å; R110-R114 PolarHBondContact O-N 2.72Å; R110-R114 VanDerWaalsContact O-N 3.16Å; E111-R114 WeakPolarHBondContact O-CB 3.31Å; E111-R114 PolarHBondContact O-N 2.7Å; R114-G116 VanDerWaalsContact C-N 3.29Å; R114-G116 PolarHBondContact O-N 2.97Å; R114-R117 WeakPolarHBondContact O-CB 3.31Å; R114-R117 PolarHBondContact O-N 3.33Å; R114-R117 VanDerWaalsContact O-N 3.15Å; R114-D118 PolarHBondContact O-N 3.3Å
115E91.6Very high92.6Very high81 Ų8158.8 Ų58.838%0.37928%0.275SS..Hα-helixtrans-60.3-39.5179-68.3-156.7126.600112.8E111 K112 A119 K432E111-E115 WeakPolarHBondContact O-CG 3.33Å; E111-E115 PolarHBondContact O-N 2.87Å; K112-E115 PolarHBondContact O-N 2.88Å; E115-A119 WeakPolarHBondContact O-CB 3.42Å; E115-A119 PolarHBondContact O-N 3.44Å; E115-K432 HydrophobicContact CB-CD 4.25Å; E115-K432 IonicContact OE1-NZ 3.79Å; E115-K432 PolarHBondContact OE1-NZ 3.39Å; E115-K432 WeakPolarHBondContact OE2-CE 3.27Å; E115-K432 IonicContact OE2-NZ 2.7Å; E115-K432 PolarHBondContact OE2-NZ 2.97Å
116G93.3Very high92.5Very high0 Ų057.3 Ų57.30%027%0.268CS..Hα-helixtrans-62.6-48.6172.900000111.5K112 R114 D118 A119 S120 L429K112-G116 PolarHBondContact O-N 3.49Å; R114-G116 VanDerWaalsContact C-N 3.29Å; R114-G116 PolarHBondContact O-N 2.97Å; G116-D118 VanDerWaalsContact C-N 3.33Å; G116-D118 PolarHBondContact O-N 3.16Å; G116-A119 PolarHBondContact O-N 3.13Å; G116-S120 WeakPolarHBondContact O-CB 3.42Å; G116-S120 PolarHBondContact O-N 2.91Å; G116-S120 PolarHBondContact O-OG 2.84Å; G116-L429 WeakPolarHBondContact O-CD1 3.39Å
117R93.5Very high92.4Very high51 Ų5157.2 Ų57.219%0.19227%0.267CS..Hα-helixtrans-58.5-43177-171.8-165.4-47.6160.95.4112.6L113 R114 S120 R121 V159 L162L113-R117 WeakPolarHBondContact O-CB 3.46Å; L113-R117 PolarHBondContact O-N 3.41Å; R114-R117 WeakPolarHBondContact O-CB 3.31Å; R114-R117 PolarHBondContact O-N 3.33Å; R114-R117 VanDerWaalsContact O-N 3.15Å; R117-S120 WeakPolarHBondContact O-CB 3.05Å; R117-S120 PolarHBondContact O-N 2.87Å; R117-R121 PolarHBondContact O-N 3.25Å; R117-V159 HydrophobicContact CG-CG1 4.01Å; R117-L162 HydrophobicContact CB-CB 3.86Å; R117-L162 HydrophobicContact CG-CB 4.3Å; R117-L162 VanDerWaalsContact CZ-O 3.26Å; R117-L162 PolarHBondContact NE-O 3.3Å; R117-L162 PolarHBondContact NH2-O 2.94Å
118D91.8Very high92.3Very high59 Ų5958.4 Ų58.432%0.31627%0.268SS..Hα-helixtrans-70.4-39.5-179.1-67.3-32000111.2R114 G116 R121 S122R114-D118 PolarHBondContact O-N 3.3Å; G116-D118 VanDerWaalsContact C-N 3.33Å; G116-D118 PolarHBondContact O-N 3.16Å; D118-R121 WeakPolarHBondContact O-CB 3.43Å; D118-R121 PolarHBondContact O-N 3.38Å; D118-R121 IonicContact OD1-CZ 2.74Å; D118-R121 VanDerWaalsContact OD1-CZ 3.25Å; D118-R121 IonicContact OD1-NH1 2.66Å; D118-R121 PolarHBondContact OD1-NH1 3.18Å; D118-R121 IonicContact OD1-NH2 3.77Å; D118-R121 PolarHBondContact OD1-NH2 2.91Å; D118-S122 PolarHBondContact O-N 3.06Å; D118-S122 VanDerWaalsContact O-N 3.07Å; D118-S122 PolarHBondContact O-OG 3.47Å
119A92.5Very high92.1Very high29 Ų2956.1 Ų56.124%0.2427%0.27CS..Hα-helixtrans-65.7-35.7170.600000113.1E115 G116 R121 S122 L123 L429E115-A119 WeakPolarHBondContact O-CB 3.42Å; E115-A119 PolarHBondContact O-N 3.44Å; G116-A119 PolarHBondContact O-N 3.13Å; A119-R121 VanDerWaalsContact C-N 3.3Å; A119-R121 PolarHBondContact O-N 2.67Å; A119-S122 PolarHBondContact O-N 3.44Å; A119-L123 PolarHBondContact O-N 3.35Å; A119-L429 HydrophobicContact CB-CD1 3.95Å
120S93.8Very high91.7Very high0 Ų056.3 Ų56.30%027%0.271CS..Hα-helixtrans-63.1-36.1171.1-590000112.1G116 R117 L123 Y124 L158 L162 L429G116-S120 WeakPolarHBondContact O-CB 3.42Å; G116-S120 PolarHBondContact O-N 2.91Å; G116-S120 PolarHBondContact O-OG 2.84Å; R117-S120 WeakPolarHBondContact O-CB 3.05Å; R117-S120 PolarHBondContact O-N 2.87Å; S120-L123 PolarHBondContact O-N 3.42Å; S120-Y124 WeakPolarHBondContact O-CB 3.29Å; S120-Y124 PolarHBondContact O-N 2.84Å; S120-L158 WeakPolarHBondContact OG-CD2 3.42Å; S120-L158 WeakPolarHBondContact OG-CG 3.42Å; S120-L162 WeakPolarHBondContact OG-CD1 3.33Å; S120-L429 WeakPolarHBondContact OG-CD2 3.46Å
121R93.3Very high91Very high94 Ų9453.5 Ų53.536%0.35526%0.264SS..Hα-helixtrans-67-45.6175.7-162.2-169.6-57.897.27.6111.1R117 D118 A119 L123 Y124 E125 V159R117-R121 PolarHBondContact O-N 3.25Å; D118-R121 WeakPolarHBondContact O-CB 3.43Å; D118-R121 PolarHBondContact O-N 3.38Å; D118-R121 IonicContact OD1-CZ 2.74Å; D118-R121 VanDerWaalsContact OD1-CZ 3.25Å; D118-R121 IonicContact OD1-NH1 2.66Å; D118-R121 PolarHBondContact OD1-NH1 3.18Å; D118-R121 IonicContact OD1-NH2 3.77Å; D118-R121 PolarHBondContact OD1-NH2 2.91Å; A119-R121 VanDerWaalsContact C-N 3.3Å; A119-R121 PolarHBondContact O-N 2.67Å; R121-L123 VanDerWaalsContact C-N 3.3Å; R121-L123 PolarHBondContact O-N 2.84Å; R121-Y124 WeakPolarHBondContact O-CB 3.4Å; R121-Y124 PolarHBondContact O-N 2.91Å; R121-Y124 VanDerWaalsContact O-N 3.15Å; R121-E125 WeakPolarHBondContact CD-OE1 3.21Å; R121-E125 WeakPolarHBondContact CG-OE1 3.47Å; R121-E125 WeakPolarHBondContact O-CB 3.34Å; R121-E125 VanDerWaalsContact O-CG 3.29Å; R121-E125 WeakPolarHBondContact O-CG 3.46Å; R121-E125 PolarHBondContact O-N 2.76Å; R121-V159 HydrophobicContact CB-CG2 4.15Å
122S93.3Very high89.8Confident63 Ų6352.1 Ų52.144%0.44126%0.263SS..Hα-helixtrans-64.1-33.1175-60.70000113.1D118 A119 H126D118-S122 PolarHBondContact O-N 3.06Å; D118-S122 VanDerWaalsContact O-N 3.07Å; D118-S122 PolarHBondContact O-OG 3.47Å; A119-S122 PolarHBondContact O-N 3.44Å; S122-H126 VanDerWaalsContact O-CB 3.3Å; S122-H126 WeakPolarHBondContact O-CB 3.45Å; S122-H126 PolarHBondContact O-N 2.68Å
123L92.9Very high88.1Confident1 Ų156.3 Ų56.31%0.00529%0.294CS..Hα-helixtrans-68.2-40.7171.217756.6000112A119 S120 R121 H126 L127 L394 L398 L425 A426 L429A119-L123 PolarHBondContact O-N 3.35Å; S120-L123 PolarHBondContact O-N 3.42Å; R121-L123 VanDerWaalsContact C-N 3.3Å; R121-L123 PolarHBondContact O-N 2.84Å; L123-H126 PolarHBondContact O-N 3.41Å; L123-L127 HydrophobicContact CD1-CD1 4.06Å; L123-L127 HydrophobicContact CD1-CG 4.08Å; L123-L127 HydrophobicContact CG-CD1 4.23Å; L123-L127 VanDerWaalsContact O-CG 3.3Å; L123-L127 WeakPolarHBondContact O-CG 3.41Å; L123-L127 PolarHBondContact O-N 3.49Å; L123-L394 HydrophobicContact CD2-CD2 3.56Å; L123-L394 HydrophobicContact CD2-CG 4.36Å; L123-L394 HydrophobicContact CG-CD2 4.36Å; L123-L398 HydrophobicContact CD1-CD1 4.4Å; L123-L425 HydrophobicContact CD1-CB 3.98Å; L123-L425 HydrophobicContact CD1-CD1 4.42Å; L123-A426 HydrophobicContact CD2-CB 3.89Å; L123-L429 HydrophobicContact CD2-CD2 4.1Å
124Y92.8Very high86.5Confident53 Ų5362 Ų6221%0.20832%0.324CS..Hα-helixtrans-61-47.7172.8169.2-91.5000111.7S120 R121 H126 L127 Q128 C152 A155 Q156S120-Y124 WeakPolarHBondContact O-CB 3.29Å; S120-Y124 PolarHBondContact O-N 2.84Å; R121-Y124 WeakPolarHBondContact O-CB 3.4Å; R121-Y124 PolarHBondContact O-N 2.91Å; R121-Y124 VanDerWaalsContact O-N 3.15Å; Y124-H126 VanDerWaalsContact C-N 3.32Å; Y124-H126 PolarHBondContact O-N 3Å; Y124-L127 PolarHBondContact O-N 2.99Å; Y124-Q128 VanDerWaalsContact O-CB 3.31Å; Y124-Q128 WeakPolarHBondContact O-CB 3.31Å; Y124-Q128 PolarHBondContact O-N 3.05Å; Y124-Q128 PolarHBondContact OH-OE1 3.26Å; Y124-Q128 VanDerWaalsContact OH-OE1 3.11Å; Y124-C152 HydrophobicContact CD2-CB 4.37Å; Y124-C152 WeakPolarHBondContact CD2-O 3.26Å; Y124-C152 HydrophobicContact CE2-CB 4.17Å; Y124-A155 HydrophobicContact CD2-CB 4.37Å; Y124-Q156 HydrophobicContact CD2-CB 3.8Å; Y124-Q156 HydrophobicContact CE2-CB 3.89Å; Y124-Q156 HydrophobicContact CE2-CG 4.33Å
125E92.2Very high84.5Confident102 Ų10263.6 Ų63.648%0.47734%0.338SS..Hα-helixtrans-58.7-42.4176.4-71.5160.2-172.900111.5R121 Q128 A129R121-E125 WeakPolarHBondContact CD-OE1 3.21Å; R121-E125 WeakPolarHBondContact CG-OE1 3.47Å; R121-E125 WeakPolarHBondContact O-CB 3.34Å; R121-E125 VanDerWaalsContact O-CG 3.29Å; R121-E125 WeakPolarHBondContact O-CG 3.46Å; R121-E125 PolarHBondContact O-N 2.76Å; E125-Q128 PolarHBondContact O-N 3.45Å; E125-A129 PolarHBondContact O-N 3.22Å
126H91.8Very high82.8Confident30 Ų3062.1 Ų62.114%0.13934%0.336CS..Hα-helixtrans-62.2-48.8175.8-174.887.5000112.5S122 L123 Y124 Q128 A129 L130 Q418 L425S122-H126 VanDerWaalsContact O-CB 3.3Å; S122-H126 WeakPolarHBondContact O-CB 3.45Å; S122-H126 PolarHBondContact O-N 2.68Å; L123-H126 PolarHBondContact O-N 3.41Å; Y124-H126 VanDerWaalsContact C-N 3.32Å; Y124-H126 PolarHBondContact O-N 3Å; H126-Q128 VanDerWaalsContact C-N 3.33Å; H126-Q128 PolarHBondContact O-N 3.44Å; H126-A129 PolarHBondContact O-N 3.35Å; H126-L130 PolarHBondContact O-N 3.27Å; H126-Q418 PolarHBondContact CE1-OE1 2.85Å; H126-Q418 PolarHBondContact NE2-O 3.36Å; H126-L425 HydrophobicContact CB-CD1 4.22Å
127L89.8Confident80.8Confident0 Ų070.1 Ų70.10%038%0.378CS..Hα-helixtrans-67.7-33.6177.9-63.4172.8000111.9L123 Y124 L130 L131 L148 C152 A155 L394 L398L123-L127 HydrophobicContact CD1-CD1 4.06Å; L123-L127 HydrophobicContact CD1-CG 4.08Å; L123-L127 HydrophobicContact CG-CD1 4.23Å; L123-L127 VanDerWaalsContact O-CG 3.3Å; L123-L127 WeakPolarHBondContact O-CG 3.41Å; L123-L127 PolarHBondContact O-N 3.49Å; Y124-L127 PolarHBondContact O-N 2.99Å; L127-L130 PolarHBondContact O-N 3.28Å; L127-L131 PolarHBondContact O-N 2.86Å; L127-L148 HydrophobicContact CB-CD1 4.3Å; L127-L148 HydrophobicContact CD2-CD1 3.89Å; L127-C152 WeakPolarHBondContact CB-SG 3.34Å; L127-A155 HydrophobicContact CD1-CB 4.3Å; L127-L394 HydrophobicContact CD1-CD1 4.4Å; L127-L398 HydrophobicContact CD1-CD1 4.3Å; L127-L398 HydrophobicContact CD1-CD2 4.19Å; L127-L398 HydrophobicContact CD2-CD1 4.25Å; L127-L398 HydrophobicContact CD2-CD2 3.62Å
128Q89.5Confident79.1Confident98 Ų9874.6 Ų74.646%0.45840%0.399SS..Hα-helixtrans-67.6-36.7175-171.8177.64.300112Y124 E125 H126 L130 L131Y124-Q128 VanDerWaalsContact O-CB 3.31Å; Y124-Q128 WeakPolarHBondContact O-CB 3.31Å; Y124-Q128 PolarHBondContact O-N 3.05Å; Y124-Q128 PolarHBondContact OH-OE1 3.26Å; Y124-Q128 VanDerWaalsContact OH-OE1 3.11Å; E125-Q128 PolarHBondContact O-N 3.45Å; H126-Q128 VanDerWaalsContact C-N 3.33Å; H126-Q128 PolarHBondContact O-N 3.44Å; Q128-L130 PolarHBondContact O-N 3.11Å; Q128-L131 WeakPolarHBondContact O-CB 3.36Å; Q128-L131 PolarHBondContact O-N 2.92Å
129A87.8Confident77.5Confident75 Ų7576.3 Ų76.362%0.6242%0.416SS*.Hα-helixtrans-63.1-24.9174.900000113.1E125 H126E125-A129 PolarHBondContact O-N 3.22Å; H126-A129 PolarHBondContact O-N 3.35Å
130L83.4Confident75.8Confident29 Ų2979.7 Ų79.715%0.15243%0.427CS..THydrogen-bonded Turntrans-83.3-12.1175.5-59.9173.8000113.3H126 L127 Q128 T132 L148 Q418H126-L130 PolarHBondContact O-N 3.27Å; L127-L130 PolarHBondContact O-N 3.28Å; Q128-L130 PolarHBondContact O-N 3.11Å; L130-T132 PolarHBondContact O-N 3.17Å; L130-T132 VanDerWaalsContact O-N 3.09Å; L130-L148 HydrophobicContact CB-CD1 4.41Å; L130-L148 HydrophobicContact CB-CD2 3.64Å; L130-L148 WeakPolarHBondContact O-CD2 3.4Å; L130-Q418 HydrophobicContact CD1-CB 4Å; L130-Q418 HydrophobicContact CD2-CB 3.54Å; L130-Q418 HydrophobicContact CD2-CG 4.02Å; L130-Q418 HydrophobicContact CG-CB 4.38Å
131L79.5Confident74.4Confident50 Ų5081.2 Ų81.226%0.26244%0.442SS..  trans-83.758171.1-70.2171.3000111.2L127 Q128 Q145 L148 A149 C152L127-L131 PolarHBondContact O-N 2.86Å; Q128-L131 WeakPolarHBondContact O-CB 3.36Å; Q128-L131 PolarHBondContact O-N 2.92Å; L131-Q145 HydrophobicContact CD2-CG 3.99Å; L131-L148 HydrophobicContact CD2-CB 4.05Å; L131-L148 HydrophobicContact CD2-CD2 3.75Å; L131-L148 HydrophobicContact CD2-CG 3.78Å; L131-L148 HydrophobicContact CG-CD2 3.97Å; L131-L148 HydrophobicContact CG-CG 3.99Å; L131-A149 HydrophobicContact CD1-CB 4.29Å; L131-A149 HydrophobicContact CD2-CB 4.26Å; L131-C152 HydrophobicContact CD1-CB 4.32Å; L131-C152 VanDerWaalsContact CD1-SG 3.53Å
132T67.4Low73.2Confident83 Ų8382 Ų8251%0.50945%0.45SS..  trans-65.3139.8177.1-29.70000110.9L130 D134L130-T132 PolarHBondContact O-N 3.17Å; L130-T132 VanDerWaalsContact O-N 3.09Å; T132-D134 VanDerWaalsContact C-N 3.27Å; T132-D134 PolarHBondContact O-N 2.75Å
133P56.5Low72.5Confident122 Ų12284.4 Ų84.479%0.79246%0.458SS*.  trans-74.51.7-176.4-20.934.5000117.2E135P133-E135 PolarHBondContact O-N 3.38Å
134D57.6Low71.8Confident129 Ų12987.5 Ų87.569%0.6947%0.474SS*.SBendtrans-61.7133.3-176-86.8-11.9000111.7T132 P136T132-D134 VanDerWaalsContact C-N 3.27Å; T132-D134 PolarHBondContact O-N 2.75Å; D134-P136 WeakPolarHBondContact O-CD 3.42Å
135E50.2Low71.2Confident187 Ų18788.1 Ų88.187%0.87448%0.479SS*.  trans-58.7118.5-171.9-67.9-173119.200112.1P133 D137P133-E135 PolarHBondContact O-N 3.38Å; E135-D137 PolarHBondContact O-N 3.07Å
136P55.4Low70.8Confident50 Ų5089.1 Ų89.133%0.32548%0.484SS..  trans-7494.3179.229.3-34.4000110.2D134 K138 Q142D134-P136 WeakPolarHBondContact O-CD 3.42Å; P136-K138 PolarHBondContact O-N 3.18Å; P136-Q142 HydrophobicContact CB-CG 4.19Å; P136-Q142 HydrophobicContact CG-CG 3.71Å
137D50.8Low70.6Confident167 Ų16790.7 Ų90.789%0.89349%0.491SS*.SBendtrans-54.22.1-179.2-133.14.4000115.6E135E135-D137 PolarHBondContact O-N 3.07Å
138K58.8Low70.5Confident145 Ų14591.2 Ų91.263%0.6349%0.494SS*.SBendtrans-152144-178.9-60-176.3-177.6-178.60111.2P136 Q140 G141P136-K138 PolarHBondContact O-N 3.18Å; K138-Q140 PolarHBondContact O-N 3.5Å; K138-Q140 VanDerWaalsContact O-N 3.13Å; K138-G141 PolarHBondContact O-N 3.25Å
139S59Low70.5Confident96 Ų9687.9 Ų87.967%0.67148%0.483SS*.Hα-helixtrans-57.2-28174.756.60000114.6G141 Q142 D143S139-G141 VanDerWaalsContact C-N 3.26Å; S139-G141 PolarHBondContact O-N 3.45Å; S139-Q142 PolarHBondContact O-N 3.37Å; S139-D143 PolarHBondContact O-N 3.06Å
140Q56.3Low70.6Confident100 Ų10087.4 Ų87.447%0.46747%0.468SS..Hα-helixtrans-67-24.9174.7-169.5-179.6-1.600113K138 Y405K138-Q140 PolarHBondContact O-N 3.5Å; K138-Q140 VanDerWaalsContact O-N 3.13Å; Q140-Y405 VanDerWaalsContact NE2-CE1 3.3Å; Q140-Y405 VanDerWaalsContact NE2-CZ 3.26Å
141G64.5Low71Confident31 Ų3186 Ų8632%0.3246%0.461SS..Hα-helixtrans-74-34.4173.400000112.5K138 S139 Q145K138-G141 PolarHBondContact O-N 3.25Å; S139-G141 VanDerWaalsContact C-N 3.26Å; S139-G141 PolarHBondContact O-N 3.45Å; G141-Q145 VanDerWaalsContact O-CB 3.3Å; G141-Q145 WeakPolarHBondContact O-CB 3.13Å; G141-Q145 PolarHBondContact O-N 3.25Å
142Q68.6Low71.5Confident110 Ų11084 Ų8451%0.51445%0.451SS..Hα-helixtrans-67.4-41.1179.5-60.7-179.9-66.500111.8P136 S139 Q145 E146P136-Q142 HydrophobicContact CB-CG 4.19Å; P136-Q142 HydrophobicContact CG-CG 3.71Å; S139-Q142 PolarHBondContact O-N 3.37Å; Q142-Q145 PolarHBondContact O-N 3.02Å; Q142-E146 PolarHBondContact O-N 3.25Å
143D76.9Confident72.7Confident115 Ų11586 Ų8662%0.61545%0.449SS*.Hα-helixtrans-60.6-46177.8-157.257.6000111.5S139 E146 Q147S139-D143 PolarHBondContact O-N 3.06Å; D143-E146 PolarHBondContact O-N 3.01Å; D143-Q147 WeakPolarHBondContact O-CG 3.29Å; D143-Q147 PolarHBondContact O-N 2.91Å; D143-Q147 VanDerWaalsContact O-N 3.09Å
144L78.2Confident74.4Confident65 Ų6583.2 Ų83.234%0.3443%0.427SS..Hα-helixtrans-67.2-36.5174.5-175.7147.7000112.3Q147 L148 L415L144-Q147 PolarHBondContact O-N 3.23Å; L144-L148 VanDerWaalsContact O-CB 3.3Å; L144-L148 WeakPolarHBondContact O-CB 3.3Å; L144-L148 PolarHBondContact O-N 3.41Å; L144-L415 HydrophobicContact CD1-CD2 4.49Å; L144-L415 HydrophobicContact CD2-CD1 4.48Å; L144-L415 HydrophobicContact CD2-CD2 4.32Å
145Q80.4Confident76.1Confident66 Ų6677.1 Ų77.131%0.30839%0.394SS..Hα-helixtrans-67.6-39.2177-170.6177.527.300112L131 G141 Q142 L148 A149L131-Q145 HydrophobicContact CD2-CG 3.99Å; G141-Q145 VanDerWaalsContact O-CB 3.3Å; G141-Q145 WeakPolarHBondContact O-CB 3.13Å; G141-Q145 PolarHBondContact O-N 3.25Å; Q142-Q145 PolarHBondContact O-N 3.02Å; Q145-L148 PolarHBondContact O-N 3.48Å; Q145-A149 WeakPolarHBondContact O-CB 3.26Å; Q145-A149 PolarHBondContact O-N 3.01Å
146E85.3Confident78.1Confident124 Ų12472.7 Ų72.758%0.57937%0.374SS*.Hα-helixtrans-66.6-41.6174.9-179.6162.8-165.800111.6Q142 D143 A149 E150Q142-E146 PolarHBondContact O-N 3.25Å; D143-E146 PolarHBondContact O-N 3.01Å; E146-A149 PolarHBondContact O-N 3.11Å; E146-E150 PolarHBondContact O-N 3.42Å
147Q86.8Confident79.9Confident63 Ų6374.8 Ų74.829%0.29438%0.379SS..Hα-helixtrans-69-33.7174.6-70.5-69.1-80.700113.5D143 L144 E150 G151 H397 L401D143-Q147 WeakPolarHBondContact O-CG 3.29Å; D143-Q147 PolarHBondContact O-N 2.91Å; D143-Q147 VanDerWaalsContact O-N 3.09Å; L144-Q147 PolarHBondContact O-N 3.23Å; Q147-E150 PolarHBondContact NE2-OE2 2.85Å; Q147-E150 WeakPolarHBondContact O-CB 3.33Å; Q147-E150 PolarHBondContact O-N 3.25Å; Q147-G151 PolarHBondContact O-N 2.94Å; Q147-H397 PolarHBondContact O-NE2 3.4Å; Q147-H397 PolarHBondContact OE1-CE1 3.48Å; Q147-H397 VanDerWaalsContact OE1-CE1 3.28Å; Q147-L401 HydrophobicContact CB-CD1 4.05Å; Q147-L401 HydrophobicContact CB-CD2 3.48Å; Q147-L401 VanDerWaalsContact CB-CD2 3.48Å; Q147-L401 HydrophobicContact CB-CG 4.35Å; Q147-L401 HydrophobicContact CG-CD2 4.05Å
148L87.2Confident81.8Confident10 Ų1067 Ų675%0.05234%0.337CS..Hα-helixtrans-68.1-40.4171.8179.561.1000111.2L127 L130 L131 L144 Q145 E150 G151 C152L127-L148 HydrophobicContact CB-CD1 4.3Å; L127-L148 HydrophobicContact CD2-CD1 3.89Å; L130-L148 HydrophobicContact CB-CD1 4.41Å; L130-L148 HydrophobicContact CB-CD2 3.64Å; L130-L148 WeakPolarHBondContact O-CD2 3.4Å; L131-L148 HydrophobicContact CD2-CB 4.05Å; L131-L148 HydrophobicContact CD2-CD2 3.75Å; L131-L148 HydrophobicContact CD2-CG 3.78Å; L131-L148 HydrophobicContact CG-CD2 3.97Å; L131-L148 HydrophobicContact CG-CG 3.99Å; L144-L148 VanDerWaalsContact O-CB 3.3Å; L144-L148 WeakPolarHBondContact O-CB 3.3Å; L144-L148 PolarHBondContact O-N 3.41Å; Q145-L148 PolarHBondContact O-N 3.48Å; L148-E150 VanDerWaalsContact C-N 3.27Å; L148-E150 PolarHBondContact O-N 2.85Å; L148-G151 WeakPolarHBondContact O-CA 3.47Å; L148-G151 PolarHBondContact O-N 3.01Å; L148-G151 VanDerWaalsContact O-N 3.08Å; L148-C152 PolarHBondContact O-N 3.19Å; L148-C152 PolarHBondContact O-SG 3.39Å
149A88.8Confident83.4Confident28 Ų2861.3 Ų61.323%0.23132%0.315CS..Hα-helixtrans-63.1-33.4172.300000112.2L131 Q145 E146 C152 R153L131-A149 HydrophobicContact CD1-CB 4.29Å; L131-A149 HydrophobicContact CD2-CB 4.26Å; Q145-A149 WeakPolarHBondContact O-CB 3.26Å; Q145-A149 PolarHBondContact O-N 3.01Å; E146-A149 PolarHBondContact O-N 3.11Å; A149-C152 WeakPolarHBondContact O-CB 3.41Å; A149-C152 PolarHBondContact O-N 2.96Å; A149-R153 WeakPolarHBondContact O-CG 3.5Å; A149-R153 PolarHBondContact O-N 3.41Å
150E90.5Very high84.9Confident65 Ų6562.6 Ų62.630%0.30431%0.31SS..Hα-helixtrans-63.1-42.5168.8-174.1143.8-107.100112.5E146 Q147 L148 C152 R153 L154 H397E146-E150 PolarHBondContact O-N 3.42Å; Q147-E150 PolarHBondContact NE2-OE2 2.85Å; Q147-E150 WeakPolarHBondContact O-CB 3.33Å; Q147-E150 PolarHBondContact O-N 3.25Å; L148-E150 VanDerWaalsContact C-N 3.27Å; L148-E150 PolarHBondContact O-N 2.85Å; E150-C152 VanDerWaalsContact C-N 3.31Å; E150-C152 PolarHBondContact O-N 3.49Å; E150-R153 PolarHBondContact O-N 3.25Å; E150-R153 IonicContact OE1-CZ 3.63Å; E150-R153 IonicContact OE1-NH2 3.6Å; E150-R153 PolarHBondContact OE1-NH2 2.88Å; E150-L154 HydrophobicContact CG-CD1 4.33Å; E150-L154 WeakPolarHBondContact O-CG 3.47Å; E150-L154 PolarHBondContact O-N 3.23Å; E150-H397 IonicContact OE2-CE1 2.73Å
151G91.7Very high86.5Confident0 Ų061.1 Ų61.10%030%0.302CS..Hα-helixtrans-56.5-42.8170.700000112.7Q147 L148 L154 A155Q147-G151 PolarHBondContact O-N 2.94Å; L148-G151 WeakPolarHBondContact O-CA 3.47Å; L148-G151 PolarHBondContact O-N 3.01Å; L148-G151 VanDerWaalsContact O-N 3.08Å; G151-L154 PolarHBondContact O-N 2.9Å; G151-A155 WeakPolarHBondContact O-CB 3.36Å; G151-A155 PolarHBondContact O-N 2.88Å
152C90.9Very high87.7Confident8 Ų859.7 Ų59.75%0.05429%0.287CS..Hα-helixtrans-63.2-45.1173.5-64.90000112.5Y124 L127 L131 L148 A149 E150 L154 A155 Q156Y124-C152 HydrophobicContact CD2-CB 4.37Å; Y124-C152 WeakPolarHBondContact CD2-O 3.26Å; Y124-C152 HydrophobicContact CE2-CB 4.17Å; L127-C152 WeakPolarHBondContact CB-SG 3.34Å; L131-C152 HydrophobicContact CD1-CB 4.32Å; L131-C152 VanDerWaalsContact CD1-SG 3.53Å; L148-C152 PolarHBondContact O-N 3.19Å; L148-C152 PolarHBondContact O-SG 3.39Å; A149-C152 WeakPolarHBondContact O-CB 3.41Å; A149-C152 PolarHBondContact O-N 2.96Å; E150-C152 VanDerWaalsContact C-N 3.31Å; E150-C152 PolarHBondContact O-N 3.49Å; C152-L154 VanDerWaalsContact C-N 3.31Å; C152-L154 PolarHBondContact O-N 3.47Å; C152-A155 PolarHBondContact O-N 3.36Å; C152-Q156 WeakPolarHBondContact O-CB 3.35Å; C152-Q156 PolarHBondContact O-N 3.09Å
153R92.3Very high88.6Confident125 Ų12556.2 Ų56.247%0.47228%0.275SS..Hα-helixtrans-57.6-44.4175.3-69.5-173.5-59.1-109.910.5111.4A149 E150 Q156 H157A149-R153 WeakPolarHBondContact O-CG 3.5Å; A149-R153 PolarHBondContact O-N 3.41Å; E150-R153 PolarHBondContact O-N 3.25Å; E150-R153 IonicContact OE1-CZ 3.63Å; E150-R153 IonicContact OE1-NH2 3.6Å; E150-R153 PolarHBondContact OE1-NH2 2.88Å; R153-Q156 PolarHBondContact O-N 2.67Å; R153-H157 VanDerWaalsContact O-CB 3.31Å; R153-H157 WeakPolarHBondContact O-CB 3.38Å; R153-H157 PolarHBondContact O-N 2.96Å
154L93Very high88.4Confident64 Ų6454.9 Ų54.934%0.33527%0.272SS..Hα-helixtrans-64.9-43.3178-71.7171000112.2E150 G151 C152 L158 L394 H397E150-L154 HydrophobicContact CG-CD1 4.33Å; E150-L154 WeakPolarHBondContact O-CG 3.47Å; E150-L154 PolarHBondContact O-N 3.23Å; G151-L154 PolarHBondContact O-N 2.9Å; C152-L154 VanDerWaalsContact C-N 3.31Å; C152-L154 PolarHBondContact O-N 3.47Å; L154-L158 WeakPolarHBondContact O-CB 3.39Å; L154-L158 PolarHBondContact O-N 3.06Å; L154-L394 HydrophobicContact CB-CD1 3.96Å; L154-L394 HydrophobicContact CD1-CD1 4.38Å; L154-H397 HydrophobicContact CD1-CB 4.34Å
155A92.8Very high87.6Confident0 Ų057.5 Ų57.50%028%0.283CS..Hα-helixtrans-65.9-39.1176.300000112.5Y124 L127 G151 C152 L158 V159 L394Y124-A155 HydrophobicContact CD2-CB 4.37Å; L127-A155 HydrophobicContact CD1-CB 4.3Å; G151-A155 WeakPolarHBondContact O-CB 3.36Å; G151-A155 PolarHBondContact O-N 2.88Å; C152-A155 PolarHBondContact O-N 3.36Å; A155-L158 WeakPolarHBondContact O-CB 3.31Å; A155-L158 PolarHBondContact O-N 3.03Å; A155-V159 PolarHBondContact O-N 3.47Å; A155-L394 HydrophobicContact CB-CD2 3.9Å
156Q92.1Very high85.8Confident94 Ų9461.2 Ų61.244%0.43931%0.305SS..Hα-helixtrans-66.2-45.9175.6-169.1179.620.200111.8Y124 C152 R153 L158 V159 Q160Y124-Q156 HydrophobicContact CD2-CB 3.8Å; Y124-Q156 HydrophobicContact CE2-CB 3.89Å; Y124-Q156 HydrophobicContact CE2-CG 4.33Å; C152-Q156 WeakPolarHBondContact O-CB 3.35Å; C152-Q156 PolarHBondContact O-N 3.09Å; R153-Q156 PolarHBondContact O-N 2.67Å; Q156-L158 PolarHBondContact O-N 3.38Å; Q156-V159 WeakPolarHBondContact O-CB 3.37Å; Q156-V159 PolarHBondContact O-N 3.47Å; Q156-V159 VanDerWaalsContact O-N 3.13Å; Q156-Q160 PolarHBondContact O-N 2.74Å
157H92.3Very high83.5Confident95 Ų9561.7 Ų61.744%0.4431%0.312SS..Hα-helixtrans-60.2-34.1173.7175.8-105.9000111.8R153 Q160 K161R153-H157 VanDerWaalsContact O-CB 3.31Å; R153-H157 WeakPolarHBondContact O-CB 3.38Å; R153-H157 PolarHBondContact O-N 2.96Å; H157-Q160 WeakPolarHBondContact O-CB 3.26Å; H157-Q160 PolarHBondContact O-N 3.31Å; H157-K161 WeakPolarHBondContact O-CB 3.49Å; H157-K161 PolarHBondContact O-N 3.21Å
158L92.4Very high81.1Confident2 Ų266 Ų661%0.0133%0.332CS..Hα-helixtrans-69-36.3174.5-177.360.9000113S120 L154 A155 Q156 Q160 K161 L162 G387 A390 S391 L394 L429S120-L158 WeakPolarHBondContact OG-CD2 3.42Å; S120-L158 WeakPolarHBondContact OG-CG 3.42Å; L154-L158 WeakPolarHBondContact O-CB 3.39Å; L154-L158 PolarHBondContact O-N 3.06Å; A155-L158 WeakPolarHBondContact O-CB 3.31Å; A155-L158 PolarHBondContact O-N 3.03Å; Q156-L158 PolarHBondContact O-N 3.38Å; L158-Q160 VanDerWaalsContact C-N 3.35Å; L158-K161 PolarHBondContact O-N 3.02Å; L158-L162 HydrophobicContact CD1-CD1 3.87Å; L158-L162 HydrophobicContact CD1-CG 4.1Å; L158-L162 HydrophobicContact CG-CD1 4.02Å; L158-L162 WeakPolarHBondContact O-CB 3.42Å; L158-L162 WeakPolarHBondContact O-CG 3.46Å; L158-L162 PolarHBondContact O-N 3.5Å; L158-G387 WeakPolarHBondContact CD1-O 3.42Å; L158-A390 HydrophobicContact CD1-CB 3.98Å; L158-S391 WeakPolarHBondContact CD2-OG 3.46Å; L158-L394 HydrophobicContact CD2-CD2 4.44Å; L158-L429 HydrophobicContact CD2-CD2 3.6Å
159V92.2Very high79.1Confident27 Ų2773.6 Ų73.616%0.16437%0.372CS..Hα-helixtrans-62.1-42.2170.2173.10000111R117 R121 A155 Q156 S163R117-V159 HydrophobicContact CG-CG1 4.01Å; R121-V159 HydrophobicContact CB-CG2 4.15Å; A155-V159 PolarHBondContact O-N 3.47Å; Q156-V159 WeakPolarHBondContact O-CB 3.37Å; Q156-V159 PolarHBondContact O-N 3.47Å; Q156-V159 VanDerWaalsContact O-N 3.13Å; V159-S163 PolarHBondContact O-N 2.9Å; V159-S163 PolarHBondContact O-OG 3.34Å
160Q89.9Confident76.7Confident122 Ų12280.2 Ų80.257%0.5740%0.398SS*.Hα-helixtrans-63.6-47.9174.6-68.2170.4-23.600111.1Q156 H157 L158 L162 S163Q156-Q160 PolarHBondContact O-N 2.74Å; H157-Q160 WeakPolarHBondContact O-CB 3.26Å; H157-Q160 PolarHBondContact O-N 3.31Å; L158-Q160 VanDerWaalsContact C-N 3.35Å; Q160-L162 VanDerWaalsContact C-N 3.3Å; Q160-L162 PolarHBondContact O-N 3.44Å; Q160-S163 WeakPolarHBondContact O-CB 3.38Å; Q160-S163 PolarHBondContact O-N 3.41Å
161K90Very high74.3Confident70 Ų7084.8 Ų84.830%0.30443%0.425SS..Hα-helixtrans-67.5-26.7-177.2-163.4161.3-165.5178.80114.2H157 L158 S163 E386H157-K161 WeakPolarHBondContact O-CB 3.49Å; H157-K161 PolarHBondContact O-N 3.21Å; L158-K161 PolarHBondContact O-N 3.02Å; K161-S163 VanDerWaalsContact C-N 3.35Å; K161-E386 HydrophobicContact CD-CB 4.49Å; K161-E386 WeakPolarHBondContact CE-OE2 3.38Å; K161-E386 IonicContact NZ-OE2 2.85Å; K161-E386 PolarHBondContact NZ-OE2 3.09Å
162L89.8Confident72.2Confident1 Ų193.4 Ų93.41%0.00547%0.465CS..THydrogen-bonded Turntrans-89.42.9171.7-65.4172000113.3L113 R117 S120 L158 Q160 L433L113-L162 HydrophobicContact CD2-CD2 3.68Å; R117-L162 HydrophobicContact CB-CB 3.86Å; R117-L162 HydrophobicContact CG-CB 4.3Å; R117-L162 VanDerWaalsContact CZ-O 3.26Å; R117-L162 PolarHBondContact NE-O 3.3Å; R117-L162 PolarHBondContact NH2-O 2.94Å; S120-L162 WeakPolarHBondContact OG-CD1 3.33Å; L158-L162 HydrophobicContact CD1-CD1 3.87Å; L158-L162 HydrophobicContact CD1-CG 4.1Å; L158-L162 HydrophobicContact CG-CD1 4.02Å; L158-L162 WeakPolarHBondContact O-CB 3.42Å; L158-L162 WeakPolarHBondContact O-CG 3.46Å; L158-L162 PolarHBondContact O-N 3.5Å; Q160-L162 VanDerWaalsContact C-N 3.3Å; Q160-L162 PolarHBondContact O-N 3.44Å; L162-L433 HydrophobicContact CD1-CD1 4.16Å; L162-L433 HydrophobicContact CD1-CD2 4.34Å; L162-L433 HydrophobicContact CD2-CD1 4.5Å; L162-L433 HydrophobicContact CD2-CD2 3.89Å
163S87.7Confident69.4Low36 Ų36100.5 Ų100.525%0.25250%0.503SS..SBendtrans-78.6160.1172.9-66.50000112V159 Q160 K161V159-S163 PolarHBondContact O-N 2.9Å; V159-S163 PolarHBondContact O-OG 3.34Å; Q160-S163 WeakPolarHBondContact O-CB 3.38Å; Q160-S163 PolarHBondContact O-N 3.41Å; K161-S163 VanDerWaalsContact C-N 3.35Å
164P72Confident66.9Low87 Ų8799.5 Ų99.557%0.56551%0.51SS*.PPolyproline II helixtrans-61.9142.8167.7-7.726.6000107.2N166P164-N166 PolarHBondContact O-N 3.48Å
165E61.8Low64.1Low120 Ų120105.4 Ų105.456%0.56154%0.536SS*.PPolyproline II helixtrans-74120.4156.7-87.2148.4168.200105.2K383E165-K383 VanDerWaalsContact CG-NZ 3.32Å; E165-K383 VanDerWaalsContact N-NZ 3.19Å; E165-K383 IonicContact OE1-NZ 3.68Å; E165-K383 WeakPolarHBondContact OE2-CE 3.47Å; E165-K383 IonicContact OE2-NZ 2.76Å; E165-K383 PolarHBondContact OE2-NZ 3.29Å
166N41.7Very low61.3Low145 Ų145110.7 Ų110.778%0.77557%0.568SS**  trans-76.1109.9146.7-67.6-10.2000103.8P164 E168P164-N166 PolarHBondContact O-N 3.48Å; N166-E168 PolarHBondContact O-N 3.35Å
167D38Very low58.7Low134 Ų134114.7 Ų114.772%0.71759%0.587SS**  trans-74.549.4175.2-69.8-37.1000110.9
168E36Very low56.4Low153 Ų153119 Ų11972%0.71561%0.607SS**  trans-129.2110169.2-68.6-170.2169.900107.8N166 E170N166-E168 PolarHBondContact O-N 3.35Å; E168-E170 PolarHBondContact O-N 2.76Å
169D45.3Very low53.7Low170 Ų170123 Ų12391%0.90964%0.641SS**  trans-68.470.2170.2-66.8-64.6000109.9D171D169-D171 PolarHBondContact O-N 2.97Å; D169-D171 VanDerWaalsContact O-N 3.12Å
170E37.6Very low50.9Low166 Ų166130.6 Ų130.678%0.77668%0.675SS**  trans-74.193.6166.6-74.6-93111.300108.4E168 E172E168-E170 PolarHBondContact O-N 2.76Å; E170-E172 PolarHBondContact O-N 2.99Å
171D40.8Very low48.3Very low161 Ų161134.7 Ų134.786%0.86169%0.69SS**  trans-49.3126.5168-83.4-47.5000110.6D169D169-D171 PolarHBondContact O-N 2.97Å; D169-D171 VanDerWaalsContact O-N 3.12Å
172E47Very low45.5Very low181 Ų181137.3 Ų137.385%0.84671%0.712SS**  trans11.798.8175.6-69.3-171.8-164.800117.9E170E170-E172 PolarHBondContact O-N 2.99Å
173D33Very low42.8Very low158 Ų158145.9 Ų145.985%0.84576%0.757SS**  trans-127.3107.3144.5-138.3-16.7000111.2Q175D173-Q175 PolarHBondContact O-N 3.38Å; D173-Q175 VanDerWaalsContact O-N 3.16Å
174V38.9Very low40.1Very low103 Ų103152.5 Ų152.562%0.62478%0.784SS**  trans-81.799.8-168.6-172.40000109.8V176V174-V176 HydrophobicContact CB-CG2 4.39Å; V174-V176 HydrophobicContact CG1-CG2 3.61Å; V174-V176 PolarHBondContact O-N 3.06Å
175Q34.6Very low38.1Very low189 Ų189153 Ų15388%0.88379%0.789SS**  trans-69.582.8163.5-69.3-165.36.600110.4D173 E177D173-Q175 PolarHBondContact O-N 3.38Å; D173-Q175 VanDerWaalsContact O-N 3.16Å; Q175-E177 PolarHBondContact O-N 3.25Å; Q175-E177 VanDerWaalsContact O-N 3.09Å
176V34.9Very low36.5Very low111 Ų111153.2 Ų153.267%0.67380%0.804SS**  trans-69.497164-174.10000107.7V174 E178V174-V176 HydrophobicContact CB-CG2 4.39Å; V174-V176 HydrophobicContact CG1-CG2 3.61Å; V174-V176 PolarHBondContact O-N 3.06Å; V176-E178 PolarHBondContact O-N 2.92Å; V176-E178 VanDerWaalsContact O-N 3.11Å
177E37.9Very low36.1Very low178 Ų178150.7 Ų150.783%0.83280%0.803SS**  trans-59.2111.9159.5-92.8-69.9145.500108.2Q175 A179Q175-E177 PolarHBondContact O-N 3.25Å; Q175-E177 VanDerWaalsContact O-N 3.09Å; E177-A179 PolarHBondContact O-N 3.4Å; E177-A179 VanDerWaalsContact O-N 3.08Å
178E43.2Very low35.9Very low185 Ų185150.4 Ų150.486%0.86481%0.809SS**  trans-79.992-166.2-173-179.2-171.300111.5V176V176-E178 PolarHBondContact O-N 2.92Å; V176-E178 VanDerWaalsContact O-N 3.11Å
179A34.6Very low35.7Very low87 Ų87154.5 Ų154.572%0.71982%0.818SS**  trans-128.4138.417100000112.8E177E177-A179 PolarHBondContact O-N 3.4Å; E177-A179 VanDerWaalsContact O-N 3.08Å
180E33.3Very low35.2Very low186 Ų186155 Ų15587%0.86982%0.815SS**  trans55.668.2167.9-58-145114.600119.2V182E180-V182 PolarHBondContact O-N 3.06Å
181K35.3Very low34.9Very low208 Ų208154 Ų15490%0.90482%0.82SS**  trans-81.788.3145.8-98.9-176.3178.9165.10111.5
182V32.9Very low34.5Very low125 Ų125154.8 Ų154.876%0.75882%0.818SS**  trans-14084.2155.1-1690000111.4E180E180-V182 PolarHBondContact O-N 3.06Å
183L32.9Very low33.7Very low180 Ų180156.3 Ų156.394%0.94282%0.822SS**  trans-129.590.4158.3-99.6171.9000108.9S185L183-S185 PolarHBondContact O-N 2.94Å
184E29.6Very low33.6Very low176 Ų176153.4 Ų153.482%0.82282%0.819SS**  trans-87.495.3-174-171.5171-158.600112.2
185S31.1Very low33.2Very low96 Ų96157.8 Ų157.867%0.67183%0.833SS**  trans67.2129.3152.879.30000119.6L183L183-S185 PolarHBondContact O-N 2.94Å
186S28.6Very low33Very low125 Ų125157.4 Ų157.487%0.87483%0.832SS**  -160.7106.3128.4-87.40000110.2
187A33.3Very low32.7Very low93 Ų93157.7 Ų157.777%0.76984%0.839SS**  trans-91.5160.8164.100000109.6
188P32.5Very low32.2Very low128 Ų128158.1 Ų158.183%0.83184%0.838SS**  -124.6136.4129.734.2-28.9000111.8
189R32.9Very low31.9Very low239 Ų239155.1 Ų155.190%0.90283%0.831SS**  trans-85.1159.2164.7-94.6-172.8171.4-168.5-2.6110.8
190E33.5Very low32.3Very low181 Ų181156.5 Ų156.585%0.84683%0.833SS**  trans-54150.8177.7-55.6160.397.900113.6
191V31.8Very low32.3Very low145 Ų145155.5 Ų155.588%0.87983%0.829SS**  trans-125.8128.3154.6-179.70000108.3
192Q32Very low32Very low176 Ų176152.5 Ų152.582%0.82282%0.822SS**  trans-79.3151.4-170.1-59.9164-12.900112.9
193K31.7Very low32.1Very low214 Ų214151.8 Ų151.893%0.9382%0.823SS**  trans-155.3150.2130.8-118.6173.7-176.7-178.40112.1
194A30.2Very low32.1Very low96 Ų96149.9 Ų149.979%0.79381%0.813SS**  trans-110.8161.2-174.800000111.6
195E31.5Very low32.1Very low196 Ų196149.4 Ų149.492%0.91681%0.811SS**  trans-146.9168140.2-137.1164.7-165.900110.2
196E29.4Very low32Very low181 Ų181152.3 Ų152.385%0.84681%0.814SS**  trans-89.1-178.1-163.8-60.3-177.797.400114.6
197S27.9Very low32.1Very low117 Ų117151.5 Ų151.582%0.81881%0.807SS**  trans87.5148.2156.988.20000116.9
198K28.5Very low31.8Very low187 Ų187150.7 Ų150.781%0.81380%0.8SS**  cis-171.2139.9-17.5158.9174.8178.5-1770109.2P200K198-P200 WeakPolarHBondContact O-CD 3.47Å
199V36.1Very low31.6Very low121 Ų121151.7 Ų151.773%0.73380%0.797SS**  trans-69.1135.4173.1-177.50000110.2
200P43.2Very low31.3Very low116 Ų116146.5 Ų146.575%0.75379%0.792SS**  -131.1151.5120.537.5-30.1000113.1K198K198-P200 WeakPolarHBondContact O-CD 3.47Å
201E33.2Very low31Very low166 Ų166143.5 Ų143.578%0.77679%0.789SS**  trans-73.8154.3157.9-62.7151.5115.600109.7
202D29.1Very low31.2Very low144 Ų144141.7 Ų141.777%0.7778%0.784SS**  165.7121.7126.8-92.5-20.6000114.2
203S35.4Very low31Very low111 Ų111141.4 Ų141.478%0.77679%0.787SS**  trans155.8111.1150.658.20000107.5
204L32Very low31Very low139 Ų139135.9 Ų135.973%0.72878%0.776SS**  cis60129.742.6-44.7-178.2000112.2
205E30.6Very low31Very low167 Ų167140.3 Ų140.378%0.7878%0.78SS**  cis-131.7-143.9-6.3-154.2108134.600107.7
206E28.5Very low31.1Very low157 Ų157133.5 Ų133.573%0.73476%0.762SS**  cis-154.6135.41.5-157.5-150114.200110.9
207C31.1Very low31.7Very low108 Ų108130.6 Ų130.673%0.7376%0.759SS**  trans58.6159.4156.2-75.50000120.8
208A26.8Very low31.8Very low76 Ų76130.9 Ų130.963%0.62876%0.759SS**  cis-161.6128-24.500000106.5
209I28.8Very low31.7Very low149 Ų149130 Ų13076%0.76476%0.763SS**  59.4119.183.1-61.2179.9000114.4
210T26.7Very low31.6Very low129 Ų129129.2 Ų129.279%0.79176%0.764SS**  trans67.6155.9166.555.50000118.4
211C27.1Very low30.9Very low118 Ų118130.7 Ų130.780%0.79777%0.765SS**  cis-143.4152.33.6-141.20000113.1
212S36.1Very low30.8Very low108 Ų108131.6 Ų131.676%0.75577%0.769SS**  trans-68.1156.9163.8-48.80000111.2
213N27.9Very low32Very low169 Ų169129 Ų12990%0.90476%0.76SS**  trans-147.5139145.3-116.7-25.6000111.3
214S30.8Very low31.7Very low98 Ų98132.8 Ų132.869%0.68577%0.766SS**  trans-106.5158-171.8540000111.7
215H30.5Very low31.6Very low190 Ų190136 Ų13688%0.8877%0.774SS**  trans-156.1112.2139.4-117.5-61.5000113
216G34Very low31.4Very low52 Ų52135.6 Ų135.654%0.53678%0.777SS.*  trans-87.2168.1145.400000109.6
217P41.1Very low31.3Very low121 Ų121135.5 Ų135.579%0.78678%0.78SS**  -126.8144.680.336.7-27.6000111.8
218C31.3Very low30.9Very low122 Ų122138.7 Ų138.782%0.82478%0.781SS**  60.9111.965-64.30000114
219D25.5Very low30.8Very low168 Ų168141.5 Ų141.590%0.89878%0.784SS**  -150.4178.8115.3-137.5-36.2000111.6
220S33.4Very low30.6Very low106 Ų106139.6 Ų139.674%0.74178%0.78SS**  trans-101.9-174.7-151.1-157.80000117.3
221N29.2Very low30.5Very low146 Ų146141.7 Ų141.778%0.78178%0.778SS**  trans-94.7171.3-163.2-74.4-82.7000116.3
222Q32Very low30.5Very low185 Ų185143.2 Ų143.286%0.86477%0.773SS**  trans98.1149155.5-68.8-81.7-48.700118.6
223P53.4Low30.2Very low90 Ų90145.8 Ų145.858%0.58477%0.774SS**  trans-127.9171-146.543.5-29.7000115.9
224H29.5Very low30.2Very low191 Ų191144.8 Ų144.888%0.88477%0.768SS**  trans-140.9156.7158.1-84.7-71.2000112.6
225K30.1Very low30.2Very low206 Ų206147.5 Ų147.590%0.89677%0.77SS**  trans-100.5134.2177.8-57.9175-179.8179.60110.3
226N26Very low30.1Very low158 Ų158142.2 Ų142.285%0.84575%0.751SS**  trans-159148.415634.9-8.5000113.7
227I25.3Very low29.8Very low155 Ų155147.7 Ų147.780%0.79577%0.768SS**  trans-85.1155.5-178-64.3150.5000110.3I229I227-I229 HydrophobicContact CG2-CD1 4.05Å
228K23.2Very low29.2Very low175 Ų175146.2 Ų146.276%0.76176%0.76SS**  trans145.5112142.8-163.7176.2-176.1-175.80109.4
229I25.4Very low28.9Very low136 Ų136146 Ų14670%0.69776%0.756SS**  68.1145.567.1-55.2163000112.5I227I227-I229 HydrophobicContact CG2-CD1 4.05Å
230T24.3Very low28.9Very low109 Ų109145.3 Ų145.367%0.66975%0.751SS**  trans99.9119.2180660000114.7
231F24Very low28.6Very low173 Ų173146 Ų14676%0.75975%0.751SS**  75.2149.961.6-85.2-47.9000112.4
232E27.3Very low28.6Very low149 Ų149144.9 Ų144.970%0.69675%0.749SS**  cis-131.6158.6-2.2-106.4149.9-170.700107.1
233E30.6Very low28.3Very low163 Ų163143.1 Ų143.176%0.76275%0.745SS**  58.3126.566-156.8166.2-165.800115
234D27.6Very low27.2Very low148 Ų148149 Ų14979%0.79176%0.756SS**  trans165.1143.5157.5-95.8-6.9000109.6
235E30Very low27.1Very low154 Ų154146.4 Ų146.472%0.7274%0.744SS**  cis-148.5153.1-9.7-143.5-158.2149.500111.8
236V29.8Very low27.1Very low80 Ų80141.6 Ų141.649%0.48574%0.736SS.*  trans-4.5151.7166.7-60.50000122.6
237N27Very low27.4Very low167 Ų167138.7 Ų138.789%0.89373%0.729SS**  -142.6120.2100.4-103.5-82.4000110.7
238S28Very low27.6Very low89 Ų89139.2 Ų139.262%0.62273%0.727SS**  trans-89173.9-172.6-41.70000112.8
239T25.2Very low28.1Very low118 Ų118137.4 Ų137.472%0.72473%0.726SS**  161.7103116.6-68.60000113.2
240L26.7Very low28.3Very low154 Ų154139.6 Ų139.681%0.80673%0.733SS**  trans55.3157.2139.7-55.1177.2000122.8
241V26.2Very low28.6Very low120 Ų120140.2 Ų140.273%0.72774%0.74SS**  cis-171.9-175.4-3582.90000109
242V29.2Very low28.9Very low123 Ų123141.1 Ų141.175%0.74575%0.747SS**  trans83.5129.5172.4-150.90000117
243D26.3Very low29.2Very low147 Ų147141.6 Ų141.679%0.78675%0.754SS**  trans-70.6155.6169.4-30.6-106.1000112.3
244R29.5Very low29.2Very low214 Ų214137.3 Ų137.381%0.80875%0.747SS**  -163.3154.1120.6-118.3-166.3155.981.616.9117.8
245E26.8Very low29.4Very low137 Ų137137.7 Ų137.764%0.6475%0.748SS**  trans-46.7176.8162.4-52.7158.4114.200116
246S31.7Very low29.4Very low104 Ų104137.1 Ų137.173%0.72775%0.75SS**  trans102.5116150.368.70000119.5
247S30.7Very low29.4Very low98 Ų98140.4 Ų140.469%0.68576%0.763SS**  trans-14.8161.6131.446.30000117
248H29.6Very low29.7Very low165 Ų165139.5 Ų139.576%0.76476%0.758SS**  cis-162.4166.945-141.1-75.2000113.1
249D34.6Very low30.2Very low138 Ų138141 Ų14174%0.73877%0.766SS**  trans-59.1149.4156.4-54.6-83.7000111.4
250E29Very low30.9Very low181 Ų181141.3 Ų141.385%0.84677%0.767SS**  -163.9146119.4-113.4179.1-174.500112.9
251C31.8Very low31.5Very low122 Ų122139.8 Ų139.882%0.82477%0.766SS**  trans-91.4154.3173.7-65.10000111.3
252Q30.4Very low31.6Very low193 Ų193137.1 Ų137.190%0.90276%0.763SS**  trans-148.6151.7153.8-118.7161.175.900111
253D33.3Very low32.3Very low158 Ų158136.9 Ų136.985%0.84576%0.764SS**  trans-136.1163.9-159.1-175.127.1000112.3
254A29.1Very low32.5Very low73 Ų73135.9 Ų135.960%0.60376%0.763SS**  trans68127.9171.100000118.8
255L32.2Very low32.6Very low157 Ų157131.5 Ų131.582%0.82277%0.766SS**  179.2100.6102.5-91.2173.9000114.3
256N30.4Very low33Very low142 Ų142130.2 Ų130.276%0.75977%0.771SS**  44.5137.6129-93.7-41.8000125
257I29.5Very low33.1Very low149 Ų149129.9 Ų129.976%0.76478%0.775SS**  trans90.4100149.7-61.2157.4000119.9
258L33.6Very low33.3Very low147 Ų147130.7 Ų130.777%0.7778%0.776SS**  23150.8126.3-73.9172.7000121.6
259P38.8Very low33.5Very low122 Ų122130.9 Ų130.979%0.79278%0.783SS**  cis-142.8-179.340.441.7-22.2000118.8
260V39.2Very low33.5Very low124 Ų124130.2 Ų130.275%0.75278%0.783SS**  trans-121.2132.8179.9169.70000110.7
261P39.6Very low33.8Very low122 Ų122126.5 Ų126.579%0.79278%0.778SS**  -138.5152.9114.436-23.1000111.7
262G27.8Very low33.8Very low64 Ų64128.8 Ų128.866%0.6678%0.778SS**  cis95.9143.824.700000111.1
263P45.2Very low34.1Very low118 Ų118125.4 Ų125.477%0.76677%0.771SS**  cis-140-152.52.333.4-7.5000114.5
264T29.3Very low34.2Very low126 Ų126123.8 Ų123.877%0.77377%0.766SS**  trans89.9100.3159.962.50000122.3
265S32.4Very low34.6Very low122 Ų122125.6 Ų125.685%0.85377%0.774SS**  43.4108116.51790000120.9
266S35.5Very low34.8Very low109 Ų109122.3 Ų122.376%0.76277%0.77SS**  -157148.4120.6-167.60000110.6
267A33.1Very low35.2Very low98 Ų98118.2 Ų118.281%0.8176%0.761SS**  trans-106.5121.7172.700000110.1
268T34.9Very low35.6Very low115 Ų115117.4 Ų117.471%0.70677%0.765SS**  trans-137110.7169.7-530000109V270T268-V270 HydrophobicContact CG2-CG2 4.34Å; T268-V270 PolarHBondContact O-N 3.02Å
269N34.6Very low35.9Very low169 Ų169118.4 Ų118.490%0.90477%0.771SS**  trans-71.4123.6171.8-65.2-40.8000109.3
270V33.2Very low36.3Very low123 Ų123115.9 Ų115.975%0.74576%0.756SS**  trans-120.1115.1166-179.80000107.6T268 M272T268-V270 HydrophobicContact CG2-CG2 4.34Å; T268-V270 PolarHBondContact O-N 3.02Å; V270-M272 PolarHBondContact O-N 2.66Å
271S35.7Very low36.9Very low104 Ų104113.5 Ų113.573%0.72775%0.745SS**  trans-70123.6177.7-177.30000110.2
272M32.9Very low36.9Very low170 Ų170114.9 Ų114.984%0.83774%0.741SS**  trans-96.7107.9159.3-73-163.1-65.600108.5V270 V274V270-M272 PolarHBondContact O-N 2.66Å; M272-V274 PolarHBondContact O-N 3.46Å
273V36.7Very low37.7Very low122 Ų122119.1 Ų119.174%0.73974%0.741SS**  trans-67.3103.9168.91740000108S275V273-S275 PolarHBondContact O-N 2.83Å
274V34.3Very low37.8Very low124 Ų124116 Ų11675%0.75273%0.725SS**  trans-79.5105.4167177.30000107.3M272 A276M272-V274 PolarHBondContact O-N 3.46Å; V274-A276 PolarHBondContact O-N 3.42Å
275S37.1Very low38.8Very low110 Ų110114.9 Ų114.977%0.76971%0.711SS**  trans-7175.5172.9-61.30000110.7V273 G277V273-S275 PolarHBondContact O-N 2.83Å; S275-G277 PolarHBondContact O-N 3.39Å; S275-G277 VanDerWaalsContact O-N 3.07Å
276A36.9Very low39.7Very low88 Ų88115.5 Ų115.573%0.72770%0.702SS**  trans-68.7100.1170.400000109.3V274V274-A276 PolarHBondContact O-N 3.42Å
277G38.8Very low40.8Very low56 Ų56114.1 Ų114.158%0.57769%0.686SS**  trans-63144.9164.200000110S275 L279S275-G277 PolarHBondContact O-N 3.39Å; S275-G277 VanDerWaalsContact O-N 3.07Å; G277-L279 PolarHBondContact O-N 2.72Å
278P39.1Very low42.1Very low132 Ų132114.2 Ų114.286%0.85767%0.672SS**  trans-69.697.6-178.728.4-34.2000110.6S280P278-S280 PolarHBondContact O-N 2.8Å
279L38.4Very low43.1Very low169 Ų169113.7 Ų113.789%0.88566%0.664SS**  trans-60.5119.2156.4-74.3167.2000106.9G277 S281G277-L279 PolarHBondContact O-N 2.72Å; L279-S281 PolarHBondContact O-N 3.46Å; L279-S281 VanDerWaalsContact O-N 3.11Å
280S48.3Very low44.2Very low68 Ų68109.6 Ų109.648%0.47664%0.64SS.*  trans-61.2117.9-174.949.90000110.4P278 E282 K283 A284P278-S280 PolarHBondContact O-N 2.8Å; S280-E282 PolarHBondContact O-N 2.84Å; S280-K283 PolarHBondContact O-N 3.12Å; S280-A284 PolarHBondContact O-N 2.84Å
281S51Low45.7Very low75 Ų75108 Ų10852%0.52463%0.626SS.*Hα-helixtrans-58.3-43.1-175.5730000110.2L279 K283 A284 E285L279-S281 PolarHBondContact O-N 3.46Å; L279-S281 VanDerWaalsContact O-N 3.11Å; S281-K283 VanDerWaalsContact C-N 3.3Å; S281-K283 PolarHBondContact O-N 2.99Å; S281-K283 VanDerWaalsContact O-N 3.17Å; S281-A284 CarbonylContact O-C 3.51Å; S281-A284 WeakPolarHBondContact O-CA 3.32Å; S281-A284 WeakPolarHBondContact O-CB 3.29Å; S281-A284 PolarHBondContact O-N 2.91Å; S281-E285 WeakPolarHBondContact CB-OE1 3.42Å; S281-E285 WeakPolarHBondContact O-CB 3.47Å; S281-E285 VanDerWaalsContact O-CG 3.31Å; S281-E285 WeakPolarHBondContact O-CG 3.32Å; S281-E285 PolarHBondContact O-N 3.37Å; S281-E285 PolarHBondContact OG-OE1 3.17Å
282E40.3Very low47.1Very low151 Ų151106.8 Ų106.871%0.70661%0.611SS**Hα-helixtrans-41.8-46.2169.3-173.5175.6-138.800114.3S280 E285 M286S280-E282 PolarHBondContact O-N 2.84Å; E282-E285 PolarHBondContact O-N 2.92Å; E282-M286 VanDerWaalsContact O-CB 3.29Å; E282-M286 WeakPolarHBondContact O-CB 3.32Å; E282-M286 PolarHBondContact O-N 3.37Å
283K43.3Very low48.8Very low152 Ų152105.4 Ų105.466%0.66160%0.603SS**Hα-helixtrans-76-26.3-179.5-169.5166.3-176.1170.60112.9S280 S281 N287S280-K283 PolarHBondContact O-N 3.12Å; S281-K283 VanDerWaalsContact C-N 3.3Å; S281-K283 PolarHBondContact O-N 2.99Å; S281-K283 VanDerWaalsContact O-N 3.17Å; K283-N287 PolarHBondContact O-ND2 3.45Å
284A48.5Very low50.3Low53 Ų53105.4 Ų105.444%0.43859%0.593SS.*Hα-helixtrans-77.6-40170.300000111.5S280 S281 N287 I288S280-A284 PolarHBondContact O-N 2.84Å; S281-A284 CarbonylContact O-C 3.51Å; S281-A284 WeakPolarHBondContact O-CA 3.32Å; S281-A284 WeakPolarHBondContact O-CB 3.29Å; S281-A284 PolarHBondContact O-N 2.91Å; A284-N287 PolarHBondContact O-N 3Å; A284-I288 VanDerWaalsContact O-CG1 3.26Å; A284-I288 WeakPolarHBondContact O-CG1 3.23Å; A284-I288 PolarHBondContact O-N 2.8Å
285E49.9Very low51.5Low103 Ų103103.7 Ų103.748%0.48158%0.579SS.*Hα-helixtrans-65.3-41.2177.8-72.7167.3-137.800111.8S281 E282 N287 I288 L289S281-E285 WeakPolarHBondContact CB-OE1 3.42Å; S281-E285 WeakPolarHBondContact O-CB 3.47Å; S281-E285 VanDerWaalsContact O-CG 3.31Å; S281-E285 WeakPolarHBondContact O-CG 3.32Å; S281-E285 PolarHBondContact O-N 3.37Å; S281-E285 PolarHBondContact OG-OE1 3.17Å; E282-E285 PolarHBondContact O-N 2.92Å; E285-N287 PolarHBondContact O-N 3.16Å; E285-I288 PolarHBondContact O-N 3.43Å; E285-L289 WeakPolarHBondContact O-CB 3.26Å; E285-L289 PolarHBondContact O-N 2.77Å
286M51.1Low52.5Low134 Ų134107 Ų10766%0.6658%0.575SS**Hα-helixtrans-54.3-51171.6-162.478.5137.500110.8E282 I288 L289 E290E282-M286 VanDerWaalsContact O-CB 3.29Å; E282-M286 WeakPolarHBondContact O-CB 3.32Å; E282-M286 PolarHBondContact O-N 3.37Å; M286-I288 PolarHBondContact O-N 3.19Å; M286-L289 PolarHBondContact O-N 3.24Å; M286-E290 WeakPolarHBondContact O-CB 3.44Å; M286-E290 PolarHBondContact O-N 3.22Å
287N58.2Low53.6Low81 Ų81106.8 Ų106.843%0.43357%0.566SS.*Hα-helixtrans-62-43.9175.7-83.7-85.6000111.8K283 A284 E285 L289 E290 I291K283-N287 PolarHBondContact O-ND2 3.45Å; A284-N287 PolarHBondContact O-N 3Å; E285-N287 PolarHBondContact O-N 3.16Å; N287-L289 PolarHBondContact O-N 3.23Å; N287-E290 PolarHBondContact O-N 3.03Å; N287-I291 HydrophobicContact CB-CD1 4.47Å; N287-I291 WeakPolarHBondContact O-CB 3.46Å; N287-I291 WeakPolarHBondContact O-CD1 3.43Å; N287-I291 WeakPolarHBondContact O-CG1 3.32Å; N287-I291 PolarHBondContact O-N 3.01Å
288I60.3Low54.2Low99 Ų99109.3 Ų109.351%0.50856%0.563SS.*Hα-helixtrans-65.3-38.2-179.6-71164.1000111.2A284 E285 M286 N292A284-I288 VanDerWaalsContact O-CG1 3.26Å; A284-I288 WeakPolarHBondContact O-CG1 3.23Å; A284-I288 PolarHBondContact O-N 2.8Å; E285-I288 PolarHBondContact O-N 3.43Å; M286-I288 PolarHBondContact O-N 3.19Å; I288-N292 VanDerWaalsContact O-CB 3.29Å; I288-N292 WeakPolarHBondContact O-CB 3.44Å; I288-N292 PolarHBondContact O-N 2.81Å; I288-N292 PolarHBondContact O-ND2 3.48Å
289L56.9Low55.3Low104 Ų104107.8 Ų107.855%0.54555%0.547SS..Hα-helixtrans-66.7-51.5174.8-86.6163.7000111.5E285 M286 N287 I291 N292 E293E285-L289 WeakPolarHBondContact O-CB 3.26Å; E285-L289 PolarHBondContact O-N 2.77Å; M286-L289 PolarHBondContact O-N 3.24Å; N287-L289 PolarHBondContact O-N 3.23Å; L289-I291 VanDerWaalsContact C-N 3.33Å; L289-I291 PolarHBondContact O-N 3.3Å; L289-N292 PolarHBondContact O-N 3.02Å; L289-N292 VanDerWaalsContact O-N 3.12Å; L289-E293 WeakPolarHBondContact O-CB 3.49Å; L289-E293 PolarHBondContact O-N 2.92Å
290E58.5Low56.2Low84 Ų84102.4 Ų102.439%0.39353%0.527SS..Hα-helixtrans-60.8-40.3179.9-168.2-168.9156.200112M286 N287 E293 K294M286-E290 WeakPolarHBondContact O-CB 3.44Å; M286-E290 PolarHBondContact O-N 3.22Å; N287-E290 PolarHBondContact O-N 3.03Å; E290-E293 PolarHBondContact O-N 3.41Å; E290-K294 HydrophobicContact CG-CD 4.24Å; E290-K294 WeakPolarHBondContact O-CB 3.47Å; E290-K294 WeakPolarHBondContact O-CG 3.39Å; E290-K294 PolarHBondContact O-N 3.18Å; E290-K294 IonicContact OE1-NZ 2.92Å; E290-K294 PolarHBondContact OE1-NZ 2.93Å
291I63.8Low57Low89 Ų89104 Ų10446%0.45653%0.527SS..Hα-helixtrans-66.9-42.9174.3-70.6166.7000110.7N287 L289 E293 K294 L295N287-I291 HydrophobicContact CB-CD1 4.47Å; N287-I291 WeakPolarHBondContact O-CB 3.46Å; N287-I291 WeakPolarHBondContact O-CD1 3.43Å; N287-I291 WeakPolarHBondContact O-CG1 3.32Å; N287-I291 PolarHBondContact O-N 3.01Å; L289-I291 VanDerWaalsContact C-N 3.33Å; L289-I291 PolarHBondContact O-N 3.3Å; I291-E293 VanDerWaalsContact C-N 3.33Å; I291-E293 PolarHBondContact O-N 3.36Å; I291-K294 PolarHBondContact O-N 3.3Å; I291-L295 HydrophobicContact CG2-CD1 3.58Å; I291-L295 HydrophobicContact CG2-CG 4.16Å; I291-L295 VanDerWaalsContact O-CB 3.26Å; I291-L295 WeakPolarHBondContact O-CB 3.37Å; I291-L295 VanDerWaalsContact O-CG 3.23Å; I291-L295 WeakPolarHBondContact O-CG 2.93Å; I291-L295 PolarHBondContact O-N 2.94Å
292N64.8Low57.2Low78 Ų78106.2 Ų106.242%0.41753%0.527SS..Hα-helixtrans-64.5-37.2176-90.1-75000112.4I288 L289 R296I288-N292 VanDerWaalsContact O-CB 3.29Å; I288-N292 WeakPolarHBondContact O-CB 3.44Å; I288-N292 PolarHBondContact O-N 2.81Å; I288-N292 PolarHBondContact O-ND2 3.48Å; L289-N292 PolarHBondContact O-N 3.02Å; L289-N292 VanDerWaalsContact O-N 3.12Å; N292-R296 WeakPolarHBondContact O-CB 3.26Å; N292-R296 WeakPolarHBondContact O-CD 3.36Å; N292-R296 WeakPolarHBondContact O-CG 3.4Å; N292-R296 PolarHBondContact O-N 2.9Å
293E67.8Low58.1Low141 Ų141104.2 Ų104.266%0.65952%0.516SS*.Hα-helixtrans-64.3-48.4175-174.4171.7-163.700111L289 E290 I291 L295 R296 P297L289-E293 WeakPolarHBondContact O-CB 3.49Å; L289-E293 PolarHBondContact O-N 2.92Å; E290-E293 PolarHBondContact O-N 3.41Å; I291-E293 VanDerWaalsContact C-N 3.33Å; I291-E293 PolarHBondContact O-N 3.36Å; E293-L295 PolarHBondContact O-N 3.44Å; E293-R296 PolarHBondContact O-N 3.09Å; E293-P297 WeakPolarHBondContact O-CD 3.46Å
294K68.7Low58.7Low123 Ų123100.6 Ų100.654%0.53550%0.501SS..Hα-helixtrans-67.4-32.6178.4-71171.1179.5179.50113.4E290 I291E290-K294 HydrophobicContact CG-CD 4.24Å; E290-K294 WeakPolarHBondContact O-CB 3.47Å; E290-K294 WeakPolarHBondContact O-CG 3.39Å; E290-K294 PolarHBondContact O-N 3.18Å; E290-K294 IonicContact OE1-NZ 2.92Å; E290-K294 PolarHBondContact OE1-NZ 2.93Å; I291-K294 PolarHBondContact O-N 3.3Å
295L60.8Low58.3Low88 Ų88102 Ų10246%0.46150%0.499SS..Hα-helixtrans-80.4-23.7178.1-71.6176.7000114I291 E293 Q298 L299I291-L295 HydrophobicContact CG2-CD1 3.58Å; I291-L295 HydrophobicContact CG2-CG 4.16Å; I291-L295 VanDerWaalsContact O-CB 3.26Å; I291-L295 WeakPolarHBondContact O-CB 3.37Å; I291-L295 VanDerWaalsContact O-CG 3.23Å; I291-L295 WeakPolarHBondContact O-CG 2.93Å; I291-L295 PolarHBondContact O-N 2.94Å; E293-L295 PolarHBondContact O-N 3.44Å; L295-Q298 PolarHBondContact O-N 3.48Å; L295-L299 VanDerWaalsContact O-CB 3.29Å; L295-L299 WeakPolarHBondContact O-CB 3.23Å; L295-L299 PolarHBondContact O-N 3.41Å
296R58.1Low58.4Low179 Ų179103.5 Ų103.568%0.67550%0.504SS*.Hα-helixtrans-61.3-50179.8-87.2167.5-178.1-165.32.1113.2N292 E293 Q298 L299 A300N292-R296 WeakPolarHBondContact O-CB 3.26Å; N292-R296 WeakPolarHBondContact O-CD 3.36Å; N292-R296 WeakPolarHBondContact O-CG 3.4Å; N292-R296 PolarHBondContact O-N 2.9Å; E293-R296 PolarHBondContact O-N 3.09Å; R296-Q298 PolarHBondContact O-N 3.28Å; R296-L299 PolarHBondContact O-N 2.96Å; R296-A300 WeakPolarHBondContact O-CB 3.27Å; R296-A300 PolarHBondContact O-N 3Å
297P60.2Low58.5Low84 Ų84100.6 Ų100.655%0.54549%0.486SS..Hα-helixtrans-58.3-45.4172.6-25.934.7000112.3E293 L299 A300 E301E293-P297 WeakPolarHBondContact O-CD 3.46Å; P297-L299 PolarHBondContact O-N 2.8Å; P297-A300 PolarHBondContact O-N 3.01Å; P297-E301 WeakPolarHBondContact O-CB 3.18Å; P297-E301 PolarHBondContact O-N 3.43Å
298Q50.1Low58.1Low109 Ų109100 Ų10051%0.50948%0.482SS..Hα-helixtrans-64-38.9-179.7-62.6-177.415.900112.2L295 R296 E301 K302L295-Q298 PolarHBondContact O-N 3.48Å; R296-Q298 PolarHBondContact O-N 3.28Å; Q298-E301 PolarHBondContact O-N 2.69Å; Q298-K302 WeakPolarHBondContact O-CB 3.21Å; Q298-K302 VanDerWaalsContact O-CG 3.26Å; Q298-K302 WeakPolarHBondContact O-CG 2.97Å; Q298-K302 PolarHBondContact O-N 3.38Å
299L62.3Low57.8Low100 Ų100100.9 Ų100.952%0.52449%0.487SS..Hα-helixtrans-68.5-39.2175-18061000111.8L295 R296 P297 K303L295-L299 VanDerWaalsContact O-CB 3.29Å; L295-L299 WeakPolarHBondContact O-CB 3.23Å; L295-L299 PolarHBondContact O-N 3.41Å; R296-L299 PolarHBondContact O-N 2.96Å; P297-L299 PolarHBondContact O-N 2.8Å; L299-K303 HydrophobicContact CD1-CD 4.5Å; L299-K303 HydrophobicContact CD1-CG 4.42Å; L299-K303 HydrophobicContact CG-CD 4.34Å; L299-K303 VanDerWaalsContact O-CB 3.29Å; L299-K303 WeakPolarHBondContact O-CB 3.44Å; L299-K303 WeakPolarHBondContact O-CG 3.41Å; L299-K303 PolarHBondContact O-N 3.36Å
300A58.5Low57.6Low55 Ų5599 Ų9946%0.45548%0.475SS..Hα-helixtrans-64.4-44.3173.800000111.3R296 P297 K303 Q304R296-A300 WeakPolarHBondContact O-CB 3.27Å; R296-A300 PolarHBondContact O-N 3Å; P297-A300 PolarHBondContact O-N 3.01Å; A300-K303 PolarHBondContact O-N 2.8Å; A300-Q304 WeakPolarHBondContact O-CB 3.42Å; A300-Q304 PolarHBondContact O-N 2.7Å
301E63.8Low57.3Low101 Ų10198.7 Ų98.747%0.47247%0.474SS..Hα-helixtrans-63-48.7176.3-161.9-150.8163.200111.2P297 Q298 K303 Q304 Q305P297-E301 WeakPolarHBondContact O-CB 3.18Å; P297-E301 PolarHBondContact O-N 3.43Å; Q298-E301 PolarHBondContact O-N 2.69Å; E301-K303 PolarHBondContact O-N 2.95Å; E301-Q304 CarbonylContact O-C 3.5Å; E301-Q304 WeakPolarHBondContact O-CA 3.33Å; E301-Q304 PolarHBondContact O-N 2.92Å; E301-Q305 WeakPolarHBondContact O-CG 3.16Å; E301-Q305 PolarHBondContact O-N 2.64Å; E301-Q305 PolarHBondContact OE1-NE2 3.19Å
302K56.5Low56.9Low122 Ų122101.2 Ų101.253%0.5348%0.481SS..Hα-helixtrans-66.3-34.9178.5-68.3-68.9167.9-167.40112.6Q298 Q304 F306Q298-K302 WeakPolarHBondContact O-CB 3.21Å; Q298-K302 VanDerWaalsContact O-CG 3.26Å; Q298-K302 WeakPolarHBondContact O-CG 2.97Å; Q298-K302 PolarHBondContact O-N 3.38Å; K302-Q304 VanDerWaalsContact C-N 3.34Å; K302-F306 VanDerWaalsContact O-CB 3.3Å; K302-F306 WeakPolarHBondContact O-CB 3.17Å; K302-F306 PolarHBondContact O-N 3.28Å
303K58.2Low56.1Low109 Ų109100.3 Ų100.347%0.47448%0.48SS..Hα-helixtrans-60.4-42.8167.2-78.3172.9178.3-178.10111.3L299 A300 E301 F306 R307L299-K303 HydrophobicContact CD1-CD 4.5Å; L299-K303 HydrophobicContact CD1-CG 4.42Å; L299-K303 HydrophobicContact CG-CD 4.34Å; L299-K303 VanDerWaalsContact O-CB 3.29Å; L299-K303 WeakPolarHBondContact O-CB 3.44Å; L299-K303 WeakPolarHBondContact O-CG 3.41Å; L299-K303 PolarHBondContact O-N 3.36Å; A300-K303 PolarHBondContact O-N 2.8Å; E301-K303 PolarHBondContact O-N 2.95Å; K303-F306 PolarHBondContact O-N 2.96Å; K303-R307 WeakPolarHBondContact O-CG 3.47Å; K303-R307 PolarHBondContact O-N 3.35Å
304Q54.8Low55.2Low76 Ų7697 Ų9736%0.35546%0.464SS..Hα-helixtrans-71.1-40.3178.7-166.858.233.800112.9A300 E301 K302 F306 R307 N308A300-Q304 WeakPolarHBondContact O-CB 3.42Å; A300-Q304 PolarHBondContact O-N 2.7Å; E301-Q304 CarbonylContact O-C 3.5Å; E301-Q304 WeakPolarHBondContact O-CA 3.33Å; E301-Q304 PolarHBondContact O-N 2.92Å; K302-Q304 VanDerWaalsContact C-N 3.34Å; Q304-F306 VanDerWaalsContact C-N 3.32Å; Q304-F306 PolarHBondContact O-N 3.29Å; Q304-R307 PolarHBondContact O-N 3.2Å; Q304-R307 VanDerWaalsContact OE1-CZ 3.3Å; Q304-N308 PolarHBondContact NE2-OD1 3.33Å; Q304-N308 WeakPolarHBondContact O-CB 3.32Å; Q304-N308 PolarHBondContact O-N 2.88Å; Q304-N308 PolarHBondContact O-OD1 3.4Å
305Q41.8Very low54.8Low83 Ų8394.7 Ų94.739%0.38846%0.457SS..Hα-helixtrans-60.1-42.8171.8-70.4-173.3-0.600110.5E301 N308 L309E301-Q305 WeakPolarHBondContact O-CG 3.16Å; E301-Q305 PolarHBondContact O-N 2.64Å; E301-Q305 PolarHBondContact OE1-NE2 3.19Å; Q305-N308 PolarHBondContact O-N 2.92Å; Q305-L309 VanDerWaalsContact O-CB 3.24Å; Q305-L309 WeakPolarHBondContact O-CB 3.3Å; Q305-L309 PolarHBondContact O-N 3.37Å
306F50.6Low54.5Low135 Ų13595 Ų9559%0.59246%0.463SS*.Hα-helixtrans-64-45.2174.1-175.2-102000112.1K302 K303 Q304 L309 K310K302-F306 VanDerWaalsContact O-CB 3.3Å; K302-F306 WeakPolarHBondContact O-CB 3.17Å; K302-F306 PolarHBondContact O-N 3.28Å; K303-F306 PolarHBondContact O-N 2.96Å; Q304-F306 VanDerWaalsContact C-N 3.32Å; Q304-F306 PolarHBondContact O-N 3.29Å; F306-L309 PolarHBondContact O-N 3.44Å; F306-K310 HydrophobicContact CE1-CD 4.46Å; F306-K310 VanDerWaalsContact O-CB 3.23Å; F306-K310 WeakPolarHBondContact O-CB 3.21Å; F306-K310 PolarHBondContact O-N 3.06Å
307R53.5Low54Low73 Ų7391.9 Ų91.928%0.27546%0.456SS..Hα-helixtrans-57.3-49.7173.4-76.2-170.7-72.4-124.23.7111.4E80 K303 Q304 L309 K310 E311E80-R307 IonicContact OE1-CZ 2.69Å; E80-R307 IonicContact OE1-NH1 3.38Å; E80-R307 PolarHBondContact OE1-NH1 3.11Å; E80-R307 IonicContact OE2-CZ 2.7Å; E80-R307 IonicContact OE2-NH1 2.58Å; E80-R307 PolarHBondContact OE2-NH1 2.97Å; K303-R307 WeakPolarHBondContact O-CG 3.47Å; K303-R307 PolarHBondContact O-N 3.35Å; Q304-R307 PolarHBondContact O-N 3.2Å; Q304-R307 VanDerWaalsContact OE1-CZ 3.3Å; R307-L309 PolarHBondContact O-N 3.41Å; R307-K310 PolarHBondContact O-N 2.87Å; R307-E311 WeakPolarHBondContact O-CB 3.44Å; R307-E311 PolarHBondContact O-N 2.82Å
308N51.1Low53.6Low68 Ų6892.1 Ų92.136%0.36445%0.452SS..Hα-helixtrans-61.6-40.3178.1-67.7-3.7000112.2Q304 Q305 K312Q304-N308 PolarHBondContact NE2-OD1 3.33Å; Q304-N308 WeakPolarHBondContact O-CB 3.32Å; Q304-N308 PolarHBondContact O-N 2.88Å; Q304-N308 PolarHBondContact O-OD1 3.4Å; Q305-N308 PolarHBondContact O-N 2.92Å; N308-K312 WeakPolarHBondContact O-CB 2.96Å; N308-K312 VanDerWaalsContact O-CG 3.28Å; N308-K312 WeakPolarHBondContact O-CG 3.31Å; N308-K312 PolarHBondContact O-N 3.36Å
309L52.8Low53.7Low117 Ų11790 Ų9061%0.61345%0.45SS*.Hα-helixtrans-70.4-38.6178.4-173.865.4000111.5Q305 F306 R307 C313Q305-L309 VanDerWaalsContact O-CB 3.24Å; Q305-L309 WeakPolarHBondContact O-CB 3.3Å; Q305-L309 PolarHBondContact O-N 3.37Å; F306-L309 PolarHBondContact O-N 3.44Å; R307-L309 PolarHBondContact O-N 3.41Å; L309-C313 VanDerWaalsContact O-CB 3.25Å; L309-C313 WeakPolarHBondContact O-CB 3.24Å; L309-C313 PolarHBondContact O-N 3.48Å
310K52.6Low53.1Low66 Ų6686.9 Ų86.929%0.28744%0.441SS..Hα-helixtrans-63.7-46.2174.1-157.1-165.9-174.9179.70110.9N73 F306 R307 C313 F314N73-K310 PolarHBondContact OD1-NZ 2.84Å; F306-K310 HydrophobicContact CE1-CD 4.46Å; F306-K310 VanDerWaalsContact O-CB 3.23Å; F306-K310 WeakPolarHBondContact O-CB 3.21Å; F306-K310 PolarHBondContact O-N 3.06Å; R307-K310 PolarHBondContact O-N 2.87Å; K310-C313 WeakPolarHBondContact O-CB 3.33Å; K310-C313 PolarHBondContact O-N 2.86Å; K310-F314 HydrophobicContact CB-CE2 4.46Å; K310-F314 HydrophobicContact CD-CE2 3.96Å; K310-F314 HydrophobicContact CD-CZ 4.2Å; K310-F314 HydrophobicContact CG-CD2 4.47Å; K310-F314 HydrophobicContact CG-CE2 3.55Å; K310-F314 HydrophobicContact CG-CZ 3.68Å; K310-F314 WeakPolarHBondContact O-CD2 3.32Å; K310-F314 WeakPolarHBondContact O-CG 3.48Å; K310-F314 PolarHBondContact O-N 3.35Å
311E53Low52.9Low77 Ų7789.6 Ų89.636%0.3644%0.443SS..Hα-helixtrans-63.1-45.7176-167.9179-139.100111.8R307 C313 F314 L315 K349R307-E311 WeakPolarHBondContact O-CB 3.44Å; R307-E311 PolarHBondContact O-N 2.82Å; E311-C313 PolarHBondContact O-N 3.42Å; E311-F314 PolarHBondContact O-N 3.26Å; E311-L315 HydrophobicContact CG-CD1 4.44Å; E311-L315 PolarHBondContact O-N 2.64Å; E311-K349 IonicContact OE1-NZ 3.7Å; E311-K349 PolarHBondContact OE1-NZ 3.1Å; E311-K349 IonicContact OE2-NZ 3.77Å
312K54.7Low52.6Low141 Ų14187.1 Ų87.161%0.61343%0.433SS*.Hα-helixtrans-58.1-45.3171.1-78.6178177.8-175.80112N308 F314 L315 T316N308-K312 WeakPolarHBondContact O-CB 2.96Å; N308-K312 VanDerWaalsContact O-CG 3.28Å; N308-K312 WeakPolarHBondContact O-CG 3.31Å; N308-K312 PolarHBondContact O-N 3.36Å; K312-F314 VanDerWaalsContact C-N 3.33Å; K312-F314 PolarHBondContact O-N 2.76Å; K312-L315 PolarHBondContact O-N 2.79Å; K312-T316 PolarHBondContact O-N 2.79Å; K312-T316 PolarHBondContact O-OG1 3.46Å; K312-T316 VanDerWaalsContact O-OG1 3.08Å
313C47.3Very low52.5Low59 Ų5983.3 Ų83.340%0.39942%0.424SS..Hα-helixtrans-59.9-42.8178.8-170.80000111.5L309 K310 E311 T316 Q317L309-C313 VanDerWaalsContact O-CB 3.25Å; L309-C313 WeakPolarHBondContact O-CB 3.24Å; L309-C313 PolarHBondContact O-N 3.48Å; K310-C313 WeakPolarHBondContact O-CB 3.33Å; K310-C313 PolarHBondContact O-N 2.86Å; E311-C313 PolarHBondContact O-N 3.42Å; C313-T316 PolarHBondContact O-N 2.9Å; C313-Q317 WeakPolarHBondContact O-CB 3.47Å; C313-Q317 VanDerWaalsContact O-CG 3.31Å; C313-Q317 WeakPolarHBondContact O-CG 3.25Å; C313-Q317 PolarHBondContact O-N 2.84Å
314F50.9Low52.4Low73 Ų7383.3 Ų83.332%0.3243%0.429SS..Hα-helixtrans-66.8-41.5174.1-59.3-41.2000112.7F69 K310 E311 K312 T316 Q317 L318F69-F314 AromaticContact CE1-CE1 3.93Å; F69-F314 HydrophobicContact CE1-CE1 3.93Å; F69-F314 HydrophobicContact CE1-CE2 4.23Å; F69-F314 AromaticContact CE1-CZ 3.47Å; F69-F314 HydrophobicContact CE1-CZ 3.47Å; F69-F314 VanDerWaalsContact CE1-CZ 3.47Å; F69-F314 HydrophobicContact CZ-CZ 4.04Å; K310-F314 HydrophobicContact CB-CE2 4.46Å; K310-F314 HydrophobicContact CD-CE2 3.96Å; K310-F314 HydrophobicContact CD-CZ 4.2Å; K310-F314 HydrophobicContact CG-CD2 4.47Å; K310-F314 HydrophobicContact CG-CE2 3.55Å; K310-F314 HydrophobicContact CG-CZ 3.68Å; K310-F314 WeakPolarHBondContact O-CD2 3.32Å; K310-F314 WeakPolarHBondContact O-CG 3.48Å; K310-F314 PolarHBondContact O-N 3.35Å; E311-F314 PolarHBondContact O-N 3.26Å; K312-F314 VanDerWaalsContact C-N 3.33Å; K312-F314 PolarHBondContact O-N 2.76Å; F314-T316 VanDerWaalsContact C-N 3.3Å; F314-T316 PolarHBondContact O-N 2.97Å; F314-Q317 PolarHBondContact O-N 3.06Å; F314-L318 WeakPolarHBondContact O-CB 3.23Å; F314-L318 PolarHBondContact O-N 3.26Å
315L58.7Low52.2Low73 Ų7382.3 Ų82.338%0.38242%0.424SS..Hα-helixtrans-59.9-39.6173.5-82.7159.4000112E311 K312 S319 L342E311-L315 HydrophobicContact CG-CD1 4.44Å; E311-L315 PolarHBondContact O-N 2.64Å; K312-L315 PolarHBondContact O-N 2.79Å; L315-S319 VanDerWaalsContact O-CB 3.26Å; L315-S319 WeakPolarHBondContact O-CB 3.5Å; L315-S319 PolarHBondContact O-N 2.72Å; L315-S319 PolarHBondContact O-OG 2.95Å; L315-L342 HydrophobicContact CD2-CD2 4.17Å
316T54.6Low52.6Low96 Ų9683.3 Ų83.359%0.58943%0.429SS*.Hα-helixtrans-68.3-42.5174.3-58.70000112.5K312 C313 F314 S319 G320K312-T316 PolarHBondContact O-N 2.79Å; K312-T316 PolarHBondContact O-OG1 3.46Å; K312-T316 VanDerWaalsContact O-OG1 3.08Å; C313-T316 PolarHBondContact O-N 2.9Å; F314-T316 VanDerWaalsContact C-N 3.3Å; F314-T316 PolarHBondContact O-N 2.97Å; T316-S319 WeakPolarHBondContact CA-OG 3.41Å; T316-S319 PolarHBondContact O-OG 3Å; T316-S319 VanDerWaalsContact O-OG 3.12Å; T316-G320 PolarHBondContact O-N 2.99Å
317Q47.9Very low52.7Low113 Ų11385.5 Ų85.553%0.52844%0.438SS..Hα-helixtrans-65.6-43.3175.6-73.6174.2-0.800111.8C313 F314 G320 F321C313-Q317 WeakPolarHBondContact O-CB 3.47Å; C313-Q317 VanDerWaalsContact O-CG 3.31Å; C313-Q317 WeakPolarHBondContact O-CG 3.25Å; C313-Q317 PolarHBondContact O-N 2.84Å; F314-Q317 PolarHBondContact O-N 3.06Å; Q317-G320 PolarHBondContact O-N 3.41Å; Q317-F321 WeakPolarHBondContact O-CB 3.48Å; Q317-F321 PolarHBondContact O-N 2.87Å
318L52.5Low52.4Low88 Ų8889.6 Ų89.646%0.46146%0.458SS..Hα-helixtrans-66-46178.7-156.889.9000110.8F314 F321 L322F314-L318 WeakPolarHBondContact O-CB 3.23Å; F314-L318 PolarHBondContact O-N 3.26Å; L318-F321 PolarHBondContact O-N 3.16Å; L318-L322 HydrophobicContact CD2-CD1 4Å; L318-L322 HydrophobicContact CG-CD1 3.94Å; L318-L322 WeakPolarHBondContact O-CB 3.24Å; L318-L322 WeakPolarHBondContact O-CD1 3.5Å; L318-L322 WeakPolarHBondContact O-CG 3.47Å; L318-L322 PolarHBondContact O-N 3.22Å
319S52.1Low52.3Low66 Ų6693.3 Ų93.346%0.46247%0.468SS..Hα-helixtrans-65.9-38.6176.254.50000112.6L315 T316 L322 A323L315-S319 VanDerWaalsContact O-CB 3.26Å; L315-S319 WeakPolarHBondContact O-CB 3.5Å; L315-S319 PolarHBondContact O-N 2.72Å; L315-S319 PolarHBondContact O-OG 2.95Å; T316-S319 WeakPolarHBondContact CA-OG 3.41Å; T316-S319 PolarHBondContact O-OG 3Å; T316-S319 VanDerWaalsContact O-OG 3.12Å; S319-L322 PolarHBondContact O-N 2.8Å; S319-A323 VanDerWaalsContact O-CB 3.25Å; S319-A323 WeakPolarHBondContact O-CB 3.18Å; S319-A323 PolarHBondContact O-N 3.43Å
320G50.1Low52Low34 Ų3498.1 Ų98.135%0.35148%0.484SS..Hα-helixtrans-62.6-44.1172.700000112.6T316 Q317 N324T316-G320 PolarHBondContact O-N 2.99Å; Q317-G320 PolarHBondContact O-N 3.41Å; G320-N324 WeakPolarHBondContact O-CB 3.05Å; G320-N324 PolarHBondContact O-N 3.48Å
321F54.1Low52Low111 Ų111101.4 Ų101.449%0.48750%0.496SS..Hα-helixtrans-60.9-46.4173.7-173.2-94000111.3Q317 L318 N324 Q325Q317-F321 WeakPolarHBondContact O-CB 3.48Å; Q317-F321 PolarHBondContact O-N 2.87Å; L318-F321 PolarHBondContact O-N 3.16Å; F321-N324 PolarHBondContact O-N 3.18Å; F321-Q325 HydrophobicContact CD1-CG 4.22Å; F321-Q325 HydrophobicContact CE1-CG 4.11Å; F321-Q325 VanDerWaalsContact O-CG 3.23Å; F321-Q325 WeakPolarHBondContact O-CG 3.49Å; F321-Q325 PolarHBondContact O-N 2.86Å
322L56.1Low52Low50 Ų50103.1 Ų103.126%0.26250%0.504SS..Hα-helixtrans-68.8-37.8-179.4-70.2163.1000112.8L318 S319 Q325 Q326 I338L318-L322 HydrophobicContact CD2-CD1 4Å; L318-L322 HydrophobicContact CG-CD1 3.94Å; L318-L322 WeakPolarHBondContact O-CB 3.24Å; L318-L322 WeakPolarHBondContact O-CD1 3.5Å; L318-L322 WeakPolarHBondContact O-CG 3.47Å; L318-L322 PolarHBondContact O-N 3.22Å; S319-L322 PolarHBondContact O-N 2.8Å; L322-Q325 WeakPolarHBondContact O-CB 3.24Å; L322-Q325 PolarHBondContact O-N 3.4Å; L322-Q325 VanDerWaalsContact O-N 3.16Å; L322-Q326 PolarHBondContact O-N 2.83Å; L322-I338 HydrophobicContact CB-CD1 4.43Å; L322-I338 HydrophobicContact CD1-CD1 3.76Å; L322-I338 HydrophobicContact CD1-CG1 4.15Å; L322-I338 HydrophobicContact CD2-CD1 4.22Å; L322-I338 HydrophobicContact CG-CD1 4.35Å
323A55.7Low51.8Low41 Ų41103.3 Ų103.334%0.33951%0.507SS..Hα-helixtrans-64.5-39.9173.900000111.9S319 Q325 Q326 K327S319-A323 VanDerWaalsContact O-CB 3.25Å; S319-A323 WeakPolarHBondContact O-CB 3.18Å; S319-A323 PolarHBondContact O-N 3.43Å; A323-Q325 VanDerWaalsContact C-N 3.29Å; A323-Q325 PolarHBondContact O-N 3.34Å; A323-Q326 PolarHBondContact O-N 2.87Å; A323-K327 PolarHBondContact O-N 3.33Å
324N55.2Low51.6Low110 Ų110102.5 Ų102.559%0.58850%0.501SS*.Hα-helixtrans-68.1-25.9173.1-78.7-18.9000112.9G320 F321G320-N324 WeakPolarHBondContact O-CB 3.05Å; G320-N324 PolarHBondContact O-N 3.48Å; F321-N324 PolarHBondContact O-N 3.18Å
325Q51.2Low51.8Low54 Ų54103.7 Ų103.725%0.25251%0.506SS..Hα-helixtrans-76-41.6170.6-61-80-23.900111.5F321 L322 A323 K327 K328 Y329F321-Q325 HydrophobicContact CD1-CG 4.22Å; F321-Q325 HydrophobicContact CE1-CG 4.11Å; F321-Q325 VanDerWaalsContact O-CG 3.23Å; F321-Q325 WeakPolarHBondContact O-CG 3.49Å; F321-Q325 PolarHBondContact O-N 2.86Å; L322-Q325 WeakPolarHBondContact O-CB 3.24Å; L322-Q325 PolarHBondContact O-N 3.4Å; L322-Q325 VanDerWaalsContact O-N 3.16Å; A323-Q325 VanDerWaalsContact C-N 3.29Å; A323-Q325 PolarHBondContact O-N 3.34Å; Q325-K327 VanDerWaalsContact C-N 3.31Å; Q325-K327 PolarHBondContact O-N 2.78Å; Q325-K328 PolarHBondContact O-N 2.79Å; Q325-Y329 PolarHBondContact O-N 2.97Å
326Q49.1Very low51.7Low104 Ų104104.2 Ų104.249%0.48651%0.51SS..Hα-helixtrans-59.3-38.5175.6-78.4-177.4-1700112.6L322 A323 K328L322-Q326 PolarHBondContact O-N 2.83Å; A323-Q326 PolarHBondContact O-N 2.87Å; Q326-K328 PolarHBondContact O-N 2.82Å
327K54.4Low51.7Low182 Ų182103.7 Ų103.779%0.79150%0.503SS*.THydrogen-bonded Turntrans-64.7-16.4173.1-74.1-178.2177.6-179.40113.9A323 Q325A323-K327 PolarHBondContact O-N 3.33Å; Q325-K327 VanDerWaalsContact C-N 3.31Å; Q325-K327 PolarHBondContact O-N 2.78Å
328K46.9Very low52.3Low158 Ų158100.7 Ų100.769%0.68749%0.49SS*.THydrogen-bonded Turntrans-108.8-26.9-173.7-159.2165.1-172.5168.60114Q325 Q326Q325-K328 PolarHBondContact O-N 2.79Å; Q326-K328 PolarHBondContact O-N 2.82Å
329Y49.3Very low53Low146 Ų146103.3 Ų103.357%0.57350%0.497SS*.SBendtrans-145.2132.4173.4-66.7-81.9000111.3Q325 Y331Q325-Y329 PolarHBondContact O-N 2.97Å; Y329-Y331 PolarHBondContact O-N 3.39Å; Y329-Y331 VanDerWaalsContact O-N 3.11Å
330K46.3Very low53.6Low218 Ų218104.8 Ų104.895%0.94850%0.496SS*.  trans-67.1105.3169.2-74.3-175.3176.2-179.10109.6
331Y51.5Low53.7Low135 Ų135107.5 Ų107.553%0.52950%0.5SS..  trans-136.392.1177.7-111.4-76.7000110.3Y329Y329-Y331 PolarHBondContact O-N 3.39Å; Y329-Y331 VanDerWaalsContact O-N 3.11Å
332E52.9Low54Low114 Ų114106.4 Ų106.453%0.53350%0.499SS..Hα-helixtrans-73.8-33.7-177.2-150.468.2-179.400111.5C334 K335 D336E332-C334 PolarHBondContact O-N 2.88Å; E332-K335 HydrophobicContact CG-CD 4.45Å; E332-K335 WeakPolarHBondContact O-CA 3.38Å; E332-K335 WeakPolarHBondContact O-CB 3.33Å; E332-K335 PolarHBondContact O-N 3.16Å; E332-K335 VanDerWaalsContact OE1-CD 3.29Å; E332-K335 WeakPolarHBondContact OE1-CD 3.45Å; E332-K335 WeakPolarHBondContact OE1-CE 3.45Å; E332-K335 IonicContact OE1-NZ 3.66Å; E332-K335 PolarHBondContact OE1-NZ 2.98Å; E332-K335 IonicContact OE2-NZ 3.98Å; E332-D336 PolarHBondContact O-N 2.87Å
333E51.3Low54.5Low145 Ų145112.4 Ų112.468%0.67852%0.518SS*.Hα-helixtrans-54.3-37.6175.6-60.3172.4159.400113.1K335 L337E333-K335 VanDerWaalsContact C-N 3.3Å; E333-K335 PolarHBondContact O-N 2.94Å; E333-L337 WeakPolarHBondContact O-CB 3.07Å; E333-L337 PolarHBondContact O-N 3.36Å
334C43.2Very low54.5Low41 Ų41112.3 Ų112.328%0.27751%0.512SS..Hα-helixtrans-66-34.7176.6-72.70000111.9E332 I338E332-C334 PolarHBondContact O-N 2.88Å; C334-I338 WeakPolarHBondContact O-CD1 3.37Å; C334-I338 WeakPolarHBondContact O-CG1 3.32Å; C334-I338 PolarHBondContact O-N 3.4Å
335K53.8Low54.8Low98 Ų98110.6 Ų110.643%0.42650%0.5SS..Hα-helixtrans-68.5-44.2-177.8-167.2-176178.6-179.10110.8E332 E333 K339E332-K335 HydrophobicContact CG-CD 4.45Å; E332-K335 WeakPolarHBondContact O-CA 3.38Å; E332-K335 WeakPolarHBondContact O-CB 3.33Å; E332-K335 PolarHBondContact O-N 3.16Å; E332-K335 VanDerWaalsContact OE1-CD 3.29Å; E332-K335 WeakPolarHBondContact OE1-CD 3.45Å; E332-K335 WeakPolarHBondContact OE1-CE 3.45Å; E332-K335 IonicContact OE1-NZ 3.66Å; E332-K335 PolarHBondContact OE1-NZ 2.98Å; E332-K335 IonicContact OE2-NZ 3.98Å; E333-K335 VanDerWaalsContact C-N 3.3Å; E333-K335 PolarHBondContact O-N 2.94Å; K335-K339 WeakPolarHBondContact O-CB 3.39Å; K335-K339 PolarHBondContact O-N 3.21Å
336D57.7Low55.3Low85 Ų85116.9 Ų116.946%0.45552%0.522SS..Hα-helixtrans-73.6-33.7176.2-74.8-49.1000112.6E332 K339 F340E332-D336 PolarHBondContact O-N 2.87Å; D336-K339 PolarHBondContact O-N 3.35Å; D336-K339 IonicContact OD1-NZ 2.61Å; D336-F340 VanDerWaalsContact O-CB 3.25Å; D336-F340 WeakPolarHBondContact O-CB 3.47Å; D336-F340 PolarHBondContact O-N 3.1Å
337L55.1Low55.6Low85 Ų85116.6 Ų116.645%0.44552%0.52SS..Hα-helixtrans-60.1-46.3170.6-179.660.3000111.9E333 F340 M341E333-L337 WeakPolarHBondContact O-CB 3.07Å; E333-L337 PolarHBondContact O-N 3.36Å; L337-F340 PolarHBondContact O-N 2.96Å; L337-M341 HydrophobicContact CD1-CG 4.46Å; L337-M341 HydrophobicContact CG-SD 4.32Å; L337-M341 WeakPolarHBondContact O-CG 3.41Å; L337-M341 PolarHBondContact O-N 3.14Å
338I60.3Low55.9Low50 Ų50112 Ų11226%0.25650%0.5SS..Hα-helixtrans-61.4-46.2176-66.4156.2000110.8L322 C334 F340 M341 L342L322-I338 HydrophobicContact CB-CD1 4.43Å; L322-I338 HydrophobicContact CD1-CD1 3.76Å; L322-I338 HydrophobicContact CD1-CG1 4.15Å; L322-I338 HydrophobicContact CD2-CD1 4.22Å; L322-I338 HydrophobicContact CG-CD1 4.35Å; C334-I338 WeakPolarHBondContact O-CD1 3.37Å; C334-I338 WeakPolarHBondContact O-CG1 3.32Å; C334-I338 PolarHBondContact O-N 3.4Å; I338-F340 VanDerWaalsContact C-N 3.31Å; I338-F340 PolarHBondContact O-N 3.18Å; I338-M341 PolarHBondContact O-N 2.64Å; I338-L342 HydrophobicContact CG2-CD1 3.84Å; I338-L342 HydrophobicContact CG2-CG 4.41Å; I338-L342 WeakPolarHBondContact O-CG 3.5Å; I338-L342 PolarHBondContact O-N 2.99Å
339K66.8Low57Low142 Ų142108.2 Ų108.262%0.61748%0.484SS*.Hα-helixtrans-61.2-38.7178.4-176.2-179174.2-169.90112K335 D336 R343K335-K339 WeakPolarHBondContact O-CB 3.39Å; K335-K339 PolarHBondContact O-N 3.21Å; D336-K339 PolarHBondContact O-N 3.35Å; D336-K339 IonicContact OD1-NZ 2.61Å; K339-R343 WeakPolarHBondContact O-CB 3.28Å; K339-R343 PolarHBondContact O-N 2.91Å; K339-R343 VanDerWaalsContact O-N 3.16Å
340F64Low58Low98 Ų98107.1 Ų107.143%0.4348%0.484SS..Hα-helixtrans-69.3-45.1174.5-178.5-108.2000111.8F43 D336 L337 I338 R343 N344F43-F340 HydrophobicContact CE1-CE1 4.39Å; F43-F340 AromaticContact CZ-CE1 3.83Å; F43-F340 HydrophobicContact CZ-CE1 3.83Å; D336-F340 VanDerWaalsContact O-CB 3.25Å; D336-F340 WeakPolarHBondContact O-CB 3.47Å; D336-F340 PolarHBondContact O-N 3.1Å; L337-F340 PolarHBondContact O-N 2.96Å; I338-F340 VanDerWaalsContact C-N 3.31Å; I338-F340 PolarHBondContact O-N 3.18Å; F340-R343 PolarHBondContact O-N 3.44Å; F340-N344 WeakPolarHBondContact CD1-ND2 3.4Å; F340-N344 WeakPolarHBondContact CD2-ND2 3.19Å; F340-N344 VanDerWaalsContact CE1-ND2 3.35Å; F340-N344 WeakPolarHBondContact CE1-ND2 3.49Å; F340-N344 VanDerWaalsContact CE2-ND2 3.25Å; F340-N344 WeakPolarHBondContact CE2-ND2 3.41Å; F340-N344 WeakPolarHBondContact CG-ND2 3.31Å; F340-N344 VanDerWaalsContact CZ-ND2 3.26Å; F340-N344 WeakPolarHBondContact CZ-ND2 3.12Å; F340-N344 PolarHBondContact O-N 3.31Å; F340-N344 PolarHBondContact O-ND2 3.22Å
341M53.3Low59.1Low91 Ų91101.1 Ų101.145%0.44846%0.46SS..Hα-helixtrans-56.4-53.5174.9-74.4175.567.800111.3L337 I338 R343 N344 E345L337-M341 HydrophobicContact CD1-CG 4.46Å; L337-M341 HydrophobicContact CG-SD 4.32Å; L337-M341 WeakPolarHBondContact O-CG 3.41Å; L337-M341 PolarHBondContact O-N 3.14Å; I338-M341 PolarHBondContact O-N 2.64Å; M341-R343 VanDerWaalsContact C-N 3.27Å; M341-R343 PolarHBondContact O-N 2.82Å; M341-N344 PolarHBondContact O-N 3.34Å; M341-E345 WeakPolarHBondContact O-CB 3.28Å; M341-E345 PolarHBondContact O-N 2.75Å
342L60.4Low60.4Low88 Ų8897 Ų9746%0.46144%0.444SS..Hα-helixtrans-61.3-32.8-179.5-68.6170.5000113L315 I338 R346L315-L342 HydrophobicContact CD2-CD2 4.17Å; I338-L342 HydrophobicContact CG2-CD1 3.84Å; I338-L342 HydrophobicContact CG2-CG 4.41Å; I338-L342 WeakPolarHBondContact O-CG 3.5Å; I338-L342 PolarHBondContact O-N 2.99Å; L342-R346 WeakPolarHBondContact O-CB 3.44Å; L342-R346 PolarHBondContact O-N 2.85Å
343R66.8Low61.3Low175 Ų17596.9 Ų96.966%0.6645%0.447SS*.Hα-helixtrans-70.4-49.8175.4-166.9-179.6-169.9-176.43.8111.8K339 F340 M341 E345 R346 Q347K339-R343 WeakPolarHBondContact O-CB 3.28Å; K339-R343 PolarHBondContact O-N 2.91Å; K339-R343 VanDerWaalsContact O-N 3.16Å; F340-R343 PolarHBondContact O-N 3.44Å; M341-R343 VanDerWaalsContact C-N 3.27Å; M341-R343 PolarHBondContact O-N 2.82Å; R343-E345 VanDerWaalsContact C-N 3.34Å; R343-E345 PolarHBondContact O-N 3.41Å; R343-R346 PolarHBondContact O-N 2.83Å; R343-Q347 WeakPolarHBondContact O-CG 3.34Å; R343-Q347 PolarHBondContact O-N 3.45Å; R343-Q347 PolarHBondContact O-OE1 2.94Å
344N55.8Low62.5Low39 Ų3992.9 Ų92.921%0.20944%0.439CS..Hα-helixtrans-63.2-40.1178-74.4-89.1000111.4K39 F340 M341 Q347 F348K39-N344 PolarHBondContact NZ-OD1 3.07Å; F340-N344 WeakPolarHBondContact CD1-ND2 3.4Å; F340-N344 WeakPolarHBondContact CD2-ND2 3.19Å; F340-N344 VanDerWaalsContact CE1-ND2 3.35Å; F340-N344 WeakPolarHBondContact CE1-ND2 3.49Å; F340-N344 VanDerWaalsContact CE2-ND2 3.25Å; F340-N344 WeakPolarHBondContact CE2-ND2 3.41Å; F340-N344 WeakPolarHBondContact CG-ND2 3.31Å; F340-N344 VanDerWaalsContact CZ-ND2 3.26Å; F340-N344 WeakPolarHBondContact CZ-ND2 3.12Å; F340-N344 PolarHBondContact O-N 3.31Å; F340-N344 PolarHBondContact O-ND2 3.22Å; M341-N344 PolarHBondContact O-N 3.34Å; N344-Q347 PolarHBondContact O-N 2.73Å; N344-F348 WeakPolarHBondContact O-CB 3.43Å; N344-F348 PolarHBondContact O-N 3.01Å
345E61.6Low64.3Low74 Ų7495.3 Ų95.335%0.34645%0.446SS..Hα-helixtrans-65.5-41.4-180-165-162.7135.600111.7M341 R343 F348 K349M341-E345 WeakPolarHBondContact O-CB 3.28Å; M341-E345 PolarHBondContact O-N 2.75Å; R343-E345 VanDerWaalsContact C-N 3.34Å; R343-E345 PolarHBondContact O-N 3.41Å; E345-F348 PolarHBondContact O-N 3.24Å; E345-K349 HydrophobicContact CG-CD 4.37Å; E345-K349 WeakPolarHBondContact O-CB 3.35Å; E345-K349 WeakPolarHBondContact O-CG 3.48Å; E345-K349 PolarHBondContact O-N 2.95Å; E345-K349 WeakPolarHBondContact OE1-CE 3.42Å; E345-K349 IonicContact OE1-NZ 2.6Å; E345-K349 PolarHBondContact OE1-NZ 3.34Å
346R61.1Low65.5Low187 Ų18792.2 Ų92.271%0.70643%0.433SS*.Hα-helixtrans-59.2-52.1171.6-177.9-176.9-67-164.6-2.4111L342 R343 F348 K349 E350L342-R346 WeakPolarHBondContact O-CB 3.44Å; L342-R346 PolarHBondContact O-N 2.85Å; R343-R346 PolarHBondContact O-N 2.83Å; R346-F348 VanDerWaalsContact C-N 3.3Å; R346-F348 PolarHBondContact O-N 3Å; R346-K349 PolarHBondContact O-N 3.11Å; R346-K349 VanDerWaalsContact O-N 3.15Å; R346-E350 WeakPolarHBondContact O-CB 3.5Å; R346-E350 PolarHBondContact O-N 2.91Å
347Q54.5Low66.6Low97 Ų9794 Ų9445%0.45344%0.442SS..Hα-helixtrans-62.1-35.8-178.1-70.7177.2-62.700112.4R343 N344 E350 E351R343-Q347 WeakPolarHBondContact O-CG 3.34Å; R343-Q347 PolarHBondContact O-N 3.45Å; R343-Q347 PolarHBondContact O-OE1 2.94Å; N344-Q347 PolarHBondContact O-N 2.73Å; Q347-E350 PolarHBondContact O-N 2.83Å; Q347-E351 WeakPolarHBondContact O-CB 3.24Å; Q347-E351 PolarHBondContact O-N 3.27Å
348F61.9Low68.2Low85 Ų8597.2 Ų97.237%0.37345%0.453SS..Hα-helixtrans-69.1-39.9174.1176.3-107.8000112.8N344 E345 R346 E350 K352N344-F348 WeakPolarHBondContact O-CB 3.43Å; N344-F348 PolarHBondContact O-N 3.01Å; E345-F348 PolarHBondContact O-N 3.24Å; R346-F348 VanDerWaalsContact C-N 3.3Å; R346-F348 PolarHBondContact O-N 3Å; F348-E350 VanDerWaalsContact C-N 3.3Å; F348-K352 VanDerWaalsContact O-CB 3.26Å; F348-K352 WeakPolarHBondContact O-CB 3.37Å; F348-K352 PolarHBondContact O-N 3.09Å; F348-K352 VanDerWaalsContact O-N 3.07Å
349K70.4Confident69.2Low80 Ų8098 Ų9835%0.34846%0.455SS..Hα-helixtrans-65.7-34.6173.8-76.2173.1169.1175.40111.7E311 E345 R346 L353E311-K349 IonicContact OE1-NZ 3.7Å; E311-K349 PolarHBondContact OE1-NZ 3.1Å; E311-K349 IonicContact OE2-NZ 3.77Å; E345-K349 HydrophobicContact CG-CD 4.37Å; E345-K349 WeakPolarHBondContact O-CB 3.35Å; E345-K349 WeakPolarHBondContact O-CG 3.48Å; E345-K349 PolarHBondContact O-N 2.95Å; E345-K349 WeakPolarHBondContact OE1-CE 3.42Å; E345-K349 IonicContact OE1-NZ 2.6Å; E345-K349 PolarHBondContact OE1-NZ 3.34Å; R346-K349 PolarHBondContact O-N 3.11Å; R346-K349 VanDerWaalsContact O-N 3.15Å; K349-L353 WeakPolarHBondContact O-CB 3.33Å; K349-L353 WeakPolarHBondContact O-CG 3.47Å; K349-L353 PolarHBondContact O-N 3.12Å; K349-L353 VanDerWaalsContact O-N 3.11Å
350E68.3Low70Confident123 Ų12393.9 Ų93.958%0.57545%0.448SS*.Hα-helixtrans-72.6-51.3177.1-173172.6-171.800112.6R346 Q347 F348 K352 L353 A354R346-E350 WeakPolarHBondContact O-CB 3.5Å; R346-E350 PolarHBondContact O-N 2.91Å; Q347-E350 PolarHBondContact O-N 2.83Å; F348-E350 VanDerWaalsContact C-N 3.3Å; E350-K352 VanDerWaalsContact C-N 3.31Å; E350-K352 PolarHBondContact O-N 3.27Å; E350-L353 PolarHBondContact O-N 3.32Å; E350-L353 VanDerWaalsContact O-N 3.13Å; E350-A354 PolarHBondContact O-N 2.8Å
351E70.8Confident71.1Confident92 Ų9292.7 Ų92.743%0.4344%0.443SS..Hα-helixtrans-57.3-44.5174.9-171.2-170.5-173.900111.1R36 Q347 L353 A354 E355R36-E351 IonicContact CZ-OE1 3.84Å; R36-E351 IonicContact CZ-OE2 3.87Å; R36-E351 IonicContact NH1-OE1 2.79Å; R36-E351 PolarHBondContact NH1-OE1 2.72Å; R36-E351 IonicContact NH1-OE2 2.64Å; R36-E351 PolarHBondContact NH1-OE2 2.77Å; Q347-E351 WeakPolarHBondContact O-CB 3.24Å; Q347-E351 PolarHBondContact O-N 3.27Å; E351-L353 VanDerWaalsContact C-N 3.33Å; E351-L353 PolarHBondContact O-N 2.96Å; E351-A354 PolarHBondContact O-N 3.41Å; E351-E355 PolarHBondContact O-N 3.33Å
352K77.4Confident73Confident48 Ų4890.9 Ų90.921%0.20943%0.434CS..Hα-helixtrans-69.1-29.1178.9-171.2156.6-169.5168.70113.1F348 E350 Q356F348-K352 VanDerWaalsContact O-CB 3.26Å; F348-K352 WeakPolarHBondContact O-CB 3.37Å; F348-K352 PolarHBondContact O-N 3.09Å; F348-K352 VanDerWaalsContact O-N 3.07Å; E350-K352 VanDerWaalsContact C-N 3.31Å; E350-K352 PolarHBondContact O-N 3.27Å; K352-Q356 WeakPolarHBondContact O-CG 3.34Å; K352-Q356 PolarHBondContact O-N 3.48Å; K352-Q356 VanDerWaalsContact O-N 3.16Å
353L73.6Confident74.3Confident111 Ų11187.7 Ų87.758%0.58142%0.417SS*.Hα-helixtrans-68.8-42.7171.3-91.7166.7000111.5K349 E350 E351 E355 Q356 L357K349-L353 WeakPolarHBondContact O-CB 3.33Å; K349-L353 WeakPolarHBondContact O-CG 3.47Å; K349-L353 PolarHBondContact O-N 3.12Å; K349-L353 VanDerWaalsContact O-N 3.11Å; E350-L353 PolarHBondContact O-N 3.32Å; E350-L353 VanDerWaalsContact O-N 3.13Å; E351-L353 VanDerWaalsContact C-N 3.33Å; E351-L353 PolarHBondContact O-N 2.96Å; L353-E355 PolarHBondContact O-N 3.41Å; L353-Q356 PolarHBondContact O-N 3.11Å; L353-L357 WeakPolarHBondContact O-CB 3.4Å; L353-L357 PolarHBondContact O-N 2.88Å
354A75.4Confident75.5Confident62 Ų6286.4 Ų86.451%0.51241%0.412SS..Hα-helixtrans-62-41177.400000112.4E350 E351 L357 K358E350-A354 PolarHBondContact O-N 2.8Å; E351-A354 PolarHBondContact O-N 3.41Å; A354-L357 PolarHBondContact O-N 2.93Å; A354-K358 PolarHBondContact O-N 3.1Å
355E81.6Confident77.2Confident91 Ų9190.1 Ų90.143%0.42543%0.428SS..Hα-helixtrans-67.2-40.2176.6-169.8165.1-129.800112.3E351 L353 K358 Q359E351-E355 PolarHBondContact O-N 3.33Å; L353-E355 PolarHBondContact O-N 3.41Å; E355-K358 PolarHBondContact O-N 2.86Å; E355-Q359 WeakPolarHBondContact O-CG 3.35Å; E355-Q359 PolarHBondContact O-N 2.98Å; E355-Q359 VanDerWaalsContact O-N 3.11Å
356Q79.6Confident78.7Confident33 Ų3389.1 Ų89.115%0.15442%0.422CS..Hα-helixtrans-67.1-37.2173.3-71-169.5-95.300112.5K352 L353 Q359 A360K352-Q356 WeakPolarHBondContact O-CG 3.34Å; K352-Q356 PolarHBondContact O-N 3.48Å; K352-Q356 VanDerWaalsContact O-N 3.16Å; L353-Q356 PolarHBondContact O-N 3.11Å; Q356-Q359 PolarHBondContact O-N 3Å; Q356-A360 WeakPolarHBondContact O-CB 3.35Å; Q356-A360 PolarHBondContact O-N 3.48Å
357L80.3Confident80.2Confident124 Ų12483.1 Ų83.165%0.64940%0.401SS*.Hα-helixtrans-62-43.8174-109.7167.3000111.6L353 A354 A360 E361L353-L357 WeakPolarHBondContact O-CB 3.4Å; L353-L357 PolarHBondContact O-N 2.88Å; A354-L357 PolarHBondContact O-N 2.93Å; L357-A360 PolarHBondContact O-N 2.64Å; L357-E361 PolarHBondContact O-N 2.91Å
358K87.4Confident82Confident152 Ų15283 Ų8366%0.66141%0.406SS*.Hα-helixtrans-61.1-45.4176.7-171.8-175.6176.3-171.70111.8A354 E355 A360 E361 E362A354-K358 PolarHBondContact O-N 3.1Å; E355-K358 PolarHBondContact O-N 2.86Å; K358-A360 VanDerWaalsContact C-N 3.33Å; K358-A360 PolarHBondContact O-N 2.85Å; K358-E361 PolarHBondContact O-N 3.4Å; K358-E362 WeakPolarHBondContact O-CB 3.31Å; K358-E362 PolarHBondContact O-N 2.92Å
359Q83.1Confident83.6Confident66 Ų6682.5 Ų82.531%0.30841%0.407SS..Hα-helixtrans-64.4-36.8177.5-72174.2-13.600112.3E355 Q356 L363E355-Q359 WeakPolarHBondContact O-CG 3.35Å; E355-Q359 PolarHBondContact O-N 2.98Å; E355-Q359 VanDerWaalsContact O-N 3.11Å; Q356-Q359 PolarHBondContact O-N 3Å; Q359-L363 WeakPolarHBondContact O-CB 3.47Å; Q359-L363 PolarHBondContact O-N 2.89Å
360A82.2Confident84.7Confident56 Ų5678.9 Ų78.946%0.46339%0.392SS..Hα-helixtrans-68.9-40.4176.700000112.7Q356 L357 K358 L363 R364Q356-A360 WeakPolarHBondContact O-CB 3.35Å; Q356-A360 PolarHBondContact O-N 3.48Å; L357-A360 PolarHBondContact O-N 2.64Å; K358-A360 VanDerWaalsContact C-N 3.33Å; K358-A360 PolarHBondContact O-N 2.85Å; A360-L363 PolarHBondContact O-N 2.86Å; A360-R364 WeakPolarHBondContact O-CB 3.42Å; A360-R364 PolarHBondContact O-N 2.96Å
361E88.8Confident85.7Confident72 Ų7277.5 Ų77.534%0.33639%0.385SS..Hα-helixtrans-70.7-37.7176.4-173.759.6-154.100111.6L357 K358 R364 Q365L357-E361 PolarHBondContact O-N 2.91Å; K358-E361 PolarHBondContact O-N 3.4Å; E361-R364 VanDerWaalsContact CD-NH1 3.28Å; E361-R364 WeakPolarHBondContact O-CB 3.45Å; E361-R364 PolarHBondContact O-N 2.87Å; E361-R364 IonicContact OE1-CZ 2.73Å; E361-R364 IonicContact OE1-NH1 2.76Å; E361-R364 PolarHBondContact OE1-NH1 2.94Å; E361-R364 VanDerWaalsContact OE2-CD 3.31Å; E361-R364 WeakPolarHBondContact OE2-CD 3.34Å; E361-R364 IonicContact OE2-CZ 2.62Å; E361-R364 IonicContact OE2-NH1 2.72Å; E361-R364 PolarHBondContact OE2-NH1 3.43Å; E361-Q365 VanDerWaalsContact O-CG 3.31Å; E361-Q365 WeakPolarHBondContact O-CG 3.35Å; E361-Q365 PolarHBondContact O-N 2.94Å
362E91.3Very high86.7Confident53 Ų5375.4 Ų75.425%0.24838%0.383CS..Hα-helixtrans-59.8-47.4171.6-168.6-178.1154.700111L92 K96 K358 R364 Q365 Y366L92-E362 HydrophobicContact CD1-CG 4.14Å; L92-E362 HydrophobicContact CD2-CG 4.49Å; K96-E362 VanDerWaalsContact CE-OE1 3.26Å; K96-E362 WeakPolarHBondContact CE-OE1 3.49Å; K96-E362 IonicContact NZ-OE1 2.72Å; K96-E362 PolarHBondContact NZ-OE1 3.18Å; K358-E362 WeakPolarHBondContact O-CB 3.31Å; K358-E362 PolarHBondContact O-N 2.92Å; E362-R364 VanDerWaalsContact C-N 3.32Å; E362-R364 PolarHBondContact O-N 3.49Å; E362-Q365 PolarHBondContact O-N 3.39Å; E362-Y366 HydrophobicContact CG-CD2 4.12Å; E362-Y366 HydrophobicContact CG-CE2 3.92Å; E362-Y366 VanDerWaalsContact O-CD2 3.26Å; E362-Y366 WeakPolarHBondContact O-CD2 3.45Å; E362-Y366 PolarHBondContact O-N 3.4Å
363L88.4Confident87.5Confident21 Ų2173.9 Ų73.911%0.1138%0.377CS..Hα-helixtrans-61.9-36.7175.3-179.763.2000112.8E91 L92 Y95 Q359 A360 K367E91-L363 HydrophobicContact CG-CD1 4.18Å; L92-L363 HydrophobicContact CB-CD1 4.34Å; L92-L363 HydrophobicContact CD1-CB 4.28Å; L92-L363 HydrophobicContact CD1-CD1 4.31Å; Y95-L363 HydrophobicContact CD2-CD1 3.61Å; Y95-L363 HydrophobicContact CE2-CD1 4.14Å; Y95-L363 HydrophobicContact CG-CD1 4.35Å; Q359-L363 WeakPolarHBondContact O-CB 3.47Å; Q359-L363 PolarHBondContact O-N 2.89Å; A360-L363 PolarHBondContact O-N 2.86Å; L363-K367 HydrophobicContact CG-CD 4.43Å; L363-K367 WeakPolarHBondContact O-CG 3.33Å; L363-K367 PolarHBondContact O-N 2.94Å
364R91.1Very high88.4Confident149 Ų14971.9 Ų71.956%0.56237%0.365SS*.Hα-helixtrans-64.6-43.9174.2178.1-172.1171.2-137.6-3.7111.4A360 E361 E362 K367 V368A360-R364 WeakPolarHBondContact O-CB 3.42Å; A360-R364 PolarHBondContact O-N 2.96Å; E361-R364 VanDerWaalsContact CD-NH1 3.28Å; E361-R364 WeakPolarHBondContact O-CB 3.45Å; E361-R364 PolarHBondContact O-N 2.87Å; E361-R364 IonicContact OE1-CZ 2.73Å; E361-R364 IonicContact OE1-NH1 2.76Å; E361-R364 PolarHBondContact OE1-NH1 2.94Å; E361-R364 VanDerWaalsContact OE2-CD 3.31Å; E361-R364 WeakPolarHBondContact OE2-CD 3.34Å; E361-R364 IonicContact OE2-CZ 2.62Å; E361-R364 IonicContact OE2-NH1 2.72Å; E361-R364 PolarHBondContact OE2-NH1 3.43Å; E362-R364 VanDerWaalsContact C-N 3.32Å; E362-R364 PolarHBondContact O-N 3.49Å; R364-K367 PolarHBondContact O-N 3.44Å; R364-V368 WeakPolarHBondContact O-CG2 3.4Å; R364-V368 PolarHBondContact O-N 3.45Å
365Q93.3Very high89.1Confident116 Ų11676.7 Ų76.754%0.54237%0.369SS..Hα-helixtrans-61.6-45.5177-72.1168.26.300111.3E361 E362 K367 V368 L369E361-Q365 VanDerWaalsContact O-CG 3.31Å; E361-Q365 WeakPolarHBondContact O-CG 3.35Å; E361-Q365 PolarHBondContact O-N 2.94Å; E362-Q365 PolarHBondContact O-N 3.39Å; Q365-K367 VanDerWaalsContact C-N 3.33Å; Q365-K367 PolarHBondContact O-N 2.93Å; Q365-V368 PolarHBondContact O-N 3.13Å; Q365-L369 WeakPolarHBondContact O-CB 3.35Å; Q365-L369 PolarHBondContact O-N 3.33Å
366Y91.7Very high89.7Confident54 Ų5474.9 Ų74.921%0.21236%0.361CS..Hα-helixtrans-61.6-36.8174.6-83.6-71000113.4L92 K96 V99 E362 L369 V370L92-Y366 HydrophobicContact CD1-CD2 3.6Å; L92-Y366 HydrophobicContact CD1-CE2 4.12Å; L92-Y366 HydrophobicContact CD1-CG 4.44Å; K96-Y366 HydrophobicContact CD-CE2 4.22Å; K96-Y366 VanDerWaalsContact CE-CZ 3.49Å; K96-Y366 WeakPolarHBondContact CE-OH 3.29Å; K96-Y366 HydrophobicContact CG-CD1 4.23Å; K96-Y366 HydrophobicContact CG-CD2 4.34Å; K96-Y366 HydrophobicContact CG-CE1 3.73Å; K96-Y366 HydrophobicContact CG-CE2 3.84Å; V99-Y366 HydrophobicContact CB-CD1 4.49Å; V99-Y366 HydrophobicContact CG2-CD1 3.87Å; V99-Y366 HydrophobicContact CG2-CE1 4.41Å; E362-Y366 HydrophobicContact CG-CD2 4.12Å; E362-Y366 HydrophobicContact CG-CE2 3.92Å; E362-Y366 VanDerWaalsContact O-CD2 3.26Å; E362-Y366 WeakPolarHBondContact O-CD2 3.45Å; E362-Y366 PolarHBondContact O-N 3.4Å; Y366-L369 PolarHBondContact O-N 3.45Å; Y366-V370 WeakPolarHBondContact O-CG2 3.45Å; Y366-V370 PolarHBondContact O-N 3.41Å
367K92.4Very high90.3Very high60 Ų6073.7 Ų73.726%0.26136%0.356SS..Hα-helixtrans-66.1-39.9174.8-77.1172.2179.7-178.90113E91 Y95 L363 R364 Q365 H371E91-K367 WeakPolarHBondContact OE1-CE 3.45Å; E91-K367 IonicContact OE1-NZ 3.14Å; E91-K367 PolarHBondContact OE1-NZ 2.99Å; Y95-K367 HydrophobicContact CD1-CG 4.12Å; Y95-K367 HydrophobicContact CD2-CG 4.45Å; Y95-K367 HydrophobicContact CE1-CG 3.6Å; Y95-K367 HydrophobicContact CE2-CD 4.28Å; Y95-K367 HydrophobicContact CE2-CG 3.97Å; Y95-K367 VanDerWaalsContact CZ-CE 3.41Å; Y95-K367 WeakPolarHBondContact OH-CE 3.45Å; L363-K367 HydrophobicContact CG-CD 4.43Å; L363-K367 WeakPolarHBondContact O-CG 3.33Å; L363-K367 PolarHBondContact O-N 2.94Å; R364-K367 PolarHBondContact O-N 3.44Å; Q365-K367 VanDerWaalsContact C-N 3.33Å; Q365-K367 PolarHBondContact O-N 2.93Å; K367-H371 PolarHBondContact O-CD2 3.15Å; K367-H371 VanDerWaalsContact O-CD2 3.31Å; K367-H371 PolarHBondContact O-N 2.93Å
368V93.9Very high90.8Very high95 Ų9572 Ų7258%0.57635%0.351SS*.Hα-helixtrans-65.7-41.5173.9173.40000110.9R364 Q365 H371 A372R364-V368 WeakPolarHBondContact O-CG2 3.4Å; R364-V368 PolarHBondContact O-N 3.45Å; Q365-V368 PolarHBondContact O-N 3.13Å; V368-H371 PolarHBondContact O-N 3.06Å; V368-A372 PolarHBondContact O-N 2.88Å
369L94.3Very high91.1Very high75 Ų7569.4 Ų69.439%0.39334%0.341SS..Hα-helixtrans-65.2-45.8179.1-178.857.1000112.4V99 Q365 Y366 H371 A372 Q373V99-L369 HydrophobicContact CG1-CD2 3.72Å; V99-L369 HydrophobicContact CG1-CG 4.3Å; V99-L369 HydrophobicContact CG2-CD2 4.08Å; V99-L369 HydrophobicContact CG2-CG 4.14Å; Q365-L369 WeakPolarHBondContact O-CB 3.35Å; Q365-L369 PolarHBondContact O-N 3.33Å; Y366-L369 PolarHBondContact O-N 3.45Å; L369-H371 PolarHBondContact O-N 3.3Å; L369-A372 WeakPolarHBondContact O-CB 3.37Å; L369-A372 PolarHBondContact O-N 3.37Å; L369-Q373 HydrophobicContact CD1-CG 4.2Å; L369-Q373 WeakPolarHBondContact O-CG 3.4Å; L369-Q373 PolarHBondContact O-N 2.89Å
370V93.9Very high91.5Very high3 Ų367.3 Ų67.32%0.01833%0.332CS..Hα-helixtrans-56.8-48.7174164.30000110.8Y95 L98 V99 Y366 A372 Q373 E374Y95-V370 HydrophobicContact CD1-CB 4.47Å; Y95-V370 HydrophobicContact CD1-CG2 3.88Å; Y95-V370 HydrophobicContact CE1-CG2 4.38Å; L98-V370 HydrophobicContact CD2-CG1 3.78Å; L98-V370 HydrophobicContact CD2-CG2 4.01Å; L98-V370 HydrophobicContact CG-CG1 4.42Å; L98-V370 HydrophobicContact CG-CG2 4.12Å; V99-V370 HydrophobicContact CG2-CG2 3.46Å; V99-V370 VanDerWaalsContact CG2-CG2 3.46Å; Y366-V370 WeakPolarHBondContact O-CG2 3.45Å; Y366-V370 PolarHBondContact O-N 3.41Å; V370-A372 PolarHBondContact O-N 2.88Å; V370-Q373 PolarHBondContact O-N 3.29Å; V370-E374 HydrophobicContact CG1-CG 4.18Å; V370-E374 VanDerWaalsContact CG1-OE1 3.23Å; V370-E374 WeakPolarHBondContact CG1-OE1 3.33Å; V370-E374 WeakPolarHBondContact O-CB 3.38Å; V370-E374 VanDerWaalsContact O-CG 3.26Å; V370-E374 WeakPolarHBondContact O-CG 3.43Å; V370-E374 PolarHBondContact O-N 3.04Å
371H89.3Confident92Very high95 Ų9569.3 Ų69.344%0.4433%0.33SS..Hα-helixtrans-67-20.3177.3-69.9-39.2000114.1K367 V368 L369 E374 R375K367-H371 PolarHBondContact O-CD2 3.15Å; K367-H371 VanDerWaalsContact O-CD2 3.31Å; K367-H371 PolarHBondContact O-N 2.93Å; V368-H371 PolarHBondContact O-N 3.06Å; L369-H371 PolarHBondContact O-N 3.3Å; H371-E374 IonicContact CE1-OE2 2.7Å; H371-E374 IonicContact CG-OE2 3.86Å; H371-E374 IonicContact ND1-OE2 3.8Å; H371-E374 PolarHBondContact ND1-OE2 2.98Å; H371-R375 VanDerWaalsContact C-NH1 3.34Å; H371-R375 WeakPolarHBondContact O-CG 3.4Å; H371-R375 PolarHBondContact O-NH1 3.08Å
372A92.1Very high92.1Very high47 Ų4769.9 Ų69.939%0.38833%0.333SS..Hα-helixtrans-76-47.917000000110.8V368 L369 V370 E374 R375 E376V368-A372 PolarHBondContact O-N 2.88Å; L369-A372 WeakPolarHBondContact O-CB 3.37Å; L369-A372 PolarHBondContact O-N 3.37Å; V370-A372 PolarHBondContact O-N 2.88Å; A372-E374 VanDerWaalsContact C-N 3.34Å; A372-E374 PolarHBondContact O-N 3.16Å; A372-R375 PolarHBondContact O-N 2.83Å; A372-E376 PolarHBondContact O-N 3.45Å; A372-E376 VanDerWaalsContact O-N 3.09Å
373Q93.8Very high92.2Very high17 Ų1768.9 Ų68.98%0.07933%0.328CS..Hα-helixtrans-63-36.9177.4-68.3-179.1-52.200112.4Q102 L106 L369 V370 E376 L377Q102-Q373 HydrophobicContact CB-CB 4.05Å; L106-Q373 HydrophobicContact CD1-CB 3.94Å; L106-Q373 HydrophobicContact CD1-CG 3.83Å; L369-Q373 HydrophobicContact CD1-CG 4.2Å; L369-Q373 WeakPolarHBondContact O-CG 3.4Å; L369-Q373 PolarHBondContact O-N 2.89Å; V370-Q373 PolarHBondContact O-N 3.29Å; Q373-E376 PolarHBondContact O-N 3.39Å; Q373-L377 VanDerWaalsContact O-CB 3.3Å; Q373-L377 WeakPolarHBondContact O-CB 3.5Å; Q373-L377 WeakPolarHBondContact O-CG 3.41Å; Q373-L377 PolarHBondContact O-N 3.12Å
374E92.1Very high92.4Very high68 Ų6868.3 Ų68.332%0.31833%0.325SS..Hα-helixtrans-60.8-43.1174.1-75.516916900112.2Q102 V370 H371 A372 L377 T378Q102-E374 VanDerWaalsContact NE2-CG 3.33Å; V370-E374 HydrophobicContact CG1-CG 4.18Å; V370-E374 VanDerWaalsContact CG1-OE1 3.23Å; V370-E374 WeakPolarHBondContact CG1-OE1 3.33Å; V370-E374 WeakPolarHBondContact O-CB 3.38Å; V370-E374 VanDerWaalsContact O-CG 3.26Å; V370-E374 WeakPolarHBondContact O-CG 3.43Å; V370-E374 PolarHBondContact O-N 3.04Å; H371-E374 IonicContact CE1-OE2 2.7Å; H371-E374 IonicContact CG-OE2 3.86Å; H371-E374 IonicContact ND1-OE2 3.8Å; H371-E374 PolarHBondContact ND1-OE2 2.98Å; A372-E374 VanDerWaalsContact C-N 3.34Å; A372-E374 PolarHBondContact O-N 3.16Å; E374-L377 PolarHBondContact O-N 3.29Å; E374-T378 PolarHBondContact O-N 2.94Å; E374-T378 PolarHBondContact O-OG1 3.19Å
375R91.3Very high92.4Very high163 Ų16366.4 Ų66.462%0.61532%0.317SS*.Hα-helixtrans-66.1-45.7177.2-70.3176.6-170.5104.5-6.4111.5H371 A372 L377 T378 Q379H371-R375 VanDerWaalsContact C-NH1 3.34Å; H371-R375 WeakPolarHBondContact O-CG 3.4Å; H371-R375 PolarHBondContact O-NH1 3.08Å; A372-R375 PolarHBondContact O-N 2.83Å; R375-L377 VanDerWaalsContact C-N 3.34Å; R375-L377 PolarHBondContact O-N 3.29Å; R375-T378 WeakPolarHBondContact O-CB 3.36Å; R375-T378 PolarHBondContact O-N 3.34Å; R375-Q379 WeakPolarHBondContact O-CG 3.34Å; R375-Q379 PolarHBondContact O-N 2.96Å; R375-Q379 PolarHBondContact O-OE1 3.45Å
376E93.9Very high92.4Very high53 Ų5363.8 Ų63.825%0.24831%0.305CS..Hα-helixtrans-63.5-41.3177.1-166.8-167.9162.900111L106 R110 A372 Q373 T378 Q379 L380L106-E376 HydrophobicContact CD2-CB 3.85Å; L106-E376 HydrophobicContact CD2-CG 3.73Å; R110-E376 IonicContact CZ-OE1 2.83Å; R110-E376 IonicContact CZ-OE2 3.95Å; R110-E376 IonicContact NE-OE1 2.71Å; R110-E376 PolarHBondContact NE-OE1 3.23Å; R110-E376 IonicContact NH2-OE1 2.66Å; R110-E376 PolarHBondContact NH2-OE1 3.28Å; R110-E376 IonicContact NH2-OE2 3.25Å; R110-E376 PolarHBondContact NH2-OE2 3.17Å; A372-E376 PolarHBondContact O-N 3.45Å; A372-E376 VanDerWaalsContact O-N 3.09Å; Q373-E376 PolarHBondContact O-N 3.39Å; E376-T378 VanDerWaalsContact C-N 3.29Å; E376-T378 PolarHBondContact O-N 2.94Å; E376-Q379 PolarHBondContact O-N 2.98Å; E376-L380 HydrophobicContact CG-CD1 4.03Å; E376-L380 HydrophobicContact CG-CG 4.11Å; E376-L380 VanDerWaalsContact O-CG 3.31Å; E376-L380 WeakPolarHBondContact O-CG 3.44Å; E376-L380 PolarHBondContact O-N 3.45Å
377L91.9Very high92.4Very high9 Ų961.2 Ų61.25%0.04730%0.295CS..Hα-helixtrans-57.5-41.5173.9-79.3171.4000111.8Q102 E105 L106 L109 Q373 E374 R375 K381Q102-L377 HydrophobicContact CB-CD1 3.92Å; Q102-L377 HydrophobicContact CG-CD1 3.79Å; E105-L377 HydrophobicContact CB-CD2 3.93Å; E105-L377 HydrophobicContact CG-CD2 3.64Å; L106-L377 HydrophobicContact CD2-CB 4.42Å; L106-L377 HydrophobicContact CD2-CD2 3.67Å; L106-L377 HydrophobicContact CD2-CG 3.7Å; L106-L377 HydrophobicContact CG-CD2 3.76Å; L106-L377 HydrophobicContact CG-CG 3.88Å; L109-L377 HydrophobicContact CD1-CD2 3.7Å; Q373-L377 VanDerWaalsContact O-CB 3.3Å; Q373-L377 WeakPolarHBondContact O-CB 3.5Å; Q373-L377 WeakPolarHBondContact O-CG 3.41Å; Q373-L377 PolarHBondContact O-N 3.12Å; E374-L377 PolarHBondContact O-N 3.29Å; R375-L377 VanDerWaalsContact C-N 3.34Å; R375-L377 PolarHBondContact O-N 3.29Å; L377-K381 VanDerWaalsContact O-CB 3.32Å; L377-K381 WeakPolarHBondContact O-CB 3.44Å; L377-K381 WeakPolarHBondContact O-CD 3.47Å; L377-K381 WeakPolarHBondContact O-CG 3.34Å; L377-K381 PolarHBondContact O-N 3.28Å; L377-K381 VanDerWaalsContact O-N 3.11Å
378T91.4Very high92.5Very high88 Ų8860.6 Ų60.654%0.5429%0.291SS..Hα-helixtrans-63.2-50.3173.8-610000111.4E374 R375 E376 L380 K381 E382E374-T378 PolarHBondContact O-N 2.94Å; E374-T378 PolarHBondContact O-OG1 3.19Å; R375-T378 WeakPolarHBondContact O-CB 3.36Å; R375-T378 PolarHBondContact O-N 3.34Å; E376-T378 VanDerWaalsContact C-N 3.29Å; E376-T378 PolarHBondContact O-N 2.94Å; T378-L380 PolarHBondContact O-N 3.38Å; T378-K381 PolarHBondContact O-N 2.88Å; T378-E382 WeakPolarHBondContact O-CB 3.41Å; T378-E382 PolarHBondContact O-N 3.06Å
379Q92.3Very high92.4Very high97 Ų9758.6 Ų58.645%0.45328%0.277SS..Hα-helixtrans-60-44.1-179.4-70.5170-60.600112.6R375 E376 E382 K383R375-Q379 WeakPolarHBondContact O-CG 3.34Å; R375-Q379 PolarHBondContact O-N 2.96Å; R375-Q379 PolarHBondContact O-OE1 3.45Å; E376-Q379 PolarHBondContact O-N 2.98Å; Q379-E382 PolarHBondContact O-N 2.87Å; Q379-K383 PolarHBondContact O-N 2.86Å
380L91.9Very high92.3Very high23 Ų2356.4 Ų56.412%0.1227%0.27CS..Hα-helixtrans-70.6-34.7179.5-60.9179.8000112.3L106 L109 R110 L113 E376 T378 L384L106-L380 HydrophobicContact CD2-CD1 3.74Å; L109-L380 HydrophobicContact CB-CB 4.29Å; L109-L380 HydrophobicContact CB-CD1 4.4Å; R110-L380 HydrophobicContact CG-CD1 3.64Å; L113-L380 HydrophobicContact CD1-CB 3.95Å; L113-L380 HydrophobicContact CD1-CD2 3.51Å; L113-L380 HydrophobicContact CD1-CG 4.21Å; E376-L380 HydrophobicContact CG-CD1 4.03Å; E376-L380 HydrophobicContact CG-CG 4.11Å; E376-L380 VanDerWaalsContact O-CG 3.31Å; E376-L380 WeakPolarHBondContact O-CG 3.44Å; E376-L380 PolarHBondContact O-N 3.45Å; T378-L380 PolarHBondContact O-N 3.38Å; L380-L384 WeakPolarHBondContact O-CB 3.31Å; L380-L384 WeakPolarHBondContact O-CG 3.48Å; L380-L384 PolarHBondContact O-N 3.36Å
381K92.8Very high92.3Very high98 Ų9856.2 Ų56.243%0.42627%0.269SS..Hα-helixtrans-66.5-39.2172.7-74.8172.5-174.8-1790111.8E105 L109 L377 T378 L384 R385E105-K381 WeakPolarHBondContact OE1-CE 3.31Å; E105-K381 IonicContact OE1-NZ 3.88Å; E105-K381 PolarHBondContact OE1-NZ 3.3Å; L109-K381 HydrophobicContact CD1-CD 4.5Å; L109-K381 HydrophobicContact CD1-CG 3.88Å; L377-K381 VanDerWaalsContact O-CB 3.32Å; L377-K381 WeakPolarHBondContact O-CB 3.44Å; L377-K381 WeakPolarHBondContact O-CD 3.47Å; L377-K381 WeakPolarHBondContact O-CG 3.34Å; L377-K381 PolarHBondContact O-N 3.28Å; L377-K381 VanDerWaalsContact O-N 3.11Å; T378-K381 PolarHBondContact O-N 2.88Å; K381-L384 PolarHBondContact O-N 3.19Å; K381-R385 PolarHBondContact O-N 2.66Å
382E91.8Very high92.5Very high83 Ų8356.3 Ų56.339%0.38827%0.265SS..Hα-helixtrans-62.7-48.8174.6-172.2130.6-105.800111.3T378 Q379 L384 R385 E386T378-E382 WeakPolarHBondContact O-CB 3.41Å; T378-E382 PolarHBondContact O-N 3.06Å; Q379-E382 PolarHBondContact O-N 2.87Å; E382-L384 VanDerWaalsContact C-N 3.33Å; E382-L384 PolarHBondContact O-N 3.1Å; E382-R385 WeakPolarHBondContact O-CB 3.32Å; E382-R385 PolarHBondContact O-N 3.06Å; E382-R385 VanDerWaalsContact O-N 3.16Å; E382-R385 IonicContact OE1-CZ 2.84Å; E382-R385 VanDerWaalsContact OE1-CZ 3.25Å; E382-R385 IonicContact OE1-NH1 4Å; E382-R385 PolarHBondContact OE1-NH1 3.34Å; E382-R385 IonicContact OE1-NH2 2.91Å; E382-R385 PolarHBondContact OE1-NH2 2.84Å; E382-E386 WeakPolarHBondContact O-CG 3.37Å; E382-E386 PolarHBondContact O-N 3.02Å
383K92.2Very high92.5Very high33 Ų3357.1 Ų57.114%0.14327%0.268CS..Hα-helixtrans-61-36.7174.7-73.4-171176.4-178.50113.7L113 E165 Q379 G387L113-K383 HydrophobicContact CD2-CB 3.97Å; E165-K383 VanDerWaalsContact CG-NZ 3.32Å; E165-K383 VanDerWaalsContact N-NZ 3.19Å; E165-K383 IonicContact OE1-NZ 3.68Å; E165-K383 WeakPolarHBondContact OE2-CE 3.47Å; E165-K383 IonicContact OE2-NZ 2.76Å; E165-K383 PolarHBondContact OE2-NZ 3.29Å; Q379-K383 PolarHBondContact O-N 2.86Å; K383-G387 PolarHBondContact O-N 3.08Å
384L92.6Very high92.5Very high9 Ų956.4 Ų56.45%0.04727%0.265CS..Hα-helixtrans-66.3-42173.5-78.5166.9000112.3L109 K112 L113 L380 K381 E382 R388 L433L109-L384 HydrophobicContact CB-CD1 4.02Å; L109-L384 HydrophobicContact CD2-CD1 3.45Å; L109-L384 VanDerWaalsContact CD2-CD1 3.45Å; L109-L384 HydrophobicContact CG-CD1 4.28Å; K112-L384 HydrophobicContact CB-CD2 4Å; L113-L384 HydrophobicContact CD1-CG 4.41Å; L113-L384 HydrophobicContact CD2-CD2 3.68Å; L113-L384 HydrophobicContact CD2-CG 3.7Å; L113-L384 HydrophobicContact CG-CD1 4.37Å; L113-L384 HydrophobicContact CG-CD2 3.73Å; L113-L384 HydrophobicContact CG-CG 3.73Å; L380-L384 WeakPolarHBondContact O-CB 3.31Å; L380-L384 WeakPolarHBondContact O-CG 3.48Å; L380-L384 PolarHBondContact O-N 3.36Å; K381-L384 PolarHBondContact O-N 3.19Å; E382-L384 VanDerWaalsContact C-N 3.33Å; E382-L384 PolarHBondContact O-N 3.1Å; L384-R388 VanDerWaalsContact O-CB 3.31Å; L384-R388 WeakPolarHBondContact O-CB 3.35Å; L384-R388 PolarHBondContact O-N 2.9Å; L384-L433 HydrophobicContact CD2-CD2 3.63Å
385R92.4Very high92.5Very high108 Ų10854 Ų5441%0.40825%0.254SS..Hα-helixtrans-60.1-54.4174-173.9-167.671.3-137.7-7.8110.3K381 E382 G387 R388 D389K381-R385 PolarHBondContact O-N 2.66Å; E382-R385 WeakPolarHBondContact O-CB 3.32Å; E382-R385 PolarHBondContact O-N 3.06Å; E382-R385 VanDerWaalsContact O-N 3.16Å; E382-R385 IonicContact OE1-CZ 2.84Å; E382-R385 VanDerWaalsContact OE1-CZ 3.25Å; E382-R385 IonicContact OE1-NH1 4Å; E382-R385 PolarHBondContact OE1-NH1 3.34Å; E382-R385 IonicContact OE1-NH2 2.91Å; E382-R385 PolarHBondContact OE1-NH2 2.84Å; R385-G387 VanDerWaalsContact C-N 3.34Å; R385-G387 PolarHBondContact O-N 3.08Å; R385-R388 WeakPolarHBondContact O-CB 3.31Å; R385-R388 PolarHBondContact O-N 3.41Å; R385-R388 VanDerWaalsContact O-N 3.1Å; R385-D389 VanDerWaalsContact O-CG 3.3Å; R385-D389 PolarHBondContact O-N 3.49Å
386E91.6Very high92.5Very high61 Ų6151.3 Ų51.329%0.28525%0.248SC..Hα-helixtrans-68.2-32.7-175.8-67.8-172.2-163.100113.6K161 E382 A390K161-E386 HydrophobicContact CD-CB 4.49Å; K161-E386 WeakPolarHBondContact CE-OE2 3.38Å; K161-E386 IonicContact NZ-OE2 2.85Å; K161-E386 PolarHBondContact NZ-OE2 3.09Å; E382-E386 WeakPolarHBondContact O-CG 3.37Å; E382-E386 PolarHBondContact O-N 3.02Å; E386-A390 WeakPolarHBondContact O-CB 3.02Å; E386-A390 PolarHBondContact O-N 3.48Å
387G93.1Very high92.4Very high0 Ų050.1 Ų50.10%024%0.243CC..Hα-helixtrans-64.4-44.6169.100000112.1L158 K383 R385 D389 A390 S391L158-G387 WeakPolarHBondContact CD1-O 3.42Å; K383-G387 PolarHBondContact O-N 3.08Å; R385-G387 VanDerWaalsContact C-N 3.34Å; R385-G387 PolarHBondContact O-N 3.08Å; G387-D389 VanDerWaalsContact C-N 3.33Å; G387-D389 PolarHBondContact O-N 3.31Å; G387-A390 PolarHBondContact O-N 3.49Å; G387-S391 WeakPolarHBondContact O-CB 3.42Å; G387-S391 PolarHBondContact O-N 2.89Å; G387-S391 PolarHBondContact O-OG 2.86Å
388R93.5Very high92.3Very high48 Ų4849.7 Ų49.718%0.18124%0.241CC..Hα-helixtrans-61-42.2175.3-169.7-165.7-50.3158.46.1111.6L384 R385 S391 R392 V430 L433L384-R388 VanDerWaalsContact O-CB 3.31Å; L384-R388 WeakPolarHBondContact O-CB 3.35Å; L384-R388 PolarHBondContact O-N 2.9Å; R385-R388 WeakPolarHBondContact O-CB 3.31Å; R385-R388 PolarHBondContact O-N 3.41Å; R385-R388 VanDerWaalsContact O-N 3.1Å; R388-S391 WeakPolarHBondContact O-CB 3.36Å; R388-S391 PolarHBondContact O-N 3.43Å; R388-R392 PolarHBondContact O-N 3.35Å; R388-V430 HydrophobicContact CG-CG1 4.04Å; R388-L433 HydrophobicContact CB-CB 3.91Å; R388-L433 HydrophobicContact CG-CB 4.28Å; R388-L433 PolarHBondContact NE-O 2.91Å; R388-L433 PolarHBondContact NH2-O 3.21Å
389D92.2Very high92.2Very high53 Ų5349.6 Ų49.628%0.28323%0.234SC..Hα-helixtrans-68-45.2179.9-66.1-35.1000111.7R385 G387 S391 R392 S393R385-D389 VanDerWaalsContact O-CG 3.3Å; R385-D389 PolarHBondContact O-N 3.49Å; G387-D389 VanDerWaalsContact C-N 3.33Å; G387-D389 PolarHBondContact O-N 3.31Å; D389-S391 VanDerWaalsContact C-N 3.3Å; D389-S391 PolarHBondContact O-N 2.96Å; D389-R392 WeakPolarHBondContact O-CB 3.43Å; D389-R392 PolarHBondContact O-N 2.97Å; D389-R392 VanDerWaalsContact O-N 3.11Å; D389-R392 IonicContact OD1-CZ 2.68Å; D389-R392 IonicContact OD1-NH1 2.67Å; D389-R392 PolarHBondContact OD1-NH1 3.4Å; D389-R392 IonicContact OD1-NH2 2.97Å; D389-R392 PolarHBondContact OD1-NH2 2.9Å; D389-S393 PolarHBondContact O-N 3.15Å; D389-S393 PolarHBondContact O-OG 3.36Å
390A92.6Very high91.9Very high28 Ų2847.7 Ų47.723%0.23124%0.235CC..Hα-helixtrans-63.3-34.4172.500000112.7L158 E386 G387 R392 S393 L394L158-A390 HydrophobicContact CD1-CB 3.98Å; E386-A390 WeakPolarHBondContact O-CB 3.02Å; E386-A390 PolarHBondContact O-N 3.48Å; G387-A390 PolarHBondContact O-N 3.49Å; A390-R392 VanDerWaalsContact C-N 3.32Å; A390-S393 PolarHBondContact O-N 3.21Å; A390-L394 WeakPolarHBondContact O-CB 3.46Å; A390-L394 PolarHBondContact O-N 2.96Å
391S93.6Very high91.5Very high0 Ų048.3 Ų48.30%024%0.238CC..Hα-helixtrans-65-36.2172.5-55.50000111.8L158 G387 R388 D389 N395 L433L158-S391 WeakPolarHBondContact CD2-OG 3.46Å; G387-S391 WeakPolarHBondContact O-CB 3.42Å; G387-S391 PolarHBondContact O-N 2.89Å; G387-S391 PolarHBondContact O-OG 2.86Å; R388-S391 WeakPolarHBondContact O-CB 3.36Å; R388-S391 PolarHBondContact O-N 3.43Å; D389-S391 VanDerWaalsContact C-N 3.3Å; D389-S391 PolarHBondContact O-N 2.96Å; S391-N395 VanDerWaalsContact O-CB 3.31Å; S391-N395 WeakPolarHBondContact O-CB 3.47Å; S391-N395 PolarHBondContact O-N 2.99Å; S391-L433 WeakPolarHBondContact OG-CD1 3.22Å
392R92.9Very high90.8Very high96 Ų9645.8 Ų45.836%0.36223%0.229SC..Hα-helixtrans-66.3-46.4174.8-159.6-167-59.297.84110.8R388 D389 A390 L394 N395 E396 V430R388-R392 PolarHBondContact O-N 3.35Å; D389-R392 WeakPolarHBondContact O-CB 3.43Å; D389-R392 PolarHBondContact O-N 2.97Å; D389-R392 VanDerWaalsContact O-N 3.11Å; D389-R392 IonicContact OD1-CZ 2.68Å; D389-R392 IonicContact OD1-NH1 2.67Å; D389-R392 PolarHBondContact OD1-NH1 3.4Å; D389-R392 IonicContact OD1-NH2 2.97Å; D389-R392 PolarHBondContact OD1-NH2 2.9Å; A390-R392 VanDerWaalsContact C-N 3.32Å; R392-L394 PolarHBondContact O-N 2.81Å; R392-N395 WeakPolarHBondContact O-CB 3.44Å; R392-N395 PolarHBondContact O-N 3.4Å; R392-E396 WeakPolarHBondContact CD-OE1 3.31Å; R392-E396 WeakPolarHBondContact CG-OE1 3.45Å; R392-E396 WeakPolarHBondContact O-CG 3.32Å; R392-E396 PolarHBondContact O-N 2.97Å; R392-V430 HydrophobicContact CB-CG2 4.28Å
393S93.1Very high89.8Confident65 Ų6546.6 Ų46.646%0.45524%0.24SC..Hα-helixtrans-62-39.6175.8-56.80000112.9D389 A390 E396 H397D389-S393 PolarHBondContact O-N 3.15Å; D389-S393 PolarHBondContact O-OG 3.36Å; A390-S393 PolarHBondContact O-N 3.21Å; S393-E396 PolarHBondContact O-N 2.84Å; S393-H397 WeakPolarHBondContact O-CB 3.42Å; S393-H397 PolarHBondContact O-N 3.11Å
394L92.7Very high88.1Confident1 Ų150.8 Ų50.81%0.00527%0.27CS..Hα-helixtrans-64.8-41.7173.3175.356.4000111.9L123 L127 L154 A155 L158 A390 R392 H397 L398L123-L394 HydrophobicContact CD2-CD2 3.56Å; L123-L394 HydrophobicContact CD2-CG 4.36Å; L123-L394 HydrophobicContact CG-CD2 4.36Å; L127-L394 HydrophobicContact CD1-CD1 4.4Å; L154-L394 HydrophobicContact CB-CD1 3.96Å; L154-L394 HydrophobicContact CD1-CD1 4.38Å; A155-L394 HydrophobicContact CB-CD2 3.9Å; L158-L394 HydrophobicContact CD2-CD2 4.44Å; A390-L394 WeakPolarHBondContact O-CB 3.46Å; A390-L394 PolarHBondContact O-N 2.96Å; R392-L394 PolarHBondContact O-N 2.81Å; L394-H397 WeakPolarHBondContact O-CB 3.29Å; L394-H397 PolarHBondContact O-N 3.42Å; L394-L398 HydrophobicContact CD1-CD1 4.07Å; L394-L398 HydrophobicContact CD1-CG 4.08Å; L394-L398 HydrophobicContact CG-CD1 4.24Å; L394-L398 VanDerWaalsContact O-CG 3.31Å; L394-L398 WeakPolarHBondContact O-CG 3.45Å; L394-L398 PolarHBondContact O-N 3.32Å
395N92.4Very high86.4Confident17 Ų1758.6 Ų58.69%0.09130%0.3CS..Hα-helixtrans-62.5-40.5174.2175.538.4000112.3S391 R392 Q399 A426 Q427S391-N395 VanDerWaalsContact O-CB 3.31Å; S391-N395 WeakPolarHBondContact O-CB 3.47Å; S391-N395 PolarHBondContact O-N 2.99Å; R392-N395 WeakPolarHBondContact O-CB 3.44Å; R392-N395 PolarHBondContact O-N 3.4Å; N395-Q399 PolarHBondContact ND2-NE2 3.39Å; N395-Q399 VanDerWaalsContact ND2-NE2 3.17Å; N395-Q399 WeakPolarHBondContact O-CB 3.41Å; N395-Q399 VanDerWaalsContact O-CG 3.28Å; N395-Q399 WeakPolarHBondContact O-CG 3.39Å; N395-Q399 PolarHBondContact O-N 3.07Å; N395-Q399 PolarHBondContact OD1-NE2 3.32Å; N395-A426 HydrophobicContact CB-CB 3.77Å; N395-Q427 WeakPolarHBondContact ND2-CG 3.49Å; N395-Q427 VanDerWaalsContact OD1-CG 3.32Å; N395-Q427 WeakPolarHBondContact OD1-CG 3.46Å; N395-Q427 PolarHBondContact OD1-NE2 2.71Å
396E91.9Very high84.4Confident107 Ų10761.6 Ų61.650%0.532%0.319SS..Hα-helixtrans-64.4-41.8174.5-72.9163-162.100111.8R392 S393 Q399 A400R392-E396 WeakPolarHBondContact CD-OE1 3.31Å; R392-E396 WeakPolarHBondContact CG-OE1 3.45Å; R392-E396 WeakPolarHBondContact O-CG 3.32Å; R392-E396 PolarHBondContact O-N 2.97Å; S393-E396 PolarHBondContact O-N 2.84Å; E396-Q399 PolarHBondContact O-N 2.73Å; E396-A400 PolarHBondContact O-N 2.81Å
397H91.7Very high82.7Confident29 Ų2961.4 Ų61.413%0.13432%0.323CS..Hα-helixtrans-60.1-50.2174.7-173.580.5000112.3Q147 E150 L154 S393 L394 Q399 A400 L401Q147-H397 PolarHBondContact O-NE2 3.4Å; Q147-H397 PolarHBondContact OE1-CE1 3.48Å; Q147-H397 VanDerWaalsContact OE1-CE1 3.28Å; E150-H397 IonicContact OE2-CE1 2.73Å; L154-H397 HydrophobicContact CD1-CB 4.34Å; S393-H397 WeakPolarHBondContact O-CB 3.42Å; S393-H397 PolarHBondContact O-N 3.11Å; L394-H397 WeakPolarHBondContact O-CB 3.29Å; L394-H397 PolarHBondContact O-N 3.42Å; H397-Q399 VanDerWaalsContact C-N 3.29Å; H397-Q399 PolarHBondContact O-N 3.48Å; H397-A400 WeakPolarHBondContact O-CB 3.5Å; H397-A400 PolarHBondContact O-N 3.17Å; H397-L401 PolarHBondContact O-N 3.38Å
398L89.3Confident80.8Confident0 Ų069.1 Ų69.10%036%0.364CS..Hα-helixtrans-65.4-32.1178.1-62.3172.9000112.2L123 L127 L394 L401 L402 L419 C423 A426L123-L398 HydrophobicContact CD1-CD1 4.4Å; L127-L398 HydrophobicContact CD1-CD1 4.3Å; L127-L398 HydrophobicContact CD1-CD2 4.19Å; L127-L398 HydrophobicContact CD2-CD1 4.25Å; L127-L398 HydrophobicContact CD2-CD2 3.62Å; L394-L398 HydrophobicContact CD1-CD1 4.07Å; L394-L398 HydrophobicContact CD1-CG 4.08Å; L394-L398 HydrophobicContact CG-CD1 4.24Å; L394-L398 VanDerWaalsContact O-CG 3.31Å; L394-L398 WeakPolarHBondContact O-CG 3.45Å; L394-L398 PolarHBondContact O-N 3.32Å; L398-L401 PolarHBondContact O-N 3.28Å; L398-L402 PolarHBondContact O-N 2.84Å; L398-L419 HydrophobicContact CD2-CD1 3.94Å; L398-C423 VanDerWaalsContact C-SG 3.53Å; L398-C423 WeakPolarHBondContact CB-SG 3.3Å; L398-A426 HydrophobicContact CD1-CB 4.25Å
399Q89.3Confident79.2Confident86 Ų8673.6 Ų73.640%0.40239%0.385SS..Hα-helixtrans-70.3-33.8172.9-78177.355.300113.5N395 E396 H397 L401 L402N395-Q399 PolarHBondContact ND2-NE2 3.39Å; N395-Q399 VanDerWaalsContact ND2-NE2 3.17Å; N395-Q399 WeakPolarHBondContact O-CB 3.41Å; N395-Q399 VanDerWaalsContact O-CG 3.28Å; N395-Q399 WeakPolarHBondContact O-CG 3.39Å; N395-Q399 PolarHBondContact O-N 3.07Å; N395-Q399 PolarHBondContact OD1-NE2 3.32Å; E396-Q399 PolarHBondContact O-N 2.73Å; H397-Q399 VanDerWaalsContact C-N 3.29Å; H397-Q399 PolarHBondContact O-N 3.48Å; Q399-L401 PolarHBondContact O-N 3.42Å; Q399-L402 PolarHBondContact O-N 3.18Å; Q399-L402 VanDerWaalsContact O-N 3.16Å
400A87.3Confident77.7Confident57 Ų5775.4 Ų75.447%0.47140%0.402SS..Hα-helixtrans-61.5-37.8172.600000111.2E396 H397 L402 T403E396-A400 PolarHBondContact O-N 2.81Å; H397-A400 WeakPolarHBondContact O-CB 3.5Å; H397-A400 PolarHBondContact O-N 3.17Å; A400-L402 VanDerWaalsContact C-N 3.29Å; A400-L402 PolarHBondContact O-N 2.75Å; A400-T403 WeakPolarHBondContact O-CB 3.45Å; A400-T403 VanDerWaalsContact O-CG2 3.28Å; A400-T403 WeakPolarHBondContact O-CG2 3.28Å; A400-T403 PolarHBondContact O-N 3.23Å; A400-T403 PolarHBondContact O-OG1 3.43Å
401L82.4Confident76.1Confident35 Ų3580.7 Ų80.718%0.18342%0.422CS..Hα-helixtrans-72.4-18176.4-61.2171.3000113.8Q147 H397 L398 Q399 T403 L419Q147-L401 HydrophobicContact CB-CD1 4.05Å; Q147-L401 HydrophobicContact CB-CD2 3.48Å; Q147-L401 VanDerWaalsContact CB-CD2 3.48Å; Q147-L401 HydrophobicContact CB-CG 4.35Å; Q147-L401 HydrophobicContact CG-CD2 4.05Å; H397-L401 PolarHBondContact O-N 3.38Å; L398-L401 PolarHBondContact O-N 3.28Å; Q399-L401 PolarHBondContact O-N 3.42Å; L401-T403 VanDerWaalsContact C-N 3.26Å; L401-T403 PolarHBondContact O-N 2.96Å; L401-L419 HydrophobicContact CB-CD1 4.37Å; L401-L419 HydrophobicContact CB-CD2 3.65Å; L401-L419 WeakPolarHBondContact O-CD2 3.45Å
402L77.7Confident74.8Confident46 Ų4682.1 Ų82.124%0.24144%0.437CS..THydrogen-bonded Turntrans-80.10.9170.9-78.5176.8000114.1L398 Q399 A400 Q416 L419 A420 C423L398-L402 PolarHBondContact O-N 2.84Å; Q399-L402 PolarHBondContact O-N 3.18Å; Q399-L402 VanDerWaalsContact O-N 3.16Å; A400-L402 VanDerWaalsContact C-N 3.29Å; A400-L402 PolarHBondContact O-N 2.75Å; L402-Q416 HydrophobicContact CD2-CG 4.09Å; L402-L419 HydrophobicContact CD2-CB 4.12Å; L402-L419 HydrophobicContact CD2-CD2 3.89Å; L402-L419 HydrophobicContact CD2-CG 3.97Å; L402-L419 HydrophobicContact CG-CD2 4.04Å; L402-L419 HydrophobicContact CG-CG 4.1Å; L402-A420 HydrophobicContact CD1-CB 4.31Å; L402-A420 HydrophobicContact CD2-CB 4.14Å; L402-C423 HydrophobicContact CD1-CB 4.19Å; L402-C423 WeakPolarHBondContact CD1-SG 3.47Å
403T70.8Confident73.7Confident100 Ų10083 Ų8361%0.61345%0.445SS*.SBendtrans-59.3135.318047.90000111.4A400 L401 Y405A400-T403 WeakPolarHBondContact O-CB 3.45Å; A400-T403 VanDerWaalsContact O-CG2 3.28Å; A400-T403 WeakPolarHBondContact O-CG2 3.28Å; A400-T403 PolarHBondContact O-N 3.23Å; A400-T403 PolarHBondContact O-OG1 3.43Å; L401-T403 VanDerWaalsContact C-N 3.26Å; L401-T403 PolarHBondContact O-N 2.96Å; T403-Y405 PolarHBondContact O-N 3.38Å
404P57.3Low73Confident121 Ų12185 Ų8579%0.78645%0.451SS*.  trans-78.887.4-160.830.6-37.1000113
405Y55.7Low72.3Confident172 Ų17288 Ų8868%0.67547%0.466SS*.  trans-74.6138.1155.9-135.6-86.8000109.1Q140 T403 P407Q140-Y405 VanDerWaalsContact NE2-CE1 3.3Å; Q140-Y405 VanDerWaalsContact NE2-CZ 3.26Å; T403-Y405 PolarHBondContact O-N 3.38Å; Y405-P407 VanDerWaalsContact O-CD 3.22Å; Y405-P407 WeakPolarHBondContact O-CD 3.39Å
406E51.2Low71.8Confident172 Ų17290.6 Ų90.680%0.80448%0.478SS*.  trans-66.3116.7177.9-69.5-173.6123.900110.3D408E406-D408 PolarHBondContact O-N 3.33Å; E406-D408 VanDerWaalsContact O-N 3.13Å
407P55.7Low71.5Confident57 Ų5791.5 Ų91.537%0.3748%0.482SS..  trans-86.491-175.233.1-30.9000110.2Y405 K409 Q413Y405-P407 VanDerWaalsContact O-CD 3.22Å; Y405-P407 WeakPolarHBondContact O-CD 3.39Å; P407-K409 PolarHBondContact O-N 3Å; P407-Q413 HydrophobicContact CB-CG 4.35Å; P407-Q413 HydrophobicContact CG-CG 4.11Å
408D52.8Low71.2Confident162 Ų16292.8 Ų92.887%0.86649%0.488SS*.  trans-54.6-4178.8-90.9-23.8000115.9E406E406-D408 PolarHBondContact O-N 3.33Å; E406-D408 VanDerWaalsContact O-N 3.13Å
409K60.4Low71.1Confident141 Ų14193.2 Ų93.261%0.61349%0.491SS*.SBendtrans-146.9147.2-174.7-60.8-177.2-178.9-178.70111.6P407 Q411 G412P407-K409 PolarHBondContact O-N 3Å; K409-Q411 PolarHBondContact O-N 3.42Å; K409-G412 PolarHBondContact O-N 3.43Å
410S61.3Low71.1Confident92 Ų9290.4 Ų90.464%0.64348%0.482SS*.Hα-helixtrans-56.9-32.1173.9540000114G412 Q413 D414S410-G412 PolarHBondContact O-N 3.39Å; S410-Q413 WeakPolarHBondContact O-CB 3.27Å; S410-Q413 PolarHBondContact O-N 3.35Å; S410-D414 PolarHBondContact O-N 3.26Å
411Q58.8Low71.2Confident139 Ų13990.9 Ų90.965%0.6547%0.474SS*.Hα-helixtrans-61.9-28.8174.7-170.8179.37.400112.9K409 L415K409-Q411 PolarHBondContact O-N 3.42Å; Q411-L415 PolarHBondContact O-N 2.92Å
412G66.6Low71.6Confident30 Ų3089.2 Ų89.231%0.30947%0.466SS..Hα-helixtrans-76-25.8173.500000113.1K409 S410 Q416K409-G412 PolarHBondContact O-N 3.43Å; S410-G412 PolarHBondContact O-N 3.39Å; G412-Q416 VanDerWaalsContact O-CB 3.26Å; G412-Q416 WeakPolarHBondContact O-CB 3.32Å; G412-Q416 PolarHBondContact O-N 3.46Å; G412-Q416 VanDerWaalsContact O-N 3.07Å
413Q69.2Low72.2Confident113 Ų11387.3 Ų87.353%0.52846%0.456SS..Hα-helixtrans-75.3-40.7178.1-59.7-179.9-51.700111.2P407 S410 Q416 E417P407-Q413 HydrophobicContact CB-CG 4.35Å; P407-Q413 HydrophobicContact CG-CG 4.11Å; S410-Q413 WeakPolarHBondContact O-CB 3.27Å; S410-Q413 PolarHBondContact O-N 3.35Å; Q413-Q416 PolarHBondContact O-N 3.42Å; Q413-E417 PolarHBondContact O-N 3.4Å
414D78.3Confident73.2Confident109 Ų10988 Ų8858%0.58345%0.447SS*.Hα-helixtrans-60.3-49.8174.8-170.658.9000111.5S410 Q416 E417 Q418S410-D414 PolarHBondContact O-N 3.26Å; D414-Q416 VanDerWaalsContact C-N 3.31Å; D414-Q416 PolarHBondContact O-N 3.4Å; D414-E417 PolarHBondContact O-N 3.26Å; D414-Q418 WeakPolarHBondContact O-CG 3.46Å; D414-Q418 PolarHBondContact O-N 3.07Å
415L78.7Confident74.8Confident62 Ų6285.2 Ų85.233%0.32543%0.426SS..Hα-helixtrans-61.7-36.9174.4-174.7148.3000112.3L144 Q411 Q418 L419L144-L415 HydrophobicContact CD1-CD2 4.49Å; L144-L415 HydrophobicContact CD2-CD1 4.48Å; L144-L415 HydrophobicContact CD2-CD2 4.32Å; Q411-L415 PolarHBondContact O-N 2.92Å; L415-Q418 PolarHBondContact O-N 3.28Å; L415-L419 VanDerWaalsContact O-CB 3.29Å; L415-L419 WeakPolarHBondContact O-CB 3.49Å; L415-L419 PolarHBondContact O-N 2.86Å
416Q80.8Confident76.6Confident72 Ų7277 Ų7734%0.33639%0.394SS..Hα-helixtrans-68.2-37.6176.2-171.9175.825.800112.3L402 G412 Q413 D414 A420L402-Q416 HydrophobicContact CD2-CG 4.09Å; G412-Q416 VanDerWaalsContact O-CB 3.26Å; G412-Q416 WeakPolarHBondContact O-CB 3.32Å; G412-Q416 PolarHBondContact O-N 3.46Å; G412-Q416 VanDerWaalsContact O-N 3.07Å; Q413-Q416 PolarHBondContact O-N 3.42Å; D414-Q416 VanDerWaalsContact C-N 3.31Å; D414-Q416 PolarHBondContact O-N 3.4Å; Q416-A420 WeakPolarHBondContact O-CB 3.47Å; Q416-A420 PolarHBondContact O-N 3.44Å
417E85.6Confident78.4Confident127 Ų12772.8 Ų72.859%0.59337%0.373SS*.Hα-helixtrans-67.6-40.5175.1-177.6161.3-166.500111.6Q413 D414 A420 E421Q413-E417 PolarHBondContact O-N 3.4Å; D414-E417 PolarHBondContact O-N 3.26Å; E417-A420 WeakPolarHBondContact O-CB 3.44Å; E417-A420 PolarHBondContact O-N 3.43Å; E417-E421 PolarHBondContact O-N 3.37Å
418Q86.8Confident80.1Confident55 Ų5574.7 Ų74.726%0.25738%0.377SS..Hα-helixtrans-69.6-35.4174.6-69.8-64.1-70.900113.4H126 L130 D414 L415 A420 E421 G422H126-Q418 PolarHBondContact CE1-OE1 2.85Å; H126-Q418 PolarHBondContact NE2-O 3.36Å; L130-Q418 HydrophobicContact CD1-CB 4Å; L130-Q418 HydrophobicContact CD2-CB 3.54Å; L130-Q418 HydrophobicContact CD2-CG 4.02Å; L130-Q418 HydrophobicContact CG-CB 4.38Å; D414-Q418 WeakPolarHBondContact O-CG 3.46Å; D414-Q418 PolarHBondContact O-N 3.07Å; L415-Q418 PolarHBondContact O-N 3.28Å; Q418-A420 VanDerWaalsContact C-N 3.34Å; Q418-E421 PolarHBondContact NE2-OE2 3.46Å; Q418-E421 VanDerWaalsContact O-CB 3.3Å; Q418-E421 WeakPolarHBondContact O-CB 3.3Å; Q418-E421 PolarHBondContact O-N 2.95Å; Q418-G422 PolarHBondContact O-N 2.96Å
419L86.6Confident82Confident10 Ų1067 Ų675%0.05234%0.336CS..Hα-helixtrans-68-36.2172.1-175.666.2000111.4L398 L401 L402 L415 E421 G422 C423L398-L419 HydrophobicContact CD2-CD1 3.94Å; L401-L419 HydrophobicContact CB-CD1 4.37Å; L401-L419 HydrophobicContact CB-CD2 3.65Å; L401-L419 WeakPolarHBondContact O-CD2 3.45Å; L402-L419 HydrophobicContact CD2-CB 4.12Å; L402-L419 HydrophobicContact CD2-CD2 3.89Å; L402-L419 HydrophobicContact CD2-CG 3.97Å; L402-L419 HydrophobicContact CG-CD2 4.04Å; L402-L419 HydrophobicContact CG-CG 4.1Å; L415-L419 VanDerWaalsContact O-CB 3.29Å; L415-L419 WeakPolarHBondContact O-CB 3.49Å; L415-L419 PolarHBondContact O-N 2.86Å; L419-E421 VanDerWaalsContact C-N 3.29Å; L419-E421 PolarHBondContact O-N 3.21Å; L419-G422 PolarHBondContact O-N 2.99Å; L419-C423 PolarHBondContact O-N 3.4Å; L419-C423 PolarHBondContact O-SG 3.26Å
420A88.5Confident83.5Confident27 Ų2761.5 Ų61.522%0.22332%0.315CS..Hα-helixtrans-66.6-30171.100000112.3L402 Q416 E417 Q418 C423 R424L402-A420 HydrophobicContact CD1-CB 4.31Å; L402-A420 HydrophobicContact CD2-CB 4.14Å; Q416-A420 WeakPolarHBondContact O-CB 3.47Å; Q416-A420 PolarHBondContact O-N 3.44Å; E417-A420 WeakPolarHBondContact O-CB 3.44Å; E417-A420 PolarHBondContact O-N 3.43Å; Q418-A420 VanDerWaalsContact C-N 3.34Å; A420-C423 PolarHBondContact O-N 3.19Å; A420-R424 WeakPolarHBondContact O-CG 3.48Å; A420-R424 PolarHBondContact O-N 2.92Å; A420-R424 PolarHBondContact O-NH1 2.91Å
421E89.9Confident84.8Confident67 Ų6763.5 Ų63.531%0.31331%0.314SS..Hα-helixtrans-65-46168.7-168.8126.7-106.900111.9E417 Q418 L419 C423 R424 L425E417-E421 PolarHBondContact O-N 3.37Å; Q418-E421 PolarHBondContact NE2-OE2 3.46Å; Q418-E421 VanDerWaalsContact O-CB 3.3Å; Q418-E421 WeakPolarHBondContact O-CB 3.3Å; Q418-E421 PolarHBondContact O-N 2.95Å; L419-E421 VanDerWaalsContact C-N 3.29Å; L419-E421 PolarHBondContact O-N 3.21Å; E421-C423 VanDerWaalsContact C-N 3.25Å; E421-C423 PolarHBondContact O-N 3.09Å; E421-R424 VanDerWaalsContact CA-CZ 3.48Å; E421-R424 WeakPolarHBondContact O-CB 3.3Å; E421-R424 PolarHBondContact O-N 3.28Å; E421-R424 IonicContact OE1-CZ 3.93Å; E421-R424 IonicContact OE1-NE 2.81Å; E421-R424 IonicContact OE1-NH2 3.78Å; E421-R424 PolarHBondContact OE1-NH2 3.47Å; E421-R424 IonicContact OE2-NH2 3Å; E421-L425 HydrophobicContact CG-CD1 4.33Å; E421-L425 WeakPolarHBondContact O-CG 3.39Å; E421-L425 PolarHBondContact O-N 3.33Å
422G90.7Very high86.2Confident0 Ų059.7 Ų59.70%030%0.295CS..Hα-helixtrans-54.8-40.9172.100000112.6Q418 L419 L425 A426Q418-G422 PolarHBondContact O-N 2.96Å; L419-G422 PolarHBondContact O-N 2.99Å; G422-L425 PolarHBondContact O-N 3.31Å; G422-A426 WeakPolarHBondContact O-CB 3.38Å; G422-A426 PolarHBondContact O-N 3.41Å
423C89.9Confident87.3Confident5 Ų558.3 Ų58.33%0.03428%0.28CS..Hα-helixtrans-64.8-43.8173.6-64.10000112.8L398 L402 L419 A420 E421 L425 A426 Q427L398-C423 VanDerWaalsContact C-SG 3.53Å; L398-C423 WeakPolarHBondContact CB-SG 3.3Å; L402-C423 HydrophobicContact CD1-CB 4.19Å; L402-C423 WeakPolarHBondContact CD1-SG 3.47Å; L419-C423 PolarHBondContact O-N 3.4Å; L419-C423 PolarHBondContact O-SG 3.26Å; A420-C423 PolarHBondContact O-N 3.19Å; E421-C423 VanDerWaalsContact C-N 3.25Å; E421-C423 PolarHBondContact O-N 3.09Å; C423-L425 VanDerWaalsContact C-N 3.32Å; C423-L425 PolarHBondContact O-N 3.06Å; C423-A426 PolarHBondContact O-N 3.49Å; C423-Q427 WeakPolarHBondContact O-CB 3.34Å; C423-Q427 VanDerWaalsContact O-CG 3.27Å; C423-Q427 WeakPolarHBondContact O-CG 3.28Å; C423-Q427 PolarHBondContact O-N 2.97Å
424R91.9Very high88.1Confident115 Ų11554.7 Ų54.743%0.43427%0.268SS..Hα-helixtrans-59.6-43.8175.4-70.6-175.2-59-95.216.6111.3A420 E421 Q427 H428A420-R424 WeakPolarHBondContact O-CG 3.48Å; A420-R424 PolarHBondContact O-N 2.92Å; A420-R424 PolarHBondContact O-NH1 2.91Å; E421-R424 VanDerWaalsContact CA-CZ 3.48Å; E421-R424 WeakPolarHBondContact O-CB 3.3Å; E421-R424 PolarHBondContact O-N 3.28Å; E421-R424 IonicContact OE1-CZ 3.93Å; E421-R424 IonicContact OE1-NE 2.81Å; E421-R424 IonicContact OE1-NH2 3.78Å; E421-R424 PolarHBondContact OE1-NH2 3.47Å; E421-R424 IonicContact OE2-NH2 3Å; R424-Q427 PolarHBondContact O-N 3.47Å; R424-H428 WeakPolarHBondContact O-CB 3.42Å; R424-H428 PolarHBondContact O-N 3.47Å
425L92.1Very high87.8Confident63 Ų6353.3 Ų53.333%0.3326%0.264SS..Hα-helixtrans-64-44.6177.4-69.9171.7000111.8L123 H126 E421 G422 C423 H428 L429L123-L425 HydrophobicContact CD1-CB 3.98Å; L123-L425 HydrophobicContact CD1-CD1 4.42Å; H126-L425 HydrophobicContact CB-CD1 4.22Å; E421-L425 HydrophobicContact CG-CD1 4.33Å; E421-L425 WeakPolarHBondContact O-CG 3.39Å; E421-L425 PolarHBondContact O-N 3.33Å; G422-L425 PolarHBondContact O-N 3.31Å; C423-L425 VanDerWaalsContact C-N 3.32Å; C423-L425 PolarHBondContact O-N 3.06Å; L425-H428 PolarHBondContact O-N 2.95Å; L425-L429 VanDerWaalsContact O-CB 3.31Å; L425-L429 WeakPolarHBondContact O-CB 3.44Å; L425-L429 PolarHBondContact O-N 3.48Å
426A92Very high86.8Confident0 Ų057.8 Ų57.80%028%0.284CS..Hα-helixtrans-65.2-37.4176.500000112.8L123 N395 L398 G422 C423 L429 V430L123-A426 HydrophobicContact CD2-CB 3.89Å; N395-A426 HydrophobicContact CB-CB 3.77Å; L398-A426 HydrophobicContact CD1-CB 4.25Å; G422-A426 WeakPolarHBondContact O-CB 3.38Å; G422-A426 PolarHBondContact O-N 3.41Å; C423-A426 PolarHBondContact O-N 3.49Å; A426-L429 WeakPolarHBondContact O-CB 3.3Å; A426-L429 PolarHBondContact O-N 3.41Å; A426-V430 WeakPolarHBondContact O-CG2 3.29Å; A426-V430 PolarHBondContact O-N 3.31Å
427Q91Very high85.2Confident82 Ų8260.7 Ų60.738%0.38330%0.302SS..Hα-helixtrans-66-44.9173.5-71.9171.217.500112.2N395 C423 R424 L429 V430 Q431N395-Q427 WeakPolarHBondContact ND2-CG 3.49Å; N395-Q427 VanDerWaalsContact OD1-CG 3.32Å; N395-Q427 WeakPolarHBondContact OD1-CG 3.46Å; N395-Q427 PolarHBondContact OD1-NE2 2.71Å; C423-Q427 WeakPolarHBondContact O-CB 3.34Å; C423-Q427 VanDerWaalsContact O-CG 3.27Å; C423-Q427 WeakPolarHBondContact O-CG 3.28Å; C423-Q427 PolarHBondContact O-N 2.97Å; R424-Q427 PolarHBondContact O-N 3.47Å; Q427-L429 VanDerWaalsContact C-N 3.26Å; Q427-L429 PolarHBondContact O-N 2.88Å; Q427-V430 PolarHBondContact O-N 3.13Å; Q427-Q431 WeakPolarHBondContact O-CG 3.46Å; Q427-Q431 PolarHBondContact O-N 3.02Å
428H91.3Very high83.2Confident97 Ų9761.9 Ų61.945%0.44931%0.312SS..Hα-helixtrans-62.4-35.1175.1178.9-102.3000111.9R424 L425 Q431 K432R424-H428 WeakPolarHBondContact O-CB 3.42Å; R424-H428 PolarHBondContact O-N 3.47Å; L425-H428 PolarHBondContact O-N 2.95Å; H428-Q431 WeakPolarHBondContact O-CB 3.37Å; H428-Q431 PolarHBondContact O-N 3.29Å; H428-K432 PolarHBondContact O-N 3.48Å
429L91.4Very high80.9Confident1 Ų166.2 Ų66.21%0.00534%0.337CS..Hα-helixtrans-66.4-42.7175.2-179.258000112.6G116 A119 S120 L123 L158 L425 A426 Q427 Q431 K432 L433G116-L429 WeakPolarHBondContact O-CD1 3.39Å; A119-L429 HydrophobicContact CB-CD1 3.95Å; S120-L429 WeakPolarHBondContact OG-CD2 3.46Å; L123-L429 HydrophobicContact CD2-CD2 4.1Å; L158-L429 HydrophobicContact CD2-CD2 3.6Å; L425-L429 VanDerWaalsContact O-CB 3.31Å; L425-L429 WeakPolarHBondContact O-CB 3.44Å; L425-L429 PolarHBondContact O-N 3.48Å; A426-L429 WeakPolarHBondContact O-CB 3.3Å; A426-L429 PolarHBondContact O-N 3.41Å; Q427-L429 VanDerWaalsContact C-N 3.26Å; Q427-L429 PolarHBondContact O-N 2.88Å; L429-Q431 VanDerWaalsContact C-N 3.3Å; L429-Q431 PolarHBondContact O-N 3.25Å; L429-K432 PolarHBondContact O-N 2.93Å; L429-L433 HydrophobicContact CD1-CD1 3.89Å; L429-L433 HydrophobicContact CD1-CG 4.32Å; L429-L433 HydrophobicContact CG-CD1 4.11Å; L429-L433 WeakPolarHBondContact O-CB 3.38Å; L429-L433 WeakPolarHBondContact O-CG 3.3Å; L429-L433 PolarHBondContact O-N 3.16Å; L429-L433 VanDerWaalsContact O-N 3.08Å
430V91.8Very high78.6Confident26 Ų2672.3 Ų72.316%0.15837%0.37CS..Hα-helixtrans-56.6-44.6169.8171.80000110.8R388 R392 A426 Q427 L433 S434R388-V430 HydrophobicContact CG-CG1 4.04Å; R392-V430 HydrophobicContact CB-CG2 4.28Å; A426-V430 WeakPolarHBondContact O-CG2 3.29Å; A426-V430 PolarHBondContact O-N 3.31Å; Q427-V430 PolarHBondContact O-N 3.13Å; V430-L433 PolarHBondContact O-N 2.86Å; V430-S434 PolarHBondContact O-N 3.44Å; V430-S434 PolarHBondContact O-OG 3.34Å
431Q89.3Confident76.3Confident133 Ų13378.8 Ų78.862%0.62140%0.401SS*.Hα-helixtrans-64.6-42.7177.6-68.8170.6-4.100112.4Q427 H428 L429 L433 S434Q427-Q431 WeakPolarHBondContact O-CG 3.46Å; Q427-Q431 PolarHBondContact O-N 3.02Å; H428-Q431 WeakPolarHBondContact O-CB 3.37Å; H428-Q431 PolarHBondContact O-N 3.29Å; L429-Q431 VanDerWaalsContact C-N 3.3Å; L429-Q431 PolarHBondContact O-N 3.25Å; Q431-L433 VanDerWaalsContact C-N 3.29Å; Q431-L433 PolarHBondContact O-N 3.01Å; Q431-S434 WeakPolarHBondContact O-CB 3.26Å; Q431-S434 PolarHBondContact O-N 3.42Å; Q431-S434 VanDerWaalsContact O-N 3.1Å
432K88.9Confident74Confident59 Ų5982.8 Ų82.826%0.25742%0.424SS..Hα-helixtrans-63.1-35.7178.8-123.7-178.9-164.4-128.80112.9K112 E115 H428 L429 S434K112-K432 PolarHBondContact NZ-O 3.26Å; E115-K432 HydrophobicContact CB-CD 4.25Å; E115-K432 IonicContact OE1-NZ 3.79Å; E115-K432 PolarHBondContact OE1-NZ 3.39Å; E115-K432 WeakPolarHBondContact OE2-CE 3.27Å; E115-K432 IonicContact OE2-NZ 2.7Å; E115-K432 PolarHBondContact OE2-NZ 2.97Å; H428-K432 PolarHBondContact O-N 3.48Å; L429-K432 PolarHBondContact O-N 2.93Å; K432-S434 VanDerWaalsContact C-N 3.31Å
433L88.9Confident71.8Confident1 Ų190.7 Ų90.71%0.00546%0.461CS..THydrogen-bonded Turntrans-83.1-1.3177.1-64.4169000113.5L162 L384 R388 S391 L429 V430 Q431L162-L433 HydrophobicContact CD1-CD1 4.16Å; L162-L433 HydrophobicContact CD1-CD2 4.34Å; L162-L433 HydrophobicContact CD2-CD1 4.5Å; L162-L433 HydrophobicContact CD2-CD2 3.89Å; L384-L433 HydrophobicContact CD2-CD2 3.63Å; R388-L433 HydrophobicContact CB-CB 3.91Å; R388-L433 HydrophobicContact CG-CB 4.28Å; R388-L433 PolarHBondContact NE-O 2.91Å; R388-L433 PolarHBondContact NH2-O 3.21Å; S391-L433 WeakPolarHBondContact OG-CD1 3.22Å; L429-L433 HydrophobicContact CD1-CD1 3.89Å; L429-L433 HydrophobicContact CD1-CG 4.32Å; L429-L433 HydrophobicContact CG-CD1 4.11Å; L429-L433 WeakPolarHBondContact O-CB 3.38Å; L429-L433 WeakPolarHBondContact O-CG 3.3Å; L429-L433 PolarHBondContact O-N 3.16Å; L429-L433 VanDerWaalsContact O-N 3.08Å; V430-L433 PolarHBondContact O-N 2.86Å; Q431-L433 VanDerWaalsContact C-N 3.29Å; Q431-L433 PolarHBondContact O-N 3.01Å
434S86.5Confident69.8Low37 Ų3798.3 Ų98.326%0.25950%0.502SS..SBendtrans-76.8160.2171.1-74.30000112.6K112 V430 Q431 K432K112-S434 PolarHBondContact NZ-O 3.02Å; V430-S434 PolarHBondContact O-N 3.44Å; V430-S434 PolarHBondContact O-OG 3.34Å; Q431-S434 WeakPolarHBondContact O-CB 3.26Å; Q431-S434 PolarHBondContact O-N 3.42Å; Q431-S434 VanDerWaalsContact O-N 3.1Å; K432-S434 VanDerWaalsContact C-N 3.31Å
435P72Confident67.2Low80 Ų8098.5 Ų98.552%0.51952%0.515SS..  trans-64.9148.1171.5-10.929000109.5N437P435-N437 PolarHBondContact O-N 2.9Å; P435-N437 VanDerWaalsContact O-N 3.12Å
436E57.6Low64.9Low157 Ų157104.5 Ų104.573%0.73454%0.541SS*.SBendtrans-8121.7178.8-148.788.3-178.600112.8K112K112-E436 WeakPolarHBondContact CE-OE2 3.36Å; K112-E436 IonicContact NZ-OE2 3.76Å; K112-E436 PolarHBondContact NZ-OE2 2.97Å
437N46.5Very low62.4Low132 Ų132110.5 Ų110.571%0.70658%0.578SS**  trans-96.8112.2-179.1-95.323.7000110.5P435 N439P435-N437 PolarHBondContact O-N 2.9Å; P435-N437 VanDerWaalsContact O-N 3.12Å; N437-N439 PolarHBondContact O-N 3.05Å
438D44.6Very low59.9Low152 Ų152115 Ų11581%0.81360%0.599SS**SBendtrans-65.5114.9167.5-74.5-54.5000111.2
439N38.4Very low57.8Low147 Ų147116.7 Ų116.779%0.78662%0.616SS**  trans62.595.6173.3-35.8-95.4000115.7N437N437-N439 PolarHBondContact O-N 3.05Å
440D37.2Very low55.2Low138 Ų138119.8 Ų119.874%0.73864%0.641SS**  trans-134.9140.3132.7-90.4-50.9000106.8D442D440-D442 PolarHBondContact O-N 2.91Å
441D40.1Very low52.6Low163 Ų163127.6 Ų127.687%0.87268%0.676SS**  trans-77.4104.2174.5-73.2-60.7000108.6E443D441-E443 PolarHBondContact O-N 2.75Å
442D41.8Very low50.1Low151 Ų151129.4 Ų129.481%0.80768%0.682SS**  trans-66.972.6177.3-81.9-36.3000111.8D440D440-D442 PolarHBondContact O-N 2.91Å
443E45.1Very low47.5Very low166 Ų166132.7 Ų132.778%0.77671%0.707SS**  trans-78.6127.6158.5-82.9-79.6-176.400109.2D441 V445D441-E443 PolarHBondContact O-N 2.75Å; E443-V445 PolarHBondContact O-N 2.87Å
444D47.2Very low45.1Very low165 Ų165140.6 Ų140.688%0.88274%0.744SS**  trans-6088-167.2-83.7-56.1000114.5
445V37.4Very low42.5Very low119 Ų119147.8 Ų147.872%0.72177%0.77SS**  trans-95.6102.7166-178.30000109.8E443 V447E443-V445 PolarHBondContact O-N 2.87Å; V445-V447 HydrophobicContact CG1-CG2 4.41Å; V445-V447 PolarHBondContact O-N 3.22Å
446Q43.4Very low40.5Very low188 Ų188149.3 Ų149.388%0.87978%0.783SS**  trans-61.1102.6164.4-67.3-174.6-000109.5E448Q446-E448 VanDerWaalsContact C-N 3.35Å; Q446-E448 PolarHBondContact O-N 2.91Å
447V39.8Very low39.2Very low126 Ų126147.6 Ų147.676%0.76479%0.788SS**  trans-74.691.2177.7-176.40000109.6V445V445-V447 HydrophobicContact CG1-CG2 4.41Å; V445-V447 PolarHBondContact O-N 3.22Å
448E38.8Very low38.3Very low178 Ų178145.8 Ų145.883%0.83279%0.792SS**  trans-54.3143.2174.2-167.4179.1-141.700112.2Q446 A450Q446-E448 VanDerWaalsContact C-N 3.35Å; Q446-E448 PolarHBondContact O-N 2.91Å; E448-A450 PolarHBondContact O-N 3.07Å
449V48.1Very low37.9Very low131 Ų131144.8 Ų144.879%0.79479%0.793SS**  trans-33.9109.9-171.1-1790000114.5E451V449-E451 PolarHBondContact O-N 2.9Å
450A35.3Very low37.4Very low66 Ų66149.5 Ų149.555%0.54580%0.8SS.*  trans-98.163.5-176.700000113.6E448 K452E448-A450 PolarHBondContact O-N 3.07Å; A450-K452 PolarHBondContact O-N 3.21Å
451E37.7Very low37.1Very low191 Ų191151.7 Ų151.789%0.89381%0.806SS**  trans-69.368164.9-167.1-172.6-176.100110.5V449V449-E451 PolarHBondContact O-N 2.9Å
452K37.8Very low36.4Very low171 Ų171152.6 Ų152.674%0.74381%0.807SS**  trans-128.910.9-166.1-75177.1-179.3160.40115.3A450 Q454A450-K452 PolarHBondContact O-N 3.21Å; K452-Q454 PolarHBondContact O-N 3.26Å; K452-Q454 VanDerWaalsContact O-N 3.09Å
453V32.7Very low35.8Very low127 Ų127154.4 Ų154.477%0.7781%0.811SS**THydrogen-bonded Turntrans-85.846.4175-162.60000112.3
454Q38.9Very low35.2Very low168 Ų168156.1 Ų156.179%0.78582%0.816SS**THydrogen-bonded Turntrans-156.435.8171.4-140.1172.898.700116.9K452K452-Q454 PolarHBondContact O-N 3.26Å; K452-Q454 VanDerWaalsContact O-N 3.09Å
455K32.3Very low34.5Very low187 Ų187153.1 Ų153.181%0.81381%0.813SS**  trans-143.730.9-179.1-116.1166.9-169.31690118.2
456S30.1Very low34.1Very low113 Ų113157.1 Ų157.179%0.7982%0.824SS**  trans-130.893.8171.9490000112.5
457S30.4Very low33.4Very low121 Ų121155.3 Ų155.385%0.84682%0.816SS**  trans-15875.6176.5-75.80000113.2
458A26.5Very low32.9Very low94 Ų94157.4 Ų157.478%0.77782%0.815SS**  trans-161.8111.8158.100000110.3
459P37.4Very low32.4Very low130 Ų130157.4 Ų157.484%0.84482%0.815SS**  trans-83.3157.2169.934.7-33.8000110.9
460R27.7Very low31.6Very low246 Ų246156.7 Ų156.793%0.92881%0.81SS**  trans-150.1148158.8-134.3174.2-174.5-172.5-1.1113.8
461E29.9Very low31.7Very low185 Ų185159.4 Ų159.486%0.86482%0.823SS**  trans-83.8166.4-166.6-64.2156.497.300114.7
462M27.3Very low31.3Very low182 Ų182158.5 Ų158.590%0.89782%0.818SS**  trans-43.2130.9166-63.9166.9136.800114.7
463Q28.2Very low30.9Very low189 Ų189158 Ų15888%0.88382%0.823SS**  trans-130.9108.1133.4-63.8-171.9-17.800104.9
464K31.9Very low31.1Very low202 Ų202157.9 Ų157.988%0.87883%0.828SS**  70.7124.469.4-160.2179.7-173.4-173.70111.2
465A32.4Very low30.6Very low101 Ų101158.2 Ų158.284%0.83584%0.835SS**  trans-76.2150.7-163.900000114.7
466E29.8Very low30.7Very low203 Ų203157.9 Ų157.995%0.94984%0.836SS**  trans-135.3165.4150.8-165.4147.2-14500108.1
467E28.9Very low30.5Very low151 Ų151160.9 Ų160.971%0.70684%0.838SS**  trans-113.4152.1-159.4-157.2-161.2153.200111.8
468K28.8Very low30.6Very low170 Ų170161.4 Ų161.474%0.73984%0.84SS**  trans77157170.7-47.3-174.7-171-178.60113.1
469E27.8Very low30.6Very low178 Ų178161.1 Ų161.183%0.83284%0.837SS**  cis-136.8160.620.5-165.8163-133.100113.5
470V32.7Very low30.2Very low115 Ų115161.7 Ų161.770%0.69783%0.832SS**  trans-91138.8-179.3168.40000110.3E472V470-E472 HydrophobicContact CG1-CG 3.87Å
471P35.7Very low30.4Very low124 Ų124156.8 Ų156.881%0.80583%0.829SS**  trans-110.9119.1141.9-4.124.2000110.3
472E31.2Very low30.2Very low172 Ų172157 Ų15780%0.80482%0.824SS**  trans-76.6131.2159.5-62.9175.6123.900107.8V470V470-E472 HydrophobicContact CG1-CG 3.87Å
473D28.9Very low30.2Very low159 Ų159154.4 Ų154.485%0.8582%0.823SS**  trans173.9103.2142.3-97.4-21.5000111.1
474S35.6Very low30.2Very low125 Ų125152.3 Ų152.387%0.87482%0.818SS**  trans177.385.3152.8-79.90000109.5
475L30Very low30.2Very low175 Ų175148.2 Ų148.292%0.91682%0.815SS**  trans-95.4116.8171.1-75.1171000110
476E32.6Very low30.1Very low180 Ų180152.9 Ų152.984%0.84182%0.819SS**  trans-152.178165.1-160.796.9-132.400106.7
477E27.8Very low30.1Very low176 Ų176146.8 Ų146.882%0.82281%0.811SS**  48.191.9101.6-169.5165.4-165.800114.8
478C30.8Very low30.1Very low132 Ų132145.3 Ų145.389%0.89282%0.818SS**  trans-156.2101.6148.8-117.70000111
479A26.5Very low30.1Very low88 Ų88147.4 Ų147.473%0.72782%0.822SS**  trans-85.8175159.400000108.8
480I30.3Very low30.1Very low142 Ų142146.3 Ų146.373%0.72882%0.822SS**  cis-154.2140.625.4-62.2166.3000108.8Y482I480-Y482 HydrophobicContact CG2-CD2 4.39Å
481T30.6Very low30.1Very low143 Ų143144.8 Ų144.888%0.87782%0.817SS**  trans-154.8118.913136.10000110.5
482Y25.9Very low29.9Very low191 Ų191145 Ų14575%0.74981%0.811SS**  trans-82.5149170.6-88.9-97.9000111.5I480I480-Y482 HydrophobicContact CG2-CD2 4.39Å
483S28.7Very low30Very low127 Ų127144.4 Ų144.489%0.88881%0.808SS**  trans-145.999.9147.8-83.50000108.8
484N27.4Very low30.9Very low144 Ų144141 Ų14177%0.7780%0.795SS**  trans-113.5133.8175.9-99.6-14000109.7
485S31.7Very low30.6Very low117 Ų117144.7 Ų144.782%0.81880%0.798SS**  trans-138.6123.5163.357.80000110.5
486H30.8Very low30.6Very low198 Ų198147.5 Ų147.592%0.91780%0.796SS**  trans-57.6161.3175.8-54.4-96.2000112.3
487G29.1Very low30.5Very low76 Ų76148 Ų14878%0.78480%0.796SS**  cis-168.1-168.43.300000108.8
488S28.9Very low30.5Very low120 Ų120145.2 Ų145.284%0.83979%0.791SS**  cis-153.6178.117.260.90000112.8
489Y29.6Very low30.3Very low213 Ų213147.9 Ų147.984%0.83579%0.788SS**  trans-55.8165165.9-85.7-117.9000112
490D27.2Very low30.5Very low156 Ų156150.8 Ų150.883%0.83479%0.789SS**  cis-155.2-166.844.2-158.43.2000114.9
491S32.3Very low30.4Very low83 Ų83149.8 Ų149.858%0.5879%0.79SS**  trans-132.1161-154.6-151.70000116.7
492N31.2Very low30.2Very low128 Ų128151 Ų15168%0.68478%0.783SS**  trans77.6122.9149-82-51.3000123.6
493Q34.6Very low30.3Very low159 Ų159148.2 Ų148.274%0.74378%0.777SS**  trans81.4172.2131.7-59-88-16.600117.7
494P47.4Very low30.2Very low89 Ų89150.6 Ų150.658%0.57877%0.774SS**  -142.8168.2-75.641.7-25000115.1
495H29.6Very low30.2Very low201 Ų201149.1 Ų149.193%0.93177%0.766SS**  trans-141.4158.3157.9-86.6-63.2000115.7
496R29.6Very low30.1Very low235 Ų235151 Ų15189%0.88776%0.76SS**  trans-97.2135.2-169.6-73.3175.7176.9179.5-1.1110.1
497K29.8Very low30.2Very low190 Ų190147.7 Ų147.783%0.82675%0.753SS**  83.5120.467.9-151.4-168.6-172-179.10113.6
498T28.4Very low30.1Very low118 Ų118150.5 Ų150.572%0.72475%0.75SS**  trans81.1102.4157.15.50000121
499K26.7Very low30.2Very low188 Ų188149 Ų14982%0.81774%0.74SS**  64.1151118.3-158.9-165.7177.8-174.90121.3
500I30.3Very low30.1Very low148 Ų148144.8 Ų144.876%0.75974%0.736SS**  trans113.2146.4158.4-58.5179.5000113.5
501T28.5Very low30.3Very low122 Ų122144.1 Ų144.175%0.74873%0.732SS**  trans-111171.5-162.147.10000113.1
502F25.7Very low30.4Very low169 Ų169147.7 Ų147.774%0.74174%0.743SS**  trans118.4105.4138.2-135.1-115.9000117.3
503E28.6Very low30.3Very low132 Ų132144.7 Ų144.762%0.61774%0.743SS**  trans68153.8131-97.267.216000125.6
504E27.4Very low30.2Very low177 Ų177143 Ų14383%0.82775%0.748SS**  trans45.8135.7159.5-66.4-173.2113.600121.2
505D27.2Very low29.8Very low112 Ų112144 Ų14460%0.59976%0.758SS**  cis165.4172.6-8.3170.233.6000105
506K29.7Very low29.8Very low157 Ų157139.8 Ų139.868%0.68375%0.751SS**  trans72.2104.8155.6-92.6171.5-168.181.80121.1
507V31.6Very low29.7Very low128 Ų128136.5 Ų136.578%0.77675%0.745SS**  trans69.7154.5138.3-56.90000118.5
508D28.8Very low30Very low136 Ų136132 Ų13273%0.72773%0.733SS**  cis-151.2155.323.5-144.3-29000116.6
509S29.9Very low30.5Very low89 Ų89133.9 Ų133.962%0.62273%0.734SS**  trans52113.1147.5-77.40000124.6
510T27.6Very low30.6Very low123 Ų123135.5 Ų135.576%0.75574%0.735SS**  64.7126.2110.5-48.30000121.2
511L31.9Very low30.8Very low143 Ų143135.5 Ų135.575%0.74973%0.732SS**  168.2113.6111.2-165.473.7000116
512I34Very low30.8Very low157 Ų157137.2 Ų137.281%0.80574%0.736SS**  trans57.4139148.4-61.3172.1000121.4
513G28.9Very low31Very low66 Ų66132.8 Ų132.868%0.6873%0.731SS**  trans-159.6-11.217700000123.5
514S32Very low31.1Very low124 Ų124132.2 Ų132.287%0.86774%0.736SS**  trans71.8163176.6-45.80000118.3
515S38.8Very low31.2Very low110 Ų110131 Ų13177%0.76973%0.73SS**  cis-177132.2-34.8-178.20000112.1
516S31.1Very low31.4Very low112 Ų112132.8 Ų132.878%0.78374%0.738SS**  trans155.3153.3153.742.70000111.1
517H27.8Very low31.9Very low166 Ų166132.2 Ų132.277%0.76974%0.741SS**  cis-163.3121.3-29.1-151-79.9000105
518V35.4Very low32.3Very low96 Ų96131.6 Ų131.658%0.58274%0.74SS**  77.5118.352.8175.50000110.7
519E38.1Very low32.1Very low157 Ų157133.6 Ų133.673%0.73475%0.745SS**  cis-166.2-157.8-3.2-143.7116.7-94.900111.5
520W29.9Very low32Very low222 Ų222136 Ų13684%0.84175%0.751SS**  trans102.8132.6162.6-7065.6000118.6
521E34.1Very low32Very low148 Ų148138.6 Ų138.669%0.69275%0.754SS**  cis-168171.3-29-131.9178.3-163.400111.8
522D28.9Very low31.9Very low157 Ų157135.9 Ų135.984%0.8475%0.747SS**  trans79.3141.6156.6-145.118.6000123.3
523A29Very low31.8Very low77 Ų77135.1 Ų135.164%0.63675%0.745SS**  trans-94-175.2-150.800000117.5
524V31.1Very low32.1Very low120 Ų120139.6 Ų139.673%0.72775%0.753SS**  -179.2118.7112.3148.90000113
525H29.3Very low32.4Very low152 Ų152141.8 Ų141.870%0.70475%0.75SS**  trans56.5121.1145.6-63.360.8000120.1
526I32.3Very low32.5Very low149 Ų149145 Ų14576%0.76475%0.753SS**  85.8127.964.4-71.8167.2000113.6
527I40.5Very low32.8Very low144 Ų144146.3 Ų146.374%0.73875%0.746SS**  trans-79.5156.7178.8-57.1159.4000110.2E529I527-E529 HydrophobicContact CG2-CG 4.34Å
528P38.9Very low33.1Very low115 Ų115146 Ų14675%0.74775%0.745SS**  -128.9137.1127.536-29.4000113.2
529E24.6Very low33Very low178 Ų178147.7 Ų147.783%0.83275%0.747SS**  trans-80.5135.4158.8-62.5167.4124.400108I527I527-E529 HydrophobicContact CG2-CG 4.34Å
530N27.5Very low32.7Very low140 Ų140147.9 Ų147.975%0.74975%0.745SS**  trans-122.7131.3144-74.515.8000103.6
531E28.4Very low32.6Very low177 Ų177140.6 Ų140.683%0.82774%0.739SS**  49.7130.971.8-66.6-171.3152.200113.2
532S29.3Very low33.1Very low87 Ų87139.2 Ų139.261%0.60874%0.742SS**  cis-167.8-172.9-20.957.60000106.3
533D32.6Very low33Very low140 Ų140138 Ų13875%0.74974%0.741SS**  trans70.1142.1167.5-46.50.3000114.5
534D35Very low33.4Very low161 Ų161139.7 Ų139.786%0.86175%0.748SS**  cis-117.8162.25-87.7-57.8000113.1
535E36.8Very low34.1Very low169 Ų169139.2 Ų139.279%0.7975%0.747SS**  trans-71.2158.3178.2-61-78.9-16800113.6
536E41.2Very low34.2Very low179 Ų179142.8 Ų142.884%0.83675%0.754SS**  -173122.3106.6-98.9-170.8-176.500112.6
537E37.9Very low34.2Very low139 Ų139142.2 Ų142.265%0.6575%0.753SS**  trans51.7126.9134.1-57.8-63.9117.200122.6
538E35.2Very low33.7Very low160 Ų160142.8 Ų142.875%0.74876%0.757SS**  trans49.4155.7131.6-64.6-157.5151.500122.5
539E32.4Very low33.4Very low131 Ų131144.2 Ų144.261%0.61275%0.754SS**  cis-148.7178.4-17.3-126.1-153.3159.500108.9
540K32.2Very low33.8Very low161 Ų161143.7 Ų143.770%0.775%0.751SS**  trans4.4148159.2-37.9-76.2168.51700121.4
541G27.9Very low34.1Very low68 Ų68141.2 Ų141.270%0.70174%0.744SS**  trans-77.7-152143.900000112
542P43.4Very low34.3Very low119 Ų119140.9 Ų140.977%0.77374%0.743SS**  cis-136.2166.7-9.342.2-25.8000115
543V28Very low34.4Very low132 Ų132145 Ų14580%0.875%0.753SS**  trans42.4106.4139.1-178.60000120.8
544S36.3Very low34.4Very low112 Ų112146.3 Ų146.378%0.78375%0.754SS**  trans71.5169.5144.1-101.30000121.1
545P46.5Very low34.2Very low111 Ų111146.3 Ų146.372%0.72175%0.749SS**  cis-140.1165.2-9.935.6-15.7000118.6
546R31.6Very low33.8Very low226 Ų226144.1 Ų144.185%0.85375%0.747SS**  trans63123.4144-85.3-176.2169.8173.1-2.5125.2
547N32.2Very low34.1Very low137 Ų137141 Ų14173%0.73374%0.743SS**  83.6146.4126.8-78.95.1000125.1
548L30.8Very low33.7Very low157 Ų157142.4 Ų142.482%0.82275%0.749SS**  trans71.9161.7165-60.8165.1000118.3
549Q31.8Very low33.5Very low145 Ų145143 Ų14368%0.67875%0.752SS**  cis-168.7157.9-48.2-160.7178.7-84.800109.1
550E33.2Very low33.5Very low166 Ų166140.3 Ų140.378%0.77675%0.747SS**  trans74.7155.9168-43-172.9167.900115.6
551S34.3Very low33.3Very low88 Ų88143.2 Ų143.262%0.61575%0.754SS**  cis-151.4173.99.554.70000113.9
552E31.6Very low33.4Very low170 Ų170146.7 Ų146.779%0.79476%0.757SS**  trans65.8157.7158.1-72.8140.9147.500119.7
553E30.6Very low32.8Very low174 Ų174149.2 Ų149.281%0.81376%0.758SS**  cis-146.4-168.813.3-146.1167.5-145.700113.8
554E33.1Very low32.8Very low167 Ų167145.8 Ų145.878%0.7875%0.749SS**  trans-72.7-178.7-168.4-57.6179.3116.500117.2
555E30.9Very low32.5Very low162 Ų162151.4 Ų151.476%0.75776%0.755SS**  cis-151.8176.9-0.4-144-164.1161.900111.2
556V29.5Very low32Very low122 Ų122151.5 Ų151.574%0.73976%0.758SS**  trans-144.2118.4-177.8179.10000114.6
557P46.9Very low31.9Very low115 Ų115147.4 Ų147.475%0.74776%0.759SS**  trans-134.6153.4132.928.9-13000112.7
558Q29.6Very low31.7Very low167 Ų167148.1 Ų148.178%0.7876%0.761SS**  cis106.5146.811-159.7176.23.600115.1
559E30.6Very low31.6Very low173 Ų173146.3 Ų146.381%0.80876%0.762SS**  trans78.1146.6176.8-64.9-165.7-174.700117.8
560S31.7Very low31.5Very low74 Ų74146.8 Ų146.852%0.51777%0.767SS.*  cis-167.1168.1-10.144.70000113.4
561W29.9Very low32.3Very low223 Ų223144.3 Ų144.385%0.84577%0.766SS**  trans65.7137.5169.7-43.8103.4000117.7
562D28.7Very low32.5Very low141 Ų141144.9 Ų144.975%0.75477%0.767SS**  cis96.7163.723.4-15920.8000114.8
563E31.3Very low32.3Very low171 Ų171145.3 Ų145.380%0.79977%0.769SS**  trans77.9139.8-175.2-14881.2-108.500116.1
564G28.7Very low32.1Very low60 Ų60145 Ų14562%0.61977%0.77SS**  trans-153.3166.9179.100000113.3
565Y29.4Very low31.9Very low231 Ų231145.2 Ų145.291%0.90678%0.776SS**  trans-140.9151178.1-96.7-88.4000112.9
566S36.2Very low31.7Very low112 Ų112141.4 Ų141.478%0.78377%0.772SS**  trans-117.4143.8-175.9-64.50000113
567T30Very low31.7Very low141 Ų141140.5 Ų140.587%0.86577%0.771SS**  trans-164.3118.9147.317.60000108
568L26.6Very low30.6Very low151 Ų151145.2 Ų145.279%0.79178%0.775SS**  cis84.696.248.8-149.2179.4000113.4
569S29.6Very low30.5Very low119 Ų119146.8 Ų146.883%0.83278%0.783SS**  trans-167.3140.1150.3-81.10000112
570I29.6Very low30.2Very low155 Ų155143.3 Ų143.380%0.79578%0.778SS**  trans-160.4155.6-168.5-57.2176000106.2
571P49.2Very low30Very low114 Ų114149.9 Ų149.974%0.7479%0.793SS**  cis-116.4-134-29.237.6-16.9000108.2
572P39.5Very low29.9Very low100 Ų100145 Ų14565%0.64979%0.793SS**  cis-130.6175.5-2535.6-15.7000116.7
573E26.8Very low29.7Very low179 Ų179142.2 Ų142.284%0.83678%0.784SS**  trans13.6138.8141.9-52.3174.1154.200118.9
574M25.9Very low29.8Very low167 Ų167139.4 Ų139.482%0.82378%0.779SS**  179134.862.3-178.6-166.3-54.100111
575L29Very low29.6Very low172 Ų172145.5 Ų145.590%0.90179%0.789SS**  trans-174.3135.9140.7-106.8175.7000111.6
576A26.7Very low29.5Very low83 Ų83142.5 Ų142.569%0.68678%0.783SS**  trans-91.2175.5164.500000109.2
577S29.3Very low29.3Very low103 Ų103142.3 Ų142.372%0.7278%0.781SS**  cis-161.4-179.321.5-163.30000112.3
578Y25.1Very low29.5Very low213 Ų213142.8 Ų142.884%0.83578%0.778SS**  trans65.589.7169.1-85.3-88.2000118.5
579Q26.5Very low30.1Very low200 Ų200143.4 Ų143.494%0.93578%0.777SS**  -149165.793.9-102.6-174.28.800110.5
580S25.7Very low30.5Very low101 Ų101146 Ų14671%0.70678%0.776SS**  trans-116.1126.2-162.3-167.50000113.4
581Y26.4Very low30.6Very low211 Ų211146.3 Ų146.383%0.82777%0.774SS**  trans40.892.2151.2-76.7-101000118.8
582S27Very low29.9Very low121 Ų121148.3 Ų148.385%0.84677%0.773SS**  -107.7128.5127.458.40000107.9
583S26.1Very low29.7Very low82 Ų82148.7 Ų148.757%0.57377%0.774SS**  trans-115119.2-174.2-170.50000110.9F585S583-F585 PolarHBondContact O-N 3.37Å
584T32Very low30Very low112 Ų112145.5 Ų145.569%0.68777%0.77SS**  trans-77105.8-174.6-41.80000111.5H586T584-H586 VanDerWaalsContact CG2-CD2 3.46Å; T584-H586 WeakPolarHBondContact CG2-CD2 3.5Å; T584-H586 WeakPolarHBondContact CG2-NE2 3.43Å
585F24.4Very low30.3Very low188 Ų188144.7 Ų144.783%0.82577%0.766SS**  trans-104.694.5165.1-82-83.3000110.3S583S583-F585 PolarHBondContact O-N 3.37Å
586H28.4Very low30.6Very low168 Ų168140.7 Ų140.778%0.77876%0.757SS**  trans-78.3141.6162-73.3-70.2000110T584 L588T584-H586 VanDerWaalsContact CG2-CD2 3.46Å; T584-H586 WeakPolarHBondContact CG2-CD2 3.5Å; T584-H586 WeakPolarHBondContact CG2-NE2 3.43Å; H586-L588 PolarHBondContact O-N 2.7Å
587S32.8Very low31.1Very low108 Ų108142.2 Ų142.276%0.75576%0.758SS**  trans-68.3111-169.9-55.20000113.7E589S587-E589 PolarHBondContact O-N 3.42Å
588L33.1Very low31.2Very low152 Ų152143.2 Ų143.280%0.79676%0.755SS**THydrogen-bonded Turntrans-79.341.9171.7-162.774.7000112.4H586H586-L588 PolarHBondContact O-N 2.7Å
589E38.9Very low31.7Very low163 Ų163140.8 Ų140.876%0.76276%0.755SS**THydrogen-bonded Turntrans-115.3-29.7-174.3-164.4158.2-157.600113.6S587 Q591S587-E589 PolarHBondContact O-N 3.42Å; E589-Q591 PolarHBondContact O-N 3.49Å
590E38.8Very low32.2Very low175 Ų175134.7 Ų134.782%0.81875%0.746SS**G310 helixtrans-76.8-17.3180-71.5-168.6120.800114.5Q592E590-Q592 PolarHBondContact O-N 2.98Å
591Q31.6Very low32.5Very low161 Ų161140.6 Ų140.675%0.75275%0.753SS**G310 helixtrans-87.41.7-173.3-146.3169.71800115.3E589E589-Q591 PolarHBondContact O-N 3.49Å
592Q34.3Very low32.7Very low155 Ų155139.3 Ų139.372%0.72475%0.754SS**G310 helixtrans-89.9-7.8174.3-67.3-166.33600114.2E590E590-Q592 PolarHBondContact O-N 2.98Å
593V35.2Very low33Very low109 Ų109144.9 Ų144.966%0.66176%0.756SS**G310 helixtrans-76.4-27.5-173.8-177.30000112.9M595V593-M595 PolarHBondContact O-N 3.3Å
594C32.6Very low33.2Very low111 Ų111153 Ų15375%0.7578%0.775SS**G310 helixtrans-87.91.1-170.3-61.70000116.3
595M33.7Very low33.1Very low151 Ų151155.6 Ų155.674%0.74478%0.784SS**G310 helixtrans-108.9-2.4-178.8-65.9-163-63.900114.9V593V593-M595 PolarHBondContact O-N 3.3Å
596A33.7Very low33.5Very low87 Ų87155.7 Ų155.772%0.71979%0.787SS**SBendtrans-90.8-4-170.600000115.5
597V37.1Very low33.8Very low115 Ų115154.4 Ų154.470%0.69779%0.791SS**SBendtrans-97.4-38.6-167.6177.20000113.7
598D31.6Very low33.8Very low125 Ų125158.9 Ų158.967%0.66880%0.797SS**G310 helixtrans-91.8-9.7-162.4-67.5-50.3000116.6G600D598-G600 PolarHBondContact O-N 2.82Å; D598-G600 VanDerWaalsContact O-N 3.12Å
599I36.4Very low33.8Very low161 Ų161159.4 Ų159.483%0.82679%0.793SS**G310 helixtrans-65.9-18.4-179.2-61.3178.5000112R601I599-R601 PolarHBondContact O-N 3.13Å
600G36.4Very low33.4Very low73 Ų73158 Ų15875%0.75379%0.786SS**G310 helixtrans-79.4-6.3-173.200000117.9D598D598-G600 PolarHBondContact O-N 2.82Å; D598-G600 VanDerWaalsContact O-N 3.12Å
601R32.6Very low33.1Very low224 Ų224156.6 Ų156.685%0.84578%0.784SS**SBendtrans-116.6-0.2-163.8-84.2-167.4175.1-81.21.9119I599I599-R601 PolarHBondContact O-N 3.13Å
602H29.6Very low33.1Very low184 Ų184156 Ų15685%0.85278%0.782SS**SBendtrans-116.226.5-169.3-95.2-68000117.3
603R34.3Very low32.8Very low238 Ų238157.2 Ų157.290%0.89879%0.787SS**SBendtrans-143.226.6-175.2-123.1-176.3-149.3-74.3-0.8118.8
604W30.8Very low32.5Very low253 Ų253156.2 Ų156.296%0.95879%0.791SS**SBendtrans-138.214-179.5-134.931.2000119.6
605D29.6Very low32.3Very low167 Ų167157.8 Ų157.889%0.89380%0.797SS**  trans-12868.6174.7-80.1-62.3000113.2
606Q32.8Very low31.9Very low189 Ų189153.6 Ų153.688%0.88379%0.792SS**  trans-155.350.5165-157.9162.188.400115.7
607V34.3Very low32.5Very low142 Ų142155.3 Ų155.386%0.86180%0.796SS**SBendtrans-154.2102.8143.9177.20000108.6
608K32Very low32.1Very low202 Ų202161.4 Ų161.488%0.87881%0.806SS**  trans169.8113.2146.2-96-77.9178175.50108.2
609K34.3Very low31.9Very low162 Ų162163.7 Ų163.770%0.70482%0.818SS**  trans-119.2151.9175.8-144.4177.8169.8-81.70107.4
610E30.5Very low31.5Very low133 Ų133161.4 Ų161.462%0.62182%0.816SS**  trans61.8144.1178.8-76.587.2-129.900115.2
611D31.3Very low31.1Very low146 Ų146169.8 Ų169.878%0.78183%0.825SS**  cis-119.9175.416.8-70.3-59.7000115.3
612Q31.2Very low30.9Very low150 Ų150166.6 Ų166.670%0.70182%0.82SS**  trans-44.5139173.6-83.885.49.200115.5
613E29.1Very low30.8Very low179 Ų179164.1 Ų164.184%0.83681%0.812SS**  77.2106.960.9-176.6-171.8-147.300114.2
614A29.5Very low30.6Very low89 Ų89159.9 Ų159.974%0.73681%0.806SS**  trans178.9125.4142.800000113.9
615T28.6Very low30.5Very low144 Ų144154.5 Ų154.588%0.88380%0.796SS**  trans52.2118.2140.3-46.80000122.2
616G24.6Very low30.6Very low62 Ų62152.4 Ų152.464%0.63978%0.781SS**  trans-120.6-154.7142.500000110.1
617P45.5Very low30.6Very low124 Ų124151.6 Ų151.681%0.80578%0.775SS**  cis-136.3143.8-32.337.1-22.1000112.9
618R29.2Very low30.2Very low242 Ų242148.2 Ų148.291%0.91377%0.769SS**  trans-147.4120.1170.1-72.6-162.1175.5-164.8-3.5117.1
619L26.8Very low30.8Very low174 Ų174144.4 Ų144.491%0.91177%0.765SS**  trans38.9149.4130.3-57.3178.9000123.1
620S29.2Very low30.6Very low113 Ų113144.9 Ų144.979%0.7977%0.77SS**  trans-95.9151.5-17351.70000116.2
621R28.2Very low30.5Very low249 Ų249145.6 Ų145.694%0.9478%0.783SS**  trans-155.5-175.2140.7-148.3159.2-176.6165.73.3112.1
622E27.4Very low30.4Very low157 Ų157145.8 Ų145.873%0.73478%0.783SS**  trans-126.7159.9-146.3-121.7-176.612800114.3
623L27Very low30.4Very low132 Ų132146.7 Ų146.769%0.69179%0.787SS**  trans80134.5147.3-69.4165.3000124.1
624L31.5Very low30.2Very low148 Ų148145 Ų14578%0.77578%0.784SS**  trans62125.8140.4-74.7164.1000123
625D28.8Very low30.2Very low140 Ų140145.1 Ų145.175%0.74978%0.779SS**  -167.3172.897.5-124.4-17.2000109.8
626E31.4Very low30.2Very low123 Ų123146.2 Ų146.258%0.57578%0.779SS**  cis-158.6153.25.6-149.6-171.6-177.100111.1
627K32.4Very low30.4Very low172 Ų172148.4 Ų148.475%0.74878%0.776SS**  trans57.8143.6163.3-68.9146.9-173.2157.20119.5
628G26.6Very low29.5Very low72 Ų72151.8 Ų151.874%0.74277%0.773SS**  cis124.5151.65.900000111.6
629P43.1Very low29.3Very low122 Ų122144.8 Ų144.879%0.79276%0.76SS**  cis-128.1-167.17.444-28000115
630E30.2Very low29.2Very low171 Ų171146.6 Ų146.680%0.79976%0.756SS**  trans-86.9169.9-179.9-42.9106.9117.700115.9
631V30.1Very low29.2Very low149 Ų149146.1 Ų146.190%0.90375%0.753SS**  -172.2163.7122.1144.70000110.4
632L28.9Very low29.2Very low149 Ų149140.4 Ų140.478%0.7875%0.745SS**  trans-99.8179.5-156.3-70.1165.8000116.9
633Q29.6Very low29.5Very low169 Ų169138.4 Ų138.479%0.7975%0.746SS**  trans-44.9167.1167.2-56.8145.2-41.900113.4
634D26.5Very low29.6Very low145 Ų145136.8 Ų136.878%0.77575%0.746SS**  cis-169.2171.635-160.14.2000113.6
635S28.9Very low29.5Very low90 Ų90133.3 Ų133.363%0.62975%0.746SS**  trans59.3127.5151.369.60000123.5
636L29.3Very low29.5Very low167 Ų167131.8 Ų131.887%0.87475%0.745SS**  trans20.5138140.7-58.8166000119.7
637D26.9Very low29.4Very low108 Ų108132.2 Ų132.258%0.57875%0.75SS**  -171.5162.854.6-171.822.4000114.1
638R27.1Very low29.2Very low195 Ų195131.1 Ų131.174%0.73675%0.748SS**  trans35.8136.6157.2-98.1174.2-77.4-115.2-15125.7
639C25.3Very low29.2Very low96 Ų96134.6 Ų134.665%0.64975%0.749SS**  trans69.4130.2145.9-63.30000118.1
640Y25.9Very low28.4Very low212 Ų212133.9 Ų133.983%0.83174%0.742SS**  cis-150.1162.234.6-103.5-78.3000114.5
641S28.5Very low28.3Very low102 Ų102133 Ų13371%0.71374%0.743SS**  trans67.9100.1152.5-57.80000120.8
642T28.5Very low28.1Very low129 Ų129131.8 Ų131.879%0.79174%0.741SS**  trans-61.6156.2136.52.30000110.7
643P32.2Very low27.9Very low116 Ų116130 Ų13075%0.75374%0.74SS**  -111119106.1-12.129.9000110
644S30.6Very low27.7Very low98 Ų98130.8 Ų130.869%0.68574%0.743SS**  52.4115.196.873.30000113.3
645G28.2Very low27.9Very low74 Ų74128.9 Ų128.976%0.76374%0.739SS**  cis140.5169.912.300000109.7
646C28.5Very low27.6Very low108 Ų108134.7 Ų134.773%0.7375%0.749SS**  cis-1461433.6-81.80000110
647L29.9Very low27.4Very low132 Ų132137.3 Ų137.369%0.69175%0.747SS**  trans49147.3132-73.172.7000120.5
648E29.3Very low27.4Very low149 Ų149137.2 Ų137.270%0.69676%0.755SS**  cis-162.3120.4-17.5-115.9158.2-163.600103.6
649L26.3Very low27.4Very low146 Ų146132.3 Ų132.376%0.76476%0.756SS**  84.5126.473.6-79.8173.6000115.7
650T26.2Very low27.3Very low107 Ų107137.1 Ų137.166%0.65677%0.766SS**  trans65.6116147.747.30000122.1
651D28.4Very low27.2Very low152 Ų152136.9 Ų136.981%0.81377%0.765SS**  69110.7120.8-55-2.9000121.6
652S26Very low27.1Very low124 Ų124137.9 Ų137.987%0.86777%0.767SS**  trans-147.1138.7134.5-174.10000110.4
653C23.8Very low27Very low111 Ų111139.2 Ų139.275%0.7577%0.768SS**  trans-97113.5-173.9-67.40000112.5
654Q26Very low26.9Very low185 Ų185142.9 Ų142.986%0.86478%0.775SS**  trans-155.3126154.1-80.7-49.5-38.800111.8
655P30.1Very low26.9Very low106 Ų106146 Ų14669%0.68878%0.779SS**  trans-127.4105.1171.935.9-20.8000114
656Y22.8Very low26.8Very low212 Ų212151.1 Ų151.183%0.83178%0.783SS**  trans-164.1144.1156.1-127-74.3000116
657R25.4Very low26.8Very low222 Ų222156.8 Ų156.884%0.83879%0.789SS**  trans64.2143.3161.9-92.5145.6-176.6-80.5-3.6117.4
658S26.3Very low26.6Very low105 Ų105155.5 Ų155.573%0.73479%0.787SS**  cis-159.5148-16.9-166.80000110
659A26.6Very low26.4Very low93 Ų93151.8 Ų151.877%0.76979%0.789SS**  trans-79.9157.1174.800000113.3
660F23.5Very low26.4Very low196 Ų196153.3 Ų153.386%0.8679%0.789SS**  trans-102.9-176.7161.6-96-97.5000110
661Y24.3Very low26.5Very low208 Ų208152.4 Ų152.482%0.81679%0.792SS**  trans89100161.9-81.1-88.3000120.3
662V25.9Very low26.5Very low122 Ų122154.4 Ų154.474%0.73979%0.794SS**  78.3140.5119.4161.70000120.9
663L27.1Very low26.6Very low158 Ų158155.8 Ų155.883%0.82779%0.792SS**  trans-85.2139.7166-65.873000109.5
664E28.8Very low27.1Very low192 Ų192159.1 Ų159.190%0.89780%0.798SS**  -154.5175.3123.6-127-177167.900112.5
665Q31.2Very low27.3Very low165 Ų165158.3 Ų158.377%0.77180%0.8SS**  trans-77.6145.6-173.3-63.6178.96500112.2
666Q27.4Very low27.3Very low181 Ų181156.3 Ų156.385%0.84680%0.799SS**  trans-131.9111.8151.2-163.716058.600110.2
667R27.1Very low27.9Very low226 Ų226153.8 Ų153.885%0.85380%0.798SS**  trans-70.6133.8167.5-69.3-178.6173-151.10.5108.7
668V25.5Very low28.4Very low106 Ų106152.3 Ų152.364%0.64280%0.798SS**  trans-129112.5159.1-178.20000107.1F670V668-F670 HydrophobicContact CG1-CD2 3.83Å; V668-F670 HydrophobicContact CG1-CE2 3.52Å; V668-F670 HydrophobicContact CG1-CZ 4.41Å
669G24.9Very low28.7Very low71 Ų71156.6 Ų156.673%0.73280%0.803SS**  trans-95.4141.216900000109.7
670F27.9Very low29Very low178 Ų178160 Ų16078%0.78181%0.808SS**  trans-126.8111.9164.1-84.9-74.4000108.8V668V668-F670 HydrophobicContact CG1-CD2 3.83Å; V668-F670 HydrophobicContact CG1-CE2 3.52Å; V668-F670 HydrophobicContact CG1-CZ 4.41Å
671A27.1Very low29.5Very low87 Ų87159.7 Ų159.772%0.71981%0.81SS**  trans-76.7153.1155.800000108.7
672F28.6Very low29.9Very low195 Ų195159.3 Ų159.386%0.85582%0.815SS**  trans-141.2114.9163.5-118.1-81.9000107.7
673D27.8Very low30.2Very low152 Ų152162.8 Ų162.881%0.81382%0.823SS**  trans-70.1143.9176.9-71.2-60.6000111D675D673-D675 PolarHBondContact O-N 3.04Å
674M34.9Very low30.8Very low181 Ų181164.6 Ų164.689%0.89283%0.828SS**  trans-89.690.3176.5-83.8-77.4-63.600109.6
675D30.6Very low31.4Very low168 Ų168164.9 Ų164.990%0.89883%0.829SS**  trans-144.3146.9170.8-139.2-24.7000112.5D673D673-D675 PolarHBondContact O-N 3.04Å
676G29.4Very low32.1Very low64 Ų64163.4 Ų163.466%0.6683%0.826SS**  trans113.323.2176.700000118.5K678G676-K678 PolarHBondContact O-N 3.31Å
677I36.1Very low32.4Very low160 Ų160162.5 Ų162.582%0.82182%0.822SS**  trans-71.6114.9157.7-65.9179.8000107.7
678K35.5Very low32.6Very low191 Ų191159.4 Ų159.483%0.8382%0.823SS**PPolyproline II helixtrans-68.5137.5168.7-69-174.4177.1-175.80109.1G676G676-K678 PolarHBondContact O-N 3.31Å
679K32.3Very low33.2Very low194 Ų194160 Ų16084%0.84383%0.828SS**PPolyproline II helixtrans-72.3140.5175.8-58-177.1179.2-173.90110.1
680D33.1Very low34.2Very low164 Ų164162.6 Ų162.688%0.87783%0.832SS**PPolyproline II helixtrans-84153.6151.4-62.7-55.2000108.4
681E34.5Very low34.5Very low190 Ų190160 Ų16089%0.88884%0.835SS**PPolyproline II helixtrans-102.2126.8-176.5-65.8170.9134.800110.8
682E32.9Very low34.9Very low200 Ų200161.5 Ų161.594%0.93584%0.837SS**  trans-132.8130.7153.4-73.1-168.5144.100108
683E31.5Very low34.8Very low195 Ų195164.2 Ų164.291%0.91184%0.842SS**  trans-95.6133.9175.2-63.4179121.900109.9
684E39.8Very low34.9Very low197 Ų197165.1 Ų165.192%0.92185%0.846SS**  trans-136.7143.3159.6-84.9-100.1121.700107.2
685E40.4Very low34.6Very low198 Ų198161.7 Ų161.793%0.92584%0.84SS**  trans-85.3121.8-157.6-69.2-172.6120.400116.6
686D45.9Very low34.5Very low133 Ų133163.7 Ų163.771%0.71184%0.835SS**  trans59.6114.8137.5-145.929000122.3
687Q34.5Very low34.5Very low162 Ų162166.6 Ų166.676%0.75783%0.831SS**  trans70.4121163.3-51.4-52.9-54.600121.2
688D32Very low34Very low162 Ų162166 Ų16687%0.86683%0.829SS**  trans-79.3150.5179.1-65.1-71.5000116.5
689P37.1Very low33.7Very low117 Ų117163.3 Ų163.376%0.7682%0.823SS**  trans-105.9156.1160.637.5-30.8000114.4
690P46.4Very low33.5Very low126 Ų126161.3 Ų161.382%0.81882%0.816SS**  trans-96.9166.4-170.737.6-37.7000117.3
691C33.8Very low33.2Very low124 Ų124160.6 Ų160.684%0.83882%0.818SS**  trans-82164.9-175.8-33.40000115.9
692P35.8Very low33Very low118 Ų118157.2 Ų157.277%0.76681%0.81SS**  trans-147.2114.5140.835.3-17000118.7
693R27.6Very low33.1Very low253 Ų253155.5 Ų155.596%0.95580%0.802SS**  63.4161.2129.6-69.1-173170.8178-2.3124.7
694L28.7Very low33.2Very low171 Ų171152.3 Ų152.390%0.89580%0.798SS**  trans-103164.7-163.3-57.2153.7000114.6
695S29.6Very low32.7Very low108 Ų108151.5 Ų151.576%0.75579%0.794SS**  -179.1141124.260.90000116.3
696R28.1Very low32.4Very low210 Ų210148 Ų14879%0.79279%0.786SS**  trans68.3150.2146.6-91.7-178.8144.6114.311.8120
697E28.7Very low31.6Very low125 Ų125149.7 Ų149.758%0.58479%0.794SS**  cis-163.9139.6-3.2-166.7145.6-13400113.2
698L26.8Very low31.4Very low149 Ų149150 Ų15078%0.7880%0.795SS**  trans58.5163.9163.5-65.3171.1000118.7
699L27.7Very low31.2Very low133 Ų133148.9 Ų148.970%0.69679%0.789SS**  cis-146.9126.215.9-173.765000113.6
700E29.1Very low30.8Very low153 Ų153148.3 Ų148.372%0.71579%0.788SS**  trans41.1118136.8-148.6162.7-120.900122.9V702E700-V702 HydrophobicContact CG-CG2 4.18Å
701V27.2Very low30.2Very low149 Ų149150.5 Ų150.590%0.90379%0.792SS**  trans-137.1139.2144.9175.90000107.3
702V30.3Very low30Very low118 Ų118150.5 Ų150.572%0.71578%0.784SS**  trans-107.8135.4-171.7170.30000110.9E700E700-V702 HydrophobicContact CG-CG2 4.18Å
703E34Very low29.6Very low165 Ų165154 Ų15477%0.77178%0.782SS**  trans-72.2167.1171.5-66.6-177.5115.300111.8
704P34.3Very low29.5Very low128 Ų128146.9 Ų146.983%0.83177%0.769SS**  -132.1159.2111.937.2-30.7000114.3
705E28.3Very low29.5Very low179 Ų179149.3 Ų149.384%0.83677%0.768SS**  trans-78168.9-169.9-62.7161.1106.800114.3
706V35.2Very low29.4Very low125 Ų125149.9 Ų149.976%0.75877%0.772SS**  trans-86.6135.6169175.30000109.9
707L29.1Very low29.4Very low169 Ų169145.9 Ų145.989%0.88577%0.772SS**  trans-133.3149.3150.7-83.8-176.9000112.5
708Q29.5Very low29.3Very low167 Ų167145.9 Ų145.978%0.7878%0.782SS**  trans-88.9-176.1171.4-60.6161.4-54.200107.4
709D27.1Very low29.3Very low139 Ų139143.7 Ų143.774%0.74378%0.779SS**  cis-162.9176.419.3-160.59.4000112.2
710S29.9Very low29.1Very low105 Ų105142.4 Ų142.473%0.73478%0.781SS**  trans74.3135.8151.575.90000120.4
711L34.2Very low28.8Very low173 Ų173140.4 Ų140.491%0.90678%0.783SS**  trans-107.5148.3164.2-69.4155000108.8
712D28Very low28.6Very low123 Ų123140.4 Ų140.466%0.65878%0.777SS**  -160153.8128.1-148.2-4.5000115
713R27.5Very low28.4Very low193 Ų193143 Ų14373%0.72878%0.782SS**  trans53.4100.3148.9-116.2161.1-75.7-129.4-1.5123.2
714C27.3Very low28Very low102 Ų102144 Ų14469%0.68979%0.786SS**  61.8121.7118.3-62.20000123.1
715Y27.7Very low28.3Very low222 Ų222142.8 Ų142.887%0.87178%0.778SS**  trans44.1109.4134.3-62.7-73.1000120.8
716S26.6Very low28.1Very low120 Ų120141.3 Ų141.384%0.83978%0.776SS**  -158158.5110.5-83.70000112.1
717T29.3Very low27.7Very low127 Ų127140.4 Ų140.478%0.77978%0.776SS**  trans-70159.3-177.6-20.10000112.6
718P26.8Very low27.5Very low125 Ų125138.7 Ų138.781%0.81278%0.776SS**  trans-121.312913334.2-28000110.9
719S25.8Very low27.6Very low102 Ų102139.2 Ų139.271%0.71378%0.779SS**  trans-106.9164.5162.260.40000110.1
720S23.8Very low27.8Very low106 Ų106138.8 Ų138.874%0.74178%0.783SS**  trans110140.3158.677.40000117.9
721C22.2Very low27.5Very low111 Ų111144.9 Ų144.975%0.7579%0.792SS**  trans70136.3161-61.90000118.3
722L23.8Very low27.1Very low149 Ų149139.8 Ų139.878%0.7878%0.781SS**  cis-165-175.8-12.9-125.6168.9000109.7
723E26.8Very low27Very low173 Ų173139.3 Ų139.381%0.80879%0.787SS**  trans70.593.8159.2-71.5171.5166.200120.2
724Q23.9Very low27.1Very low186 Ų186134.3 Ų134.387%0.86978%0.782SS**  -65167.8128.3-83.9-177.8-30.100110.3
725P40.8Very low27.2Very low102 Ų102139.7 Ų139.766%0.66279%0.794SS**  cis-141.5-173.623.744.2-25.5000117.6
726D25.8Very low27.3Very low149 Ų149139.7 Ų139.780%0.79779%0.794SS**  trans59.4118.5155.4-58.7-27.4000120.1
727S24.9Very low27.5Very low106 Ų106138.6 Ų138.674%0.74179%0.792SS**  -175.1155.460.440.80000114.7
728C26.3Very low27.7Very low132 Ų132140.7 Ų140.789%0.89280%0.798SS**  trans68.2150.1161.4-65.80000120.3
729Q30.7Very low27.9Very low179 Ų179141.7 Ų141.784%0.83679%0.791SS**  trans-79.3168.5-175.7-59.5173-32.500112.8
730P31.1Very low28.2Very low130 Ų130146 Ų14684%0.84480%0.8SS**  -138.2165101.139.6-30.1000116.6
731Y24Very low28.5Very low233 Ų233148 Ų14891%0.91480%0.796SS**  trans-73.6154.7174.4-139.9-107.9000112.6
732G26.8Very low28.9Very low66 Ų66152.1 Ų152.168%0.6880%0.803SS**  trans141.1135147.500000119.4
733S26.3Very low29.2Very low112 Ų112151.2 Ų151.278%0.78380%0.804SS**  trans64.9104.4167.7-159.80000116.8
734S28.5Very low29.3Very low88 Ų88146.3 Ų146.362%0.61580%0.8SS**  cis82.8111.439.687.10000115.8
735F29.4Very low29.7Very low215 Ų215147.3 Ų147.394%0.94380%0.802SS**  trans-115.7149.5154.2-80.5-83000108.7
736Y30.3Very low29.4Very low223 Ų223148.1 Ų148.188%0.87581%0.81SS**  trans-87.1142.5-167.4-93.9-100.6000113.7
737A30.2Very low29.8Very low96 Ų96149.3 Ų149.379%0.79382%0.815SS**  trans-73.6161.6162.900000111.4
738L32.8Very low30.1Very low172 Ų172151.7 Ų151.790%0.90182%0.819SS**  trans-115.5124.3176.4-131.8159000108.6E740L738-E740 PolarHBondContact O-N 2.96Å
739E31.6Very low30.5Very low145 Ų145152 Ų15268%0.67882%0.817SS**  trans-73.5114.5-175.7-61.1178.6132.300111.6K741E739-K741 WeakPolarHBondContact OE2-CE 3.43Å; E739-K741 IonicContact OE2-NZ 2.64Å; E739-K741 PolarHBondContact OE2-NZ 3.21Å
740E32.4Very low30.8Very low192 Ų192150.8 Ų150.890%0.89785%0.852SS**  trans-82.3127.9158.8-172.7162.1-147.100109.3L738L738-E740 PolarHBondContact O-N 2.96Å
741K31.1Very low30.8Very low150 Ų150151.8 Ų151.865%0.65285%0.853SS**  trans-109.2114.5-172.6-81175.1177152.20111.6E739 V743E739-K741 WeakPolarHBondContact OE2-CE 3.43Å; E739-K741 IonicContact OE2-NZ 2.64Å; E739-K741 PolarHBondContact OE2-NZ 3.21Å; K741-V743 PolarHBondContact O-N 3.19Å
742H29.5Very low31.2Very low196 Ų196147.5 Ų147.591%0.90785%0.849SS**  trans-49.4129.7168.3-72.8-89.8000111.7
743V30.9Very low31.4Very low130 Ų130152.1 Ų152.179%0.78886%0.859SS**  trans-119.2112.6158.6178.20000106.5K741K741-V743 PolarHBondContact O-N 3.19Å
744G29Very low31.7Very low71 Ų71154.4 Ų154.473%0.73286%0.863SS**  trans-80.3137.1-178.800000112
745F31.6Very low31.9Very low207 Ų207158.6 Ų158.691%0.90888%0.879SS**  trans-87.5114.4165-79-86.6000109.7
746S34.9Very low32.1Very low118 Ų118154.8 Ų154.883%0.82587%0.874SS**  trans-77126.1165.1-62.40000109.7
747L33.5Very low32.2Very low174 Ų174149.9 Ų149.991%0.91187%0.874SS**  trans-71.2133.3155.2-77.7161.4000108.3
748D30.3Very low32.4Very low156 Ų156154.1 Ų154.183%0.83488%0.881SS**  trans-120.6154.4164.8-164.310.9000108.8
749V34.8Very low32.3Very low140 Ų140152.6 Ų152.685%0.84888%0.879SS**  trans-120.1113.6-169.6178.10000110
750G38.2Very low32.4Very low152 Ų152153.3 Ų153.3100%1.56790%0.897SS**  trans-157.40176.900000112.5

Retrieved 750 of 750 residues in 1093.5 ms (Link to these results)