A0A087YID9_POEFO Loading...

Coiled-coil domain containing 92

AlphaFold DB , UniProt , Accession A0A087YID9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 334 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
1Q55.3Low67.7Low218 Ų218100.6 Ų100.6100%1.01958%0.584SS**  0-29.30-123.4161.210.600112.1
2T59.1Low69.2Low105 Ų10598.7 Ų98.764%0.64457%0.574SS**Hα-helixtrans-70.9-37.517743.70000114.9I4 A5 M6T2-I4 PolarHBondContact O-N 3.35Å; T2-A5 PolarHBondContact O-N 3.33Å; T2-M6 PolarHBondContact O-N 3.09Å; T2-M6 VanDerWaalsContact O-N 3.08Å
3D60Low70.6Confident118 Ų11899.4 Ų99.463%0.63157%0.574SS**Hα-helixtrans-69.3-32.1-178.6-68.5-35.2000113.8A5 M6 A7D3-A5 VanDerWaalsContact C-N 3.31Å; D3-A5 PolarHBondContact O-N 2.69Å; D3-M6 PolarHBondContact O-N 2.67Å; D3-A7 WeakPolarHBondContact O-CB 3.24Å; D3-A7 PolarHBondContact O-N 2.8Å
4I64.8Low71.9Confident134 Ų134100.8 Ų100.869%0.68757%0.572SS**Hα-helixtrans-69.8-32.7176.5-60.6172.9000110.5T2 S8T2-I4 PolarHBondContact O-N 3.35Å; I4-S8 WeakPolarHBondContact O-CB 3.18Å; I4-S8 PolarHBondContact O-N 2.86Å; I4-S8 VanDerWaalsContact O-N 3.08Å; I4-S8 PolarHBondContact O-OG 3.34Å
5A63.8Low73.1Confident56 Ų56100.8 Ų100.846%0.46357%0.57SS.*Hα-helixtrans-75.4-35.2176.200000112.8T2 D3 S8 A9T2-A5 PolarHBondContact O-N 3.33Å; D3-A5 VanDerWaalsContact C-N 3.31Å; D3-A5 PolarHBondContact O-N 2.69Å; A5-S8 WeakPolarHBondContact CA-OG 3.33Å; A5-S8 PolarHBondContact O-OG 2.81Å; A5-A9 VanDerWaalsContact O-CB 3.28Å; A5-A9 WeakPolarHBondContact O-CB 3.46Å; A5-A9 PolarHBondContact O-N 3.05Å
6M65.8Low74.3Confident119 Ų119102.5 Ų102.559%0.58657%0.572SS**Hα-helixtrans-70.1-38.9172.3-90.7-160.1-79.800112.3T2 D3 A9 N10T2-M6 PolarHBondContact O-N 3.09Å; T2-M6 VanDerWaalsContact O-N 3.08Å; D3-M6 PolarHBondContact O-N 2.67Å; M6-A9 PolarHBondContact O-N 3.48Å; M6-N10 PolarHBondContact O-N 3.4Å
7A70.3Confident75.4Confident55 Ų55102.4 Ų102.446%0.45557%0.569SS.*Hα-helixtrans-64.3-41.3174.700000111.9D3 N10 V11D3-A7 WeakPolarHBondContact O-CB 3.24Å; D3-A7 PolarHBondContact O-N 2.8Å; A7-N10 PolarHBondContact O-N 2.92Å; A7-V11 VanDerWaalsContact O-CG2 3.27Å; A7-V11 WeakPolarHBondContact O-CG2 3.33Å; A7-V11 PolarHBondContact O-N 3.44Å
8S70.4Confident76.3Confident71 Ų71102.7 Ų102.750%0.49757%0.565SS.*Hα-helixtrans-69.7-33.617668.30000113.1I4 A5 T12I4-S8 WeakPolarHBondContact O-CB 3.18Å; I4-S8 PolarHBondContact O-N 2.86Å; I4-S8 VanDerWaalsContact O-N 3.08Å; I4-S8 PolarHBondContact O-OG 3.34Å; A5-S8 WeakPolarHBondContact CA-OG 3.33Å; A5-S8 PolarHBondContact O-OG 2.81Å; S8-T12 PolarHBondContact O-N 3Å; S8-T12 PolarHBondContact O-OG1 2.77Å
9A75.4Confident77.3Confident50 Ų50100.4 Ų100.441%0.41356%0.558SS.*Hα-helixtrans-66.3-39.8172.500000112.6A5 M6 T12 L13A5-A9 VanDerWaalsContact O-CB 3.28Å; A5-A9 WeakPolarHBondContact O-CB 3.46Å; A5-A9 PolarHBondContact O-N 3.05Å; M6-A9 PolarHBondContact O-N 3.48Å; A9-T12 VanDerWaalsContact CA-OG1 3.25Å; A9-T12 WeakPolarHBondContact CA-OG1 3.36Å; A9-T12 PolarHBondContact O-N 2.93Å; A9-T12 PolarHBondContact O-OG1 2.91Å; A9-L13 WeakPolarHBondContact O-CB 3.25Å; A9-L13 PolarHBondContact O-N 2.72Å
10N78.3Confident78.1Confident102 Ų10298.3 Ų98.355%0.54555%0.554SS.*Hα-helixtrans-67.6-43.7175.3-84.3-15.7000112.1M6 A7 T12 L13 E14M6-N10 PolarHBondContact O-N 3.4Å; A7-N10 PolarHBondContact O-N 2.92Å; N10-T12 VanDerWaalsContact C-N 3.28Å; N10-T12 PolarHBondContact O-N 2.78Å; N10-L13 PolarHBondContact O-N 2.96Å; N10-E14 WeakPolarHBondContact O-CG 3.47Å; N10-E14 PolarHBondContact O-N 2.86Å
11V81.5Confident78.9Confident79 Ų7998.7 Ų98.748%0.47955%0.551SS.*Hα-helixtrans-62.7-35.9176.4171.90000111.5A7 N15A7-V11 VanDerWaalsContact O-CG2 3.27Å; A7-V11 WeakPolarHBondContact O-CG2 3.33Å; A7-V11 PolarHBondContact O-N 3.44Å; V11-N15 WeakPolarHBondContact O-CB 3.25Å; V11-N15 PolarHBondContact O-N 3.18Å; V11-N15 PolarHBondContact O-ND2 2.85Å
12T85.5Confident80.8Confident77 Ų7796.1 Ų96.147%0.47254%0.536SS..Hα-helixtrans-70.5-37.8175.338.30000112.6S8 A9 N10 N15 Q16S8-T12 PolarHBondContact O-N 3Å; S8-T12 PolarHBondContact O-OG1 2.77Å; A9-T12 VanDerWaalsContact CA-OG1 3.25Å; A9-T12 WeakPolarHBondContact CA-OG1 3.36Å; A9-T12 PolarHBondContact O-N 2.93Å; A9-T12 PolarHBondContact O-OG1 2.91Å; N10-T12 VanDerWaalsContact C-N 3.28Å; N10-T12 PolarHBondContact O-N 2.78Å; T12-N15 PolarHBondContact O-N 3.05Å; T12-Q16 VanDerWaalsContact O-CG 3.32Å; T12-Q16 WeakPolarHBondContact O-CG 3.4Å; T12-Q16 PolarHBondContact O-N 3.21Å
13L87.9Confident82.6Confident108 Ų10895.9 Ų95.957%0.56553%0.531SS*.Hα-helixtrans-67.2-41.1175.1-166.470.9000112.2A9 N10 N15 Q16 L17A9-L13 WeakPolarHBondContact O-CB 3.25Å; A9-L13 PolarHBondContact O-N 2.72Å; N10-L13 PolarHBondContact O-N 2.96Å; L13-N15 VanDerWaalsContact C-N 3.35Å; L13-N15 PolarHBondContact O-N 3.21Å; L13-Q16 WeakPolarHBondContact O-CB 3.41Å; L13-Q16 PolarHBondContact O-N 2.76Å; L13-L17 WeakPolarHBondContact O-CB 3.14Å; L13-L17 PolarHBondContact O-N 3.37Å
14E88.4Confident84.3Confident119 Ų11995 Ų9556%0.55653%0.526SS*.Hα-helixtrans-63.4-40.5174.2-74.8-176.8170.600111.9N10 Q16 L17 H18N10-E14 WeakPolarHBondContact O-CG 3.47Å; N10-E14 PolarHBondContact O-N 2.86Å; E14-Q16 VanDerWaalsContact C-N 3.35Å; E14-L17 PolarHBondContact O-N 3.47Å; E14-H18 WeakPolarHBondContact O-CB 3.32Å; E14-H18 PolarHBondContact O-N 2.65Å; E14-H18 PolarHBondContact O-ND1 2.64Å
15N90.4Very high85.8Confident101 Ų10193.6 Ų93.654%0.5452%0.519SS..Hα-helixtrans-65.4-37.2173.8-75.3-33.8000112V11 T12 L13 S19V11-N15 WeakPolarHBondContact O-CB 3.25Å; V11-N15 PolarHBondContact O-N 3.18Å; V11-N15 PolarHBondContact O-ND2 2.85Å; T12-N15 PolarHBondContact O-N 3.05Å; L13-N15 VanDerWaalsContact C-N 3.35Å; L13-N15 PolarHBondContact O-N 3.21Å; N15-S19 WeakPolarHBondContact O-CB 3.22Å; N15-S19 PolarHBondContact O-N 3.4Å
16Q92.6Very high87.4Confident128 Ų12897.4 Ų97.460%0.59853%0.526SS*.Hα-helixtrans-66.4-41.2173.7-75.9176.98.100112T12 L13 E14 S19 A20T12-Q16 VanDerWaalsContact O-CG 3.32Å; T12-Q16 WeakPolarHBondContact O-CG 3.4Å; T12-Q16 PolarHBondContact O-N 3.21Å; L13-Q16 WeakPolarHBondContact O-CB 3.41Å; L13-Q16 PolarHBondContact O-N 2.76Å; E14-Q16 VanDerWaalsContact C-N 3.35Å; Q16-S19 PolarHBondContact O-N 2.88Å; Q16-A20 VanDerWaalsContact O-CB 3.28Å; Q16-A20 WeakPolarHBondContact O-CB 3.46Å; Q16-A20 PolarHBondContact O-N 3.37Å
17L91.6Very high88.9Confident101 Ų10195.6 Ų95.653%0.52952%0.518SS..Hα-helixtrans-63.3-48.1175.3-170.6104.5000111.1L13 E14 S19 A20 Q21L13-L17 WeakPolarHBondContact O-CB 3.14Å; L13-L17 PolarHBondContact O-N 3.37Å; E14-L17 PolarHBondContact O-N 3.47Å; L17-S19 VanDerWaalsContact C-N 3.31Å; L17-S19 PolarHBondContact O-N 3.3Å; L17-A20 PolarHBondContact O-N 2.76Å; L17-Q21 WeakPolarHBondContact O-CB 3.2Å; L17-Q21 VanDerWaalsContact O-CG 3.28Å; L17-Q21 WeakPolarHBondContact O-CG 3.21Å; L17-Q21 PolarHBondContact O-N 3.43Å
18H92.9Very high90.1Very high107 Ų10798.5 Ų98.550%0.49552%0.522SS..Hα-helixtrans-63-37.4176.5-79.484.8000112.1E14 K22E14-H18 WeakPolarHBondContact O-CB 3.32Å; E14-H18 PolarHBondContact O-N 2.65Å; E14-H18 PolarHBondContact O-ND1 2.64Å; H18-K22 PolarHBondContact O-N 2.82Å
19S94.3Very high91.4Very high60 Ų60100.6 Ų100.642%0.4252%0.524SS..Hα-helixtrans-66.8-45.7174.9-176.40000111.7N15 Q16 L17 Q21 K22 N23N15-S19 WeakPolarHBondContact O-CB 3.22Å; N15-S19 PolarHBondContact O-N 3.4Å; Q16-S19 PolarHBondContact O-N 2.88Å; L17-S19 VanDerWaalsContact C-N 3.31Å; L17-S19 PolarHBondContact O-N 3.3Å; S19-Q21 PolarHBondContact O-N 3.32Å; S19-K22 PolarHBondContact O-N 3.46Å; S19-N23 WeakPolarHBondContact O-CB 3.48Å; S19-N23 VanDerWaalsContact O-CG 3.26Å; S19-N23 PolarHBondContact O-N 2.88Å; S19-N23 PolarHBondContact O-ND2 3.31Å
20A94.1Very high92.4Very high58 Ų58101.7 Ų101.748%0.47952%0.523SS..Hα-helixtrans-62.4-40.7176.200000112Q16 L17 N23 L24Q16-A20 VanDerWaalsContact O-CB 3.28Å; Q16-A20 WeakPolarHBondContact O-CB 3.46Å; Q16-A20 PolarHBondContact O-N 3.37Å; L17-A20 PolarHBondContact O-N 2.76Å; A20-N23 PolarHBondContact O-N 2.88Å; A20-L24 WeakPolarHBondContact O-CB 2.88Å; A20-L24 PolarHBondContact O-N 2.85Å
21Q94.4Very high93.3Very high106 Ų106101.7 Ų101.750%0.49552%0.519SS..Hα-helixtrans-63.3-43.5174.4-75.4174.1-8.700112.1L17 S19 L24 L25L17-Q21 WeakPolarHBondContact O-CB 3.2Å; L17-Q21 VanDerWaalsContact O-CG 3.28Å; L17-Q21 WeakPolarHBondContact O-CG 3.21Å; L17-Q21 PolarHBondContact O-N 3.43Å; S19-Q21 PolarHBondContact O-N 3.32Å; Q21-L24 PolarHBondContact O-N 2.99Å; Q21-L25 WeakPolarHBondContact O-CB 3.44Å; Q21-L25 PolarHBondContact O-N 3.42Å
22K95.8Very high94.1Very high164 Ų16499.8 Ų99.871%0.71351%0.512SS*.Hα-helixtrans-63.3-42.5173.9-85.8-176.7170.3175.10112.4H18 S19 L24 L25 F26H18-K22 PolarHBondContact O-N 2.82Å; S19-K22 PolarHBondContact O-N 3.46Å; K22-L24 VanDerWaalsContact C-N 3.34Å; K22-L25 PolarHBondContact O-N 2.86Å; K22-F26 WeakPolarHBondContact O-CB 3.49Å; K22-F26 PolarHBondContact O-N 3.41Å
23N96Very high94.6Very high100 Ų10099.9 Ų99.954%0.53551%0.51SS..Hα-helixtrans-64-40.7177-72-20.6000111.6S19 A20 F26 L27S19-N23 WeakPolarHBondContact O-CB 3.48Å; S19-N23 VanDerWaalsContact O-CG 3.26Å; S19-N23 PolarHBondContact O-N 2.88Å; S19-N23 PolarHBondContact O-ND2 3.31Å; A20-N23 PolarHBondContact O-N 2.88Å; N23-F26 PolarHBondContact O-N 2.83Å; N23-L27 WeakPolarHBondContact O-CB 3.39Å; N23-L27 PolarHBondContact O-N 2.98Å
24L96Very high95.1Very high100 Ų10098.2 Ų98.252%0.52450%0.504SS..Hα-helixtrans-62-46.4175.2179.162.8000111.1A20 Q21 K22 L27 Q28A20-L24 WeakPolarHBondContact O-CB 2.88Å; A20-L24 PolarHBondContact O-N 2.85Å; Q21-L24 PolarHBondContact O-N 2.99Å; K22-L24 VanDerWaalsContact C-N 3.34Å; L24-L27 PolarHBondContact O-N 3.49Å; L24-Q28 HydrophobicContact CD1-CG 4.4Å; L24-Q28 WeakPolarHBondContact O-CB 3.28Å; L24-Q28 VanDerWaalsContact O-CG 3.24Å; L24-Q28 WeakPolarHBondContact O-CG 3.34Å; L24-Q28 PolarHBondContact O-N 3.02Å
25L96.5Very high95.5Very high105 Ų10597.2 Ų97.255%0.5550%0.502SS..Hα-helixtrans-66.3-39.1179-168141.9000111.7Q21 K22 Q28 Q29Q21-L25 WeakPolarHBondContact O-CB 3.44Å; Q21-L25 PolarHBondContact O-N 3.42Å; K22-L25 PolarHBondContact O-N 2.86Å; L25-Q28 PolarHBondContact O-N 3.41Å; L25-Q29 WeakPolarHBondContact O-CB 3.08Å; L25-Q29 PolarHBondContact O-N 3.37Å
26F96.9Very high95.9Very high135 Ų13598.9 Ų98.959%0.59251%0.505SS*.Hα-helixtrans-59.4-48.1172.3177.3-95.8000111.1K22 N23 Q28 Q29 D30K22-F26 WeakPolarHBondContact O-CB 3.49Å; K22-F26 PolarHBondContact O-N 3.41Å; N23-F26 PolarHBondContact O-N 2.83Å; F26-Q28 PolarHBondContact O-N 2.88Å; F26-Q29 PolarHBondContact O-N 2.9Å; F26-D30 WeakPolarHBondContact O-CB 3.47Å; F26-D30 PolarHBondContact O-N 3.34Å
27L97.1Very high96.2Very high82 Ų8294.8 Ų94.843%0.42950%0.497SS..Hα-helixtrans-65.9-39.2180-166.666.9000111.9N23 L24 Q29 D30 H31N23-L27 WeakPolarHBondContact O-CB 3.39Å; N23-L27 PolarHBondContact O-N 2.98Å; L24-L27 PolarHBondContact O-N 3.49Å; L27-Q29 VanDerWaalsContact C-N 3.35Å; L27-D30 PolarHBondContact O-N 3.29Å; L27-H31 WeakPolarHBondContact O-CB 3.34Å; L27-H31 PolarHBondContact O-CD2 2.94Å; L27-H31 VanDerWaalsContact O-CD2 3.31Å; L27-H31 PolarHBondContact O-N 3.49Å
28Q96.6Very high96.5Very high115 Ų11594.6 Ų94.654%0.53750%0.496SS..Hα-helixtrans-61.9-42.8173.3-75.2173.5-14.800111.8L24 L25 F26 A32L24-Q28 HydrophobicContact CD1-CG 4.4Å; L24-Q28 WeakPolarHBondContact O-CB 3.28Å; L24-Q28 VanDerWaalsContact O-CG 3.24Å; L24-Q28 WeakPolarHBondContact O-CG 3.34Å; L24-Q28 PolarHBondContact O-N 3.02Å; L25-Q28 PolarHBondContact O-N 3.41Å; F26-Q28 PolarHBondContact O-N 2.88Å; Q28-A32 WeakPolarHBondContact O-CB 3.42Å; Q28-A32 PolarHBondContact O-N 3.43Å
29Q96.9Very high96.7Very high116 Ų11694.3 Ų94.354%0.54249%0.494SS..Hα-helixtrans-66.9-42.2176.4-176.9128.7-300111.6L25 F26 L27 A32 N33L25-Q29 WeakPolarHBondContact O-CB 3.08Å; L25-Q29 PolarHBondContact O-N 3.37Å; F26-Q29 PolarHBondContact O-N 2.9Å; L27-Q29 VanDerWaalsContact C-N 3.35Å; Q29-A32 PolarHBondContact O-N 3.49Å; Q29-N33 PolarHBondContact O-N 3.14Å; Q29-N33 PolarHBondContact O-ND2 3.28Å
30D96.9Very high96.9Very high72 Ų7293.8 Ų93.839%0.38549%0.494SS..Hα-helixtrans-63.1-48.4177.5-165.857.5000111.1F26 L27 A32 N33 T34F26-D30 WeakPolarHBondContact O-CB 3.47Å; F26-D30 PolarHBondContact O-N 3.34Å; L27-D30 PolarHBondContact O-N 3.29Å; D30-A32 VanDerWaalsContact C-N 3.31Å; D30-A32 PolarHBondContact O-N 2.94Å; D30-N33 CarbonylContact O-C 3.57Å; D30-N33 WeakPolarHBondContact O-CA 3.47Å; D30-N33 WeakPolarHBondContact O-CB 3.29Å; D30-N33 PolarHBondContact O-N 3.37Å; D30-T34 PolarHBondContact O-N 3.44Å; D30-T34 PolarHBondContact O-OG1 3.11Å; D30-T34 VanDerWaalsContact O-OG1 3.09Å
31H97.1Very high97.1Very high102 Ų10295.1 Ų95.147%0.47249%0.49SS..Hα-helixtrans-57.7-42.3173.8-70.6-176.1000112.4L27 N33 T34 L35L27-H31 WeakPolarHBondContact O-CB 3.34Å; L27-H31 PolarHBondContact O-CD2 2.94Å; L27-H31 VanDerWaalsContact O-CD2 3.31Å; L27-H31 PolarHBondContact O-N 3.49Å; H31-N33 VanDerWaalsContact C-N 3.29Å; H31-N33 PolarHBondContact O-N 2.85Å; H31-T34 PolarHBondContact O-N 3.01Å; H31-L35 WeakPolarHBondContact O-CB 3.43Å; H31-L35 WeakPolarHBondContact O-CG 3.49Å; H31-L35 PolarHBondContact O-N 3.33Å
32A97.6Very high97.3Very high40 Ų4094 Ų9433%0.33149%0.487SS..Hα-helixtrans-63.7-3617600000111.9Q28 Q29 D30 K36Q28-A32 WeakPolarHBondContact O-CB 3.42Å; Q28-A32 PolarHBondContact O-N 3.43Å; Q29-A32 PolarHBondContact O-N 3.49Å; D30-A32 VanDerWaalsContact C-N 3.31Å; D30-A32 PolarHBondContact O-N 2.94Å; A32-K36 WeakPolarHBondContact O-CD 3.33Å; A32-K36 VanDerWaalsContact O-CG 3.22Å; A32-K36 WeakPolarHBondContact O-CG 3.42Å; A32-K36 PolarHBondContact O-N 3.34Å; A32-K36 VanDerWaalsContact O-N 3.11Å
33N97.4Very high97.4Very high78 Ų7893.5 Ų93.542%0.41748%0.48SS..Hα-helixtrans-70-43.7175.1-67.6-25.2000111.7Q29 D30 H31 L35 K36 G37Q29-N33 PolarHBondContact O-N 3.14Å; Q29-N33 PolarHBondContact O-ND2 3.28Å; D30-N33 CarbonylContact O-C 3.57Å; D30-N33 WeakPolarHBondContact O-CA 3.47Å; D30-N33 WeakPolarHBondContact O-CB 3.29Å; D30-N33 PolarHBondContact O-N 3.37Å; H31-N33 VanDerWaalsContact C-N 3.29Å; H31-N33 PolarHBondContact O-N 2.85Å; N33-L35 PolarHBondContact O-N 3.32Å; N33-K36 PolarHBondContact O-N 3.44Å; N33-G37 PolarHBondContact O-N 2.97Å
34T97.6Very high97.5Very high74 Ų7494.3 Ų94.345%0.45448%0.476SS..Hα-helixtrans-59.4-46.7175.1-50.60000111.3D30 H31 K36 G37 L38D30-T34 PolarHBondContact O-N 3.44Å; D30-T34 PolarHBondContact O-OG1 3.11Å; D30-T34 VanDerWaalsContact O-OG1 3.09Å; H31-T34 PolarHBondContact O-N 3.01Å; T34-K36 VanDerWaalsContact C-N 3.35Å; T34-K36 PolarHBondContact O-N 2.86Å; T34-G37 PolarHBondContact O-N 2.94Å; T34-G37 VanDerWaalsContact O-N 3.14Å; T34-L38 HydrophobicContact CG2-CD1 4.29Å; T34-L38 WeakPolarHBondContact O-CG 3.47Å; T34-L38 PolarHBondContact O-N 2.81Å
35L97.9Very high97.6Very high97 Ų9793.4 Ų93.451%0.50847%0.471SS..Hα-helixtrans-61.6-40.7177.4-76.2171.2000112.4H31 N33 G37 L38 H39H31-L35 WeakPolarHBondContact O-CB 3.43Å; H31-L35 WeakPolarHBondContact O-CG 3.49Å; H31-L35 PolarHBondContact O-N 3.33Å; N33-L35 PolarHBondContact O-N 3.32Å; L35-G37 VanDerWaalsContact C-N 3.33Å; L35-G37 PolarHBondContact O-N 3.09Å; L35-L38 PolarHBondContact O-N 3.21Å; L35-H39 WeakPolarHBondContact O-CB 3.4Å; L35-H39 VanDerWaalsContact O-CG 3.3Å; L35-H39 PolarHBondContact O-N 3.25Å; L35-H39 PolarHBondContact O-ND1 3.34Å
36K98Very high97.7Very high137 Ų13793.7 Ų93.760%0.59647%0.47SS*.Hα-helixtrans-60.5-43173.6-75168.8-174173.40111.5A32 N33 T34 H39 A40A32-K36 WeakPolarHBondContact O-CD 3.33Å; A32-K36 VanDerWaalsContact O-CG 3.22Å; A32-K36 WeakPolarHBondContact O-CG 3.42Å; A32-K36 PolarHBondContact O-N 3.34Å; A32-K36 VanDerWaalsContact O-N 3.11Å; N33-K36 PolarHBondContact O-N 3.44Å; T34-K36 VanDerWaalsContact C-N 3.35Å; T34-K36 PolarHBondContact O-N 2.86Å; K36-H39 PolarHBondContact O-N 3.45Å; K36-A40 PolarHBondContact O-N 3.45Å
37G98Very high97.8Very high42 Ų4292.4 Ų92.443%0.43347%0.466SS..Hα-helixtrans-61.9-47.5175.900000112.6N33 T34 L35 H39 A40 E41N33-G37 PolarHBondContact O-N 2.97Å; T34-G37 PolarHBondContact O-N 2.94Å; T34-G37 VanDerWaalsContact O-N 3.14Å; L35-G37 VanDerWaalsContact C-N 3.33Å; L35-G37 PolarHBondContact O-N 3.09Å; G37-H39 PolarHBondContact O-N 3.36Å; G37-A40 WeakPolarHBondContact O-CB 3.46Å; G37-A40 PolarHBondContact O-N 2.86Å; G37-A40 VanDerWaalsContact O-N 3.16Å; G37-E41 PolarHBondContact O-N 2.98Å
38L98.3Very high97.8Very high97 Ų9793.5 Ų93.551%0.50847%0.469SS..Hα-helixtrans-61.5-43.9177-69.5174.8000112.1T34 L35 A40 E41 I42T34-L38 HydrophobicContact CG2-CD1 4.29Å; T34-L38 WeakPolarHBondContact O-CG 3.47Å; T34-L38 PolarHBondContact O-N 2.81Å; L35-L38 PolarHBondContact O-N 3.21Å; L38-A40 VanDerWaalsContact C-N 3.29Å; L38-A40 PolarHBondContact O-N 3.18Å; L38-E41 PolarHBondContact O-N 2.91Å; L38-I42 VanDerWaalsContact O-CG1 3.29Å; L38-I42 WeakPolarHBondContact O-CG1 3.44Å; L38-I42 PolarHBondContact O-N 3.47Å
39H98.2Very high97.9Very high100 Ų10091.7 Ų91.746%0.46347%0.468SS..Hα-helixtrans-64-33.8175.5-69.9153.8000112.8L35 K36 G37 R43L35-H39 WeakPolarHBondContact O-CB 3.4Å; L35-H39 VanDerWaalsContact O-CG 3.3Å; L35-H39 PolarHBondContact O-N 3.25Å; L35-H39 PolarHBondContact O-ND1 3.34Å; K36-H39 PolarHBondContact O-N 3.45Å; G37-H39 PolarHBondContact O-N 3.36Å; H39-R43 WeakPolarHBondContact O-CB 3.4Å; H39-R43 WeakPolarHBondContact O-CG 3.45Å; H39-R43 PolarHBondContact O-N 2.87Å; H39-R43 VanDerWaalsContact O-N 3.09Å; H39-R43 PolarHBondContact O-NE 3.44Å
40A98.2Very high97.9Very high50 Ų5090.1 Ų90.141%0.41347%0.466SS..Hα-helixtrans-65.6-42.7173.300000111.3K36 G37 L38 R43 R44K36-A40 PolarHBondContact O-N 3.45Å; G37-A40 WeakPolarHBondContact O-CB 3.46Å; G37-A40 PolarHBondContact O-N 2.86Å; G37-A40 VanDerWaalsContact O-N 3.16Å; L38-A40 VanDerWaalsContact C-N 3.29Å; L38-A40 PolarHBondContact O-N 3.18Å; A40-R43 PolarHBondContact O-N 2.87Å; A40-R44 WeakPolarHBondContact O-CB 3.49Å; A40-R44 PolarHBondContact O-N 3.2Å
41E98.2Very high97.9Very high85 Ų8590.7 Ų90.740%0.39747%0.469SS..Hα-helixtrans-69.1-40.3179-172.257.7-159.700112.6G37 L38 R43 R44 L45G37-E41 PolarHBondContact O-N 2.98Å; L38-E41 PolarHBondContact O-N 2.91Å; E41-R43 VanDerWaalsContact C-N 3.32Å; E41-R43 PolarHBondContact O-N 3.32Å; E41-R44 WeakPolarHBondContact O-CB 3.22Å; E41-R44 PolarHBondContact O-N 3.4Å; E41-R44 IonicContact OE1-CZ 3.77Å; E41-R44 VanDerWaalsContact OE1-CZ 3.25Å; E41-R44 IonicContact OE1-NE 3.94Å; E41-R44 PolarHBondContact OE1-NE 3.16Å; E41-R44 IonicContact OE1-NH2 3.9Å; E41-R44 PolarHBondContact OE1-NH2 2.93Å; E41-R44 IonicContact OE2-CZ 2.65Å; E41-R44 IonicContact OE2-NE 3.76Å; E41-R44 PolarHBondContact OE2-NE 3.02Å; E41-L45 HydrophobicContact CG-CD1 4.34Å; E41-L45 PolarHBondContact O-N 3.37Å
42I98.2Very high97.8Very high83 Ų8390.3 Ų90.343%0.42647%0.47SS..Hα-helixtrans-58.4-46.9172.7-70.4165.5000109.9L38 R44 L45 Q46L38-I42 VanDerWaalsContact O-CG1 3.29Å; L38-I42 WeakPolarHBondContact O-CG1 3.44Å; L38-I42 PolarHBondContact O-N 3.47Å; I42-R44 VanDerWaalsContact C-N 3.33Å; I42-R44 PolarHBondContact O-N 3.49Å; I42-L45 PolarHBondContact O-N 2.95Å; I42-Q46 HydrophobicContact CG2-CG 4.28Å; I42-Q46 WeakPolarHBondContact O-CB 3.48Å; I42-Q46 WeakPolarHBondContact O-CG 3.42Å; I42-Q46 PolarHBondContact O-N 2.85Å
43R98.3Very high97.7Very high153 Ų15392.4 Ų92.458%0.57748%0.479SS*.Hα-helixtrans-62.2-40.4176.4-77.8-175.1-72.1-107.4-0.4112.2H39 A40 E41 Q46 Q47H39-R43 WeakPolarHBondContact O-CB 3.4Å; H39-R43 WeakPolarHBondContact O-CG 3.45Å; H39-R43 PolarHBondContact O-N 2.87Å; H39-R43 VanDerWaalsContact O-N 3.09Å; H39-R43 PolarHBondContact O-NE 3.44Å; A40-R43 PolarHBondContact O-N 2.87Å; E41-R43 VanDerWaalsContact C-N 3.32Å; E41-R43 PolarHBondContact O-N 3.32Å; R43-Q46 PolarHBondContact O-N 3.18Å; R43-Q47 WeakPolarHBondContact O-CB 3.46Å; R43-Q47 PolarHBondContact O-N 3.33Å
44R98.4Very high97.5Very high117 Ų11796.5 Ų96.544%0.44249%0.49SS..Hα-helixtrans-62.1-46.7176.9-166.5-164.769.569.21.3111.6A40 E41 I42 Q47 Q48A40-R44 WeakPolarHBondContact O-CB 3.49Å; A40-R44 PolarHBondContact O-N 3.2Å; E41-R44 WeakPolarHBondContact O-CB 3.22Å; E41-R44 PolarHBondContact O-N 3.4Å; E41-R44 IonicContact OE1-CZ 3.77Å; E41-R44 VanDerWaalsContact OE1-CZ 3.25Å; E41-R44 IonicContact OE1-NE 3.94Å; E41-R44 PolarHBondContact OE1-NE 3.16Å; E41-R44 IonicContact OE1-NH2 3.9Å; E41-R44 PolarHBondContact OE1-NH2 2.93Å; E41-R44 IonicContact OE2-CZ 2.65Å; E41-R44 IonicContact OE2-NE 3.76Å; E41-R44 PolarHBondContact OE2-NE 3.02Å; I42-R44 VanDerWaalsContact C-N 3.33Å; I42-R44 PolarHBondContact O-N 3.49Å; R44-Q47 PolarHBondContact O-N 3.3Å; R44-Q48 WeakPolarHBondContact O-CB 3.36Å; R44-Q48 PolarHBondContact O-N 3.07Å
45L98.4Very high97.2Very high81 Ų8197.4 Ų97.442%0.42449%0.489SS..Hα-helixtrans-65.8-42.3177-77167.6000111.9E41 I42 Q47 Q48 C49E41-L45 HydrophobicContact CG-CD1 4.34Å; E41-L45 PolarHBondContact O-N 3.37Å; I42-L45 PolarHBondContact O-N 2.95Å; L45-Q47 VanDerWaalsContact C-N 3.32Å; L45-Q47 PolarHBondContact O-N 2.79Å; L45-Q48 PolarHBondContact O-N 2.78Å; L45-C49 WeakPolarHBondContact O-CB 3.33Å; L45-C49 PolarHBondContact O-N 2.72Å; L45-C49 PolarHBondContact O-SG 3.01Å; L45-C49 VanDerWaalsContact O-SG 3.34Å
46Q98.1Very high96.7Very high111 Ų11198 Ų9852%0.51949%0.492SS..Hα-helixtrans-59.3-44.2175.1-76.2171.3-25.500111.4I42 R43 C49 T50I42-Q46 HydrophobicContact CG2-CG 4.28Å; I42-Q46 WeakPolarHBondContact O-CB 3.48Å; I42-Q46 WeakPolarHBondContact O-CG 3.42Å; I42-Q46 PolarHBondContact O-N 2.85Å; R43-Q46 PolarHBondContact O-N 3.18Å; Q46-C49 PolarHBondContact O-N 3.49Å; Q46-T50 WeakPolarHBondContact O-CB 3.45Å; Q46-T50 PolarHBondContact O-N 3.44Å; Q46-T50 PolarHBondContact O-OG1 2.98Å
47Q97.8Very high96.1Very high108 Ų10895.1 Ų95.151%0.50549%0.486SS..Hα-helixtrans-61.1-48.4174.3-172.762.654.600110.8R43 R44 L45 C49 T50 D51R43-Q47 WeakPolarHBondContact O-CB 3.46Å; R43-Q47 PolarHBondContact O-N 3.33Å; R44-Q47 PolarHBondContact O-N 3.3Å; L45-Q47 VanDerWaalsContact C-N 3.32Å; L45-Q47 PolarHBondContact O-N 2.79Å; Q47-C49 VanDerWaalsContact C-N 3.34Å; Q47-C49 PolarHBondContact O-N 2.69Å; Q47-T50 CarbonylContact O-C 3.59Å; Q47-T50 WeakPolarHBondContact O-CA 3.47Å; Q47-T50 WeakPolarHBondContact O-CB 3.19Å; Q47-T50 PolarHBondContact O-N 2.94Å; Q47-D51 PolarHBondContact NE2-OD1 2.77Å; Q47-D51 PolarHBondContact O-N 3.46Å
48Q97.9Very high95.4Very high105 Ų10595.4 Ų95.449%0.49148%0.479SS..Hα-helixtrans-60.9-40.6179.3-172.4179.4-1600112.7R44 L45 T50 D51 L52R44-Q48 WeakPolarHBondContact O-CB 3.36Å; R44-Q48 PolarHBondContact O-N 3.07Å; L45-Q48 PolarHBondContact O-N 2.78Å; Q48-T50 VanDerWaalsContact C-N 3.33Å; Q48-D51 PolarHBondContact O-N 3.5Å; Q48-L52 WeakPolarHBondContact O-CB 3.49Å; Q48-L52 PolarHBondContact O-N 2.86Å
49C97.9Very high94.5Very high77 Ų7799.2 Ų99.252%0.5249%0.487SS..Hα-helixtrans-65.1-38.6173.9-71.70000111.5L45 Q46 Q47 T53L45-C49 WeakPolarHBondContact O-CB 3.33Å; L45-C49 PolarHBondContact O-N 2.72Å; L45-C49 PolarHBondContact O-SG 3.01Å; L45-C49 VanDerWaalsContact O-SG 3.34Å; Q46-C49 PolarHBondContact O-N 3.49Å; Q47-C49 VanDerWaalsContact C-N 3.34Å; Q47-C49 PolarHBondContact O-N 2.69Å; C49-T53 VanDerWaalsContact O-CB 3.25Å; C49-T53 WeakPolarHBondContact O-CB 3.34Å; C49-T53 PolarHBondContact O-N 2.89Å; C49-T53 PolarHBondContact O-OG1 3.5Å
50T97.3Very high93Very high84 Ų8499.1 Ų99.152%0.51550%0.497SS..Hα-helixtrans-66.3-44.9176.8-540000110.8Q46 Q47 Q48 T53 Y54Q46-T50 WeakPolarHBondContact O-CB 3.45Å; Q46-T50 PolarHBondContact O-N 3.44Å; Q46-T50 PolarHBondContact O-OG1 2.98Å; Q47-T50 CarbonylContact O-C 3.59Å; Q47-T50 WeakPolarHBondContact O-CA 3.47Å; Q47-T50 WeakPolarHBondContact O-CB 3.19Å; Q47-T50 PolarHBondContact O-N 2.94Å; Q48-T50 VanDerWaalsContact C-N 3.33Å; T50-T53 PolarHBondContact O-N 3.42Å; T50-Y54 WeakPolarHBondContact O-CB 3.22Å; T50-Y54 PolarHBondContact O-N 3.38Å
51D96.4Very high91.5Very high83 Ų83100.4 Ų100.444%0.44450%0.503SS..Hα-helixtrans-63.8-44.1178.1-64.7-18.2000111.3Q47 Q48 Y54 E55Q47-D51 PolarHBondContact NE2-OD1 2.77Å; Q47-D51 PolarHBondContact O-N 3.46Å; Q48-D51 PolarHBondContact O-N 3.5Å; D51-Y54 CarbonylContact O-C 3.4Å; D51-Y54 WeakPolarHBondContact O-CB 3.01Å; D51-Y54 PolarHBondContact O-N 2.91Å; D51-E55 WeakPolarHBondContact O-CB 3.28Å; D51-E55 PolarHBondContact O-N 3.42Å
52L96.3Very high89.7Confident95 Ų95101 Ų10150%0.49751%0.509SS..Hα-helixtrans-67.2-39.1177-174.565.9000111.8Q48 Y54 E55 L56Q48-L52 WeakPolarHBondContact O-CB 3.49Å; Q48-L52 PolarHBondContact O-N 2.86Å; L52-Y54 VanDerWaalsContact C-N 3.32Å; L52-E55 PolarHBondContact O-N 3.35Å; L52-L56 HydrophobicContact CG-CD1 4.38Å; L52-L56 WeakPolarHBondContact O-CB 3.25Å; L52-L56 WeakPolarHBondContact O-CG 3.39Å; L52-L56 PolarHBondContact O-N 3.22Å
53T94.5Very high87.9Confident83 Ų83100.5 Ų100.551%0.50951%0.512SS..Hα-helixtrans-64.6-40.7174.7-58.10000110.4C49 T50 T57C49-T53 VanDerWaalsContact O-CB 3.25Å; C49-T53 WeakPolarHBondContact O-CB 3.34Å; C49-T53 PolarHBondContact O-N 2.89Å; C49-T53 PolarHBondContact O-OG1 3.5Å; T50-T53 PolarHBondContact O-N 3.42Å; T53-T57 VanDerWaalsContact O-CB 3.25Å; T53-T57 WeakPolarHBondContact O-CB 3.4Å; T53-T57 PolarHBondContact O-N 2.93Å; T53-T57 PolarHBondContact O-OG1 3.03Å
54Y94.2Very high86.1Confident164 Ų16496.1 Ų96.164%0.64351%0.505SS*.Hα-helixtrans-63.4-45.5173.2-180-98.2000110.9T50 D51 L52 L56 T57 V58T50-Y54 WeakPolarHBondContact O-CB 3.22Å; T50-Y54 PolarHBondContact O-N 3.38Å; D51-Y54 CarbonylContact O-C 3.4Å; D51-Y54 WeakPolarHBondContact O-CB 3.01Å; D51-Y54 PolarHBondContact O-N 2.91Å; L52-Y54 VanDerWaalsContact C-N 3.32Å; Y54-L56 PolarHBondContact O-N 3.21Å; Y54-T57 PolarHBondContact O-N 3.37Å; Y54-V58 HydrophobicContact CD1-CG2 4Å; Y54-V58 HydrophobicContact CD2-CG2 3.92Å; Y54-V58 HydrophobicContact CE1-CG2 3.66Å; Y54-V58 HydrophobicContact CE2-CG2 3.57Å; Y54-V58 HydrophobicContact CG-CG2 4.12Å; Y54-V58 VanDerWaalsContact CZ-CG2 3.43Å; Y54-V58 WeakPolarHBondContact O-CB 2.99Å; Y54-V58 WeakPolarHBondContact O-CG2 3.49Å; Y54-V58 PolarHBondContact O-N 3.01Å
55E90.1Very high84.2Confident93 Ų9394.9 Ų94.944%0.43551%0.506SS..Hα-helixtrans-60.6-46.5177-169.5-170.9151.900111.5D51 L52 R59D51-E55 WeakPolarHBondContact O-CB 3.28Å; D51-E55 PolarHBondContact O-N 3.42Å; L52-E55 PolarHBondContact O-N 3.35Å; E55-R59 HydrophobicContact CG-CG 4.21Å; E55-R59 WeakPolarHBondContact O-CB 3.32Å; E55-R59 WeakPolarHBondContact O-CG 3.5Å; E55-R59 PolarHBondContact O-N 3.05Å; E55-R59 IonicContact OE1-NH1 2.66Å; E55-R59 PolarHBondContact OE1-NH1 3.04Å
56L88.8Confident82.8Confident111 Ų11195 Ų9558%0.58151%0.514SS*.Hα-helixtrans-64.9-45.2177.9-72.5173.3000111.8L52 Y54 S60L52-L56 HydrophobicContact CG-CD1 4.38Å; L52-L56 WeakPolarHBondContact O-CB 3.25Å; L52-L56 WeakPolarHBondContact O-CG 3.39Å; L52-L56 PolarHBondContact O-N 3.22Å; Y54-L56 PolarHBondContact O-N 3.21Å; L56-S60 WeakPolarHBondContact O-CB 3.38Å; L56-S60 PolarHBondContact O-N 3.4Å; L56-S60 PolarHBondContact O-OG 3.26Å
57T85.8Confident82Confident76 Ų7693 Ų9347%0.46651%0.513SS..Hα-helixtrans-62.6-51.5178.6-54.60000109.4T53 Y54 S60 S61T53-T57 VanDerWaalsContact O-CB 3.25Å; T53-T57 WeakPolarHBondContact O-CB 3.4Å; T53-T57 PolarHBondContact O-N 2.93Å; T53-T57 PolarHBondContact O-OG1 3.03Å; Y54-T57 PolarHBondContact O-N 3.37Å; T57-S60 WeakPolarHBondContact CA-OG 3.27Å; T57-S60 CarbonylContact O-C 3.6Å; T57-S60 PolarHBondContact O-N 2.82Å; T57-S60 PolarHBondContact O-OG 3.38Å; T57-S61 WeakPolarHBondContact O-CB 3.46Å; T57-S61 PolarHBondContact O-N 2.86Å; T57-S61 PolarHBondContact O-OG 2.79Å
58V83.2Confident81.4Confident48 Ų4892.8 Ų92.829%0.29151%0.512SS..Hα-helixtrans-57.9-53.9177.1172.90000110.4Y54 S60 S61 D62Y54-V58 HydrophobicContact CD1-CG2 4Å; Y54-V58 HydrophobicContact CD2-CG2 3.92Å; Y54-V58 HydrophobicContact CE1-CG2 3.66Å; Y54-V58 HydrophobicContact CE2-CG2 3.57Å; Y54-V58 HydrophobicContact CG-CG2 4.12Å; Y54-V58 VanDerWaalsContact CZ-CG2 3.43Å; Y54-V58 WeakPolarHBondContact O-CB 2.99Å; Y54-V58 WeakPolarHBondContact O-CG2 3.49Å; Y54-V58 PolarHBondContact O-N 3.01Å; V58-S60 PolarHBondContact O-N 2.86Å; V58-S61 WeakPolarHBondContact CA-OG 3.28Å; V58-S61 CarbonylContact O-C 3.58Å; V58-S61 PolarHBondContact O-N 2.88Å; V58-S61 PolarHBondContact O-OG 3.23Å; V58-D62 WeakPolarHBondContact O-CA 3.15Å; V58-D62 WeakPolarHBondContact O-CB 3.42Å; V58-D62 PolarHBondContact O-N 2.66Å
59R78.1Confident80.9Confident176 Ų17693.2 Ų93.266%0.66451%0.513SS*.Hα-helixtrans-64.1-24.4179.7-67.9-176.188.8174.55.4114.2E55E55-R59 HydrophobicContact CG-CG 4.21Å; E55-R59 WeakPolarHBondContact O-CB 3.32Å; E55-R59 WeakPolarHBondContact O-CG 3.5Å; E55-R59 PolarHBondContact O-N 3.05Å; E55-R59 IonicContact OE1-NH1 2.66Å; E55-R59 PolarHBondContact OE1-NH1 3.04Å
60S66.5Low80.6Confident98 Ų9897.9 Ų97.969%0.68552%0.52SS*.Hα-helixtrans-83.8-28.117371.20000113.3L56 T57 V58L56-S60 WeakPolarHBondContact O-CB 3.38Å; L56-S60 PolarHBondContact O-N 3.4Å; L56-S60 PolarHBondContact O-OG 3.26Å; T57-S60 WeakPolarHBondContact CA-OG 3.27Å; T57-S60 CarbonylContact O-C 3.6Å; T57-S60 PolarHBondContact O-N 2.82Å; T57-S60 PolarHBondContact O-OG 3.38Å; V58-S60 PolarHBondContact O-N 2.86Å
61S67.7Low80.3Confident77 Ų7797.5 Ų97.554%0.53852%0.52SS..Hα-helixtrans-95.2-9.5177.767.10000113.4T57 V58 P63T57-S61 WeakPolarHBondContact O-CB 3.46Å; T57-S61 PolarHBondContact O-N 2.86Å; T57-S61 PolarHBondContact O-OG 2.79Å; V58-S61 WeakPolarHBondContact CA-OG 3.28Å; V58-S61 CarbonylContact O-C 3.58Å; V58-S61 PolarHBondContact O-N 2.88Å; V58-S61 PolarHBondContact O-OG 3.23Å; S61-P63 VanDerWaalsContact C-CD 3.43Å; S61-P63 WeakPolarHBondContact O-CD 3.34Å
62D59.8Low80.1Confident97 Ų97100.8 Ų100.852%0.51953%0.526SS..SBendtrans-84.893.9168.4-161.414.3000103.1V58 S64V58-D62 WeakPolarHBondContact O-CA 3.15Å; V58-D62 WeakPolarHBondContact O-CB 3.42Å; V58-D62 PolarHBondContact O-N 2.66Å; D62-S64 PolarHBondContact O-N 3.03Å
63P59.5Low80.1Confident74 Ų74100.8 Ų100.848%0.48152%0.524SS..  trans-63.185.4161.731.3-34.6000103.6S61 D65S61-P63 VanDerWaalsContact C-CD 3.43Å; S61-P63 WeakPolarHBondContact O-CD 3.34Å; P63-D65 PolarHBondContact O-N 3.01Å
64S61.2Low80.2Confident61 Ų61101.2 Ų101.243%0.42752%0.522SS..  trans-63.581.7156.6-171.50000103.4D62 S66 S67 E68D62-S64 PolarHBondContact O-N 3.03Å; S64-S66 PolarHBondContact O-N 3.03Å; S64-S66 VanDerWaalsContact O-N 3.07Å; S64-S67 PolarHBondContact O-N 2.89Å; S64-E68 PolarHBondContact O-N 3.32Å
65D59.3Low80.4Confident90 Ų9098.8 Ų98.848%0.48152%0.517SS..Hα-helixtrans-48.8-37.2176.4-83.1-30.7000106.6P63 S67 E68 E69P63-D65 PolarHBondContact O-N 3.01Å; D65-S67 VanDerWaalsContact C-N 3.33Å; D65-S67 PolarHBondContact O-N 3.13Å; D65-E68 PolarHBondContact O-N 3.21Å; D65-E69 HydrophobicContact CB-CG 4.33Å; D65-E69 WeakPolarHBondContact O-CA 3.35Å; D65-E69 WeakPolarHBondContact O-CB 3.34Å; D65-E69 WeakPolarHBondContact O-CG 3.38Å; D65-E69 PolarHBondContact O-N 3.42Å
66S69.2Low80.8Confident84 Ų84101.4 Ų101.459%0.58752%0.523SS*.Hα-helixtrans-50.2-40.9171.4-170.90000115.6S64 R70S64-S66 PolarHBondContact O-N 3.03Å; S64-S66 VanDerWaalsContact O-N 3.07Å; S66-R70 WeakPolarHBondContact O-CB 3.42Å; S66-R70 PolarHBondContact O-N 2.86Å; S66-R70 VanDerWaalsContact O-N 3.15Å
67S81.1Confident81.2Confident70 Ų70104 Ų10449%0.4953%0.525SS..Hα-helixtrans-79.5-45.1179.6-174.90000112.3S64 D65 R70 C71S64-S67 PolarHBondContact O-N 2.89Å; D65-S67 VanDerWaalsContact C-N 3.33Å; D65-S67 PolarHBondContact O-N 3.13Å; S67-R70 PolarHBondContact O-N 3.37Å; S67-C71 PolarHBondContact O-N 2.93Å; S67-C71 PolarHBondContact O-SG 3.49Å
68E85.4Confident81.8Confident103 Ų103103.5 Ų103.548%0.48152%0.524SS..Hα-helixtrans-69.7-42.9178.2-72.4-166-17300112.2S64 D65 R70 C71 R72S64-E68 PolarHBondContact O-N 3.32Å; D65-E68 PolarHBondContact O-N 3.21Å; E68-R70 VanDerWaalsContact C-N 3.33Å; E68-R70 PolarHBondContact O-N 3.27Å; E68-C71 WeakPolarHBondContact O-CB 3.48Å; E68-C71 PolarHBondContact O-N 3.35Å; E68-R72 WeakPolarHBondContact O-CG 3.36Å; E68-R72 PolarHBondContact O-N 2.89Å; E68-R72 IonicContact OE2-NH2 3.52Å; E68-R72 PolarHBondContact OE2-NH2 3.47Å
69E87.8Confident82.5Confident113 Ų113106 Ų10653%0.52853%0.532SS..Hα-helixtrans-60.5-42.4173-68.4171.3164.100110.8D65 C71 R72 E73D65-E69 HydrophobicContact CB-CG 4.33Å; D65-E69 WeakPolarHBondContact O-CA 3.35Å; D65-E69 WeakPolarHBondContact O-CB 3.34Å; D65-E69 WeakPolarHBondContact O-CG 3.38Å; D65-E69 PolarHBondContact O-N 3.42Å; E69-C71 VanDerWaalsContact C-N 3.33Å; E69-C71 PolarHBondContact O-N 2.9Å; E69-R72 PolarHBondContact O-N 3.48Å; E69-E73 VanDerWaalsContact O-CB 3.32Å; E69-E73 WeakPolarHBondContact O-CB 3.41Å; E69-E73 PolarHBondContact O-N 2.8Å
70R89.9Confident83.5Confident176 Ų176102.8 Ų102.866%0.66453%0.525SS*.Hα-helixtrans-63-39.7174.1179.3175.3-179.51610.7111.9S66 S67 E68 E73 L74S66-R70 WeakPolarHBondContact O-CB 3.42Å; S66-R70 PolarHBondContact O-N 2.86Å; S66-R70 VanDerWaalsContact O-N 3.15Å; S67-R70 PolarHBondContact O-N 3.37Å; E68-R70 VanDerWaalsContact C-N 3.33Å; E68-R70 PolarHBondContact O-N 3.27Å; R70-E73 PolarHBondContact O-N 3.28Å; R70-L74 HydrophobicContact CG-CD1 4.19Å; R70-L74 WeakPolarHBondContact O-CB 3.35Å; R70-L74 VanDerWaalsContact O-CG 3.28Å; R70-L74 WeakPolarHBondContact O-CG 3.47Å; R70-L74 PolarHBondContact O-N 3.15Å
71C90.6Very high85Confident75 Ų75102.8 Ų102.851%0.50752%0.517SS..Hα-helixtrans-64.2-44.4174.5-70.90000111.4S67 E68 E69 E73 L74 Q75S67-C71 PolarHBondContact O-N 2.93Å; S67-C71 PolarHBondContact O-SG 3.49Å; E68-C71 WeakPolarHBondContact O-CB 3.48Å; E68-C71 PolarHBondContact O-N 3.35Å; E69-C71 VanDerWaalsContact C-N 3.33Å; E69-C71 PolarHBondContact O-N 2.9Å; C71-E73 PolarHBondContact O-N 3.47Å; C71-L74 PolarHBondContact O-N 3.48Å; C71-Q75 WeakPolarHBondContact O-CB 3.4Å; C71-Q75 PolarHBondContact O-N 3.18Å
72R94.1Very high86.5Confident152 Ų152105.2 Ų105.257%0.57452%0.52SS*.Hα-helixtrans-64.1-39176.4-68.9177-163.7171.910.9112.2E68 E69 Q75 R76E68-R72 WeakPolarHBondContact O-CG 3.36Å; E68-R72 PolarHBondContact O-N 2.89Å; E68-R72 IonicContact OE2-NH2 3.52Å; E68-R72 PolarHBondContact OE2-NH2 3.47Å; E69-R72 PolarHBondContact O-N 3.48Å; R72-Q75 PolarHBondContact O-N 2.65Å; R72-R76 WeakPolarHBondContact O-CB 3.32Å; R72-R76 PolarHBondContact O-N 3Å
73E95.9Very high88.3Confident96 Ų96103.3 Ų103.345%0.44952%0.517SS..Hα-helixtrans-66-45.2175.9-176.259-144.800111.4E69 R70 C71 Q75 R76 R77E69-E73 VanDerWaalsContact O-CB 3.32Å; E69-E73 WeakPolarHBondContact O-CB 3.41Å; E69-E73 PolarHBondContact O-N 2.8Å; R70-E73 PolarHBondContact O-N 3.28Å; C71-E73 PolarHBondContact O-N 3.47Å; E73-Q75 VanDerWaalsContact C-N 3.31Å; E73-Q75 PolarHBondContact O-N 3.31Å; E73-R76 PolarHBondContact O-N 3.01Å; E73-R76 IonicContact OE1-NH1 3.25Å; E73-R76 IonicContact OE2-CZ 3.98Å; E73-R76 IonicContact OE2-NH1 3.01Å; E73-R76 PolarHBondContact OE2-NH1 3.28Å; E73-R76 IonicContact OE2-NH2 3.18Å; E73-R77 WeakPolarHBondContact O-CB 3.28Å; E73-R77 PolarHBondContact O-N 2.95Å
74L96.6Very high90.2Very high91 Ų91104.3 Ų104.348%0.47652%0.515SS..Hα-helixtrans-61.4-42.3174.5-75.1172.1000111.2R70 C71 R77 C78R70-L74 HydrophobicContact CG-CD1 4.19Å; R70-L74 WeakPolarHBondContact O-CB 3.35Å; R70-L74 VanDerWaalsContact O-CG 3.28Å; R70-L74 WeakPolarHBondContact O-CG 3.47Å; R70-L74 PolarHBondContact O-N 3.15Å; C71-L74 PolarHBondContact O-N 3.48Å; L74-R77 PolarHBondContact O-N 3.08Å; L74-C78 WeakPolarHBondContact O-CB 3.27Å; L74-C78 PolarHBondContact O-N 2.77Å; L74-C78 PolarHBondContact O-SG 3.35Å
75Q97.4Very high92Very high114 Ų114106.1 Ų106.153%0.53352%0.52SS..Hα-helixtrans-61.3-48.5176.2-175.7177.9-1400111.4C71 R72 E73 R77 C78 E79C71-Q75 WeakPolarHBondContact O-CB 3.4Å; C71-Q75 PolarHBondContact O-N 3.18Å; R72-Q75 PolarHBondContact O-N 2.65Å; E73-Q75 VanDerWaalsContact C-N 3.31Å; E73-Q75 PolarHBondContact O-N 3.31Å; Q75-R77 VanDerWaalsContact C-N 3.26Å; Q75-R77 PolarHBondContact O-N 3.26Å; Q75-C78 WeakPolarHBondContact O-CB 3.01Å; Q75-C78 PolarHBondContact O-N 3.45Å; Q75-C78 VanDerWaalsContact O-N 3.13Å; Q75-E79 WeakPolarHBondContact CG-OE1 3.41Å; Q75-E79 PolarHBondContact NE2-OE1 3.4Å; Q75-E79 WeakPolarHBondContact O-CG 3.46Å; Q75-E79 PolarHBondContact O-N 3.08Å
76R98Very high93.9Very high147 Ų147107.9 Ų107.956%0.55552%0.523SS*.Hα-helixtrans-58.5-40.7175.8-166.6-166.4-58.5131.57111.5R72 E73 E79 E80R72-R76 WeakPolarHBondContact O-CB 3.32Å; R72-R76 PolarHBondContact O-N 3Å; E73-R76 PolarHBondContact O-N 3.01Å; E73-R76 IonicContact OE1-NH1 3.25Å; E73-R76 IonicContact OE2-CZ 3.98Å; E73-R76 IonicContact OE2-NH1 3.01Å; E73-R76 PolarHBondContact OE2-NH1 3.28Å; E73-R76 IonicContact OE2-NH2 3.18Å; R76-E79 PolarHBondContact O-N 3.39Å; R76-E80 WeakPolarHBondContact O-CB 3.33Å; R76-E80 PolarHBondContact O-N 2.84Å
77R98.1Very high95.3Very high165 Ų165109.9 Ų109.962%0.62352%0.521SS*.Hα-helixtrans-67.4-37.6177.7-171.5171.8-177.9171.30.9112.1E73 L74 Q75 L81E73-R77 WeakPolarHBondContact O-CB 3.28Å; E73-R77 PolarHBondContact O-N 2.95Å; L74-R77 PolarHBondContact O-N 3.08Å; Q75-R77 VanDerWaalsContact C-N 3.26Å; Q75-R77 PolarHBondContact O-N 3.26Å; R77-L81 HydrophobicContact CG-CD1 4.27Å; R77-L81 WeakPolarHBondContact O-CB 3.5Å; R77-L81 WeakPolarHBondContact O-CG 3.48Å; R77-L81 PolarHBondContact O-N 2.99Å
78C98.2Very high96.1Very high67 Ų67112.6 Ų112.645%0.45352%0.524SS..Hα-helixtrans-62.8-49.2172.2-74.50000110.8L74 Q75 E80 L81 E82L74-C78 WeakPolarHBondContact O-CB 3.27Å; L74-C78 PolarHBondContact O-N 2.77Å; L74-C78 PolarHBondContact O-SG 3.35Å; Q75-C78 WeakPolarHBondContact O-CB 3.01Å; Q75-C78 PolarHBondContact O-N 3.45Å; Q75-C78 VanDerWaalsContact O-N 3.13Å; C78-E80 VanDerWaalsContact C-N 3.34Å; C78-E80 PolarHBondContact O-N 2.97Å; C78-L81 PolarHBondContact O-N 3.47Å; C78-E82 WeakPolarHBondContact O-CB 3.5Å; C78-E82 WeakPolarHBondContact O-CG 3.33Å; C78-E82 PolarHBondContact O-N 2.9Å
79E98.5Very high96.7Very high100 Ų100112.7 Ų112.747%0.46753%0.525SS..Hα-helixtrans-59.5-42.6178.1-70.6169.1-171.400112Q75 R76 E82 A83Q75-E79 WeakPolarHBondContact CG-OE1 3.41Å; Q75-E79 PolarHBondContact NE2-OE1 3.4Å; Q75-E79 WeakPolarHBondContact O-CG 3.46Å; Q75-E79 PolarHBondContact O-N 3.08Å; R76-E79 PolarHBondContact O-N 3.39Å; E79-E82 PolarHBondContact O-N 3.4Å; E79-A83 WeakPolarHBondContact O-CB 3.44Å; E79-A83 PolarHBondContact O-N 2.91Å
80E98.6Very high97.2Very high109 Ų109112.4 Ų112.451%0.50952%0.523SS..Hα-helixtrans-63.4-44.4175.5178.262.8-142.700111.8R76 C78 A83 Q84R76-E80 WeakPolarHBondContact O-CB 3.33Å; R76-E80 PolarHBondContact O-N 2.84Å; C78-E80 VanDerWaalsContact C-N 3.34Å; C78-E80 PolarHBondContact O-N 2.97Å; E80-A83 PolarHBondContact O-N 2.9Å; E80-Q84 WeakPolarHBondContact O-CB 3.49Å; E80-Q84 WeakPolarHBondContact O-CG 3.33Å; E80-Q84 PolarHBondContact O-N 3.18Å; E80-Q84 PolarHBondContact OE1-NE2 3.32Å
81L98.5Very high97.7Very high97 Ų97107.3 Ų107.351%0.50851%0.507SS..Hα-helixtrans-65.8-38.2177.1-74.1172000112R77 C78 Q84 L85R77-L81 HydrophobicContact CG-CD1 4.27Å; R77-L81 WeakPolarHBondContact O-CB 3.5Å; R77-L81 WeakPolarHBondContact O-CG 3.48Å; R77-L81 PolarHBondContact O-N 2.99Å; C78-L81 PolarHBondContact O-N 3.47Å; L81-Q84 PolarHBondContact O-N 2.82Å; L81-L85 WeakPolarHBondContact O-CB 3.49Å; L81-L85 PolarHBondContact O-N 2.93Å
82E98.4Very high98.1Very high129 Ų129108 Ų10860%0.60351%0.506SS*.Hα-helixtrans-64.8-42.1174.4-74.7174.3-173.100111.4C78 E79 L85 K86C78-E82 WeakPolarHBondContact O-CB 3.5Å; C78-E82 WeakPolarHBondContact O-CG 3.33Å; C78-E82 PolarHBondContact O-N 2.9Å; E79-E82 PolarHBondContact O-N 3.4Å; E82-L85 PolarHBondContact O-N 3.42Å; E82-K86 WeakPolarHBondContact O-CB 3.48Å; E82-K86 PolarHBondContact O-N 3.41Å
83A98.6Very high98.3Very high56 Ų56104.6 Ų104.646%0.46350%0.502SS..Hα-helixtrans-63.8-4217500000111.9E79 E80 K86 K87E79-A83 WeakPolarHBondContact O-CB 3.44Å; E79-A83 PolarHBondContact O-N 2.91Å; E80-A83 PolarHBondContact O-N 2.9Å; A83-K86 PolarHBondContact O-N 2.84Å; A83-K87 WeakPolarHBondContact O-CB 3.22Å; A83-K87 PolarHBondContact O-N 3.26Å
84Q98.6Very high98.4Very high96 Ų96104.9 Ų104.945%0.44950%0.503SS..Hα-helixtrans-64.9-41.9175-73.8-179.636.400112E80 L81 K87 K88E80-Q84 WeakPolarHBondContact O-CB 3.49Å; E80-Q84 WeakPolarHBondContact O-CG 3.33Å; E80-Q84 PolarHBondContact O-N 3.18Å; E80-Q84 PolarHBondContact OE1-NE2 3.32Å; L81-Q84 PolarHBondContact O-N 2.82Å; Q84-K87 PolarHBondContact O-N 2.9Å; Q84-K88 WeakPolarHBondContact O-CB 3.38Å; Q84-K88 VanDerWaalsContact O-CG 3.28Å; Q84-K88 WeakPolarHBondContact O-CG 3.36Å; Q84-K88 PolarHBondContact O-N 3.05Å
85L98.6Very high98.5Very high99 Ų99105.7 Ų105.752%0.51851%0.507SS..Hα-helixtrans-60.1-50176179.464.7000110.2L81 E82 K87 K88 E89L81-L85 WeakPolarHBondContact O-CB 3.49Å; L81-L85 PolarHBondContact O-N 2.93Å; E82-L85 PolarHBondContact O-N 3.42Å; L85-K87 VanDerWaalsContact C-N 3.34Å; L85-K87 PolarHBondContact O-N 2.82Å; L85-K88 CarbonylContact O-C 3.57Å; L85-K88 WeakPolarHBondContact O-CA 3.33Å; L85-K88 WeakPolarHBondContact O-CB 3.39Å; L85-K88 PolarHBondContact O-N 2.9Å; L85-E89 HydrophobicContact CD1-CG 4.43Å; L85-E89 HydrophobicContact CG-CG 4.46Å; L85-E89 WeakPolarHBondContact O-CG 3.37Å; L85-E89 PolarHBondContact O-N 3.38Å
86K98.8Very high98.6Very high126 Ų126105 Ų10555%0.54851%0.507SS..Hα-helixtrans-58.8-44.5178.7-172.7-179.2178.5-174.20112.1E82 A83 K88 E89 E90E82-K86 WeakPolarHBondContact O-CB 3.48Å; E82-K86 PolarHBondContact O-N 3.41Å; A83-K86 PolarHBondContact O-N 2.84Å; K86-K88 VanDerWaalsContact C-N 3.3Å; K86-K88 PolarHBondContact O-N 3.25Å; K86-E89 PolarHBondContact O-N 3.4Å; K86-E90 VanDerWaalsContact CE-OE1 3.27Å; K86-E90 WeakPolarHBondContact CE-OE1 3.5Å; K86-E90 WeakPolarHBondContact O-CG 3.28Å; K86-E90 PolarHBondContact O-N 3.34Å
87K98.8Very high98.6Very high126 Ų126104.3 Ų104.355%0.54850%0.504SS..Hα-helixtrans-59.7-42174.9-178.8177.5177.8178.60111.7A83 Q84 L85 E90 E91A83-K87 WeakPolarHBondContact O-CB 3.22Å; A83-K87 PolarHBondContact O-N 3.26Å; Q84-K87 PolarHBondContact O-N 2.9Å; L85-K87 VanDerWaalsContact C-N 3.34Å; L85-K87 PolarHBondContact O-N 2.82Å; K87-E90 PolarHBondContact O-N 2.85Å; K87-E91 WeakPolarHBondContact CE-OE1 3.28Å; K87-E91 WeakPolarHBondContact O-CB 3.33Å; K87-E91 WeakPolarHBondContact O-CG 3.19Å; K87-E91 PolarHBondContact O-N 3.26Å
88K98.7Very high98.6Very high127 Ų12799 Ų9955%0.55249%0.488SS*.Hα-helixtrans-68.8-35.8178.1-72.2-73.1163.2-154.60112.4Q84 L85 K86 E91 N92Q84-K88 WeakPolarHBondContact O-CB 3.38Å; Q84-K88 VanDerWaalsContact O-CG 3.28Å; Q84-K88 WeakPolarHBondContact O-CG 3.36Å; Q84-K88 PolarHBondContact O-N 3.05Å; L85-K88 CarbonylContact O-C 3.57Å; L85-K88 WeakPolarHBondContact O-CA 3.33Å; L85-K88 WeakPolarHBondContact O-CB 3.39Å; L85-K88 PolarHBondContact O-N 2.9Å; K86-K88 VanDerWaalsContact C-N 3.3Å; K86-K88 PolarHBondContact O-N 3.25Å; K88-E91 IonicContact NZ-OE1 2.72Å; K88-E91 IonicContact NZ-OE2 3.71Å; K88-E91 PolarHBondContact NZ-OE2 2.98Å; K88-N92 VanDerWaalsContact O-CB 3.24Å; K88-N92 WeakPolarHBondContact O-CB 3.31Å; K88-N92 PolarHBondContact O-N 3.1Å
89E98.7Very high98.7Very high106 Ų106100.3 Ų100.350%0.49549%0.49SS..Hα-helixtrans-64.3-45.8172.7-72173.916300110.9L85 K86 N92 T93L85-E89 HydrophobicContact CD1-CG 4.43Å; L85-E89 HydrophobicContact CG-CG 4.46Å; L85-E89 WeakPolarHBondContact O-CG 3.37Å; L85-E89 PolarHBondContact O-N 3.38Å; K86-E89 PolarHBondContact O-N 3.4Å; E89-N92 WeakPolarHBondContact O-CB 3.49Å; E89-N92 PolarHBondContact O-N 2.71Å; E89-T93 VanDerWaalsContact O-CG2 3.28Å; E89-T93 WeakPolarHBondContact O-CG2 3.24Å; E89-T93 PolarHBondContact O-N 3.48Å; E89-T93 PolarHBondContact O-OG1 3Å
90E98.7Very high98.7Very high107 Ų107102.3 Ų102.350%0.550%0.499SS..Hα-helixtrans-59.2-50.7174.9-72.1170-173.700111.5K86 K87 N92 T93 E94K86-E90 VanDerWaalsContact CE-OE1 3.27Å; K86-E90 WeakPolarHBondContact CE-OE1 3.5Å; K86-E90 WeakPolarHBondContact O-CG 3.28Å; K86-E90 PolarHBondContact O-N 3.34Å; K87-E90 PolarHBondContact O-N 2.85Å; E90-N92 VanDerWaalsContact C-N 3.29Å; E90-N92 PolarHBondContact O-N 2.96Å; E90-T93 PolarHBondContact O-N 3.41Å; E90-T93 PolarHBondContact O-OG1 3.19Å; E90-E94 PolarHBondContact O-N 3.34Å
91E98.7Very high98.7Very high68 Ų68103.5 Ų103.532%0.31851%0.505SS..Hα-helixtrans-55.8-42.3174.3-74.2172.8-171.600111.7K87 K88 E94 L95K87-E91 WeakPolarHBondContact CE-OE1 3.28Å; K87-E91 WeakPolarHBondContact O-CB 3.33Å; K87-E91 WeakPolarHBondContact O-CG 3.19Å; K87-E91 PolarHBondContact O-N 3.26Å; K88-E91 IonicContact NZ-OE1 2.72Å; K88-E91 IonicContact NZ-OE2 3.71Å; K88-E91 PolarHBondContact NZ-OE2 2.98Å; E91-E94 PolarHBondContact O-N 2.95Å; E91-L95 VanDerWaalsContact O-CG 3.31Å; E91-L95 WeakPolarHBondContact O-CG 3.47Å; E91-L95 PolarHBondContact O-N 3.2Å
92N98.7Very high98.7Very high90 Ų90104.7 Ų104.748%0.48151%0.506SS..Hα-helixtrans-65.6-44.8178.5-169.1-46.6000111.6K88 E89 E90 E94 L95 L96K88-N92 VanDerWaalsContact O-CB 3.24Å; K88-N92 WeakPolarHBondContact O-CB 3.31Å; K88-N92 PolarHBondContact O-N 3.1Å; E89-N92 WeakPolarHBondContact O-CB 3.49Å; E89-N92 PolarHBondContact O-N 2.71Å; E90-N92 VanDerWaalsContact C-N 3.29Å; E90-N92 PolarHBondContact O-N 2.96Å; N92-E94 VanDerWaalsContact C-N 3.26Å; N92-E94 PolarHBondContact O-N 3.41Å; N92-L95 PolarHBondContact O-N 3.32Å; N92-L96 WeakPolarHBondContact O-CG 3.27Å; N92-L96 PolarHBondContact O-N 2.86Å; N92-L96 WeakPolarHBondContact OD1-CD1 3.38Å
93T98.8Very high98.7Very high80 Ų80103 Ų10349%0.49150%0.501SS..Hα-helixtrans-61.3-36.7177.562.50000112.1E89 E90 L96 R97E89-T93 VanDerWaalsContact O-CG2 3.28Å; E89-T93 WeakPolarHBondContact O-CG2 3.24Å; E89-T93 PolarHBondContact O-N 3.48Å; E89-T93 PolarHBondContact O-OG1 3Å; E90-T93 PolarHBondContact O-N 3.41Å; E90-T93 PolarHBondContact O-OG1 3.19Å; T93-L96 PolarHBondContact O-N 3.12Å; T93-R97 PolarHBondContact O-N 3.5Å; T93-R97 VanDerWaalsContact O-N 3.12Å
94E98.7Very high98.7Very high102 Ų102102.9 Ų102.948%0.47750%0.501SS..Hα-helixtrans-66.6-46.5174.1178.3161.9-134.700111.9E90 E91 N92 L96 R97 D98E90-E94 PolarHBondContact O-N 3.34Å; E91-E94 PolarHBondContact O-N 2.95Å; N92-E94 VanDerWaalsContact C-N 3.26Å; N92-E94 PolarHBondContact O-N 3.41Å; E94-L96 VanDerWaalsContact C-N 3.28Å; E94-L96 PolarHBondContact O-N 3.03Å; E94-R97 PolarHBondContact O-N 2.72Å; E94-R97 IonicContact OE1-NH2 3.03Å; E94-D98 PolarHBondContact O-N 3.34Å
95L98.7Very high98.7Very high108 Ų108103.6 Ų103.657%0.56551%0.505SS*.Hα-helixtrans-60.3-37.3176-70.9173.1000112.5E91 N92 D98 L99E91-L95 VanDerWaalsContact O-CG 3.31Å; E91-L95 WeakPolarHBondContact O-CG 3.47Å; E91-L95 PolarHBondContact O-N 3.2Å; N92-L95 PolarHBondContact O-N 3.32Å; L95-D98 PolarHBondContact O-N 3.48Å; L95-L99 WeakPolarHBondContact O-CB 3.41Å; L95-L99 WeakPolarHBondContact O-CG 3.37Å; L95-L99 PolarHBondContact O-N 2.91Å
96L98.8Very high98.7Very high100 Ų100102.8 Ų102.852%0.52450%0.5SS..Hα-helixtrans-64.6-44.1175.4-74.8173.9000111.9N92 T93 E94 D98 L99 E100N92-L96 WeakPolarHBondContact O-CG 3.27Å; N92-L96 PolarHBondContact O-N 2.86Å; N92-L96 WeakPolarHBondContact OD1-CD1 3.38Å; T93-L96 PolarHBondContact O-N 3.12Å; E94-L96 VanDerWaalsContact C-N 3.28Å; E94-L96 PolarHBondContact O-N 3.03Å; L96-D98 VanDerWaalsContact C-N 3.34Å; L96-D98 PolarHBondContact O-N 3.21Å; L96-L99 PolarHBondContact O-N 2.91Å; L96-E100 PolarHBondContact O-N 3.27Å
97R98.8Very high98.7Very high133 Ų13399.5 Ų99.550%0.50249%0.494SS..Hα-helixtrans-60.9-43.1174.2-74.9-168.5-67.289.8-3.2112T93 E94 L99 E100 Q101T93-R97 PolarHBondContact O-N 3.5Å; T93-R97 VanDerWaalsContact O-N 3.12Å; E94-R97 PolarHBondContact O-N 2.72Å; E94-R97 IonicContact OE1-NH2 3.03Å; R97-L99 VanDerWaalsContact C-N 3.34Å; R97-L99 PolarHBondContact O-N 3.13Å; R97-E100 PolarHBondContact O-N 2.95Å; R97-Q101 PolarHBondContact O-N 3.48Å
98D98.8Very high98.7Very high53 Ų5397.7 Ų97.728%0.28349%0.493SS..Hα-helixtrans-63.5-40.4178.1-86.115.2000112.1E94 L95 L96 Q101 K102E94-D98 PolarHBondContact O-N 3.34Å; L95-D98 PolarHBondContact O-N 3.48Å; L96-D98 VanDerWaalsContact C-N 3.34Å; L96-D98 PolarHBondContact O-N 3.21Å; D98-Q101 PolarHBondContact O-N 3.18Å; D98-K102 WeakPolarHBondContact O-CB 3.32Å; D98-K102 VanDerWaalsContact O-CG 3.27Å; D98-K102 WeakPolarHBondContact O-CG 3.46Å; D98-K102 PolarHBondContact O-N 3.49Å
99L98.8Very high98.8Very high94 Ų9496.1 Ų96.149%0.49249%0.49SS..Hα-helixtrans-63.4-43.9174.2-77.7173.8000111.3L95 L96 R97 K102 N103L95-L99 WeakPolarHBondContact O-CB 3.41Å; L95-L99 WeakPolarHBondContact O-CG 3.37Å; L95-L99 PolarHBondContact O-N 2.91Å; L96-L99 PolarHBondContact O-N 2.91Å; R97-L99 VanDerWaalsContact C-N 3.34Å; R97-L99 PolarHBondContact O-N 3.13Å; L99-K102 PolarHBondContact O-N 2.94Å; L99-N103 WeakPolarHBondContact O-CB 3.45Å; L99-N103 VanDerWaalsContact O-CG 3.22Å; L99-N103 PolarHBondContact O-N 2.95Å; L99-N103 PolarHBondContact O-ND2 2.88Å
100E98.8Very high98.8Very high142 Ų14295.6 Ų95.666%0.66449%0.488SS*.Hα-helixtrans-60.7-46.9176.3-174.2174.4-165.500111.5L96 R97 K102 N103 A104L96-E100 PolarHBondContact O-N 3.27Å; R97-E100 PolarHBondContact O-N 2.95Å; E100-K102 PolarHBondContact O-N 3.49Å; E100-N103 PolarHBondContact O-N 3.33Å; E100-A104 WeakPolarHBondContact O-CB 3.48Å; E100-A104 PolarHBondContact O-N 3.19Å
101Q98.8Very high98.8Very high134 Ų13494.6 Ų94.663%0.62649%0.486SS*.Hα-helixtrans-60.1-44.6176.5-173.8-175.113.400111.9R97 D98 A104 M105R97-Q101 PolarHBondContact O-N 3.48Å; D98-Q101 PolarHBondContact O-N 3.18Å; Q101-A104 PolarHBondContact O-N 3.39Å; Q101-M105 PolarHBondContact O-N 2.96Å
102K98.8Very high98.8Very high123 Ų12393.4 Ų93.454%0.53548%0.483SS..Hα-helixtrans-64.7-41.8177.6-75.3170.3-177.2159.80111.5D98 L99 E100 A104 M105 I106D98-K102 WeakPolarHBondContact O-CB 3.32Å; D98-K102 VanDerWaalsContact O-CG 3.27Å; D98-K102 WeakPolarHBondContact O-CG 3.46Å; D98-K102 PolarHBondContact O-N 3.49Å; L99-K102 PolarHBondContact O-N 2.94Å; E100-K102 PolarHBondContact O-N 3.49Å; K102-A104 VanDerWaalsContact C-N 3.34Å; K102-A104 PolarHBondContact O-N 3.04Å; K102-M105 WeakPolarHBondContact O-CB 3.38Å; K102-M105 PolarHBondContact O-N 2.9Å; K102-I106 VanDerWaalsContact O-CG1 3.28Å; K102-I106 WeakPolarHBondContact O-CG1 3.45Å; K102-I106 PolarHBondContact O-N 3.37Å
103N98.8Very high98.8Very high93 Ų9393.6 Ų93.650%0.49748%0.483SS..Hα-helixtrans-64.3-38.2176.1-74.6-27.8000112.3L99 E100 I106 S107L99-N103 WeakPolarHBondContact O-CB 3.45Å; L99-N103 VanDerWaalsContact O-CG 3.22Å; L99-N103 PolarHBondContact O-N 2.95Å; L99-N103 PolarHBondContact O-ND2 2.88Å; E100-N103 PolarHBondContact O-N 3.33Å; N103-I106 PolarHBondContact O-N 3.41Å; N103-S107 PolarHBondContact O-N 3.27Å; N103-S107 PolarHBondContact O-OG 2.97Å
104A98.8Very high98.8Very high54 Ų5495.3 Ų95.345%0.44648%0.484SS..Hα-helixtrans-63-44.8172.700000111.2E100 Q101 K102 I106 S107 V108E100-A104 WeakPolarHBondContact O-CB 3.48Å; E100-A104 PolarHBondContact O-N 3.19Å; Q101-A104 PolarHBondContact O-N 3.39Å; K102-A104 VanDerWaalsContact C-N 3.34Å; K102-A104 PolarHBondContact O-N 3.04Å; A104-I106 PolarHBondContact O-N 3.23Å; A104-S107 WeakPolarHBondContact O-CB 3.35Å; A104-S107 PolarHBondContact O-N 3.49Å; A104-V108 WeakPolarHBondContact O-CG2 3.48Å; A104-V108 PolarHBondContact O-N 3.23Å
105M98.8Very high98.8Very high110 Ų11095.9 Ų95.954%0.54249%0.486SS..Hα-helixtrans-60.5-45175.4-176.864.270.600112Q101 K102 S107 V108 L109Q101-M105 PolarHBondContact O-N 2.96Å; K102-M105 WeakPolarHBondContact O-CB 3.38Å; K102-M105 PolarHBondContact O-N 2.9Å; M105-S107 VanDerWaalsContact C-N 3.31Å; M105-S107 PolarHBondContact O-N 3.43Å; M105-V108 PolarHBondContact O-N 2.86Å; M105-L109 HydrophobicContact CG-CD1 4.17Å; M105-L109 WeakPolarHBondContact O-CG 3.45Å; M105-L109 PolarHBondContact O-N 3.48Å
106I98.8Very high98.8Very high82 Ų8297.4 Ų97.442%0.42149%0.485SS..Hα-helixtrans-57.3-47.6175.5-70.1167.2000109.7K102 N103 A104 V108 L109 E110K102-I106 VanDerWaalsContact O-CG1 3.28Å; K102-I106 WeakPolarHBondContact O-CG1 3.45Å; K102-I106 PolarHBondContact O-N 3.37Å; N103-I106 PolarHBondContact O-N 3.41Å; A104-I106 PolarHBondContact O-N 3.23Å; I106-V108 VanDerWaalsContact C-N 3.32Å; I106-V108 PolarHBondContact O-N 3.35Å; I106-L109 PolarHBondContact O-N 2.97Å; I106-L109 VanDerWaalsContact O-N 3.15Å; I106-E110 HydrophobicContact CG2-CG 4.1Å; I106-E110 WeakPolarHBondContact O-CB 3.29Å; I106-E110 WeakPolarHBondContact O-CG 3.28Å; I106-E110 PolarHBondContact O-N 3.4Å
107S98.8Very high98.8Very high58 Ų5898.4 Ų98.441%0.40649%0.486SS..Hα-helixtrans-58.8-42179.4-58.30000112.5N103 A104 M105 N111N103-S107 PolarHBondContact O-N 3.27Å; N103-S107 PolarHBondContact O-OG 2.97Å; A104-S107 WeakPolarHBondContact O-CB 3.35Å; A104-S107 PolarHBondContact O-N 3.49Å; M105-S107 VanDerWaalsContact C-N 3.31Å; M105-S107 PolarHBondContact O-N 3.43Å; S107-N111 WeakPolarHBondContact O-CB 3.37Å; S107-N111 VanDerWaalsContact O-CG 3.25Å; S107-N111 PolarHBondContact O-N 2.86Å; S107-N111 PolarHBondContact O-ND2 2.72Å
108V98.8Very high98.8Very high88 Ų8898.4 Ų98.453%0.53349%0.49SS..Hα-helixtrans-64.3-45.1176172.30000111.2A104 M105 I106 N111 T112A104-V108 WeakPolarHBondContact O-CG2 3.48Å; A104-V108 PolarHBondContact O-N 3.23Å; M105-V108 PolarHBondContact O-N 2.86Å; I106-V108 VanDerWaalsContact C-N 3.32Å; I106-V108 PolarHBondContact O-N 3.35Å; V108-N111 PolarHBondContact O-N 3.2Å; V108-T112 VanDerWaalsContact O-CB 3.29Å; V108-T112 WeakPolarHBondContact O-CB 3.34Å; V108-T112 PolarHBondContact O-N 2.93Å; V108-T112 PolarHBondContact O-OG1 3.45Å
109L98.8Very high98.8Very high94 Ų94101.5 Ų101.549%0.49250%0.501SS..Hα-helixtrans-65.4-42.8178.9-70.4174.9000111.9M105 I106 T112 I113M105-L109 HydrophobicContact CG-CD1 4.17Å; M105-L109 WeakPolarHBondContact O-CG 3.45Å; M105-L109 PolarHBondContact O-N 3.48Å; I106-L109 PolarHBondContact O-N 2.97Å; I106-L109 VanDerWaalsContact O-N 3.15Å; L109-T112 WeakPolarHBondContact O-CB 3.33Å; L109-T112 PolarHBondContact O-N 3.45Å; L109-I113 WeakPolarHBondContact O-CG1 3.5Å; L109-I113 PolarHBondContact O-N 3.1Å
110E98.8Very high98.8Very high95 Ų95104.1 Ų104.144%0.44451%0.505SS..Hα-helixtrans-59.9-47.2175.4-75.3-176.4173.600111.7I106 T112 I113 K114I106-E110 HydrophobicContact CG2-CG 4.1Å; I106-E110 WeakPolarHBondContact O-CB 3.29Å; I106-E110 WeakPolarHBondContact O-CG 3.28Å; I106-E110 PolarHBondContact O-N 3.4Å; E110-T112 VanDerWaalsContact C-N 3.3Å; E110-T112 PolarHBondContact O-N 3.27Å; E110-I113 PolarHBondContact O-N 3.42Å; E110-K114 WeakPolarHBondContact O-CB 3.42Å; E110-K114 VanDerWaalsContact O-CG 3.3Å; E110-K114 WeakPolarHBondContact O-CG 3.43Å; E110-K114 PolarHBondContact O-N 3.26Å
111N98.8Very high98.8Very high86 Ų86101.6 Ų101.646%0.4650%0.496SS..Hα-helixtrans-61.9-42.2176.6-73.4-20.7000111.3S107 V108 I113 K114 E115S107-N111 WeakPolarHBondContact O-CB 3.37Å; S107-N111 VanDerWaalsContact O-CG 3.25Å; S107-N111 PolarHBondContact O-N 2.86Å; S107-N111 PolarHBondContact O-ND2 2.72Å; V108-N111 PolarHBondContact O-N 3.2Å; N111-I113 VanDerWaalsContact C-N 3.33Å; N111-I113 PolarHBondContact O-N 3.29Å; N111-K114 PolarHBondContact O-N 3.03Å; N111-E115 WeakPolarHBondContact O-CB 3.41Å; N111-E115 WeakPolarHBondContact O-CG 3.3Å; N111-E115 PolarHBondContact O-N 3.43Å
112T98.8Very high98.8Very high42 Ų4299.8 Ų99.826%0.25849%0.487SS..Hα-helixtrans-61.1-41.9177.7-62.50000111.9V108 L109 E110 R116V108-T112 VanDerWaalsContact O-CB 3.29Å; V108-T112 WeakPolarHBondContact O-CB 3.34Å; V108-T112 PolarHBondContact O-N 2.93Å; V108-T112 PolarHBondContact O-OG1 3.45Å; L109-T112 WeakPolarHBondContact O-CB 3.33Å; L109-T112 PolarHBondContact O-N 3.45Å; E110-T112 VanDerWaalsContact C-N 3.3Å; E110-T112 PolarHBondContact O-N 3.27Å; T112-R116 WeakPolarHBondContact O-CG 3.37Å; T112-R116 PolarHBondContact O-N 2.91Å; T112-R116 VanDerWaalsContact O-N 3.09Å
113I98.8Very high98.8Very high94 Ų9498.3 Ų98.348%0.48248%0.483SS..Hα-helixtrans-65.5-50.2176-71.2166.5000110L109 E110 N111 E115 R116 E117L109-I113 WeakPolarHBondContact O-CG1 3.5Å; L109-I113 PolarHBondContact O-N 3.1Å; E110-I113 PolarHBondContact O-N 3.42Å; N111-I113 VanDerWaalsContact C-N 3.33Å; N111-I113 PolarHBondContact O-N 3.29Å; I113-E115 VanDerWaalsContact C-N 3.27Å; I113-E115 PolarHBondContact O-N 2.96Å; I113-R116 PolarHBondContact O-N 2.81Å; I113-E117 HydrophobicContact CG2-CG 4.18Å; I113-E117 WeakPolarHBondContact O-CG 3.47Å; I113-E117 PolarHBondContact O-N 3.34Å
114K98.8Very high98.8Very high117 Ų11799.4 Ų99.451%0.50949%0.488SS..Hα-helixtrans-55.2-42.3178.3-73.4169.3-176.3163.20112.1E110 N111 K118E110-K114 WeakPolarHBondContact O-CB 3.42Å; E110-K114 VanDerWaalsContact O-CG 3.3Å; E110-K114 WeakPolarHBondContact O-CG 3.43Å; E110-K114 PolarHBondContact O-N 3.26Å; N111-K114 PolarHBondContact O-N 3.03Å; K114-K118 WeakPolarHBondContact O-CB 3.45Å; K114-K118 PolarHBondContact O-N 3.32Å
115E98.8Very high98.8Very high114 Ų114103 Ų10353%0.53349%0.493SS..Hα-helixtrans-66.1-41.6176.7-76.5179.3-165.200112.8N111 I113 K118 K119N111-E115 WeakPolarHBondContact O-CB 3.41Å; N111-E115 WeakPolarHBondContact O-CG 3.3Å; N111-E115 PolarHBondContact O-N 3.43Å; I113-E115 VanDerWaalsContact C-N 3.27Å; I113-E115 PolarHBondContact O-N 2.96Å; E115-K118 PolarHBondContact O-N 2.88Å; E115-K119 WeakPolarHBondContact O-CG 3.37Å; E115-K119 PolarHBondContact O-N 3.42Å
116R98.8Very high98.8Very high140 Ų140104 Ų10453%0.52850%0.498SS..Hα-helixtrans-66.3-43.2176.3-76.1-170.5174.8107.98.8111.9T112 I113 K118 K119 Y120T112-R116 WeakPolarHBondContact O-CG 3.37Å; T112-R116 PolarHBondContact O-N 2.91Å; T112-R116 VanDerWaalsContact O-N 3.09Å; I113-R116 PolarHBondContact O-N 2.81Å; R116-K118 VanDerWaalsContact C-N 3.32Å; R116-K118 PolarHBondContact O-N 2.94Å; R116-K119 PolarHBondContact O-N 3.08Å; R116-Y120 HydrophobicContact CB-CE2 4.25Å; R116-Y120 VanDerWaalsContact O-CD2 3.27Å; R116-Y120 WeakPolarHBondContact O-CD2 2.98Å; R116-Y120 PolarHBondContact O-N 3.47Å
117E98.7Very high98.8Very high120 Ų120106 Ų10656%0.56150%0.504SS*.Hα-helixtrans-58.6-45.4174.9-72.7177.416200111.3I113 K119 Y120 L121I113-E117 HydrophobicContact CG2-CG 4.18Å; I113-E117 WeakPolarHBondContact O-CG 3.47Å; I113-E117 PolarHBondContact O-N 3.34Å; E117-K119 PolarHBondContact O-N 3.16Å; E117-Y120 PolarHBondContact O-N 3.35Å; E117-L121 WeakPolarHBondContact O-CB 3.49Å; E117-L121 PolarHBondContact O-N 3.15Å
118K98.8Very high98.8Very high133 Ų133106.8 Ų106.858%0.57851%0.509SS*.Hα-helixtrans-58.3-48.9175.2-178.8179.4174-176.50111.6K114 E115 R116 Y120 L121 E122K114-K118 WeakPolarHBondContact O-CB 3.45Å; K114-K118 PolarHBondContact O-N 3.32Å; E115-K118 PolarHBondContact O-N 2.88Å; R116-K118 VanDerWaalsContact C-N 3.32Å; R116-K118 PolarHBondContact O-N 2.94Å; K118-Y120 PolarHBondContact O-N 3.47Å; K118-L121 PolarHBondContact O-N 2.84Å; K118-E122 WeakPolarHBondContact CE-OE1 3.27Å; K118-E122 WeakPolarHBondContact CG-OE1 3.33Å; K118-E122 WeakPolarHBondContact O-CG 3.39Å; K118-E122 PolarHBondContact O-N 3.25Å
119K98.8Very high98.8Very high119 Ų119108.5 Ų108.552%0.51751%0.511SS..Hα-helixtrans-58.9-48178.4-74.8171.9-178.6171.40111.8E115 R116 E117 L121 E122 E123E115-K119 WeakPolarHBondContact O-CG 3.37Å; E115-K119 PolarHBondContact O-N 3.42Å; R116-K119 PolarHBondContact O-N 3.08Å; E117-K119 PolarHBondContact O-N 3.16Å; K119-L121 VanDerWaalsContact C-N 3.33Å; K119-L121 PolarHBondContact O-N 3.35Å; K119-E122 PolarHBondContact O-N 3.47Å; K119-E123 WeakPolarHBondContact O-CG 3.35Å; K119-E123 PolarHBondContact O-N 3.35Å
120Y98.8Very high98.8Very high148 Ų148110.8 Ų110.858%0.5852%0.517SS*.Hα-helixtrans-65.9-35.8179.4-64.6-35.7000112.9R116 E117 K118 E123 L124R116-Y120 HydrophobicContact CB-CE2 4.25Å; R116-Y120 VanDerWaalsContact O-CD2 3.27Å; R116-Y120 WeakPolarHBondContact O-CD2 2.98Å; R116-Y120 PolarHBondContact O-N 3.47Å; E117-Y120 PolarHBondContact O-N 3.35Å; K118-Y120 PolarHBondContact O-N 3.47Å; Y120-E123 PolarHBondContact O-N 2.88Å; Y120-L124 VanDerWaalsContact O-CB 3.28Å; Y120-L124 WeakPolarHBondContact O-CB 3.33Å; Y120-L124 PolarHBondContact O-N 2.94Å
121L98.8Very high98.8Very high90 Ų90112 Ų11247%0.47153%0.526SS..Hα-helixtrans-65.9-41.1175.2-174.265.8000111.6E117 K118 K119 L124 K125E117-L121 WeakPolarHBondContact O-CB 3.49Å; E117-L121 PolarHBondContact O-N 3.15Å; K118-L121 PolarHBondContact O-N 2.84Å; K119-L121 VanDerWaalsContact C-N 3.33Å; K119-L121 PolarHBondContact O-N 3.35Å; L121-L124 PolarHBondContact O-N 3.36Å; L121-K125 VanDerWaalsContact O-CG 3.29Å; L121-K125 WeakPolarHBondContact O-CG 3.44Å; L121-K125 PolarHBondContact O-N 3.09Å
122E98.8Very high98.8Very high95 Ų95110.9 Ų110.944%0.44453%0.529SS..Hα-helixtrans-63.2-47.3174.6-73.7171.1-172.200111.3K118 K119 L124 K125 M126K118-E122 WeakPolarHBondContact CE-OE1 3.27Å; K118-E122 WeakPolarHBondContact CG-OE1 3.33Å; K118-E122 WeakPolarHBondContact O-CG 3.39Å; K118-E122 PolarHBondContact O-N 3.25Å; K119-E122 PolarHBondContact O-N 3.47Å; E122-L124 VanDerWaalsContact C-N 3.3Å; E122-L124 PolarHBondContact O-N 3.06Å; E122-K125 WeakPolarHBondContact O-CB 3.49Å; E122-K125 PolarHBondContact O-N 3Å; E122-M126 WeakPolarHBondContact O-CG 3.45Å; E122-M126 PolarHBondContact O-N 3.45Å
123E98.8Very high98.8Very high93 Ų93112 Ų11244%0.43554%0.536SS..Hα-helixtrans-58.5-42.1174.8-75.5-175.7-150.100112.5K119 Y120 M126 K127K119-E123 WeakPolarHBondContact O-CG 3.35Å; K119-E123 PolarHBondContact O-N 3.35Å; Y120-E123 PolarHBondContact O-N 2.88Å; E123-M126 PolarHBondContact O-N 3.27Å; E123-K127 WeakPolarHBondContact O-CB 3.49Å; E123-K127 WeakPolarHBondContact O-CG 3.39Å; E123-K127 PolarHBondContact O-N 3.29Å; E123-K127 IonicContact OE2-NZ 3.27Å; E123-K127 PolarHBondContact OE2-NZ 2.84Å
124L98.8Very high98.8Very high115 Ų115111.7 Ų111.760%0.60253%0.534SS*.Hα-helixtrans-64.4-42.4178.1-175.963.1000111.1Y120 L121 E122 K127 S128Y120-L124 VanDerWaalsContact O-CB 3.28Å; Y120-L124 WeakPolarHBondContact O-CB 3.33Å; Y120-L124 PolarHBondContact O-N 2.94Å; L121-L124 PolarHBondContact O-N 3.36Å; E122-L124 VanDerWaalsContact C-N 3.3Å; E122-L124 PolarHBondContact O-N 3.06Å; L124-K127 PolarHBondContact O-N 3.3Å; L124-S128 VanDerWaalsContact O-CB 3.24Å; L124-S128 WeakPolarHBondContact O-CB 3.47Å; L124-S128 PolarHBondContact O-N 3.14Å
125K98.8Very high98.8Very high129 Ų129109.7 Ų109.756%0.56154%0.535SS*.Hα-helixtrans-60.2-45.5174.1-75.6170.3179175.90111.4L121 E122 S128 H129L121-K125 VanDerWaalsContact O-CG 3.29Å; L121-K125 WeakPolarHBondContact O-CG 3.44Å; L121-K125 PolarHBondContact O-N 3.09Å; E122-K125 WeakPolarHBondContact O-CB 3.49Å; E122-K125 PolarHBondContact O-N 3Å; K125-S128 PolarHBondContact O-N 3.41Å; K125-H129 WeakPolarHBondContact O-CB 3.29Å; K125-H129 PolarHBondContact O-N 3.37Å
126M98.8Very high98.8Very high131 Ų131105.7 Ų105.765%0.64553%0.525SS*.Hα-helixtrans-63.1-44.4178.4-68.5-56.1-67.100112E122 E123 H129 K130E122-M126 WeakPolarHBondContact O-CG 3.45Å; E122-M126 PolarHBondContact O-N 3.45Å; E123-M126 PolarHBondContact O-N 3.27Å; M126-H129 PolarHBondContact O-N 3.37Å; M126-K130 WeakPolarHBondContact O-CB 3.28Å; M126-K130 PolarHBondContact O-N 3.4Å
127K98.7Very high98.8Very high126 Ų126103 Ų10355%0.54852%0.518SS..Hα-helixtrans-64.6-42.2176.3-72.7168.3-177.8159.20111.7E123 L124 K130 L131E123-K127 WeakPolarHBondContact O-CB 3.49Å; E123-K127 WeakPolarHBondContact O-CG 3.39Å; E123-K127 PolarHBondContact O-N 3.29Å; E123-K127 IonicContact OE2-NZ 3.27Å; E123-K127 PolarHBondContact OE2-NZ 2.84Å; L124-K127 PolarHBondContact O-N 3.3Å; K127-K130 PolarHBondContact O-N 2.93Å; K127-L131 WeakPolarHBondContact O-CG 3.49Å; K127-L131 PolarHBondContact O-N 3.43Å
128S98.8Very high98.8Very high74 Ų74102.9 Ų102.952%0.51752%0.521SS..Hα-helixtrans-60.9-45.5175.8177.90000111.6L124 K125 K130 L131 A132L124-S128 VanDerWaalsContact O-CB 3.24Å; L124-S128 WeakPolarHBondContact O-CB 3.47Å; L124-S128 PolarHBondContact O-N 3.14Å; K125-S128 PolarHBondContact O-N 3.41Å; S128-K130 PolarHBondContact O-N 3.27Å; S128-L131 PolarHBondContact O-N 2.78Å; S128-A132 PolarHBondContact O-N 3.38Å
129H98.8Very high98.7Very high123 Ų123102.1 Ų102.157%0.56952%0.519SS*.Hα-helixtrans-61-45.7175.7-17958.8000111.8K125 M126 L131 A132 V133K125-H129 WeakPolarHBondContact O-CB 3.29Å; K125-H129 PolarHBondContact O-N 3.37Å; M126-H129 PolarHBondContact O-N 3.37Å; H129-L131 VanDerWaalsContact C-N 3.34Å; H129-L131 PolarHBondContact O-N 2.92Å; H129-A132 WeakPolarHBondContact O-CB 3.46Å; H129-A132 PolarHBondContact O-N 3.49Å; H129-A132 VanDerWaalsContact O-N 3.16Å; H129-V133 WeakPolarHBondContact O-CG2 3.24Å; H129-V133 PolarHBondContact O-N 3.49Å
130K98.8Very high98.7Very high142 Ų142102.9 Ų102.962%0.61752%0.524SS*.Hα-helixtrans-59.6-43.1176.4-176174.7-179.1177.20112.4M126 K127 S128 A132 V133 L134M126-K130 WeakPolarHBondContact O-CB 3.28Å; M126-K130 PolarHBondContact O-N 3.4Å; K127-K130 PolarHBondContact O-N 2.93Å; S128-K130 PolarHBondContact O-N 3.27Å; K130-A132 VanDerWaalsContact C-N 3.34Å; K130-V133 PolarHBondContact O-N 3.25Å; K130-L134 HydrophobicContact CG-CD1 4.22Å; K130-L134 WeakPolarHBondContact O-CG 3.49Å; K130-L134 PolarHBondContact O-N 2.93Å
131L98.8Very high98.7Very high122 Ų122104.2 Ų104.264%0.63953%0.528SS*.Hα-helixtrans-62.3-41.5175.5-76.7172.3000111.7K127 S128 H129 V133 L134 S135K127-L131 WeakPolarHBondContact O-CG 3.49Å; K127-L131 PolarHBondContact O-N 3.43Å; S128-L131 PolarHBondContact O-N 2.78Å; H129-L131 VanDerWaalsContact C-N 3.34Å; H129-L131 PolarHBondContact O-N 2.92Å; L131-V133 PolarHBondContact O-N 2.97Å; L131-L134 PolarHBondContact O-N 3.41Å; L131-S135 WeakPolarHBondContact O-CB 3.46Å; L131-S135 PolarHBondContact O-N 3.32Å
132A98.8Very high98.7Very high62 Ų62102.1 Ų102.151%0.51252%0.524SS..Hα-helixtrans-61.8-42.5177.200000112S128 H129 K130 G136S128-A132 PolarHBondContact O-N 3.38Å; H129-A132 WeakPolarHBondContact O-CB 3.46Å; H129-A132 PolarHBondContact O-N 3.49Å; H129-A132 VanDerWaalsContact O-N 3.16Å; K130-A132 VanDerWaalsContact C-N 3.34Å; A132-G136 PolarHBondContact O-N 2.92Å
133V98.8Very high98.7Very high66 Ų66100.6 Ų100.640%0.452%0.524SS..Hα-helixtrans-62.3-52.8176.4173.80000111.1H129 K130 L131 S135 G136 E137H129-V133 WeakPolarHBondContact O-CG2 3.24Å; H129-V133 PolarHBondContact O-N 3.49Å; K130-V133 PolarHBondContact O-N 3.25Å; L131-V133 PolarHBondContact O-N 2.97Å; V133-S135 VanDerWaalsContact C-N 3.32Å; V133-S135 PolarHBondContact O-N 3.3Å; V133-G136 WeakPolarHBondContact O-CA 3.42Å; V133-G136 PolarHBondContact O-N 3.46Å; V133-G136 VanDerWaalsContact O-N 3.08Å; V133-E137 PolarHBondContact O-N 2.98Å
134L98.8Very high98.7Very high87 Ų87100 Ų10046%0.45553%0.527SS..Hα-helixtrans-63-37.7-180-68.9174.3000112.5K130 L131 G136 E137 L138K130-L134 HydrophobicContact CG-CD1 4.22Å; K130-L134 WeakPolarHBondContact O-CG 3.49Å; K130-L134 PolarHBondContact O-N 2.93Å; L131-L134 PolarHBondContact O-N 3.41Å; L134-G136 VanDerWaalsContact C-N 3.32Å; L134-E137 PolarHBondContact O-N 3.36Å; L134-L138 WeakPolarHBondContact O-CB 3.45Å; L134-L138 PolarHBondContact O-N 3.02Å
135S98.6Very high98.7Very high74 Ų7499.6 Ų99.652%0.51752%0.524SS..Hα-helixtrans-63.2-40.4173.9-171.60000111.2L131 V133 L138 E139L131-S135 WeakPolarHBondContact O-CB 3.46Å; L131-S135 PolarHBondContact O-N 3.32Å; V133-S135 VanDerWaalsContact C-N 3.32Å; V133-S135 PolarHBondContact O-N 3.3Å; S135-L138 PolarHBondContact O-N 3.41Å; S135-E139 WeakPolarHBondContact O-CB 3.46Å; S135-E139 PolarHBondContact O-N 2.79Å
136G98.8Very high98.7Very high31 Ų3196.1 Ų96.132%0.3252%0.519SS..Hα-helixtrans-63-44.2174.600000112.4A132 V133 L134 L138 E139 Q140A132-G136 PolarHBondContact O-N 2.92Å; V133-G136 WeakPolarHBondContact O-CA 3.42Å; V133-G136 PolarHBondContact O-N 3.46Å; V133-G136 VanDerWaalsContact O-N 3.08Å; L134-G136 VanDerWaalsContact C-N 3.32Å; G136-L138 VanDerWaalsContact C-N 3.34Å; G136-L138 PolarHBondContact O-N 3.35Å; G136-E139 PolarHBondContact O-N 3.48Å; G136-Q140 VanDerWaalsContact O-CG 3.29Å; G136-Q140 WeakPolarHBondContact O-CG 3.46Å; G136-Q140 PolarHBondContact O-N 3.2Å
137E98.6Very high98.7Very high84 Ų8497 Ų9739%0.39352%0.517SS..Hα-helixtrans-62.1-41.2175.7-70.4177.5-16300112.3V133 L134 Q140 R141V133-E137 PolarHBondContact O-N 2.98Å; L134-E137 PolarHBondContact O-N 3.36Å; E137-Q140 PolarHBondContact O-N 2.92Å; E137-R141 WeakPolarHBondContact O-CG 3.42Å; E137-R141 PolarHBondContact O-N 2.95Å
138L98.8Very high98.7Very high117 Ų11795 Ų9561%0.61351%0.511SS*.Hα-helixtrans-64.6-43.2177.6-172.6127.3000111.4L134 S135 G136 R141 A142L134-L138 WeakPolarHBondContact O-CB 3.45Å; L134-L138 PolarHBondContact O-N 3.02Å; S135-L138 PolarHBondContact O-N 3.41Å; G136-L138 VanDerWaalsContact C-N 3.34Å; G136-L138 PolarHBondContact O-N 3.35Å; L138-R141 PolarHBondContact O-N 2.9Å; L138-A142 WeakPolarHBondContact O-CB 3.2Å; L138-A142 PolarHBondContact O-N 2.78Å
139E98.6Very high98.6Very high116 Ų11694.2 Ų94.254%0.54250%0.504SS..Hα-helixtrans-63.3-41176.6-170.660.2-140.700111.9S135 G136 A142 S143S135-E139 WeakPolarHBondContact O-CB 3.46Å; S135-E139 PolarHBondContact O-N 2.79Å; G136-E139 PolarHBondContact O-N 3.48Å; E139-A142 PolarHBondContact O-N 3.49Å; E139-S143 WeakPolarHBondContact O-CB 3.34Å; E139-S143 PolarHBondContact O-N 2.98Å; E139-S143 PolarHBondContact O-OG 2.94Å
140Q98.8Very high98.6Very high135 Ų13592 Ų9263%0.63150%0.502SS*.Hα-helixtrans-62.7-42.9175-73.7173.24.400112G136 E137 S143 T144G136-Q140 VanDerWaalsContact O-CG 3.29Å; G136-Q140 WeakPolarHBondContact O-CG 3.46Å; G136-Q140 PolarHBondContact O-N 3.2Å; E137-Q140 PolarHBondContact O-N 2.92Å; Q140-S143 PolarHBondContact O-N 2.75Å; Q140-T144 PolarHBondContact O-N 3.14Å; Q140-T144 PolarHBondContact O-OG1 2.89Å
141R98.6Very high98.6Very high176 Ų17689.8 Ų89.866%0.66449%0.494SS*.Hα-helixtrans-64.2-44.4175.1-71.2179.9-171.9-139.45.2111.4E137 L138 S143 T144 I145E137-R141 WeakPolarHBondContact O-CG 3.42Å; E137-R141 PolarHBondContact O-N 2.95Å; L138-R141 PolarHBondContact O-N 2.9Å; R141-S143 VanDerWaalsContact C-N 3.34Å; R141-S143 PolarHBondContact O-N 3.06Å; R141-T144 PolarHBondContact O-N 3.33Å; R141-I145 WeakPolarHBondContact O-CG1 3.43Å; R141-I145 PolarHBondContact O-N 3.41Å
142A98.6Very high98.5Very high46 Ų4690 Ų9038%0.3850%0.495SS..Hα-helixtrans-59.4-44.5176.400000111.6L138 E139 T144 I145 A146L138-A142 WeakPolarHBondContact O-CB 3.2Å; L138-A142 PolarHBondContact O-N 2.78Å; E139-A142 PolarHBondContact O-N 3.49Å; A142-T144 VanDerWaalsContact C-N 3.35Å; A142-T144 PolarHBondContact O-N 3.42Å; A142-I145 PolarHBondContact O-N 3.35Å; A142-A146 WeakPolarHBondContact O-CB 3.45Å; A142-A146 PolarHBondContact O-N 2.91Å
143S98.5Very high98.4Very high64 Ų6492.9 Ų92.945%0.44850%0.497SS..Hα-helixtrans-59.6-43.3175.2-65.30000112.2E139 Q140 R141 A146 Y147E139-S143 WeakPolarHBondContact O-CB 3.34Å; E139-S143 PolarHBondContact O-N 2.98Å; E139-S143 PolarHBondContact O-OG 2.94Å; Q140-S143 PolarHBondContact O-N 2.75Å; R141-S143 VanDerWaalsContact C-N 3.34Å; R141-S143 PolarHBondContact O-N 3.06Å; S143-A146 PolarHBondContact O-N 2.84Å; S143-Y147 WeakPolarHBondContact O-CB 3.32Å; S143-Y147 PolarHBondContact O-N 3.47Å
144T98.6Very high98.3Very high79 Ų7992.1 Ų92.149%0.48550%0.498SS..Hα-helixtrans-64.4-44.2177.3-56.20000111.4Q140 R141 A142 A146 Y147 L148Q140-T144 PolarHBondContact O-N 3.14Å; Q140-T144 PolarHBondContact O-OG1 2.89Å; R141-T144 PolarHBondContact O-N 3.33Å; A142-T144 VanDerWaalsContact C-N 3.35Å; A142-T144 PolarHBondContact O-N 3.42Å; T144-A146 PolarHBondContact O-N 3.44Å; T144-Y147 PolarHBondContact O-N 3.32Å; T144-L148 HydrophobicContact CG2-CD1 4.13Å; T144-L148 HydrophobicContact CG2-CG 4.45Å; T144-L148 WeakPolarHBondContact O-CG 3.4Å; T144-L148 PolarHBondContact O-N 2.95Å
145I98.6Very high98.1Very high107 Ų10791.3 Ų91.355%0.54950%0.497SS..Hα-helixtrans-61.4-45.1176.7-68.6165.6000110.4R141 A142 Y147 L148 T149R141-I145 WeakPolarHBondContact O-CG1 3.43Å; R141-I145 PolarHBondContact O-N 3.41Å; A142-I145 PolarHBondContact O-N 3.35Å; I145-Y147 VanDerWaalsContact C-N 3.32Å; I145-Y147 PolarHBondContact O-N 3.46Å; I145-L148 PolarHBondContact O-N 3.08Å; I145-T149 WeakPolarHBondContact O-CB 3.29Å; I145-T149 PolarHBondContact O-N 3.38Å; I145-T149 PolarHBondContact O-OG1 3.49Å
146A98.6Very high97.9Very high56 Ų5694 Ų9446%0.46350%0.5SS..Hα-helixtrans-61.2-41.4177.600000112A142 S143 T144 S150A142-A146 WeakPolarHBondContact O-CB 3.45Å; A142-A146 PolarHBondContact O-N 2.91Å; S143-A146 PolarHBondContact O-N 2.84Å; T144-A146 PolarHBondContact O-N 3.44Å; A146-S150 WeakPolarHBondContact O-CB 3.27Å; A146-S150 PolarHBondContact O-N 2.91Å; A146-S150 PolarHBondContact O-OG 3.42Å
147Y98.6Very high97.7Very high150 Ų150100.5 Ų100.559%0.58852%0.519SS*.Hα-helixtrans-61.7-52174.8175-101.9000112.1S143 T144 I145 T149 S150 Q151S143-Y147 WeakPolarHBondContact O-CB 3.32Å; S143-Y147 PolarHBondContact O-N 3.47Å; T144-Y147 PolarHBondContact O-N 3.32Å; I145-Y147 VanDerWaalsContact C-N 3.32Å; I145-Y147 PolarHBondContact O-N 3.46Å; Y147-T149 VanDerWaalsContact C-N 3.32Å; Y147-T149 PolarHBondContact O-N 3.02Å; Y147-S150 WeakPolarHBondContact O-CB 3.37Å; Y147-S150 PolarHBondContact O-N 3.05Å; Y147-Q151 PolarHBondContact O-N 2.96Å
148L98.5Very high97.4Very high83 Ų83104.1 Ų104.144%0.43553%0.533SS..Hα-helixtrans-62.9-39.2178.6-67.7175.4000111.9T144 I145 S150 Q151 L152T144-L148 HydrophobicContact CG2-CD1 4.13Å; T144-L148 HydrophobicContact CG2-CG 4.45Å; T144-L148 WeakPolarHBondContact O-CG 3.4Å; T144-L148 PolarHBondContact O-N 2.95Å; I145-L148 PolarHBondContact O-N 3.08Å; L148-S150 VanDerWaalsContact C-N 3.34Å; L148-S150 PolarHBondContact O-N 3.38Å; L148-Q151 WeakPolarHBondContact O-CB 3.22Å; L148-Q151 PolarHBondContact O-N 3.3Å; L148-L152 WeakPolarHBondContact O-CG 3.45Å; L148-L152 PolarHBondContact O-N 3.33Å
149T98.3Very high97Very high58 Ų58104.2 Ų104.236%0.35653%0.534SS..Hα-helixtrans-61.1-44.5174.8-58.60000110.8I145 Y147 Q151 L152 H153I145-T149 WeakPolarHBondContact O-CB 3.29Å; I145-T149 PolarHBondContact O-N 3.38Å; I145-T149 PolarHBondContact O-OG1 3.49Å; Y147-T149 VanDerWaalsContact C-N 3.32Å; Y147-T149 PolarHBondContact O-N 3.02Å; T149-Q151 VanDerWaalsContact C-N 3.35Å; T149-Q151 PolarHBondContact O-N 3.39Å; T149-L152 PolarHBondContact O-N 2.99Å; T149-H153 PolarHBondContact O-CD2 3.37Å; T149-H153 PolarHBondContact O-N 3.42Å
150S97.9Very high96.5Very high76 Ų76104 Ų10453%0.53154%0.536SS..Hα-helixtrans-61.9-41.3174.3-58.70000111.9A146 Y147 L148 H153 A154A146-S150 WeakPolarHBondContact O-CB 3.27Å; A146-S150 PolarHBondContact O-N 2.91Å; A146-S150 PolarHBondContact O-OG 3.42Å; Y147-S150 WeakPolarHBondContact O-CB 3.37Å; Y147-S150 PolarHBondContact O-N 3.05Å; L148-S150 VanDerWaalsContact C-N 3.34Å; L148-S150 PolarHBondContact O-N 3.38Å; S150-H153 PolarHBondContact O-N 3.48Å; S150-A154 WeakPolarHBondContact O-CB 3.48Å; S150-A154 PolarHBondContact O-N 3.16Å
151Q98.2Very high95.6Very high96 Ų96100.9 Ų100.945%0.44953%0.533SS..Hα-helixtrans-63.9-41.9176.3-171-179.34800112.2Y147 L148 T149 A154 T155Y147-Q151 PolarHBondContact O-N 2.96Å; L148-Q151 WeakPolarHBondContact O-CB 3.22Å; L148-Q151 PolarHBondContact O-N 3.3Å; T149-Q151 VanDerWaalsContact C-N 3.35Å; T149-Q151 PolarHBondContact O-N 3.39Å; Q151-A154 PolarHBondContact O-N 3.45Å; Q151-T155 WeakPolarHBondContact O-CB 3.47Å; Q151-T155 PolarHBondContact O-N 2.85Å; Q151-T155 PolarHBondContact O-OG1 2.95Å
152L97.3Very high93.9Very high127 Ų12795.4 Ų95.467%0.66553%0.532SS*.Hα-helixtrans-61.3-46.8173.6-75.6174.1000111.1L148 T149 A154 T155 K156L148-L152 WeakPolarHBondContact O-CG 3.45Å; L148-L152 PolarHBondContact O-N 3.33Å; T149-L152 PolarHBondContact O-N 2.99Å; L152-A154 PolarHBondContact O-N 3.35Å; L152-T155 PolarHBondContact O-N 3.47Å; L152-K156 WeakPolarHBondContact O-CB 3.41Å; L152-K156 PolarHBondContact O-N 3.01Å
153H96.7Very high92Very high122 Ų12298.5 Ų98.557%0.56555%0.551SS**Hα-helixtrans-61.8-43176.3-77.4-63.1000112.5T149 S150 K156 K157T149-H153 PolarHBondContact O-CD2 3.37Å; T149-H153 PolarHBondContact O-N 3.42Å; S150-H153 PolarHBondContact O-N 3.48Å; H153-K156 PolarHBondContact O-N 3Å; H153-K157 WeakPolarHBondContact O-CB 3.46Å; H153-K157 PolarHBondContact O-N 2.81Å
154A96.1Very high89.7Confident50 Ų5098.7 Ų98.741%0.41355%0.552SS.*Hα-helixtrans-62-43.6176.800000111.8S150 Q151 L152 K157 K158S150-A154 WeakPolarHBondContact O-CB 3.48Å; S150-A154 PolarHBondContact O-N 3.16Å; Q151-A154 PolarHBondContact O-N 3.45Å; L152-A154 PolarHBondContact O-N 3.35Å; A154-K157 PolarHBondContact O-N 2.98Å; A154-K158 WeakPolarHBondContact O-CG 3.38Å; A154-K158 PolarHBondContact O-N 3.36Å
155T95.3Very high87.4Confident71 Ų71100.4 Ų100.444%0.43657%0.567SS.*Hα-helixtrans-66.9-45.4178.2-54.70000111.4Q151 L152 K157 K158 L159Q151-T155 WeakPolarHBondContact O-CB 3.47Å; Q151-T155 PolarHBondContact O-N 2.85Å; Q151-T155 PolarHBondContact O-OG1 2.95Å; L152-T155 PolarHBondContact O-N 3.47Å; T155-K157 VanDerWaalsContact C-N 3.31Å; T155-K157 PolarHBondContact O-N 2.95Å; T155-K158 PolarHBondContact O-N 2.88Å; T155-K158 VanDerWaalsContact O-N 3.14Å; T155-L159 HydrophobicContact CG2-CD1 4.39Å; T155-L159 WeakPolarHBondContact O-CG 3.33Å; T155-L159 PolarHBondContact O-N 3.3Å
156K94.6Very high84.9Confident131 Ų131104.9 Ų104.957%0.5759%0.586SS**Hα-helixtrans-55.3-47.1173.6179.7176179.1177.70111L152 H153 K158 L159 L160L152-K156 WeakPolarHBondContact O-CB 3.41Å; L152-K156 PolarHBondContact O-N 3.01Å; H153-K156 PolarHBondContact O-N 3Å; K156-K158 VanDerWaalsContact C-N 3.34Å; K156-K158 PolarHBondContact O-N 3.42Å; K156-L159 PolarHBondContact O-N 3.08Å; K156-L160 HydrophobicContact CG-CD1 3.79Å; K156-L160 WeakPolarHBondContact O-CD1 3.41Å; K156-L160 PolarHBondContact O-N 3.42Å
157K93.6Very high82.3Confident166 Ų166106.1 Ų106.172%0.72260%0.596SS**Hα-helixtrans-60.5-42.1177.4-173.6178.2178.51800112H153 A154 T155 A161H153-K157 WeakPolarHBondContact O-CB 3.46Å; H153-K157 PolarHBondContact O-N 2.81Å; A154-K157 PolarHBondContact O-N 2.98Å; T155-K157 VanDerWaalsContact C-N 3.31Å; T155-K157 PolarHBondContact O-N 2.95Å; K157-A161 VanDerWaalsContact O-CB 3.26Å; K157-A161 WeakPolarHBondContact O-CB 3.4Å; K157-A161 PolarHBondContact O-N 3.43Å
158K92.6Very high79.8Confident161 Ų161104.5 Ų104.570%0.761%0.606SS**Hα-helixtrans-63.7-43176.1-72.9177.1-179.8-176.30112.5A154 T155 K156 A161 G162A154-K158 WeakPolarHBondContact O-CG 3.38Å; A154-K158 PolarHBondContact O-N 3.36Å; T155-K158 PolarHBondContact O-N 2.88Å; T155-K158 VanDerWaalsContact O-N 3.14Å; K156-K158 VanDerWaalsContact C-N 3.34Å; K156-K158 PolarHBondContact O-N 3.42Å; K158-A161 PolarHBondContact O-N 2.89Å; K158-G162 PolarHBondContact O-N 2.92Å
159L91.4Very high78Confident118 Ų118106.5 Ų106.562%0.61862%0.624SS**Hα-helixtrans-63.6-45.8176.4-70.2174000111.6T155 K156 A161 G162 S163T155-L159 HydrophobicContact CG2-CD1 4.39Å; T155-L159 WeakPolarHBondContact O-CG 3.33Å; T155-L159 PolarHBondContact O-N 3.3Å; K156-L159 PolarHBondContact O-N 3.08Å; L159-A161 VanDerWaalsContact C-N 3.33Å; L159-A161 PolarHBondContact O-N 2.99Å; L159-G162 PolarHBondContact O-N 3.28Å; L159-S163 PolarHBondContact O-N 3.22Å; L159-S163 PolarHBondContact O-OG 3.46Å
160L87.6Confident75.4Confident112 Ų112110.7 Ų110.759%0.58664%0.644SS**Hα-helixtrans-64.7-36.9176.8-89.274.9000112.3K156K156-L160 HydrophobicContact CG-CD1 3.79Å; K156-L160 WeakPolarHBondContact O-CD1 3.41Å; K156-L160 PolarHBondContact O-N 3.42Å
161A79.2Confident72.9Confident69 Ų69113.8 Ų113.857%0.5766%0.66SS**Hα-helixtrans-71.1-32.3174.700000112.7K157 K158 L159K157-A161 VanDerWaalsContact O-CB 3.26Å; K157-A161 WeakPolarHBondContact O-CB 3.4Å; K157-A161 PolarHBondContact O-N 3.43Å; K158-A161 PolarHBondContact O-N 2.89Å; L159-A161 VanDerWaalsContact C-N 3.33Å; L159-A161 PolarHBondContact O-N 2.99Å
162G63.7Low70.5Confident62 Ų62113.9 Ų113.964%0.63967%0.671SS**Hα-helixtrans-76.8-23.9177.200000114.5K158 L159 S164K158-G162 PolarHBondContact O-N 2.92Å; L159-G162 PolarHBondContact O-N 3.28Å; G162-S164 VanDerWaalsContact C-N 3.27Å
163S57.4Low68.4Low111 Ų111113.8 Ų113.878%0.77668%0.678SS**THydrogen-bonded Turntrans-85.47.5172.2-68.80000113.9L159L159-S163 PolarHBondContact O-N 3.22Å; L159-S163 PolarHBondContact O-OG 3.46Å
164S51.3Low66Low67 Ų67116.1 Ų116.147%0.46969%0.693SS.*  trans-125.357.9179.8-169.20000111.3G162G162-S164 VanDerWaalsContact C-N 3.27Å
165S49.6Very low63.6Low116 Ų116118.6 Ų118.681%0.81171%0.707SS**SBendtrans-91.7129.7140.9-83.30000106.4
166E47.3Very low61.5Low201 Ų201119.8 Ų119.894%0.93972%0.718SS**SBendtrans82.361.8-163.1-61.1-88.8142.600115.2
167A44Very low59.2Low81 Ų81124.6 Ų124.667%0.66974%0.735SS**  trans-165.7122.9138.400000111
168S44.7Very low57.1Low116 Ų116126.5 Ų126.581%0.81174%0.743SS**  trans-52155.4-175.8-92.20000116.9N170S168-N170 PolarHBondContact O-N 2.87Å
169P60.4Low55Low126 Ų126124.4 Ų124.482%0.81875%0.746SS**  trans-89.999.5173.135.1-26.6000109.9
170N45.4Very low53.1Low145 Ų145124.9 Ų124.978%0.77575%0.754SS**  trans-168.3109.7160.6-136.2-7.6000108.8S168S168-N170 PolarHBondContact O-N 2.87Å
171V45.1Very low52Low141 Ų141124.8 Ų124.886%0.85576%0.76SS**  -167.7130.5100.2-153.10000108.6
172S47.8Very low51.4Low99 Ų99126.9 Ų126.969%0.69277%0.768SS**  trans-63.7169.7170.4-71.90000113.3
173P52.7Low51.3Low125 Ų125129.9 Ų129.981%0.81278%0.776SS**  trans-87139.6-152.634.9-31.7000112.5
174I45.8Very low50.8Low171 Ų171129 Ų12988%0.87778%0.775SS**  trans-100.9111.3170.7-51.5167.1000108.1
175S46.5Very low50.3Low101 Ų101135 Ų13571%0.70679%0.793SS**  trans-55.8161167.6-177.80000112.3
176S51.3Low50Low96 Ų96136.6 Ų136.667%0.67179%0.793SS**  trans92.161155.673.30000119.6
177Y46.6Very low49.9Very low233 Ų233138 Ų13891%0.91479%0.789SS**  trans-121.5111.1130.5-70.8-83.6000107.2P179Y177-P179 VanDerWaalsContact O-CD 3.24Å; Y177-P179 WeakPolarHBondContact O-CD 3.5Å
178K48.7Very low49.6Very low206 Ų206141.3 Ų141.390%0.89679%0.791SS**  trans-81.2113.1167.8-85.1-177.1174-174.10107.5
179P48.8Very low49.8Very low116 Ų116141.1 Ų141.175%0.75379%0.787SS**  trans-71.8130.4152.5-4.123.9000107.1Y177Y177-P179 VanDerWaalsContact O-CD 3.24Å; Y177-P179 WeakPolarHBondContact O-CD 3.5Å
180T52.1Low48.8Very low129 Ų129143 Ų14379%0.79178%0.784SS**  trans-43.5129.2172.4-39.40000111
181P63Low49.2Very low110 Ų110140.9 Ų140.971%0.71478%0.777SS**PPolyproline II helixtrans-69.8135.7175.515.4-11.4000110
182P67.8Low49.5Very low113 Ų113140.6 Ų140.673%0.73478%0.778SS**PPolyproline II helixtrans-64.8146.6165.927.9-31.7000109.3A184P182-A184 PolarHBondContact O-N 2.96Å
183P60.5Low49.9Very low124 Ų124146.7 Ų146.781%0.80579%0.786SS**PPolyproline II helixtrans-60.5137.1-178.524.4-32.9000111K185P183-K185 PolarHBondContact O-N 3.34Å
184A46.6Very low50.2Low93 Ų93152.1 Ų152.177%0.76979%0.79SS**  trans-54.9109.9173.600000110.3P182P182-A184 PolarHBondContact O-N 2.96Å
185K41.8Very low50.3Low192 Ų192153.6 Ų153.684%0.83579%0.785SS**  trans-91.986.6150.3-82.5-176177.51790106.5P183 R187P183-K185 PolarHBondContact O-N 3.34Å; K185-R187 VanDerWaalsContact C-N 3.25Å; K185-R187 PolarHBondContact O-N 2.92Å
186D43Very low50.3Low151 Ų151157.3 Ų157.381%0.80779%0.793SS**  trans-59.4100.1155.1-94.5-34.3000107.4Q188D186-Q188 VanDerWaalsContact C-N 3.31Å; D186-Q188 PolarHBondContact O-N 2.74Å; D186-Q188 VanDerWaalsContact O-N 3.17Å
187R45.9Very low50.3Low231 Ų231159.5 Ų159.587%0.87279%0.791SS**  trans-73.391.7160.3-73.3-176.8170.6-174.5-2106.7K185K185-R187 VanDerWaalsContact C-N 3.25Å; K185-R187 PolarHBondContact O-N 2.92Å
188Q37.9Very low50.9Low149 Ų149158.1 Ų158.170%0.69679%0.79SS**  trans-63132.9148.2-80.8-69.9-42.800107.9D186 E190D186-Q188 VanDerWaalsContact C-N 3.31Å; D186-Q188 PolarHBondContact O-N 2.74Å; D186-Q188 VanDerWaalsContact O-N 3.17Å; Q188-E190 PolarHBondContact O-N 3.42Å
189P49Very low51Low112 Ų112153.5 Ų153.573%0.72778%0.783SS**  trans-75.481.7165.731-28.9000107.9T191P189-T191 VanDerWaalsContact C-N 3.27Å; P189-T191 PolarHBondContact O-N 2.82Å
190E38.6Very low51.1Low165 Ų165156.6 Ų156.677%0.77179%0.792SS**  trans-71.790.5168.7-156.691.5-157.700107.3Q188 P192Q188-E190 PolarHBondContact O-N 3.42Å; E190-P192 VanDerWaalsContact O-CD 3.27Å; E190-P192 WeakPolarHBondContact O-CD 3.4Å
191T53.4Low51.1Low101 Ų101156 Ų15662%0.6279%0.793SS**  trans-54.9126.7162.555.70000107.7P189 R193P189-T191 VanDerWaalsContact C-N 3.27Å; P189-T191 PolarHBondContact O-N 2.82Å; T191-R193 PolarHBondContact O-N 2.92Å
192P51.2Low50.2Low136 Ų136158.8 Ų158.888%0.88380%0.797SS**  trans-7368.8168.6-14.930.9000109.3E190 R194E190-P192 VanDerWaalsContact O-CD 3.27Å; E190-P192 WeakPolarHBondContact O-CD 3.4Å; P192-R194 PolarHBondContact O-N 3.38Å; P192-R194 VanDerWaalsContact O-N 3.08Å
193R56.5Low49.2Very low226 Ų226159.5 Ų159.585%0.85380%0.802SS**  trans-78.795.3172.4-142177-173-179.12107T191 R195T191-R193 PolarHBondContact O-N 2.92Å; R193-R195 PolarHBondContact O-N 3.44Å
194R59Low48.5Very low240 Ų240161.6 Ų161.691%0.90681%0.805SS**  trans26.693.4153.4-76.8174.3126.8-1670.5114.8P192P192-R194 PolarHBondContact O-N 3.38Å; P192-R194 VanDerWaalsContact O-N 3.08Å
195R48.2Very low48.2Very low201 Ų201164.6 Ų164.676%0.75880%0.803SS**  trans-133.888.9141.9-158.4176.7-174-1725.4108.3R193 K197R193-R195 PolarHBondContact O-N 3.44Å; R195-K197 HydrophobicContact CG-CG 4.02Å; R195-K197 VanDerWaalsContact NE-CE 3.35Å; R195-K197 PolarHBondContact O-N 3.29Å
196M47.2Very low48.3Very low180 Ų180160.5 Ų160.589%0.88780%0.796SS**  trans-60.990.1160.5-70.2-17969.400107.3K198M196-K198 PolarHBondContact O-N 3.49Å
197K50.4Low48.2Very low142 Ų142161.3 Ų161.362%0.61780%0.795SS**  trans-82.2103.1159.9-77.2-122.7178.6175.10106R195 S199R195-K197 HydrophobicContact CG-CG 4.02Å; R195-K197 VanDerWaalsContact NE-CE 3.35Å; R195-K197 PolarHBondContact O-N 3.29Å; K197-S199 PolarHBondContact O-N 2.96Å
198K58.6Low48.3Very low204 Ų204153.5 Ų153.589%0.88777%0.77SS**  trans-29.798.1162.3-27-178.5-172.8-176.10110.4M196M196-K198 PolarHBondContact O-N 3.49Å
199S51.4Low48.7Very low109 Ų109150.5 Ų150.576%0.76276%0.762SS**  trans-141.467162.5-57.40000106.1K197K197-S199 PolarHBondContact O-N 2.96Å
200L51Low48.8Very low180 Ų180149 Ų14994%0.94275%0.745SS**  trans-120.959.3173-129.8127.7000107.3
201S51.7Low49.6Very low116 Ų116144.8 Ų144.881%0.81173%0.73SS**  trans-150.560.1172.661.30000107.6
202Q45.2Very low49.8Very low170 Ų170145.2 Ų145.279%0.79472%0.722SS**SBendtrans-128.3116.5157.1-157166.515.900104.1L204Q202-L204 PolarHBondContact O-N 3.38Å
203P45.6Very low50.1Low128 Ų128146.6 Ų146.683%0.83171%0.709SS**  trans-57.7111176.8-22.833.2000107.8H205P203-H205 PolarHBondContact O-N 2.91Å
204L45.4Very low49.7Very low167 Ų167142 Ų14287%0.87470%0.701SS**  trans-62.3128.5162.2-66.6176.1000105.4Q202Q202-L204 PolarHBondContact O-N 3.38Å
205H41Very low50Low156 Ų156131.2 Ų131.272%0.72266%0.664SS**  trans-27.7140.2175.5-160.1-85.5000113P203 E207P203-H205 PolarHBondContact O-N 2.91Å; H205-E207 PolarHBondContact O-N 2.68Å
206P44Very low50.5Low106 Ų106128.6 Ų128.669%0.68867%0.673SS**  trans-58.4101.7176.222.9-31000109.3L208P206-L208 PolarHBondContact O-N 3.45Å; P206-L208 VanDerWaalsContact O-N 3.14Å
207E41.1Very low51.1Low168 Ų168124.9 Ų124.979%0.78566%0.657SS**  trans-73.7100.1174.6-80.4-83.3173.700106.6H205 T209H205-E207 PolarHBondContact O-N 2.68Å; E207-T209 PolarHBondContact O-N 2.97Å; E207-T209 VanDerWaalsContact O-N 3.08Å
208L47.9Very low51.6Low68 Ų68120.7 Ų120.736%0.35665%0.654SS.*  trans-58.3111.2175.5-72.5152.7000108.3P206 E210 R224P206-L208 PolarHBondContact O-N 3.45Å; P206-L208 VanDerWaalsContact O-N 3.14Å; L208-E210 PolarHBondContact O-N 2.92Å; L208-R224 HydrophobicContact CD2-CB 4.49Å
209T46.3Very low51.4Low86 Ų86119.8 Ų119.853%0.52865%0.645SS.*  trans-74.2111.6176.1-62.90000108.7E207 V211E207-T209 PolarHBondContact O-N 2.97Å; E207-T209 VanDerWaalsContact O-N 3.08Å; T209-V211 HydrophobicContact CG2-CG2 4.1Å; T209-V211 PolarHBondContact O-N 2.85Å; T209-V211 VanDerWaalsContact O-N 3.1Å
210E50.8Low51.7Low80 Ų80122.9 Ų122.937%0.37464%0.64SS.*EExtended strand (participates in β ladder)trans-74.598.1176.1-67.6-176.8174.700110.1L208 Y212 V222 R224L208-E210 PolarHBondContact O-N 2.92Å; E210-Y212 HydrophobicContact CB-CE2 3.99Å; E210-Y212 WeakPolarHBondContact O-CD2 3.15Å; E210-Y212 PolarHBondContact OE2-OH 3.33Å; E210-V222 HydrophobicContact CG-CG1 4.3Å; E210-R224 IonicContact OE1-CZ 2.84Å; E210-R224 IonicContact OE1-NE 3.41Å; E210-R224 IonicContact OE1-NH2 3.72Å; E210-R224 PolarHBondContact OE1-NH2 3.17Å
211V56.7Low52Low76 Ų76118.8 Ų118.846%0.46162%0.618SS.*EExtended strand (participates in β ladder)trans-88112.5173.7-176.40000108.6T209 R213T209-V211 HydrophobicContact CG2-CG2 4.1Å; T209-V211 PolarHBondContact O-N 2.85Å; T209-V211 VanDerWaalsContact O-N 3.1Å; V211-R213 PolarHBondContact O-N 3.4Å
212Y56.5Low52.2Low111 Ų111116.9 Ų116.944%0.43560%0.601SS.*EExtended strand (participates in β ladder)trans-81.7108.4175.3-66-94000109.2E210 V222E210-Y212 HydrophobicContact CB-CE2 3.99Å; E210-Y212 WeakPolarHBondContact O-CD2 3.15Å; E210-Y212 PolarHBondContact OE2-OH 3.33Å; Y212-V222 HydrophobicContact CD1-CG2 4.31Å; Y212-V222 HydrophobicContact CE1-CG2 3.91Å
213R58.8Low52.7Low164 Ų164113 Ų11362%0.61959%0.585SS**EExtended strand (participates in β ladder)trans-99.7140.9163.9-80.4-167.6-172.9109.1-0.7110.2V211 I221V211-R213 PolarHBondContact O-N 3.4Å; R213-I221 PolarHBondContact O-N 2.85Å
214L47.2Very low53Low130 Ų130113.6 Ų113.668%0.68157%0.571SS**EExtended strand (participates in β ladder)trans-87.5118.4174.8-158.668000108.4R220L214-R220 HydrophobicContact CD1-CG 4.1Å
215G64.6Low53.3Low13 Ų13111.3 Ų111.313%0.13456%0.556CS.*PPolyproline II helixtrans-71.7162.817700000112.4D217 G218 R219G215-D217 PolarHBondContact O-N 2.94Å; G215-D217 VanDerWaalsContact O-N 3.1Å; G215-G218 PolarHBondContact O-N 3.47Å; G215-R219 PolarHBondContact N-O 2.9Å; G215-R219 VanDerWaalsContact N-O 3.13Å
216P58.4Low53.7Low146 Ų146109 Ų10995%0.94856%0.555SS**THydrogen-bonded Turntrans-63.1-14.5-179.926.4-33.7000113.9
217D61.3Low54.3Low103 Ų103109.4 Ų109.455%0.55156%0.555SS**THydrogen-bonded Turntrans-98.17.5176.756.6-36.2000113.4G215 R219G215-D217 PolarHBondContact O-N 2.94Å; G215-D217 VanDerWaalsContact O-N 3.1Å; D217-R219 PolarHBondContact O-N 3.21Å
218G60.5Low55.3Low53 Ų53108.7 Ų108.755%0.54656%0.557SS.*SBendtrans75.73.3174.900000115G215G215-G218 PolarHBondContact O-N 3.47Å
219R54.3Low56.3Low186 Ų186109.2 Ų109.270%0.70257%0.571SS**PPolyproline II helixtrans-88.2140.1175.5-62.5-178.5-179.3-154.71.1110.1G215 D217 I221G215-R219 PolarHBondContact N-O 2.9Å; G215-R219 VanDerWaalsContact N-O 3.13Å; D217-R219 PolarHBondContact O-N 3.21Å; R219-I221 PolarHBondContact O-N 2.87Å
220R57.4Low57.6Low173 Ų173113.2 Ų113.265%0.65359%0.586SS**EExtended strand (participates in β ladder)trans-78.2119.6177.6-62.3178.783.3-176.12.7108.7L214L214-R220 HydrophobicContact CD1-CG 4.1Å
221I58.4Low58.4Low94 Ų94114.8 Ų114.848%0.48260%0.603SS.*EExtended strand (participates in β ladder)trans-100.9121.9175.2-61.1172.4000107.5R213 R219R213-I221 PolarHBondContact O-N 2.85Å; R219-I221 PolarHBondContact O-N 2.87Å
222V55.7Low59.2Low76 Ų76114.5 Ų114.546%0.46160%0.599SS.*EExtended strand (participates in β ladder)trans-87106.6172.7-179.60000107.4E210 Y212E210-V222 HydrophobicContact CG-CG1 4.3Å; Y212-V222 HydrophobicContact CD1-CG2 4.31Å; Y212-V222 HydrophobicContact CE1-CG2 3.91Å
223L55.4Low59.9Low88 Ų88115 Ų11546%0.46162%0.616SS.*EExtended strand (participates in β ladder)trans-98.6113.2173.4-171.367.4000108.5E225L223-E225 PolarHBondContact O-N 3.35Å
224R51.8Low60.2Low141 Ų141110 Ų11053%0.53260%0.604SS.*EExtended strand (participates in β ladder)trans-87.496.7171.3-78-145172-165.6-4.7109L208 E210L208-R224 HydrophobicContact CD2-CB 4.49Å; E210-R224 IonicContact OE1-CZ 2.84Å; E210-R224 IonicContact OE1-NE 3.41Å; E210-R224 IonicContact OE1-NH2 3.72Å; E210-R224 PolarHBondContact OE1-NH2 3.17Å
225E51.3Low61.2Low119 Ų119107.4 Ų107.456%0.55659%0.594SS**  trans-99.7126.4175.6-163.7166.6-169.800109.2L223 V227L223-E225 PolarHBondContact O-N 3.35Å; E225-V227 PolarHBondContact O-N 3.49Å; E225-V227 VanDerWaalsContact O-N 3.16Å
226P50.3Low61.1Low109 Ų109115.4 Ų115.471%0.70863%0.626SS**  trans-68112.2173.326.3-29.6000108.4D228P226-D228 PolarHBondContact O-N 3.19Å
227V55.6Low61.2Low113 Ų113115 Ų11569%0.68562%0.615SS**PPolyproline II helixtrans-77.5121.5174-176.90000107.5E225 A229E225-V227 PolarHBondContact O-N 3.49Å; E225-V227 VanDerWaalsContact O-N 3.16Å; V227-A229 PolarHBondContact O-N 2.81Å
228D63.3Low61.2Low153 Ų153116.2 Ų116.282%0.81862%0.617SS**PPolyproline II helixtrans-61.6127.3171.3-165.416.3000108.5P226 M230P226-D228 PolarHBondContact O-N 3.19Å; D228-M230 PolarHBondContact O-N 2.93Å
229A67Low60.8Low80 Ų80117.5 Ų117.566%0.66162%0.623SS**PPolyproline II helixtrans-62.2133.7-177.200000108.7V227V227-A229 PolarHBondContact O-N 2.81Å
230M74.3Confident60.7Low169 Ų169112.2 Ų112.283%0.83363%0.626SS**PPolyproline II helixtrans-51.6134.6177.3-86.6-177.935.500110.1D228 D232D228-M230 PolarHBondContact O-N 2.93Å; M230-D232 PolarHBondContact O-N 2.86Å
231P68.8Low60.4Low113 Ų113115.2 Ų115.273%0.73464%0.638SS**PPolyproline II helixtrans-57.2137.5179.422.7-31.8000109.8P233P231-P233 VanDerWaalsContact O-N 3.16Å
232D72.6Confident59.3Low71 Ų71119.3 Ų119.338%0.3865%0.654SS.*PPolyproline II helixtrans-49.7121.3-178.1-179.2-14.6000109.5M230 T234 P235 Q238M230-D232 PolarHBondContact O-N 2.86Å; D232-T234 PolarHBondContact O-N 3.49Å; D232-T234 WeakPolarHBondContact OD1-CA 3.24Å; D232-T234 PolarHBondContact OD1-N 3.07Å; D232-T234 PolarHBondContact OD1-OG1 3.06Å; D232-P235 WeakPolarHBondContact O-CD 3.42Å; D232-Q238 PolarHBondContact OD2-NE2 3.14Å
233P70.1Confident58.2Low121 Ų121120.7 Ų120.779%0.78667%0.668SS**SBendtrans-66.3-5-179.428-35.7000113.3P231P231-P233 VanDerWaalsContact O-N 3.16Å
234T66.3Low57.6Low60 Ų60121.8 Ų121.837%0.36868%0.68SS.*  trans-132.259.1-174.448.60000113.7D232 F236 L237D232-T234 PolarHBondContact O-N 3.49Å; D232-T234 WeakPolarHBondContact OD1-CA 3.24Å; D232-T234 PolarHBondContact OD1-N 3.07Å; D232-T234 PolarHBondContact OD1-OG1 3.06Å; T234-F236 PolarHBondContact O-N 2.94Å; T234-L237 HydrophobicContact CG2-CD1 3.7Å; T234-L237 HydrophobicContact CG2-CG 4.29Å; T234-L237 PolarHBondContact O-N 3.42Å; T234-L237 VanDerWaalsContact O-N 3.14Å
235P67.4Low56.7Low75 Ų75122.4 Ų122.449%0.48769%0.694SS.*G310 helixtrans-62.7-22.5-177.627.6-34.6000112.9D232D232-P235 WeakPolarHBondContact O-CD 3.42Å
236F62.9Low56.1Low180 Ų180120.2 Ų120.279%0.78970%0.696SS**G310 helixtrans-85.3-11.2-177.5-48.3-73.1000114.1T234 Q238T234-F236 PolarHBondContact O-N 2.94Å; F236-Q238 VanDerWaalsContact C-N 3.33Å
237L61.5Low55.4Low139 Ų139123.6 Ų123.673%0.72870%0.702SS**G310 helixtrans-84.5-10.5-179.6-63.8-175.8000113T234T234-L237 HydrophobicContact CG2-CD1 3.7Å; T234-L237 HydrophobicContact CG2-CG 4.29Å; T234-L237 PolarHBondContact O-N 3.42Å; T234-L237 VanDerWaalsContact O-N 3.14Å
238Q59.8Low54.9Low127 Ų127127.5 Ų127.559%0.59371%0.713SS**SBendtrans-91.2-10.4-177.2-59.4-171.8-1.400113.8D232 F236 G240 R241D232-Q238 PolarHBondContact OD2-NE2 3.14Å; F236-Q238 VanDerWaalsContact C-N 3.33Å; Q238-G240 PolarHBondContact O-N 3.38Å; Q238-R241 PolarHBondContact O-N 2.92Å
239A53.3Low53.9Low80 Ų80126.8 Ų126.866%0.66171%0.713SS**THydrogen-bonded Turntrans-68.37.8-177.700000115.4
240G52.4Low53Low75 Ų75129.4 Ų129.477%0.77372%0.721SS**THydrogen-bonded Turntrans-112.76.6-178.400000114.9Q238Q238-G240 PolarHBondContact O-N 3.38Å
241R50.5Low51.3Low237 Ų237132.9 Ų132.989%0.89472%0.724SS**  trans-133.660.8-176.9-145-177.8-151-116.14.7112Q238Q238-R241 PolarHBondContact O-N 2.92Å
242E35.6Very low49.9Very low179 Ų179136 Ų13684%0.83673%0.729SS**  trans-77.8116.5170-52.1-89.9144.300108.6
243S32.2Very low48.5Very low105 Ų105143.9 Ų143.973%0.73475%0.754SS**  trans-108.2140.7149.672.60000107.7D245S243-D245 PolarHBondContact O-N 3.34Å
244P43.1Very low47.3Very low112 Ų112143.5 Ų143.573%0.72775%0.751SS**  trans-80125.2-176.233.3-29.8000109
245D33.3Very low46.4Very low154 Ų154145.5 Ų145.582%0.82477%0.774SS**  169.1138.5120.7-84.5-32.8000111.7S243S243-D245 PolarHBondContact O-N 3.34Å
246A37.3Very low45.6Very low72 Ų72147.9 Ų147.960%0.59579%0.787SS**  trans73.7101.2161.300000118
247H36.1Very low45.1Very low180 Ų180147 Ų14783%0.83379%0.788SS**  174121.790-83.9-67.1000110.8V249H247-V249 PolarHBondContact O-N 3.02Å
248H46.3Very low44.8Very low196 Ų196145.2 Ų145.291%0.90779%0.785SS**  trans-56.1122.9165.1-75.3-101.4000110.7
249V41.3Very low44.7Very low137 Ų137145.2 Ų145.283%0.8380%0.797SS**  trans-137.1118.1150.8-173.40000108.5H247 R251H247-V249 PolarHBondContact O-N 3.02Å; V249-R251 PolarHBondContact O-N 3.4Å
250V47.8Very low44.6Very low135 Ų135149.2 Ų149.282%0.81881%0.805SS**  trans-49.2122.8171.4173.90000110
251R39.3Very low44Very low242 Ų242149.9 Ų149.991%0.91380%0.803SS**  trans-141.699.3156.7-148.2176.8-176.3-162.70.9110.6V249V249-R251 PolarHBondContact O-N 3.4Å
252E38.8Very low43.6Very low179 Ų179144.1 Ų144.184%0.83680%0.799SS**PPolyproline II helixtrans-49.1125.3169.3-163.5175.4-166.600110.7
253R44.2Very low43.8Very low237 Ų237143.7 Ų143.789%0.89480%0.803SS**PPolyproline II helixtrans-93.4123.6169.2-108.7-175.3178148.6-0.2107.9A255R253-A255 PolarHBondContact O-N 2.93Å
254P45Very low44.2Very low112 Ų112149.9 Ų149.973%0.72781%0.81SS**PPolyproline II helixtrans-71.2121.8163.927.5-29.4000109
255A47.2Very low43.9Very low103 Ų103149.6 Ų149.685%0.85181%0.81SS**  trans-81.3115.3165.700000108.3R253R253-A255 PolarHBondContact O-N 2.93Å
256V50.8Low44.5Very low125 Ų125148 Ų14876%0.75881%0.808SS**  trans-121.786.3172.4-177.30000108.7
257I51.3Low44.9Very low160 Ų160152.2 Ų152.282%0.82182%0.82SS**  trans-148.7116.8141.6-51.8-177.6000106.8
258P55.5Low45.5Very low102 Ų102149 Ų14966%0.66281%0.814SS**PPolyproline II helixtrans-73.6151171.728.3-30.5000111.5I260P258-I260 PolarHBondContact O-N 3.44Å
259P58.5Low45.5Very low128 Ų128144.8 Ų144.883%0.83181%0.805SS**PPolyproline II helixtrans-68.8131179.328.1-32.5000110.8A261P259-A261 PolarHBondContact O-N 2.95Å
260I49.7Very low45.4Very low164 Ų164146.7 Ų146.784%0.84181%0.809SS**PPolyproline II helixtrans-69.3119.8172.4-56.2170.9000107.7P258 S262P258-I260 PolarHBondContact O-N 3.44Å; I260-S262 PolarHBondContact O-N 3.47Å
261A40.5Very low44.7Very low88 Ų88144 Ų14473%0.72781%0.808SS**PPolyproline II helixtrans-71.4122.7170.200000109.5P259 D263P259-A261 PolarHBondContact O-N 2.95Å; A261-D263 PolarHBondContact O-N 3.3Å
262S42.3Very low44.5Very low117 Ų117137 Ų13782%0.81880%0.802SS**  trans-68.6114.3166.8-78.50000109.6I260 R264I260-S262 PolarHBondContact O-N 3.47Å; S262-R264 PolarHBondContact O-N 3.47Å
263D39.1Very low44.3Very low169 Ų169135 Ų13590%0.90480%0.802SS**  trans-65.394.9165.2-94.1-29.2000109.6A261A261-D263 PolarHBondContact O-N 3.3Å
264R40.7Very low43.9Very low235 Ų235128.1 Ų128.189%0.88780%0.796SS**  trans-94.591.1160.7-171177.8-175.2-163.80.8107.2S262 P266S262-R264 PolarHBondContact O-N 3.47Å; R264-P266 WeakPolarHBondContact O-CD 3.26Å
265S36.5Very low43.3Very low106 Ų106128.2 Ų128.274%0.74180%0.799SS**PPolyproline II helixtrans-66.1128172.456.50000110.9
266P45.8Very low43.4Very low120 Ų120128.4 Ų128.478%0.77979%0.792SS**PPolyproline II helixtrans-82.1144.5170.228.4-24.6000112R264R264-P266 WeakPolarHBondContact O-CD 3.26Å
267I46.7Very low42.7Very low162 Ų162133.7 Ų133.783%0.83180%0.798SS**PPolyproline II helixtrans-58.5139.8-179.8-61.6157.5000112.4
268P48.4Very low41.9Very low111 Ų111134.3 Ų134.372%0.72180%0.797SS**PPolyproline II helixtrans-98.6156.1153.335-27.5000112
269P47.4Very low41.2Very low109 Ų109134.9 Ų134.971%0.70880%0.804SS**PPolyproline II helixtrans-91.8165.2-16636.9-34.8000114.7
270L37.8Very low40.8Very low176 Ų176134.4 Ų134.492%0.92180%0.801SS**  trans77.5113.4156.3-69.4146000118.9
271G33.8Very low40.2Very low78 Ų78131 Ų13180%0.80480%0.797SS**  trans151.3110.4160.100000113.2
272A33.7Very low40.1Very low95 Ų95137.5 Ų137.579%0.78580%0.803SS**  trans-56.8149.4-17300000115.9
273V35.9Very low39.8Very low138 Ų138139.5 Ų139.584%0.83680%0.799SS**  167.6129.997.4168.60000110.3
274A34.8Very low40Very low93 Ų93141.9 Ų141.977%0.76980%0.796SS**  trans71.1109.5154.800000122.6
275S33.3Very low40.1Very low113 Ų113139.9 Ų139.979%0.7980%0.797SS**  trans-61.7-179.3143.8-88.60000112.9
276P48.4Very low40.5Very low107 Ų107143.8 Ų143.870%0.69580%0.802SS**  cis-138.1162.3-6.422.62.4000116.5
277R37.3Very low40.3Very low236 Ų236149.2 Ų149.289%0.89181%0.808SS**  trans28.8122.4135.4-56.4-177.8167.8-151.6-4119.9
278H34Very low40.2Very low174 Ų174145.6 Ų145.681%0.80680%0.801SS**  -161.5120.3122.7-129.2-79000111.9
279S39.7Very low40.1Very low114 Ų114149.6 Ų149.680%0.79781%0.81SS**  trans-108148.7148.5-50.40000106.6
280P50.9Low40.4Very low117 Ų117150.7 Ų150.776%0.7682%0.815SS**  -145.9171.1110.631.3-10.8000114.3
281A37.4Very low40.8Very low94 Ų94145.7 Ų145.778%0.77781%0.805SS**  trans-71.1158.2-167.900000116.9
282R38.3Very low41.9Very low224 Ų224147.8 Ų147.885%0.84580%0.803SS**  trans156.9146.1140.6-97.2-175.5175.1-176-0.9107.1
283E36.4Very low42.7Very low158 Ų158147.6 Ų147.674%0.73880%0.801SS**  cis-172.1158.19175.1160-169.500106
284R43Very low43Very low219 Ų219149.7 Ų149.783%0.82680%0.801SS**  trans-53.9146.3-178.9-65.4171.8171.7-178-4.4112
285Q42.2Very low43.9Very low194 Ų194156.7 Ų156.791%0.90781%0.808SS**  -168.9120.6120-101.1166.317.700111.2
286H45.1Very low44.5Very low187 Ų187158 Ų15887%0.86681%0.805SS**  trans-61.4130.4168.6-57.5-73.5000109.7
287R41.9Very low44.3Very low235 Ų235158.6 Ų158.689%0.88781%0.808SS**  trans-123.8111.5164.5-154.8170.9-172.1179.61.5109.7
288A43.7Very low44.5Very low85 Ų85156.3 Ų156.370%0.70281%0.807SS**  trans-56.8140.6175.500000111.5V290A288-V290 PolarHBondContact O-N 3Å
289H47Very low44.8Very low195 Ų195151.5 Ų151.590%0.90381%0.805SS**  trans-69.6115.8171.4-55.1-52.2000109.2G291H289-G291 PolarHBondContact O-N 3.23Å
290V52.9Low45.1Very low133 Ų133152.7 Ų152.781%0.80681%0.808SS**  trans-81.4111.4173.5175.80000107.6A288 V292A288-V290 PolarHBondContact O-N 3Å; V290-V292 PolarHBondContact O-N 2.85Å
291G47Very low45.1Very low70 Ų70152.7 Ų152.772%0.72281%0.807SS**  trans-68.5124.1169.800000110.4H289 A293H289-G291 PolarHBondContact O-N 3.23Å; G291-A293 PolarHBondContact O-N 3.45Å
292V56.4Low45.4Very low123 Ų123154.4 Ų154.475%0.74581%0.811SS**  trans-80108.7172.9175.10000108V290V290-V292 PolarHBondContact O-N 2.85Å
293A51.3Low45.6Very low91 Ų91151.9 Ų151.975%0.75281%0.813SS**PPolyproline II helixtrans-89.9122.6168.900000109.4G291 R295G291-A293 PolarHBondContact O-N 3.45Å; A293-R295 PolarHBondContact O-N 3.39Å
294H42.3Very low45.9Very low182 Ų182148.2 Ų148.284%0.84381%0.81SS**PPolyproline II helixtrans-69.7116.1170.1-72.8-86.3000109.8
295R52.4Low46Very low240 Ų240143.7 Ų143.791%0.90681%0.809SS**PPolyproline II helixtrans-95122.1165.3-106.3-176.7179.1166.20.2108.9A293A293-R295 PolarHBondContact O-N 3.39Å
296I46.7Very low46Very low141 Ų141140.3 Ų140.372%0.72380%0.804SS**PPolyproline II helixtrans-79.5124.3169.2-58.3171.1000107.8
297P45.4Very low45.6Very low118 Ų118140.7 Ų140.777%0.76681%0.806SS**PPolyproline II helixtrans-84.1126168.596.9000110.4
298H39.8Very low45.4Very low188 Ų188134 Ų13487%0.8780%0.801SS**  trans-81.5112.5164.4-67.1-74.9000109
299G41.6Very low45.2Very low74 Ų74139.2 Ų139.276%0.76381%0.811SS**  trans-107.9140.517200000111.6
300T46.3Very low45Very low139 Ų139137.8 Ų137.885%0.85381%0.809SS**PPolyproline II helixtrans-60159.4179.5110000114.3
301P49.8Very low44.4Very low116 Ų116140.8 Ų140.875%0.75381%0.814SS**PPolyproline II helixtrans-84.7147.8-16534.3-33.1000113
302P44.4Very low44Very low130 Ų130144.2 Ų144.284%0.84482%0.821SS**PPolyproline II helixtrans-89.1149.8171.633.9-29.8000112.8
303L42.9Very low43.3Very low171 Ų171146.4 Ų146.490%0.89583%0.828SS**PPolyproline II helixtrans-65.5156.3178.8-169.565.3000112.7
304A40.9Very low42.8Very low82 Ų82146.7 Ų146.768%0.67883%0.831SS**PPolyproline II helixtrans-49.9156-175.400000116.8
305P46.2Very low42.9Very low123 Ų123144.7 Ų144.780%0.79983%0.831SS**PPolyproline II helixtrans-85.9147.9-177.233.5-33.3000113.6
306P42.5Very low42.6Very low124 Ų124140.2 Ų140.281%0.80583%0.825SS**PPolyproline II helixtrans-90.2171.7157.435.4-27.2000111.7
307Q37Very low42.5Very low195 Ų195142.1 Ų142.191%0.91183%0.831SS**PPolyproline II helixtrans-63.5153.6-154.6-58.9-179.4-65.400116.9
308A37.4Very low42.3Very low95 Ų95143.3 Ų143.379%0.78584%0.835SS**PPolyproline II helixtrans-79122.4171.100000111
309E39.4Very low42Very low193 Ų193140.3 Ų140.390%0.90283%0.826SS**PPolyproline II helixtrans-99120.1159.4-70.6-178.2164.900107.5
310L42Very low41.7Very low165 Ų165143.8 Ų143.886%0.86482%0.822SS**  trans-92104.6175-72.9165.8000108.2
311E40.7Very low41.2Very low197 Ų197143.5 Ų143.592%0.92182%0.815SS**  trans-84.8108.8164.7-109.7-179.2163.300109.1L313E311-L313 PolarHBondContact O-N 2.91Å
312T39.6Very low40.9Very low142 Ų142146.9 Ų146.987%0.87182%0.818SS**  trans-82.1106.7177.3-20.60000108.9
313L40.5Very low40.6Very low168 Ų168147.7 Ų147.788%0.8882%0.82SS**PPolyproline II helixtrans-75.5121.4171-102.9148.5000110E311E311-L313 PolarHBondContact O-N 2.91Å
314A41Very low40.4Very low98 Ų98147.9 Ų147.981%0.8182%0.821SS**PPolyproline II helixtrans-63.5133.3177.600000111.5
315V43.9Very low40.2Very low140 Ų140152.7 Ų152.785%0.84883%0.83SS**PPolyproline II helixtrans-95.9123.1167.7-176.60000107.7
316D47.4Very low40Very low146 Ų146155.6 Ų155.678%0.78183%0.83SS**PPolyproline II helixtrans-61.9137.9-179.2-166.818.5000111.8
317Q43.3Very low39.8Very low181 Ų181160.4 Ų160.485%0.84683%0.832SS**PPolyproline II helixtrans-85.6126.7-178.3-67.7178.23800109
318V41.2Very low40.2Very low143 Ų143156.1 Ų156.187%0.86782%0.824SS**  trans-123.5134161.2-156.70000108.7
319N34.7Very low40.4Very low125 Ų125160.5 Ų160.567%0.66883%0.828SS**  trans-91.6146.7-150.9-154.329.3000112.7
320E35.5Very low40.9Very low146 Ų146156.1 Ų156.168%0.68282%0.824SS**  trans54.8147.7154.7-27.3-157.3141.900119.1
321D35.7Very low41.2Very low133 Ų133155.5 Ų155.571%0.71182%0.822SS**  cis-172.2162.727.3-139.1-13.9000109.8
322K42.5Very low41.9Very low188 Ų188157.5 Ų157.582%0.81782%0.821SS**  trans80.795.2170.4-58.5-179.2176.6-170.40118.9
323V38.3Very low42.6Very low146 Ų146156.7 Ų156.789%0.88582%0.816SS**  trans-136.8121.1133.2-1780000110.1Q325V323-Q325 PolarHBondContact O-N 3.46Å
324L39.5Very low42.9Very low175 Ų175158.7 Ų158.792%0.91684%0.835SS**  trans-60.7114.7173.2-77.5153.2000110.9
325Q36.9Very low43Very low183 Ų183161.7 Ų161.786%0.85584%0.836SS**  trans-81.7120.4166-172.2178.513.300109.4V323V323-Q325 PolarHBondContact O-N 3.46Å
326K41.1Very low42.9Very low185 Ų185162.8 Ų162.880%0.80484%0.835SS**  trans-162.5113.9153.5-110.7167.6-172.9-179.10112.9
327R39Very low42.7Very low225 Ų225163.8 Ų163.885%0.84984%0.838SS**  trans64.7114140.8-65.8-173.9176.5-171.9-2.5117.9
328S44.2Very low42.6Very low105 Ų105162.8 Ų162.873%0.73484%0.838SS**  70.9100.481.5-179.30000112.2
329E42.7Very low42.7Very low187 Ų187164 Ų16487%0.87484%0.836SS**  -173.9133114.9-106.4167.1167.300109.8
330A48.4Very low43.3Very low100 Ų100166.6 Ų166.683%0.82685%0.847SS**  trans-74.7134.2162.500000107.4
331D49.5Very low43.8Very low153 Ų153168.1 Ų168.182%0.81886%0.859SS**  trans-143.2131.6152.7-142.7-8.5000111.9
332R54.6Low44.5Very low239 Ų239170.8 Ų170.890%0.90287%0.87SS**  trans-113.4111-178.1-99.1-178.5158.2168.2-4.6106.2
333T54.9Low44.6Very low124 Ų124169.3 Ų169.376%0.76188%0.875SS**  trans-172.2135.416422.40000106.1
334V46.2Very low45.2Very low210 Ų210171.5 Ų171.5100%1.27387%0.874SS**  cis-142.8016.6171.10000108.2

Retrieved 334 of 334 residues in 399.9 ms (Link to these results)