A0A087YI57_POEFO Loading...

BEN domain containing 7

AlphaFold DB , UniProt , Accession A0A087YI57, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 488 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M55.3Low69.6Low254 Ų254115 Ų115100%1.25162%0.615SS**  0138.90-66.9174.4175.200107.8
2G56.7Low70.6Confident49 Ų49113.2 Ų113.251%0.50560%0.603SS.*  trans170.3-29.1-18000000115.3G4 S5G2-G4 PolarHBondContact O-N 2.96Å; G2-S5 WeakPolarHBondContact O-CB 3.09Å; G2-S5 PolarHBondContact O-N 2.83Å
3D54.8Low71.6Confident123 Ų123111.2 Ų111.266%0.65860%0.598SS**Hα-helixtrans-50.6-62.8-172.8-152.128.5000112.9S5 M6D3-S5 PolarHBondContact O-N 3.32Å; D3-M6 WeakPolarHBondContact O-CA 3.26Å; D3-M6 VanDerWaalsContact O-CB 3.3Å; D3-M6 WeakPolarHBondContact O-CB 3.25Å; D3-M6 PolarHBondContact O-N 2.6Å
4G62.5Low72.4Confident41 Ų41105.9 Ų105.942%0.42358%0.582SS.*Hα-helixtrans-56.2-14.9-176.200000117.2G2 M6 E7 I8G2-G4 PolarHBondContact O-N 2.96Å; G4-M6 VanDerWaalsContact C-N 3.26Å; G4-E7 VanDerWaalsContact CA-OE2 3.31Å; G4-E7 WeakPolarHBondContact CA-OE2 3.43Å; G4-E7 PolarHBondContact N-OE2 2.96Å; G4-I8 WeakPolarHBondContact O-CB 3.44Å; G4-I8 WeakPolarHBondContact O-CD1 3.19Å; G4-I8 VanDerWaalsContact O-CG1 3.27Å; G4-I8 WeakPolarHBondContact O-CG1 3.45Å; G4-I8 PolarHBondContact O-N 3.49Å; G4-I8 VanDerWaalsContact O-N 3.1Å
5S60Low73.2Confident91 Ų91107 Ų10764%0.63658%0.584SS**Hα-helixtrans-64.5-34.8168.5-170.50000111.4G2 D3 K9G2-S5 WeakPolarHBondContact O-CB 3.09Å; G2-S5 PolarHBondContact O-N 2.83Å; D3-S5 PolarHBondContact O-N 3.32Å; S5-K9 VanDerWaalsContact O-CB 3.28Å; S5-K9 WeakPolarHBondContact O-CB 3.46Å; S5-K9 PolarHBondContact O-N 3.35Å
6M70.5Confident73.5Confident116 Ų116108.4 Ų108.457%0.57159%0.587SS**Hα-helixtrans-73.7-40.2176.2-51.9-156.9-16700111.8D3 G4 K9 K10D3-M6 WeakPolarHBondContact O-CA 3.26Å; D3-M6 VanDerWaalsContact O-CB 3.3Å; D3-M6 WeakPolarHBondContact O-CB 3.25Å; D3-M6 PolarHBondContact O-N 2.6Å; G4-M6 VanDerWaalsContact C-N 3.26Å; M6-K9 PolarHBondContact O-N 2.91Å; M6-K10 WeakPolarHBondContact O-CB 3.43Å; M6-K10 WeakPolarHBondContact O-CD 3.32Å; M6-K10 WeakPolarHBondContact O-CG 3.48Å; M6-K10 PolarHBondContact O-N 3.4Å
7E77Confident73.7Confident68 Ų68113.2 Ų113.232%0.31860%0.595SS.*Hα-helixtrans-63.2-47175.5-78.956.1-103.300111.3G4 K9 K10 Q11G4-E7 VanDerWaalsContact CA-OE2 3.31Å; G4-E7 WeakPolarHBondContact CA-OE2 3.43Å; G4-E7 PolarHBondContact N-OE2 2.96Å; E7-K9 VanDerWaalsContact C-N 3.32Å; E7-K9 PolarHBondContact O-N 2.71Å; E7-K10 PolarHBondContact O-N 3.37Å; E7-K10 IonicContact OE1-NZ 2.65Å; E7-K10 PolarHBondContact OE1-NZ 2.68Å; E7-Q11 WeakPolarHBondContact O-CG 3.12Å; E7-Q11 PolarHBondContact O-N 3.36Å
8I78.9Confident73.7Confident100 Ų100113.7 Ų113.751%0.51360%0.597SS.*Hα-helixtrans-62-42.1177.5-67.9167.6000110.1G4 Q11 I12G4-I8 WeakPolarHBondContact O-CB 3.44Å; G4-I8 WeakPolarHBondContact O-CD1 3.19Å; G4-I8 VanDerWaalsContact O-CG1 3.27Å; G4-I8 WeakPolarHBondContact O-CG1 3.45Å; G4-I8 PolarHBondContact O-N 3.49Å; G4-I8 VanDerWaalsContact O-N 3.1Å; I8-Q11 PolarHBondContact O-N 3.43Å; I8-I12 HydrophobicContact CG2-CD1 3.69Å; I8-I12 HydrophobicContact CG2-CG1 4.39Å; I8-I12 WeakPolarHBondContact O-CB 3.33Å; I8-I12 VanDerWaalsContact O-CG1 3.28Å; I8-I12 WeakPolarHBondContact O-CG1 3.24Å; I8-I12 PolarHBondContact O-N 2.84Å
9K81.1Confident73.7Confident152 Ų152113 Ų11366%0.66159%0.593SS**Hα-helixtrans-63.3-43.6175.5-167.5172.9-177.3179.20112.2S5 M6 E7 I12 T13S5-K9 VanDerWaalsContact O-CB 3.28Å; S5-K9 WeakPolarHBondContact O-CB 3.46Å; S5-K9 PolarHBondContact O-N 3.35Å; M6-K9 PolarHBondContact O-N 2.91Å; E7-K9 VanDerWaalsContact C-N 3.32Å; E7-K9 PolarHBondContact O-N 2.71Å; K9-I12 PolarHBondContact O-N 2.64Å; K9-T13 WeakPolarHBondContact O-CB 3.31Å; K9-T13 PolarHBondContact O-N 2.82Å; K9-T13 PolarHBondContact O-OG1 3.23Å; K9-T13 VanDerWaalsContact O-OG1 3.07Å
10K84.2Confident73.2Confident130 Ų130109.2 Ų109.257%0.56558%0.583SS**Hα-helixtrans-59.2-45.7174.2-68.9159.2-1641660111.2M6 E7 G14M6-K10 WeakPolarHBondContact O-CB 3.43Å; M6-K10 WeakPolarHBondContact O-CD 3.32Å; M6-K10 WeakPolarHBondContact O-CG 3.48Å; M6-K10 PolarHBondContact O-N 3.4Å; E7-K10 PolarHBondContact O-N 3.37Å; E7-K10 IonicContact OE1-NZ 2.65Å; E7-K10 PolarHBondContact OE1-NZ 2.68Å; K10-G14 PolarHBondContact O-N 3.42Å
11Q84.5Confident72.6Confident141 Ų141108.3 Ų108.366%0.65958%0.578SS**Hα-helixtrans-62.8-47.3177.2-77.4-175.2-21.800112.3E7 I8 G14 M15E7-Q11 WeakPolarHBondContact O-CG 3.12Å; E7-Q11 PolarHBondContact O-N 3.36Å; I8-Q11 PolarHBondContact O-N 3.43Å; Q11-G14 PolarHBondContact O-N 3.29Å; Q11-M15 WeakPolarHBondContact O-CB 3.26Å; Q11-M15 PolarHBondContact O-N 2.99Å
12I81.4Confident72.8Confident93 Ų93105.1 Ų105.148%0.47756%0.557SS.*Hα-helixtrans-61.8-46.5178.7-68.7167.7000110.6I8 K9 G14 M15 M16I8-I12 HydrophobicContact CG2-CD1 3.69Å; I8-I12 HydrophobicContact CG2-CG1 4.39Å; I8-I12 WeakPolarHBondContact O-CB 3.33Å; I8-I12 VanDerWaalsContact O-CG1 3.28Å; I8-I12 WeakPolarHBondContact O-CG1 3.24Å; I8-I12 PolarHBondContact O-N 2.84Å; K9-I12 PolarHBondContact O-N 2.64Å; I12-G14 PolarHBondContact O-N 3.2Å; I12-M15 PolarHBondContact O-N 2.96Å; I12-M16 HydrophobicContact CG2-SD 4.28Å; I12-M16 WeakPolarHBondContact O-CB 3.46Å; I12-M16 WeakPolarHBondContact O-CG 3.32Å; I12-M16 PolarHBondContact O-N 2.84Å
13T83.6Confident72.5Confident88 Ų88108.3 Ų108.354%0.5457%0.567SS.*Hα-helixtrans-62.7-41.1176.6-58.60000112.1K9 M16 R17K9-T13 WeakPolarHBondContact O-CB 3.31Å; K9-T13 PolarHBondContact O-N 2.82Å; K9-T13 PolarHBondContact O-OG1 3.23Å; K9-T13 VanDerWaalsContact O-OG1 3.07Å; T13-M16 PolarHBondContact O-N 2.89Å; T13-R17 PolarHBondContact O-N 2.83Å; T13-R17 VanDerWaalsContact O-N 3.11Å
14G83.8Confident72.3Confident36 Ų36105.7 Ų105.737%0.37157%0.569SS.*Hα-helixtrans-62.4-43.9174.500000112.7K10 Q11 I12 R17 L18K10-G14 PolarHBondContact O-N 3.42Å; Q11-G14 PolarHBondContact O-N 3.29Å; I12-G14 PolarHBondContact O-N 3.2Å; G14-R17 WeakPolarHBondContact O-CB 3.33Å; G14-R17 PolarHBondContact O-N 3.49Å; G14-L18 PolarHBondContact O-N 3.18Å
15M83.5Confident72.1Confident123 Ų123114.2 Ų114.261%0.60659%0.589SS**Hα-helixtrans-70.1-37.1179.4-157174.877.500112Q11 I12 R17 L18 L19Q11-M15 WeakPolarHBondContact O-CB 3.26Å; Q11-M15 PolarHBondContact O-N 2.99Å; I12-M15 PolarHBondContact O-N 2.96Å; M15-R17 VanDerWaalsContact C-N 3.29Å; M15-R17 PolarHBondContact O-N 3.21Å; M15-L18 PolarHBondContact O-N 2.98Å; M15-L19 VanDerWaalsContact O-CG 3.3Å; M15-L19 WeakPolarHBondContact O-CG 3.47Å; M15-L19 PolarHBondContact O-N 3.08Å; M15-L19 VanDerWaalsContact O-N 3.08Å
16M78.1Confident71.7Confident130 Ų130112.4 Ų112.464%0.6458%0.584SS**Hα-helixtrans-59.6-37.7170.7-77.9-177.668.100112.3I12 T13 L19 G20I12-M16 HydrophobicContact CG2-SD 4.28Å; I12-M16 WeakPolarHBondContact O-CB 3.46Å; I12-M16 WeakPolarHBondContact O-CG 3.32Å; I12-M16 PolarHBondContact O-N 2.84Å; T13-M16 PolarHBondContact O-N 2.89Å; M16-L19 PolarHBondContact O-N 3.39Å; M16-G20 PolarHBondContact O-N 3.27Å
17R77.9Confident70.2Confident190 Ų190118.1 Ų118.172%0.71760%0.601SS**Hα-helixtrans-62.8-50.5176-163.2173.1-170.4151.43111.4T13 G14 M15 L19 G20 D21T13-R17 PolarHBondContact O-N 2.83Å; T13-R17 VanDerWaalsContact O-N 3.11Å; G14-R17 WeakPolarHBondContact O-CB 3.33Å; G14-R17 PolarHBondContact O-N 3.49Å; M15-R17 VanDerWaalsContact C-N 3.29Å; M15-R17 PolarHBondContact O-N 3.21Å; R17-L19 PolarHBondContact O-N 3.27Å; R17-G20 PolarHBondContact O-N 2.62Å; R17-D21 VanDerWaalsContact O-CG 3.28Å; R17-D21 PolarHBondContact O-N 3.26Å
18L72.8Confident68.2Low121 Ų121123.7 Ų123.763%0.63463%0.627SS**Hα-helixtrans-59.4-28.3177-65.7172.2000113.7G14 M15G14-L18 PolarHBondContact O-N 3.18Å; M15-L18 PolarHBondContact O-N 2.98Å
19L74.1Confident66.3Low101 Ų101129.6 Ų129.653%0.52964%0.643SS.*Hα-helixtrans-83.3-36.3174.5-66.9169.7000112.3M15 M16 R17 K22 T23M15-L19 VanDerWaalsContact O-CG 3.3Å; M15-L19 WeakPolarHBondContact O-CG 3.47Å; M15-L19 PolarHBondContact O-N 3.08Å; M15-L19 VanDerWaalsContact O-N 3.08Å; M16-L19 PolarHBondContact O-N 3.39Å; R17-L19 PolarHBondContact O-N 3.27Å; L19-K22 PolarHBondContact O-N 3.02Å; L19-T23 PolarHBondContact O-N 3.47Å; L19-T23 PolarHBondContact O-OG1 2.85Å
20G63.6Low64.1Low37 Ų37129.9 Ų129.938%0.38165%0.651SS.*Hα-helixtrans-61.8-45.3173.100000112.6M16 R17 K22 T23 G24M16-G20 PolarHBondContact O-N 3.27Å; R17-G20 PolarHBondContact O-N 2.62Å; G20-K22 PolarHBondContact O-N 2.91Å; G20-K22 VanDerWaalsContact O-N 3.1Å; G20-T23 PolarHBondContact O-N 3.19Å; G20-G24 PolarHBondContact O-N 2.92Å
21D61Low61.5Low91 Ų91127.4 Ų127.449%0.48766%0.663SS.*Hα-helixtrans-62.4-20.1-179.4-65.9-32.6000113.9R17 R25R17-D21 VanDerWaalsContact O-CG 3.28Å; R17-D21 PolarHBondContact O-N 3.26Å; D21-R25 PolarHBondContact O-NH2 3.15Å; D21-R25 VanDerWaalsContact O-NH2 3.1Å
22K58.1Low59.4Low186 Ų186127.6 Ų127.681%0.80967%0.673SS**Hα-helixtrans-92.1-22.5171.6-84.2-177.3173.6176.50114.2L19 G20L19-K22 PolarHBondContact O-N 3.02Å; G20-K22 PolarHBondContact O-N 2.91Å; G20-K22 VanDerWaalsContact O-N 3.1Å
23T52.3Low56.9Low117 Ų117130.9 Ų130.972%0.71869%0.686SS**Hα-helixtrans-95.3-32.8-174.8-51.50000112.2L19 G20 R25L19-T23 PolarHBondContact O-N 3.47Å; L19-T23 PolarHBondContact O-OG1 2.85Å; G20-T23 PolarHBondContact O-N 3.19Å; T23-R25 VanDerWaalsContact C-N 3.31Å; T23-R25 PolarHBondContact O-N 3.45Å
24G50.7Low54.5Low68 Ų68134.5 Ų134.570%0.70170%0.697SS**SBendtrans-77.79.2-172.300000117.8G20G20-G24 PolarHBondContact O-N 2.92Å
25R56.6Low51.7Low220 Ų220138.6 Ų138.683%0.8371%0.71SS**  trans-115.247179.8-87.7-177.1-72.5-130.7-9.8113.7D21 T23D21-R25 PolarHBondContact O-NH2 3.15Å; D21-R25 VanDerWaalsContact O-NH2 3.1Å; T23-R25 VanDerWaalsContact C-N 3.31Å; T23-R25 PolarHBondContact O-N 3.45Å
26G51.9Low49.1Very low53 Ų53138.1 Ų138.155%0.54672%0.719SS.*SBendtrans-132.9131.416300000110.1
27Y40.3Very low46.7Very low236 Ų236137.7 Ų137.793%0.92573%0.729SS**  trans67.180.4178.5-61.7-85.1000117.9
28Q34Very low44.4Very low185 Ų185135 Ų13586%0.86473%0.734SS**  trans-145.9138.5133.5-158.280.833.200108.2
29R40Very low42.2Very low224 Ų224138.6 Ų138.685%0.84574%0.744SS**  trans-151.6141.6164.5-165.6-167.2-114.8-1162108.5
30L33.6Very low39.8Very low157 Ų157141.9 Ų141.982%0.82276%0.757SS**  trans70.9136.7-175.9-50.3179.2000113.4
31G29.6Very low38.5Very low79 Ų79144.7 Ų144.781%0.81477%0.768SS**  trans133.997.5-160.100000107.8
32V41.3Very low36.8Very low145 Ų145147 Ų14788%0.87978%0.776SS**  trans-80.6130.6-1801710000109.1
33E28.7Very low35.3Very low162 Ų162145.8 Ų145.876%0.75777%0.774SS**  trans-155.2153.2144.2-115.5-70.261.900109.2
34Q32.1Very low34Very low163 Ų163145 Ų14576%0.76277%0.773SS**  trans-101.1-165-173.9-149.617128.500110.9
35N26.1Very low32.9Very low122 Ų122149.6 Ų149.665%0.65278%0.776SS**  trans77.6131.7164.7-42.1-49.5000117.6
36S29.4Very low31.7Very low113 Ų113147 Ų14779%0.7978%0.778SS**  cis-159.8131.6-25.141.60000108.8
37S26.7Very low30.4Very low121 Ų121151.3 Ų151.385%0.84679%0.788SS**  trans-98.3129.7172.554.60000110.3
38T28.8Very low29.6Very low133 Ų133145.5 Ų145.582%0.81678%0.781SS**  trans-75.6148.3-170.5-33.90000113.6
39K27.9Very low29.2Very low197 Ų197144.5 Ų144.586%0.85778%0.778SS**  trans102110.7161.2-58-170.1176.5-173.40118.3
40E23.1Very low28.6Very low171 Ų171142.8 Ų142.880%0.79978%0.78SS**  trans-51.1178146.6-107.7-155.6100.700114.2
41P35.7Very low28.2Very low95 Ų95140.6 Ų140.662%0.61778%0.777SS**  cis-124.3-164.416.145.6-30.3000113.3
42Q26.1Very low29.4Very low139 Ų139142.2 Ų142.265%0.6577%0.774SS**  cis-158.1178.76.8-144.9151.3-80.300110.4
43E25.8Very low29.3Very low161 Ų161140.8 Ų140.875%0.75277%0.767SS**  trans45.2122.3153.7-78.2155.5-131.100119.7
44S26.6Very low29.4Very low102 Ų102139.2 Ų139.271%0.71377%0.769SS**  -177.4138.256.7-171.10000113.9
45Q27Very low29.2Very low164 Ų164138.8 Ų138.877%0.76677%0.771SS**  trans45.8123.2147.9-74.7-169.4-7.600125.1
46L30.6Very low30Very low164 Ų164138.3 Ų138.386%0.85977%0.774SS**  trans93.9146.3134.4-68.9167.7000121.2
47N25.7Very low29.8Very low144 Ų144138.8 Ų138.877%0.7777%0.772SS**  trans-148.3135.3-169.7163.733.1000108.4
48C22.5Very low29.7Very low115 Ų115138.8 Ų138.878%0.77777%0.767SS**  trans-155.9148.6157.3-151.50000111.3
49M25.3Very low29.7Very low163 Ų163136.3 Ų136.380%0.80376%0.755SS**  trans-103164.9171.2-57.5-177.575.400109.9
50H27.7Very low29.6Very low189 Ų189135 Ų13588%0.87575%0.752SS**  trans-165.2177.2137.8-92.3-53.9000110.1
51S26.1Very low29.7Very low110 Ų110133.3 Ų133.377%0.76975%0.748SS**  trans-129.7176.9-149.558.50000114.9
52P54.4Low29.3Very low114 Ų114136.7 Ų136.774%0.7476%0.756SS**  trans-97.2-169.3-159.241-38.3000114.7
53P40.1Very low29.2Very low115 Ų115134.6 Ų134.675%0.74776%0.756SS**  -148.2147.2110.738.3-22.6000118.5
54V29.8Very low29.1Very low129 Ų129137.6 Ų137.678%0.78276%0.761SS**  38.1133.6127.2176.90000119.1
55L27.8Very low29.1Very low154 Ų154137.5 Ų137.581%0.80676%0.76SS**  cis-166.3-155.7-7.6-108.6-175.2000106.1
56P42.5Very low29.4Very low112 Ų112135.4 Ų135.473%0.72776%0.764SS**  cis-125.6-144.9-3.632.6-5.5000111.7
57V25.1Very low29.5Very low122 Ų122133.7 Ų133.774%0.73976%0.762SS**  cis-159.9155.24.6880000112.8
58V25.9Very low29.6Very low121 Ų121130.4 Ų130.473%0.73376%0.763SS**  trans6.1139.4145.2174.40000119.5
59S27.5Very low30Very low82 Ų82132.4 Ų132.457%0.57377%0.766SS**  cis-166.2166.1-5.7-111.10000114.8
60E26.2Very low31.3Very low170 Ų170129.9 Ų129.979%0.79476%0.761SS**  trans38.9107.1142.1-66.3151.7104.200123.2
61D26Very low31.3Very low134 Ų134129.8 Ų129.872%0.71776%0.761SS**  45.4138.8103.7-12630000124.1
62Q27.1Very low32.2Very low166 Ų166129.1 Ų129.178%0.77675%0.754SS**  trans77.3117.1151.8-72173.863.100124.2
63S22.8Very low32.3Very low95 Ų95128.9 Ų128.966%0.66475%0.753SS**  trans92.8152.8135.1-154.90000121.9
64W24.7Very low32.7Very low225 Ų225128.9 Ų128.985%0.85275%0.753SS**  trans75.9104.3165.7-58.1108.2000121.3
65S25.7Very low32.5Very low100 Ų100127.8 Ų127.870%0.69975%0.751SS**  trans51.3125.1130.3-57.30000123.2
66S34.8Very low32.5Very low119 Ų119125.4 Ų125.483%0.83275%0.747SS**  trans-64.5148.9142.2-45.10000110.4
67P31.4Very low31.7Very low128 Ų128129.8 Ų129.883%0.83176%0.755SS**  -142.6167.191.238.3-24.3000113.9
68G27.3Very low31.8Very low76 Ų76128.4 Ų128.478%0.78475%0.751SS**  trans-169.27.2-17600000120.5
69D31.7Very low31.9Very low157 Ų157129.1 Ų129.184%0.8476%0.756SS**  trans-169.9153.2165.3-115.4-30.6000106.9
70P52.3Low31.9Very low109 Ų109130.3 Ų130.371%0.70876%0.764SS**  cis-141.2-17632.344-26.6000116.5
71E27.7Very low32.2Very low187 Ų187129.8 Ų129.887%0.87477%0.766SS**  trans-140.6157.6148.4-95.2-129.372.500113.6
72P45.1Very low32.8Very low96 Ų96129.1 Ų129.162%0.62377%0.769SS**  trans-138.9-131.8-145.645.6-24.1000111.9
73P57.2Low32.8Very low109 Ų109129.2 Ų129.271%0.70877%0.774SS**  cis-116.4-59.3-32.228.4-21000124.1
74P49Very low33Very low115 Ų115128.6 Ų128.675%0.74778%0.783SS**  -120.5129.9-113.336-23.6000118.1
75S25.2Very low33.3Very low106 Ų106127.1 Ų127.174%0.74179%0.786SS**  -156.7118.8128.2-168.50000113.6
76S28Very low33.3Very low104 Ų104127.3 Ų127.373%0.72779%0.794SS**  trans58.794.2145.6-48.10000121.2
77K25.4Very low33.1Very low204 Ų204127.4 Ų127.489%0.88779%0.793SS**  29.6142.4114.5-80.2-179.3177.3175.80119.5
78S26.2Very low33Very low94 Ų94126.2 Ų126.266%0.65779%0.787SS**  cis-173.4148.510.343.60000114.1
79T28.6Very low33.3Very low136 Ų136131.1 Ų131.183%0.83479%0.79SS**  trans56132131.7-52.40000119.5
80S26.8Very low33.1Very low106 Ų106135 Ų13574%0.74179%0.794SS**  cis-161.5165.41440000112.4
81L34Very low32.1Very low160 Ų160135.5 Ų135.584%0.83880%0.801SS**  trans-98.7159.4158.9-95.2159000110.7
82P37.7Very low32.6Very low120 Ų120133.2 Ų133.278%0.77980%0.8SS**  -134.5161.4129.637.6-28.5000114.9
83N27.1Very low32Very low167 Ų167139.9 Ų139.989%0.89381%0.813SS**  trans-61.6157.1-173.2-74.3-26.5000116.6
84G26.3Very low31.5Very low83 Ų83140.6 Ų140.686%0.85682%0.82SS**  trans-156.8101.6161.100000111.5
85Q31.1Very low30.9Very low193 Ų193146.8 Ų146.890%0.90283%0.829SS**  trans-107.4122.9-166.4173.7-177.5-14.200112.8
86A27Very low31.5Very low105 Ų105145.4 Ų145.487%0.86883%0.831SS**  trans-160.2157.816300000111.6
87C29.7Very low31.7Very low120 Ų120148.9 Ų148.981%0.81184%0.84SS**  trans-127.5155.5-175.7-1760000112.1
88S29.7Very low32.1Very low103 Ų103150.3 Ų150.372%0.7284%0.84SS**  trans68153.8177.979.30000114.6
89Q34.1Very low32.2Very low179 Ų179152.2 Ų152.284%0.83685%0.848SS**  cis-143.4166.725.8-61.3173.3-5.800112.5
90Y27.1Very low32.3Very low238 Ų238152 Ų15293%0.93385%0.846SS**  trans-73.8131.6171.5-70.1-96.8000111.9
91S31.2Very low32.3Very low121 Ų121152 Ų15285%0.84685%0.847SS**  trans-155.7135.9155.9-158.70000113.4
92T39.3Very low32Very low138 Ų138150.7 Ų150.785%0.84785%0.845SS**  trans-85.7109.7176.6500000111.3
93R32.4Very low31.6Very low237 Ų237150.4 Ų150.489%0.89484%0.841SS**  trans-155.1123.5156.6-136.4173.3-177.5-169.7-0.4114
94S45Very low31.8Very low123 Ų123152.1 Ų152.186%0.8684%0.841SS**  trans-65133.9163.639.10000110.2
95R36.8Very low32Very low246 Ų246155 Ų15593%0.92884%0.837SS**  trans-138.6124.8172.5-133.5178.2-176.3-172.70.7108.4
96G39.2Very low32Very low76 Ų76153 Ų15378%0.78483%0.831SS**PPolyproline II helixtrans-67.7136.3-173.900000112.5R98G96-R98 PolarHBondContact O-N 3.04Å
97L32.1Very low32.4Very low178 Ų178155.9 Ų155.993%0.93283%0.83SS**PPolyproline II helixtrans-72116.7170.5-77.2164.2000109.4
98R32.2Very low32.6Very low233 Ų233158.9 Ų158.988%0.87983%0.83SS**PPolyproline II helixtrans-81.8120.4162.9-69.8-175.2-69.2-162.80.9107.6G96 V100G96-R98 PolarHBondContact O-N 3.04Å; R98-V100 PolarHBondContact O-N 3.47Å
99T30Very low32.9Very low135 Ų135159 Ų15983%0.82883%0.828SS**PPolyproline II helixtrans-62.8122.417343.50000110.2
100V29.3Very low32.7Very low130 Ų130156.3 Ų156.379%0.78883%0.829SS**  trans-88.9109.3168.9177.20000107.9R98R98-V100 PolarHBondContact O-N 3.47Å
101S26.4Very low32.9Very low108 Ų108153.3 Ų153.376%0.75582%0.823SS**  trans-93.8100.6172.953.80000109.7
102T27.6Very low32.9Very low131 Ų131154.5 Ų154.580%0.80483%0.826SS**  trans-87.4115.4173.6-520000109.6
103T29.4Very low32.5Very low114 Ų114157.5 Ų157.570%0.69983%0.827SS**  trans-76.6151.7175.538.90000112.5
104K32.5Very low32.3Very low204 Ų204154 Ų15489%0.88783%0.826SS**  trans-137.2137.4143.8-89.1-168.2173.8-177.50109
105D29.9Very low31.8Very low143 Ų143156.4 Ų156.477%0.76582%0.824SS**  trans-73.5176.8-178.6-48.6-90.6000110.4
106L31.4Very low31.8Very low152 Ų152152.6 Ų152.680%0.79682%0.821SS**  cis-167.2143.432179.765000111.4
107I35.1Very low31.8Very low164 Ų164159.6 Ų159.684%0.84182%0.824SS**  trans174.3144.5133-89.9157.4000110.1
108K33.6Very low32.1Very low184 Ų184157.2 Ų157.280%0.882%0.819SS**  trans-113.3179.9-177.6-113.1-167172.4-1680109.3
109P36.7Very low32.4Very low106 Ų106150.7 Ų150.769%0.68882%0.815SS**  cis-134.3171.6-3137.5-22.4000113.3
110S28.6Very low33.2Very low121 Ų121150.4 Ų150.485%0.84681%0.813SS**  trans-159.4154.2134.354.30000110.2
111E31.6Very low34Very low175 Ų175149.7 Ų149.782%0.81881%0.811SS**  trans-117.5128.3-172.5-61.7-176.9158.200111.3
112T32.7Very low35.2Very low147 Ų147152.9 Ų152.990%0.90281%0.814SS**  trans-152.7138.8146.5-20.60000108.9
113K30.2Very low36.5Very low200 Ų200154 Ų15487%0.8781%0.813SS**  trans-90.6136173.5-59.3170.3-175.8171.50108.2
114D27.4Very low37.9Very low165 Ų165154.5 Ų154.588%0.88282%0.818SS**  -154.8169.4110.5-138.8-25.4000111.8
115E35.6Very low39Very low173 Ų173149.4 Ų149.481%0.80881%0.807SS**  trans-89132.3-165.5-172.5179.6130.400113.6
116L36.6Very low40.9Very low165 Ų165146.3 Ų146.386%0.86480%0.796SS**  trans-165.6158.7146.9-107.8167.9000112.8
117R39.3Very low41.7Very low224 Ų224148.9 Ų148.985%0.84581%0.806SS**PPolyproline II helixtrans-74.5150.7-159.6-61173.9-176.41710.6115
118P37.1Very low43.4Very low128 Ų128144.3 Ų144.383%0.83179%0.788SS**PPolyproline II helixtrans-68.6143.2173.529.9-35.6000112.3
119A39.6Very low44.7Very low96 Ų96143 Ų14379%0.79379%0.79SS**PPolyproline II helixtrans-75.6146.3175.600000112.1
120V46.3Very low46.3Very low129 Ų129140.9 Ų140.978%0.78278%0.777SS**PPolyproline II helixtrans-73.9131.7170.7177.90000108.9E122V120-E122 PolarHBondContact O-N 3.39Å
121P46.3Very low48.8Very low115 Ų115142.1 Ų142.175%0.74777%0.767SS**PPolyproline II helixtrans-61.6120.5173.8-23.234.2000111.4I123P121-I123 PolarHBondContact O-N 2.94Å
122E51.9Low51.3Low175 Ų175136 Ų13682%0.81875%0.751SS**PPolyproline II helixtrans-67.5119.6175-66.1-171.1143.500109.9V120V120-E122 PolarHBondContact O-N 3.39Å
123I53.7Low53.8Low154 Ų154133.3 Ų133.379%0.7974%0.735SS**PPolyproline II helixtrans-70122.5172.1-59.3172.9000107.4P121 C125P121-I123 PolarHBondContact O-N 2.94Å; I123-C125 PolarHBondContact O-N 3.37Å
124P60.2Low56.6Low124 Ų124128 Ų12881%0.80572%0.715SS**  trans-67.2107.1-171.424.8-33.8000111.6
125C56.2Low59.5Low98 Ų98126.1 Ų126.166%0.66270%0.701SS**  trans-83.2116.5174.655.40000110.3I123I123-C125 PolarHBondContact O-N 3.37Å
126C68.4Low62.2Low77 Ų77120.6 Ų120.652%0.5269%0.685SS.*  trans55155.7179.7770000117.8C128C126-C128 HydrophobicContact CB-CB 3.99Å; C126-C128 WeakPolarHBondContact CB-SG 3.32Å; C126-C128 PolarHBondContact O-N 3.38Å; C126-C128 VanDerWaalsContact O-N 3.15Å; C126-C128 WeakPolarHBondContact SG-CA 3.18Å; C126-C128 WeakPolarHBondContact SG-CB 3.19Å; C126-C128 PolarHBondContact SG-N 3.4Å; C126-C128 PolarHBondContact SG-O 2.91Å; C126-C128 VanDerWaalsContact SG-O 3.34Å; C126-C128 CovalentContact SG-SG 2.03Å; C126-C128 PolarHBondContact SG-SG 3.03Å
127M48.1Very low64.8Low207 Ų207116.9 Ų116.9100%1.0267%0.665SS**SBendtrans-8348.2160.9-68173.460.100110.4
128C71.5Confident67.4Low68 Ų68109.8 Ų109.846%0.45964%0.643SS.*SBendtrans-135.5135.8-17572.30000111.4C126 C130C126-C128 HydrophobicContact CB-CB 3.99Å; C126-C128 WeakPolarHBondContact CB-SG 3.32Å; C126-C128 PolarHBondContact O-N 3.38Å; C126-C128 VanDerWaalsContact O-N 3.15Å; C126-C128 WeakPolarHBondContact SG-CA 3.18Å; C126-C128 WeakPolarHBondContact SG-CB 3.19Å; C126-C128 PolarHBondContact SG-N 3.4Å; C126-C128 PolarHBondContact SG-O 2.91Å; C126-C128 VanDerWaalsContact SG-O 3.34Å; C126-C128 CovalentContact SG-SG 2.03Å; C126-C128 PolarHBondContact SG-SG 3.03Å; C128-C130 PolarHBondContact O-N 3.48Å; C128-C130 PolarHBondContact SG-SG 3.45Å
129N60.9Low70.1Confident156 Ų156109.6 Ų109.683%0.83463%0.631SS**  trans-78.650.2-170.4-167.913.1000112.8K131N129-K131 VanDerWaalsContact C-N 3.26Å; N129-K131 PolarHBondContact O-N 3.1Å
130C70Confident72.7Confident62 Ų62111.1 Ų111.142%0.41962%0.622SS.*  trans-844.5-175.6-67.80000113.6C128 G132 T133 L134C128-C130 PolarHBondContact O-N 3.48Å; C128-C130 PolarHBondContact SG-SG 3.45Å; C130-G132 VanDerWaalsContact C-N 3.34Å; C130-G132 PolarHBondContact O-N 3.32Å; C130-T133 PolarHBondContact O-N 3.49Å; C130-L134 VanDerWaalsContact O-CB 3.28Å; C130-L134 WeakPolarHBondContact O-CB 3.46Å; C130-L134 PolarHBondContact O-N 3.02Å
131K80.4Confident74.9Confident147 Ų147109.3 Ų109.364%0.63961%0.608SS**Hα-helixtrans-57-45-177.5-172.8165.7-176.61630112.1N129 Q135N129-K131 VanDerWaalsContact C-N 3.26Å; N129-K131 PolarHBondContact O-N 3.1Å; K131-Q135 WeakPolarHBondContact O-CB 3.17Å; K131-Q135 PolarHBondContact O-N 3.37Å
132G84Confident77.1Confident47 Ų47110.4 Ų110.449%0.48560%0.597SS.*Hα-helixtrans-63.4-50.6176.300000112.9C130 L134 Q135 A136C130-G132 VanDerWaalsContact C-N 3.34Å; C130-G132 PolarHBondContact O-N 3.32Å; G132-L134 PolarHBondContact O-N 3.38Å; G132-Q135 PolarHBondContact O-N 2.97Å; G132-A136 PolarHBondContact O-N 3.44Å
133T85.4Confident78.9Confident90 Ų90104.4 Ų104.455%0.55258%0.577SS**Hα-helixtrans-61.8-44.1-179.8-420000112.1C130 A136 I137C130-T133 PolarHBondContact O-N 3.49Å; T133-A136 PolarHBondContact O-N 3.22Å; T133-I137 HydrophobicContact CG2-CD1 4.18Å; T133-I137 WeakPolarHBondContact O-CG1 3.45Å; T133-I137 PolarHBondContact O-N 3.3Å
134L89.2Confident80.7Confident87 Ų87102.2 Ų102.246%0.45557%0.565SS.*Hα-helixtrans-64.3-42176.2-179.660.6000111.4C130 G132 A136 I137 L138C130-L134 VanDerWaalsContact O-CB 3.28Å; C130-L134 WeakPolarHBondContact O-CB 3.46Å; C130-L134 PolarHBondContact O-N 3.02Å; G132-L134 PolarHBondContact O-N 3.38Å; L134-A136 VanDerWaalsContact C-N 3.34Å; L134-A136 PolarHBondContact O-N 2.91Å; L134-I137 PolarHBondContact O-N 2.92Å; L134-L138 HydrophobicContact CD1-CD1 4.02Å; L134-L138 HydrophobicContact CD1-CG 4.18Å; L134-L138 HydrophobicContact CG-CD1 3.94Å; L134-L138 HydrophobicContact CG-CG 4.49Å; L134-L138 VanDerWaalsContact O-CB 3.32Å; L134-L138 WeakPolarHBondContact O-CB 3.28Å; L134-L138 WeakPolarHBondContact O-CG 3.32Å; L134-L138 PolarHBondContact O-N 3.02Å
135Q89.7Confident82.2Confident126 Ų126104 Ų10459%0.58956%0.556SS**Hα-helixtrans-65-36.6176.9-174.6169.9-7.400112.2K131 G132 H139K131-Q135 WeakPolarHBondContact O-CB 3.17Å; K131-Q135 PolarHBondContact O-N 3.37Å; G132-Q135 PolarHBondContact O-N 2.97Å; Q135-H139 WeakPolarHBondContact O-CB 3.42Å; Q135-H139 PolarHBondContact O-N 3.39Å
136A90.5Very high83.6Confident57 Ų57108 Ų10847%0.47156%0.556SS.*Hα-helixtrans-64.6-52.3173.900000111.9G132 T133 L134 L138 H139 E140G132-A136 PolarHBondContact O-N 3.44Å; T133-A136 PolarHBondContact O-N 3.22Å; L134-A136 VanDerWaalsContact C-N 3.34Å; L134-A136 PolarHBondContact O-N 2.91Å; A136-L138 VanDerWaalsContact C-N 3.3Å; A136-L138 PolarHBondContact O-N 2.96Å; A136-H139 WeakPolarHBondContact O-CA 3.28Å; A136-H139 WeakPolarHBondContact O-CB 3.5Å; A136-H139 PolarHBondContact O-N 3.21Å; A136-E140 PolarHBondContact O-N 3.29Å
137I92.9Very high84.4Confident87 Ų87108.9 Ų108.945%0.44656%0.556SS.*Hα-helixtrans-57.4-43.7177-66.5164.1000110.8T133 L134 H139 E140 L141T133-I137 HydrophobicContact CG2-CD1 4.18Å; T133-I137 WeakPolarHBondContact O-CG1 3.45Å; T133-I137 PolarHBondContact O-N 3.3Å; L134-I137 PolarHBondContact O-N 2.92Å; I137-H139 VanDerWaalsContact C-N 3.28Å; I137-H139 PolarHBondContact O-N 3.19Å; I137-E140 PolarHBondContact O-N 2.81Å; I137-L141 HydrophobicContact CG2-CD1 3.96Å; I137-L141 HydrophobicContact CG2-CG 4.47Å; I137-L141 WeakPolarHBondContact O-CB 3.49Å; I137-L141 VanDerWaalsContact O-CG 3.31Å; I137-L141 WeakPolarHBondContact O-CG 3.42Å; I137-L141 PolarHBondContact O-N 2.72Å
138L93.1Very high85.9Confident75 Ų75105.4 Ų105.439%0.39354%0.539SS..Hα-helixtrans-69.1-22.8176.2-69.6173.6000113.2L134 A136 R142L134-L138 HydrophobicContact CD1-CD1 4.02Å; L134-L138 HydrophobicContact CD1-CG 4.18Å; L134-L138 HydrophobicContact CG-CD1 3.94Å; L134-L138 HydrophobicContact CG-CG 4.49Å; L134-L138 VanDerWaalsContact O-CB 3.32Å; L134-L138 WeakPolarHBondContact O-CB 3.28Å; L134-L138 WeakPolarHBondContact O-CG 3.32Å; L134-L138 PolarHBondContact O-N 3.02Å; A136-L138 VanDerWaalsContact C-N 3.3Å; A136-L138 PolarHBondContact O-N 2.96Å; L138-R142 WeakPolarHBondContact O-CD 3.45Å; L138-R142 VanDerWaalsContact O-CG 3.23Å; L138-R142 WeakPolarHBondContact O-CG 3.04Å; L138-R142 PolarHBondContact O-NH1 3.14Å
139H94.3Very high86.3Confident124 Ų124108.4 Ų108.457%0.57455%0.546SS*.Hα-helixtrans-76.2-46172.1-175.6-99.4000110.8Q135 A136 I137 R142 A143Q135-H139 WeakPolarHBondContact O-CB 3.42Å; Q135-H139 PolarHBondContact O-N 3.39Å; A136-H139 WeakPolarHBondContact O-CA 3.28Å; A136-H139 WeakPolarHBondContact O-CB 3.5Å; A136-H139 PolarHBondContact O-N 3.21Å; I137-H139 VanDerWaalsContact C-N 3.28Å; I137-H139 PolarHBondContact O-N 3.19Å; H139-R142 WeakPolarHBondContact O-CA 3.48Å; H139-R142 WeakPolarHBondContact O-CB 3.36Å; H139-R142 PolarHBondContact O-N 2.95Å; H139-A143 PolarHBondContact O-N 3.01Å
140E92.7Very high86.6Confident128 Ų128105.2 Ų105.260%0.59853%0.532SS*.Hα-helixtrans-61.3-45.6178.8-169.6160.8-143.400112.1A136 I137 R142 A143 M144A136-E140 PolarHBondContact O-N 3.29Å; I137-E140 PolarHBondContact O-N 2.81Å; E140-R142 PolarHBondContact O-N 3.33Å; E140-A143 WeakPolarHBondContact O-CA 3.28Å; E140-A143 WeakPolarHBondContact O-CB 3.48Å; E140-A143 PolarHBondContact O-N 3.12Å; E140-M144 WeakPolarHBondContact O-CG 3.26Å; E140-M144 PolarHBondContact O-N 2.89Å
141L93.3Very high86.2Confident92 Ų92107.8 Ų107.848%0.48254%0.538SS..Hα-helixtrans-61.7-26.2173.6-69.8171.8000113.6I137 M144 R145I137-L141 HydrophobicContact CG2-CD1 3.96Å; I137-L141 HydrophobicContact CG2-CG 4.47Å; I137-L141 WeakPolarHBondContact O-CB 3.49Å; I137-L141 VanDerWaalsContact O-CG 3.31Å; I137-L141 WeakPolarHBondContact O-CG 3.42Å; I137-L141 PolarHBondContact O-N 2.72Å; L141-M144 HydrophobicContact CD2-SD 4.4Å; L141-R145 WeakPolarHBondContact O-CB 3.37Å; L141-R145 PolarHBondContact O-N 3.12Å
142R93.1Very high84.9Confident137 Ų137110 Ų11052%0.51755%0.548SS..Hα-helixtrans-78.7-35.7171.3-69.7173.1-168.4115.6-14.3111.6L138 H139 E140 R145 R146L138-R142 WeakPolarHBondContact O-CD 3.45Å; L138-R142 VanDerWaalsContact O-CG 3.23Å; L138-R142 WeakPolarHBondContact O-CG 3.04Å; L138-R142 PolarHBondContact O-NH1 3.14Å; H139-R142 WeakPolarHBondContact O-CA 3.48Å; H139-R142 WeakPolarHBondContact O-CB 3.36Å; H139-R142 PolarHBondContact O-N 2.95Å; E140-R142 PolarHBondContact O-N 3.33Å; R142-R145 PolarHBondContact O-N 3.09Å; R142-R146 WeakPolarHBondContact O-CG 3.35Å; R142-R146 PolarHBondContact O-N 2.97Å; R142-R146 VanDerWaalsContact O-N 3.11Å
143A90.2Very high83.4Confident49 Ų49110.4 Ų110.441%0.40555%0.552SS.*Hα-helixtrans-65.7-48.4175.300000111.5H139 E140 R145 R146 L147H139-A143 PolarHBondContact O-N 3.01Å; E140-A143 WeakPolarHBondContact O-CA 3.28Å; E140-A143 WeakPolarHBondContact O-CB 3.48Å; E140-A143 PolarHBondContact O-N 3.12Å; A143-R145 VanDerWaalsContact C-N 3.31Å; A143-R145 PolarHBondContact O-N 3.18Å; A143-R146 WeakPolarHBondContact O-CB 3.48Å; A143-R146 PolarHBondContact O-N 2.92Å; A143-R146 VanDerWaalsContact O-N 3.12Å; A143-L147 PolarHBondContact O-N 2.99Å
144M90.3Very high81.7Confident109 Ų109110 Ų11054%0.53755%0.549SS..Hα-helixtrans-55.2-45.5173.9-66.1177.379.900111.6E140 L141 R146 L147 M148E140-M144 WeakPolarHBondContact O-CG 3.26Å; E140-M144 PolarHBondContact O-N 2.89Å; L141-M144 HydrophobicContact CD2-SD 4.4Å; M144-R146 VanDerWaalsContact C-N 3.34Å; M144-R146 PolarHBondContact O-N 3.01Å; M144-L147 PolarHBondContact O-N 3.46Å; M144-M148 WeakPolarHBondContact O-CG 3.3Å; M144-M148 PolarHBondContact O-N 3.41Å
145R91.8Very high79.5Confident162 Ų162114.5 Ų114.561%0.61157%0.566SS**Hα-helixtrans-59.7-41.3177.3-172.4179.7-59.91781.7112.7L141 R142 A143 Q149L141-R145 WeakPolarHBondContact O-CB 3.37Å; L141-R145 PolarHBondContact O-N 3.12Å; R142-R145 PolarHBondContact O-N 3.09Å; A143-R145 VanDerWaalsContact C-N 3.31Å; A143-R145 PolarHBondContact O-N 3.18Å; R145-Q149 WeakPolarHBondContact O-CB 3.06Å; R145-Q149 VanDerWaalsContact O-CG 3.23Å; R145-Q149 WeakPolarHBondContact O-CG 3.22Å; R145-Q149 PolarHBondContact O-N 2.88Å; R145-Q149 VanDerWaalsContact O-N 3.15Å
146R86.8Confident77.4Confident180 Ų180118 Ų11868%0.67958%0.582SS**Hα-helixtrans-65.5-42.6175.7-74.5173.2172.1175.4-3.3111.7R142 A143 M144 Q149 T150R142-R146 WeakPolarHBondContact O-CG 3.35Å; R142-R146 PolarHBondContact O-N 2.97Å; R142-R146 VanDerWaalsContact O-N 3.11Å; A143-R146 WeakPolarHBondContact O-CB 3.48Å; A143-R146 PolarHBondContact O-N 2.92Å; A143-R146 VanDerWaalsContact O-N 3.12Å; M144-R146 VanDerWaalsContact C-N 3.34Å; M144-R146 PolarHBondContact O-N 3.01Å; R146-Q149 PolarHBondContact O-N 3.38Å; R146-T150 PolarHBondContact O-N 3.34Å; R146-T150 PolarHBondContact O-OG1 2.94Å
147L85Confident75Confident96 Ų96125.9 Ų125.950%0.50360%0.6SS.*Hα-helixtrans-66-42-179.9-172.7148.8000112.3A143 M144 Q149 T150 Q151A143-L147 PolarHBondContact O-N 2.99Å; M144-L147 PolarHBondContact O-N 3.46Å; L147-Q149 VanDerWaalsContact C-N 3.27Å; L147-Q149 PolarHBondContact O-N 2.86Å; L147-T150 PolarHBondContact O-N 3.19Å; L147-T150 PolarHBondContact O-OG1 3.07Å; L147-T150 VanDerWaalsContact O-OG1 3.12Å; L147-Q151 HydrophobicContact CD2-CG 4.34Å; L147-Q151 WeakPolarHBondContact O-CG 3.33Å; L147-Q151 PolarHBondContact O-N 3.02Å
148M79.8Confident72.4Confident134 Ų134132.3 Ų132.366%0.6662%0.618SS**Hα-helixtrans-64-33.1172.5-67-179.579.700112.3M144 K152M144-M148 WeakPolarHBondContact O-CG 3.3Å; M144-M148 PolarHBondContact O-N 3.41Å; M148-K152 PolarHBondContact O-N 3.28Å
149Q78.2Confident69.6Low131 Ų131137.2 Ų137.261%0.61264%0.639SS**Hα-helixtrans-72.8-36.4176.9-76.2172.8-16.900112.6R145 R146 L147R145-Q149 WeakPolarHBondContact O-CB 3.06Å; R145-Q149 VanDerWaalsContact O-CG 3.23Å; R145-Q149 WeakPolarHBondContact O-CG 3.22Å; R145-Q149 PolarHBondContact O-N 2.88Å; R145-Q149 VanDerWaalsContact O-N 3.15Å; R146-Q149 PolarHBondContact O-N 3.38Å; L147-Q149 VanDerWaalsContact C-N 3.27Å; L147-Q149 PolarHBondContact O-N 2.86Å
150T68.7Low66.9Low89 Ų89139.8 Ų139.855%0.54665%0.651SS.*Hα-helixtrans-75.2-37.4175.247.20000112.9R146 L147 K152 G153 T154R146-T150 PolarHBondContact O-N 3.34Å; R146-T150 PolarHBondContact O-OG1 2.94Å; L147-T150 PolarHBondContact O-N 3.19Å; L147-T150 PolarHBondContact O-OG1 3.07Å; L147-T150 VanDerWaalsContact O-OG1 3.12Å; T150-K152 PolarHBondContact O-N 3.05Å; T150-G153 PolarHBondContact O-N 3.19Å; T150-G153 VanDerWaalsContact O-N 3.08Å; T150-T154 WeakPolarHBondContact O-CG2 3.22Å; T150-T154 PolarHBondContact O-N 3.02Å; T150-T154 PolarHBondContact O-OG1 2.88Å; T150-T154 VanDerWaalsContact O-OG1 3.11Å
151Q61.6Low64.1Low117 Ų117139.2 Ų139.255%0.54766%0.657SS.*Hα-helixtrans-58.9-34.5173.4-76.8-174.8-8.100112.7L147 G153 T154L147-Q151 HydrophobicContact CD2-CG 4.34Å; L147-Q151 WeakPolarHBondContact O-CG 3.33Å; L147-Q151 PolarHBondContact O-N 3.02Å; Q151-G153 PolarHBondContact O-N 2.64Å; Q151-T154 PolarHBondContact O-OG1 2.91Å
152K52Low61.1Low193 Ų193144.9 Ų144.984%0.83968%0.677SS**THydrogen-bonded Turntrans-68.9-11.3177.8-167.9165.3-178176.30114.3M148 T150M148-K152 PolarHBondContact O-N 3.28Å; T150-K152 PolarHBondContact O-N 3.05Å
153G53.3Low58Low56 Ų56144.5 Ų144.558%0.57770%0.696SS**THydrogen-bonded Turntrans-118.45.7-178.500000115.7T150 Q151T150-G153 PolarHBondContact O-N 3.19Å; T150-G153 VanDerWaalsContact O-N 3.08Å; Q151-G153 PolarHBondContact O-N 2.64Å
154T50Low55.2Low81 Ų81147.2 Ų147.250%0.49771%0.711SS.*THydrogen-bonded Turntrans-110.9-12.1-17143.30000116.1T150 Q151T150-T154 WeakPolarHBondContact O-CG2 3.22Å; T150-T154 PolarHBondContact O-N 3.02Å; T150-T154 PolarHBondContact O-OG1 2.88Å; T150-T154 VanDerWaalsContact O-OG1 3.11Å; Q151-T154 PolarHBondContact O-OG1 2.91Å
155F42.8Very low52.2Low181 Ų181148 Ų14879%0.79473%0.727SS**SBendtrans-69-42174.7-88.3-89.8000112.8R157F155-R157 PolarHBondContact O-N 2.81Å; F155-R157 VanDerWaalsContact O-N 3.11Å
156E44Very low49.2Very low199 Ų199148.8 Ų148.893%0.9374%0.737SS**THydrogen-bonded Turntrans-70.4-9.1-173.9-157.4171.7-146.900114.2
157R41.9Very low47.1Very low224 Ų224144.4 Ų144.485%0.84573%0.732SS**THydrogen-bonded Turntrans-117.712-172.3-144.3-176.3-173.1-175.23.1115.5F155F155-R157 PolarHBondContact O-N 2.81Å; F155-R157 VanDerWaalsContact O-N 3.11Å
158R38.3Very low44.6Very low221 Ų221148 Ų14883%0.83475%0.746SS**SBendtrans-115.8-13.1-178.8-145.6177.2-172.7-169.31.2115.8
159E34.5Very low42.2Very low179 Ų179148 Ų14884%0.83675%0.753SS**SBendtrans-903.2179.5-61.2-158.113600114.6
160H37.3Very low39.8Very low178 Ų178146.1 Ų146.182%0.82475%0.754SS**SBendtrans-119.257.1178.6-83.932000112.1
161T33.7Very low38Very low116 Ų116149.6 Ų149.671%0.71277%0.769SS**SBendtrans-153.762.8166.6-28.10000114
162K28.9Very low36.3Very low211 Ų211149.1 Ų149.192%0.91778%0.778SS**  trans166.293.2146.3-93162.3-177.2-176.20112.8
163S28.9Very low35.3Very low129 Ų129145.8 Ų145.890%0.90278%0.779SS**  trans-158.4159.7134.1-163.10000108.3
164S31.5Very low34.2Very low105 Ų105148.6 Ų148.673%0.73479%0.79SS**  trans-118.7174.7-176-164.20000111.5
165C26.2Very low33.9Very low127 Ų127150.4 Ų150.486%0.85880%0.803SS**  trans84125.1174.7-57.30000117
166Q29.7Very low33.3Very low178 Ų178153.5 Ų153.583%0.83281%0.81SS**  trans-100.8-173.8177.6-89.8-96.2-26.400109
167P43.9Very low33.1Very low88 Ų88155.9 Ų155.957%0.57181%0.81SS**  cis-138.8-174.14.925.80.2000116.6
168H30.6Very low32.8Very low171 Ų171153.3 Ų153.379%0.79281%0.811SS**  trans72.7146.4149.7-67.5-36.7000119.5
169V29.8Very low32.5Very low135 Ų135147.3 Ų147.382%0.81880%0.803SS**  cis-131.6166.4-4-168.50000109.7
170S27.5Very low32.5Very low91 Ų91147 Ų14764%0.63680%0.802SS**  trans-91.7161.5179.250.70000115.2
171L30.7Very low32.3Very low161 Ų161148.2 Ų148.284%0.84381%0.805SS**  161.8123.9122.5-87.5154.7000115.9
172S26.3Very low32.5Very low108 Ų108154.5 Ų154.576%0.75582%0.815SS**  trans4135.4142.8-173.20000121.3
173S31.3Very low33.4Very low122 Ų122155.8 Ų155.885%0.85381%0.814SS**  -176.8170.4109.847.60000114.3
174S30.2Very low34.1Very low116 Ų116155.1 Ų155.181%0.81181%0.807SS**  trans-106164.2-166.7-133.20000113.4
175P44Very low34.6Very low118 Ų118157.5 Ų157.577%0.76681%0.808SS**  trans-90.8168.2-16136.9-37.5000115.3
176R30.5Very low35Very low247 Ų247162 Ų16293%0.93281%0.809SS**  trans-134.5138.9164.1-67.5-173.3-178.1-113-0.8111.8
177R39.1Very low35.6Very low248 Ų248161.6 Ų161.694%0.93680%0.804SS**  trans-91.4142.7168.6-66178176.8175.3-1.3110.1
178I34.8Very low35.1Very low171 Ų171163.5 Ų163.588%0.87781%0.814SS**  trans-131.5161.8155.5-63.2-174.2000107.6
179S32.2Very low35.1Very low94 Ų94160.6 Ų160.666%0.65781%0.809SS**  trans-144.8169.4-163.160.50000114.7
180Q35.6Very low35.3Very low172 Ų172160 Ų16080%0.80481%0.808SS**  trans71.4126.5166.3-50.8-177.712.200119.7
181K33Very low35.6Very low205 Ų205163.8 Ų163.889%0.89182%0.82SS**  -167.3-178.9101.2-104.4174.7-179.7176.90112.6
182R38.1Very low35.5Very low247 Ų247162 Ų16293%0.93282%0.82SS**  trans-114.2165.9-162.2-63.4167.678.9-178.73.9113.1
183R46.5Very low35.7Very low239 Ų239164.7 Ų164.790%0.90283%0.826SS**  trans-70.1169.3179.2-37.6176.8-179.7174.6-2.6112.3
184P45.2Very low35.6Very low115 Ų115165.1 Ų165.175%0.74783%0.827SS**  -153.315171.439.9-19.4000120.1
185M41.4Very low35.6Very low155 Ų155162.6 Ų162.676%0.76482%0.82SS**  trans43.5127.6138.9-59.6-92.962.200124.3
186Y35.3Very low34.9Very low221 Ų221164.4 Ų164.487%0.86783%0.829SS**  -139.8174.8128.3-157.1-103.3000110.3
187K40.5Very low34.9Very low170 Ų170155.8 Ų155.874%0.73982%0.817SS**  trans-129.4160.3-175.8-67.6-178.7178.3178.90112.3
188V33.6Very low34.6Very low128 Ų128155.6 Ų155.678%0.77682%0.816SS**  trans162103.2148149.70000106.4
189T32.1Very low34.3Very low110 Ų110153 Ų15368%0.67581%0.808SS**  83.7115.780.4-56.30000113.4
190P33.8Very low34.2Very low123 Ų123152.5 Ų152.580%0.79981%0.81SS**  trans-86.1156.717235.7-34.1000112.4
191L34Very low33.9Very low169 Ų169151.1 Ų151.189%0.88581%0.807SS**  trans-126.2124.3176.7-71.1173.6000111.7
192S28.2Very low33.6Very low123 Ų123150 Ų15086%0.8680%0.803SS**  trans179117132.9-174.80000109.5
193L30.8Very low33.2Very low166 Ų166144 Ų14487%0.86980%0.798SS**  trans-163107.1172.5-146.3151.7000112
194C28.1Very low32.6Very low131 Ų131138.7 Ų138.789%0.88580%0.795SS**  trans-173.9143156-105.30000109.8
195G30.7Very low31.7Very low63 Ų63137.2 Ų137.265%0.64980%0.801SS**  cis135.980.9-17.300000116.5
196T29.8Very low30.9Very low156 Ų156133.8 Ų133.896%0.95781%0.805SS**  trans-174.3154.8160.820.90000109.4
197G29.4Very low30.6Very low66 Ų66128.7 Ų128.768%0.6880%0.802SS**  cis165.8104-1400000116.4
198R34.8Very low30Very low243 Ų243127 Ų12792%0.91781%0.806SS**  trans85.3140.9152-53.3-177.664.6171.70.7122.9
199T26.8Very low29.8Very low116 Ų116129 Ų12971%0.71281%0.812SS**  trans80.788.6146.2-45.20000123
200A29.8Very low29.7Very low85 Ų85132.5 Ų132.570%0.70282%0.817SS**  50.8129.1115.600000126
201L29.6Very low29.2Very low143 Ų143132.5 Ų132.575%0.74982%0.815SS**  trans85.3150.1136-73.9167.8000123.5
202F28.5Very low28.9Very low182 Ų182130 Ų13080%0.79881%0.812SS**  trans68.8115.9173.4-50.8-71.4000117.4
203S28Very low29.7Very low119 Ų119129.7 Ų129.783%0.83281%0.807SS**  -156.6159.868.9-75.20000114.6
204P35.4Very low29.6Very low129 Ų129131.9 Ų131.984%0.83880%0.804SS**  trans-97.4161.9176.438.6-34.4000113.7
205G26.1Very low29.6Very low84 Ų84131.6 Ų131.687%0.86679%0.789SS**  trans-164.3103.916800000110.3
206G24.8Very low29.6Very low83 Ų83135.8 Ų135.886%0.85680%0.797SS**  trans-111.8163.2-17700000112.9
207S27Very low29.7Very low113 Ų113132 Ų13279%0.7978%0.782SS**  trans-145.6122.3162.4-173.60000110
208T28.9Very low29.8Very low135 Ų135138.1 Ų138.183%0.82879%0.789SS**  trans-135.1109.3175.9-56.60000107.4
209L29.6Very low29.6Very low171 Ų171133.6 Ų133.690%0.89578%0.776SS**  trans-134.1160170.1-78.3-179.6000111.4
210K30.2Very low29.7Very low182 Ų182137.1 Ų137.179%0.79178%0.782SS**  trans-152.8135-150.5-164.1-171.7-178.8-174.10110.6
211T22.8Very low29.6Very low123 Ų123139.6 Ų139.676%0.75578%0.779SS**  trans60.6132.7157.141.50000121.9
212S27.9Very low29.4Very low118 Ų118137.2 Ų137.283%0.82577%0.773SS**  trans98.1135.6142.1-147.50000119.8
213P45.3Very low29.5Very low116 Ų116135.9 Ų135.975%0.75377%0.769SS**  trans-114.4163175.641.7-33.3000114.8
214R28.3Very low29.5Very low212 Ų212137.5 Ų137.580%0.876%0.761SS**  trans171.2156.8156-105.7-173.6155.7-162.8-23.6109.2
215E28.8Very low29.2Very low125 Ų125138 Ų13858%0.58476%0.757SS**  cis-158.7-164.7-12.7-156.2149.7-131.100109.3
216D30.6Very low29.2Very low151 Ų151139.9 Ų139.981%0.80775%0.747SS**  trans74.6140.2162.5-74.4-45.7000120.2
217A30.4Very low29.3Very low77 Ų77140.6 Ų140.664%0.63674%0.738SS**  cis-163.9168.3-10.200000114.1
218K31.3Very low29.4Very low193 Ų193140.5 Ų140.584%0.83974%0.738SS**  trans74.3142.9157.2-76.9-179.1180172.90119.5
219K31.1Very low29.5Very low148 Ų148142 Ų14264%0.64374%0.74SS**  cis-163.8176.5-18.3-144.8-179.1-170.8-88.40110.4E221K219-E221 IonicContact NZ-OE1 2.71Å; K219-E221 PolarHBondContact NZ-OE1 2.79Å; K219-E221 IonicContact NZ-OE2 3.32Å; K219-E221 PolarHBondContact NZ-OE2 3.01Å
220K28.7Very low29.4Very low191 Ų191142.2 Ų142.283%0.8374%0.74SS**  trans89.3109.3179.2-60-169.3175.4-173.30113.9
221E27.7Very low29.2Very low137 Ų137138 Ų13864%0.6473%0.734SS**  cis72.2130.522.2-142.7178.7175.100111.1K219K219-E221 IonicContact NZ-OE1 2.71Å; K219-E221 PolarHBondContact NZ-OE1 2.79Å; K219-E221 IonicContact NZ-OE2 3.32Å; K219-E221 PolarHBondContact NZ-OE2 3.01Å
222C26.7Very low29.3Very low93 Ų93137.1 Ų137.163%0.62873%0.731SS**  cis-127.5147.624.5-110.20000111.2
223E29.7Very low29.2Very low153 Ų153138 Ų13872%0.71573%0.727SS**  65.5145.989.7-74.9-160.4125.500115.9
224K28.6Very low28.2Very low154 Ų154138.4 Ų138.467%0.6773%0.727SS**  cis-178.4136.7-6.3159.2-179-176.9174.10110.9
225L29.3Very low28.2Very low140 Ų140134 Ų13473%0.73373%0.728SS**  trans41.6165.6149.3-54173.2000120.1
226D25.5Very low28.3Very low123 Ų123137 Ų13766%0.65874%0.742SS**  cis-157.9159.814-139.8-40.5000113.8
227S28Very low29.1Very low98 Ų98134.5 Ų134.569%0.68573%0.734SS**  trans46.8144.1144.3-72.70000127
228S27.7Very low29.2Very low111 Ų111137 Ų13778%0.77674%0.744SS**  trans95100.4137.766.10000123.9
229L30.8Very low29Very low165 Ų165132.6 Ų132.686%0.86474%0.738SS**  25.1129.6124.7-65.2166000122.5
230I28.2Very low28.9Very low176 Ų176135.9 Ų135.990%0.90375%0.746SS**  trans166.3162.2139.4-90154.2000107.8
231S25Very low28.8Very low95 Ų95132.4 Ų132.466%0.66474%0.736SS**  -168.8150-61.3-167.80000108.3
232C25.9Very low29Very low103 Ų103132.2 Ų132.270%0.69674%0.74SS**  trans65.9114.6159.6-71.70000122.6
233D24.9Very low29.2Very low138 Ų138136.7 Ų136.774%0.73875%0.751SS**  93.4124.9118.3-75.9-54.5000125.8
234V25.5Very low29.3Very low123 Ų123137 Ų13775%0.74576%0.756SS**  trans36.4121130.8176.20000120.6
235S28.8Very low29.4Very low119 Ų119134.1 Ų134.183%0.83276%0.762SS**  -162.1157.2122.2-81.70000112.2
236E30.5Very low29.4Very low189 Ų189134.5 Ų134.588%0.88377%0.765SS**  trans-94.6178.9-176.7-111.5-152.397.400113.1
237P47.8Very low29.6Very low99 Ų99134.1 Ų134.164%0.64377%0.772SS**  trans-100.6176.3-156.641.2-39.6000115.2
238P32Very low29.7Very low128 Ų128132.8 Ų132.883%0.83177%0.773SS**  trans-103.2166.3149.936.3-29.1000112.4
239S26.1Very low30.1Very low102 Ų102133.6 Ų133.671%0.71377%0.774SS**  trans-134166-172.367.90000112.6
240R29.2Very low30.5Very low216 Ų216134.8 Ų134.882%0.81577%0.774SS**  trans67.5149.8163.2-66.7-17679.4164.37.6115.5
241N26.9Very low30.6Very low118 Ų118129.7 Ų129.763%0.63177%0.765SS**  cis-145.417711.2-93.9-36.9000110.2
242D31.4Very low31.4Very low134 Ų134130.9 Ų130.972%0.71777%0.771SS**  trans-70.9154.1177.4-41-102.3000115.5
243Q31.5Very low31.6Very low186 Ų186133.3 Ų133.387%0.86978%0.776SS**  trans-174.7108.7131-101.9151.3112.300115.1
244I31.6Very low31.9Very low159 Ų159132.9 Ų132.982%0.81577%0.773SS**  trans23.9134.3130.8-63168.4000120.8
245A30.4Very low32.2Very low95 Ų95133.9 Ų133.979%0.78577%0.774SS**  trans69.9156.415600000119
246D29.1Very low32.6Very low148 Ų148132.8 Ų132.879%0.79177%0.772SS**  cis-165.9150.6-28.2175.934.4000107.8
247S31.5Very low33Very low115 Ų115132 Ų13280%0.80477%0.773SS**  trans153.5106.2160.9-760000110.7
248G30Very low32.2Very low70 Ų70131 Ų13172%0.72278%0.782SS**  trans-93163.8174.100000114.2
249T36.2Very low32.1Very low128 Ų128127.7 Ų127.779%0.78577%0.77SS**  trans-161.1112167.7-84.70000109.8
250H38Very low32.5Very low189 Ų189131.6 Ų131.688%0.87578%0.777SS**  trans35138155-52.8-102.4000120.3
251G30.1Very low32.9Very low69 Ų69131 Ų13171%0.71178%0.783SS**  cis-170.5-175.313.200000112.3
252P42.1Very low33.3Very low121 Ų121128.7 Ų128.779%0.78678%0.781SS**  trans-134.8164.1-133.843-29000120.3
253L30.2Very low34Very low153 Ų153130.5 Ų130.580%0.80179%0.789SS**  trans72.4117.6143-106.479.4000124.1
254L31.7Very low34.9Very low129 Ų129126.4 Ų126.468%0.67577%0.77SS**  trans72.1147.7131.3-85.2-176.8000124.5
255N32Very low37.2Very low145 Ų145121.9 Ų121.978%0.77575%0.752SS**  trans72143.7161.9-59.2-25.2000116.5
256A36.5Very low39.9Very low95 Ų95122.5 Ų122.579%0.78574%0.742SS**  cis-165167-0.100000108.6
257L38.3Very low42.9Very low172 Ų172117.8 Ų117.890%0.90172%0.719SS**  cis-169.8144.6-12.616366000108.2
258G32.7Very low45.9Very low80 Ų80117.1 Ų117.183%0.82570%0.699SS**SBendtrans133.284.216200000114.8
259G28.7Very low48.9Very low57 Ų57114.1 Ų114.159%0.58867%0.666SS**SBendcis-168.9-175.1200000112.4
260H33.9Very low51.5Low185 Ų185108.3 Ų108.386%0.85663%0.632SS**  trans60.163.4177.7-63-81.8000116.7A262H260-A262 PolarHBondContact O-N 3.45Å
261Q37.5Very low53.9Low204 Ų204105.6 Ų105.695%0.95362%0.619SS**  trans-70.681.1147-74.2-171.915.200109.6
262A36.3Very low56.7Low69 Ų69108.7 Ų108.757%0.5762%0.62SS**  trans-139.580.3163.300000106.2H260 E264H260-A262 PolarHBondContact O-N 3.45Å; A262-E264 PolarHBondContact O-N 2.99Å
263L46.5Very low59.1Low171 Ų171105.7 Ų105.790%0.89559%0.593SS**  trans-7866.9179-152.1158.3000108.7
264E50.7Low62Low100 Ų100103.9 Ų103.947%0.46758%0.584SS.*  trans-44.6136.4157.2-77.2-71.6136.100108.1A262 D266 A280A262-E264 PolarHBondContact O-N 2.99Å; E264-D266 PolarHBondContact O-N 3.18Å; E264-A280 VanDerWaalsContact OE2-CB 3.26Å; E264-A280 WeakPolarHBondContact OE2-CB 3.36Å
265S79.1Confident64.9Low64 Ų6498 Ų9845%0.44855%0.553SS.*  trans-71.898.4-175.524.10000109.5V267 K279S265-V267 PolarHBondContact O-N 2.95Å; S265-K279 WeakPolarHBondContact O-CB 3.45Å; S265-K279 PolarHBondContact O-N 2.84Å
266D87.3Confident67.9Low108 Ų10896.2 Ų96.258%0.57854%0.539SS*.EExtended strand (participates in β ladder)trans-69.1125.7174.8-83-32000110.7E264 F276 S278E264-D266 PolarHBondContact O-N 3.18Å; D266-F276 HydrophobicContact CB-CB 4.42Å; D266-S278 VanDerWaalsContact OD1-CA 3.25Å; D266-S278 WeakPolarHBondContact OD1-CA 3.5Å; D266-S278 PolarHBondContact OD1-N 2.86Å
267V92Very high70.7Confident50 Ų5091.9 Ų91.930%0.30350%0.503SS..EExtended strand (participates in β ladder)trans-110.7129.6-177.31730000109.1S265 L269 F276 I277 K279 L282S265-V267 PolarHBondContact O-N 2.95Å; V267-L269 PolarHBondContact O-N 2.96Å; V267-F276 WeakPolarHBondContact O-CA 3.46Å; V267-I277 PolarHBondContact N-O 3.35Å; V267-I277 PolarHBondContact O-N 2.92Å; V267-K279 HydrophobicContact CG2-CB 3.89Å; V267-K279 HydrophobicContact CG2-CD 4.42Å; V267-K279 HydrophobicContact CG2-CG 4.2Å; V267-L282 HydrophobicContact CB-CD2 4.41Å; V267-L282 HydrophobicContact CG1-CD2 4.07Å
268R93.9Very high73.4Confident101 Ų10185 Ų8538%0.38147%0.469SS..EExtended strand (participates in β ladder)trans-70.3126.3174.6-160.9177.7-176.3-140.1-0.9109.6E271 Y273 D274 F276R268-E271 VanDerWaalsContact CZ-O 3.3Å; R268-E271 PolarHBondContact NH1-O 3.15Å; R268-E271 PolarHBondContact NH2-O 3.44Å; R268-Y273 WeakPolarHBondContact CG-O 3.2Å; R268-Y273 PolarHBondContact NE-O 3.06Å; R268-D274 IonicContact CZ-OD1 3.37Å; R268-D274 IonicContact NE-OD1 2.64Å; R268-D274 PolarHBondContact NE-OD1 3.34Å; R268-D274 IonicContact NH2-OD1 3.54Å; R268-D274 PolarHBondContact NH2-OD1 2.86Å; R268-F276 HydrophobicContact CB-CD1 3.94Å; R268-F276 HydrophobicContact CB-CE1 3.65Å; R268-F276 HydrophobicContact CB-CZ 4.27Å; R268-F276 HydrophobicContact CG-CD1 4.32Å; R268-F276 HydrophobicContact CG-CE1 3.86Å; R268-F276 HydrophobicContact CG-CZ 3.95Å
269L92.8Very high76.1Confident6 Ų685.3 Ų85.33%0.03145%0.448CS..EExtended strand (participates in β ladder)trans-75.7-28.4-170.1-168.367.7000113.2V267 V275 I277 L282 F304 A337 I338 F341V267-L269 PolarHBondContact O-N 2.96Å; L269-V275 HydrophobicContact CB-CG1 4.44Å; L269-V275 WeakPolarHBondContact CB-O 3.43Å; L269-V275 HydrophobicContact CD2-CG1 4.38Å; L269-V275 PolarHBondContact N-O 3.5Å; L269-I277 HydrophobicContact CD1-CG2 4.15Å; L269-L282 HydrophobicContact CD1-CD1 4.16Å; L269-F304 HydrophobicContact CD2-CE2 3.68Å; L269-F304 HydrophobicContact CD2-CZ 3.93Å; L269-A337 HydrophobicContact CD2-CB 4.21Å; L269-I338 HydrophobicContact CD2-CB 4.28Å; L269-I338 HydrophobicContact CD2-CG1 3.61Å; L269-F341 HydrophobicContact CD1-CB 4.11Å; L269-F341 HydrophobicContact CD1-CD1 3.77Å; L269-F341 HydrophobicContact CD1-CD2 3.87Å; L269-F341 HydrophobicContact CD1-CE1 4.13Å; L269-F341 HydrophobicContact CD1-CE2 4.21Å; L269-F341 HydrophobicContact CD1-CG 3.62Å; L269-F341 HydrophobicContact CD1-CZ 4.34Å; L269-F341 HydrophobicContact CG-CB 3.86Å; L269-F341 HydrophobicContact CG-CD1 4.43Å; L269-F341 HydrophobicContact CG-CD2 4.32Å; L269-F341 HydrophobicContact CG-CG 3.95Å; L269-F341 WeakPolarHBondContact O-CB 3.48Å; L269-F341 WeakPolarHBondContact O-CD2 3.19Å
270A91.9Very high79.2Confident7 Ų785.2 Ų85.26%0.05844%0.441CS..EExtended strand (participates in β ladder)trans-150.8150.4175.100000111.5D272 Y273 A337 V340A270-D272 VanDerWaalsContact C-N 3.28Å; A270-D272 PolarHBondContact O-N 3.23Å; A270-Y273 HydrophobicContact CB-CD2 3.71Å; A270-Y273 HydrophobicContact CB-CG 4.34Å; A270-Y273 PolarHBondContact O-N 3.3Å; A270-A337 HydrophobicContact CB-CB 4.45Å; A270-V340 HydrophobicContact CB-CB 4.44Å; A270-V340 HydrophobicContact CB-CG1 4.27Å
271E88.7Confident82.1Confident131 Ų13180.1 Ų80.161%0.61242%0.418SS*.THydrogen-bonded Turntrans-65.1-23.8-173.9-72.1127.6-101.400114.7R268 K344R268-E271 VanDerWaalsContact CZ-O 3.3Å; R268-E271 PolarHBondContact NH1-O 3.15Å; R268-E271 PolarHBondContact NH2-O 3.44Å; E271-K344 IonicContact OE1-NZ 2.79Å; E271-K344 PolarHBondContact OE1-NZ 3.03Å; E271-K344 IonicContact OE2-NZ 2.62Å
272D88.3Confident84.7Confident135 Ų13570.9 Ų70.972%0.72238%0.375SS*.THydrogen-bonded Turntrans-98.93.8178.7-49.5-56.8000113.7A270A270-D272 VanDerWaalsContact C-N 3.28Å; A270-D272 PolarHBondContact O-N 3.23Å
273Y92Very high87.4Confident57 Ų5770.6 Ų70.622%0.22436%0.364CS..EExtended strand (participates in β ladder)trans-133.6127.7-166.7-65.7-100.1000112.8R268 A270 V275 N333 A337 V340R268-Y273 WeakPolarHBondContact CG-O 3.2Å; R268-Y273 PolarHBondContact NE-O 3.06Å; A270-Y273 HydrophobicContact CB-CD2 3.71Å; A270-Y273 HydrophobicContact CB-CG 4.34Å; A270-Y273 PolarHBondContact O-N 3.3Å; Y273-V275 PolarHBondContact O-N 2.99Å; Y273-N333 WeakPolarHBondContact CD1-O 3.34Å; Y273-N333 WeakPolarHBondContact CD1-OD1 3.44Å; Y273-N333 WeakPolarHBondContact CE1-O 3.41Å; Y273-A337 HydrophobicContact CD1-CB 3.81Å; Y273-A337 HydrophobicContact CD2-CB 4.33Å; Y273-A337 HydrophobicContact CG-CB 3.66Å; Y273-V340 HydrophobicContact CE2-CB 4.46Å; Y273-V340 HydrophobicContact CE2-CG2 3.98Å
274D91.4Very high89.6Confident115 Ų11565.7 Ų65.762%0.61534%0.344SS*.EExtended strand (participates in β ladder)trans-8358.8177.6-58.8-31.1000111.5R268 F276R268-D274 IonicContact CZ-OD1 3.37Å; R268-D274 IonicContact NE-OD1 2.64Å; R268-D274 PolarHBondContact NE-OD1 3.34Å; R268-D274 IonicContact NH2-OD1 3.54Å; R268-D274 PolarHBondContact NH2-OD1 2.86Å; D274-F276 HydrophobicContact CB-CE2 4.34Å
275V93.5Very high91.5Very high6 Ų661.8 Ų61.84%0.03633%0.326CS..EExtended strand (participates in β ladder)trans-125.9112.7-173.9177.50000107.8L269 Y273 F304 I334 A337L269-V275 HydrophobicContact CB-CG1 4.44Å; L269-V275 WeakPolarHBondContact CB-O 3.43Å; L269-V275 HydrophobicContact CD2-CG1 4.38Å; L269-V275 PolarHBondContact N-O 3.5Å; Y273-V275 PolarHBondContact O-N 2.99Å; V275-F304 HydrophobicContact CG1-CD1 4.15Å; V275-F304 HydrophobicContact CG1-CE1 3.39Å; V275-F304 HydrophobicContact CG1-CE2 4.47Å; V275-F304 HydrophobicContact CG1-CZ 3.58Å; V275-I334 HydrophobicContact CG1-CG1 4.3Å; V275-I334 HydrophobicContact CG2-CG1 4.1Å; V275-A337 HydrophobicContact CB-CB 3.71Å; V275-A337 HydrophobicContact CG1-CB 3.92Å; V275-A337 HydrophobicContact CG2-CB 3.78Å
276F94.1Very high92.1Very high107 Ų10760.1 Ų60.147%0.46931%0.312SS..EExtended strand (participates in β ladder)trans-113.9148.2-171.7-63.3-94.9000111.4D266 V267 R268 D274 F304D266-F276 HydrophobicContact CB-CB 4.42Å; V267-F276 WeakPolarHBondContact O-CA 3.46Å; R268-F276 HydrophobicContact CB-CD1 3.94Å; R268-F276 HydrophobicContact CB-CE1 3.65Å; R268-F276 HydrophobicContact CB-CZ 4.27Å; R268-F276 HydrophobicContact CG-CD1 4.32Å; R268-F276 HydrophobicContact CG-CE1 3.86Å; R268-F276 HydrophobicContact CG-CZ 3.95Å; D274-F276 HydrophobicContact CB-CE2 4.34Å; F276-F304 VanDerWaalsContact O-CE1 3.24Å; F276-F304 WeakPolarHBondContact O-CE1 3.47Å
277I94.1Very high92.2Very high5 Ų560.2 Ų60.23%0.02632%0.316CS..EExtended strand (participates in β ladder)trans-142.6141.9176.1-177.3167.5000109.2V267 L269 K279 Q281 L282 I285 L300 A303 F304V267-I277 PolarHBondContact N-O 3.35Å; V267-I277 PolarHBondContact O-N 2.92Å; L269-I277 HydrophobicContact CD1-CG2 4.15Å; I277-K279 PolarHBondContact O-N 3.03Å; I277-Q281 HydrophobicContact CD1-CB 4.43Å; I277-Q281 HydrophobicContact CD1-CG 4.16Å; I277-Q281 HydrophobicContact CG1-CB 4.21Å; I277-Q281 HydrophobicContact CG1-CG 4.35Å; I277-L282 HydrophobicContact CD1-CB 4.41Å; I277-L282 HydrophobicContact CG1-CB 4.45Å; I277-L282 HydrophobicContact CG2-CB 4.03Å; I277-L282 HydrophobicContact CG2-CD1 4.34Å; I277-L282 HydrophobicContact CG2-CD2 4.03Å; I277-L282 HydrophobicContact CG2-CG 4.36Å; I277-I285 HydrophobicContact CD1-CD1 4.44Å; I277-L300 HydrophobicContact CD1-CD2 4.3Å; I277-A303 HydrophobicContact CD1-CB 4.12Å; I277-F304 HydrophobicContact CB-CE2 4.31Å; I277-F304 HydrophobicContact CB-CZ 3.77Å; I277-F304 HydrophobicContact CD1-CE2 4.09Å; I277-F304 HydrophobicContact CD1-CZ 4.4Å; I277-F304 HydrophobicContact CG2-CZ 4.34Å
278S95.2Very high91.8Very high28 Ų2862.8 Ų62.820%0.19633%0.328CS..EExtended strand (participates in β ladder)trans-64.4135.2179.263.80000110.9D266 A280 Q281 L282D266-S278 VanDerWaalsContact OD1-CA 3.25Å; D266-S278 WeakPolarHBondContact OD1-CA 3.5Å; D266-S278 PolarHBondContact OD1-N 2.86Å; S278-A280 VanDerWaalsContact C-N 3.27Å; S278-A280 PolarHBondContact O-N 3.43Å; S278-Q281 WeakPolarHBondContact O-CB 3.46Å; S278-Q281 PolarHBondContact O-N 3.38Å; S278-Q281 VanDerWaalsContact OG-CB 3.31Å; S278-Q281 WeakPolarHBondContact OG-CB 3.26Å; S278-L282 PolarHBondContact O-N 3.1Å
279K91Very high91.2Very high86 Ų8661.2 Ų61.237%0.37432%0.323SS..Hα-helixtrans-55.9-40.7-174.4-175.4175.1-171.9-57.60112.5S265 V267 I277 Q281 L282 D283S265-K279 WeakPolarHBondContact O-CB 3.45Å; S265-K279 PolarHBondContact O-N 2.84Å; V267-K279 HydrophobicContact CG2-CB 3.89Å; V267-K279 HydrophobicContact CG2-CD 4.42Å; V267-K279 HydrophobicContact CG2-CG 4.2Å; I277-K279 PolarHBondContact O-N 3.03Å; K279-Q281 VanDerWaalsContact C-N 3.32Å; K279-Q281 PolarHBondContact O-N 3.46Å; K279-L282 PolarHBondContact O-N 2.92Å; K279-D283 WeakPolarHBondContact CG-OD2 3.35Å; K279-D283 IonicContact NZ-OD1 2.6Å; K279-D283 IonicContact NZ-OD2 2.64Å; K279-D283 PolarHBondContact NZ-OD2 2.99Å; K279-D283 WeakPolarHBondContact O-CB 3.16Å; K279-D283 VanDerWaalsContact O-CG 3.27Å; K279-D283 PolarHBondContact O-N 3.11Å
280A93.4Very high90.3Very high54 Ų5463.7 Ų63.745%0.44634%0.338SS..Hα-helixtrans-62.1-37.9176.800000112.8E264 S278 S284E264-A280 VanDerWaalsContact OE2-CB 3.26Å; E264-A280 WeakPolarHBondContact OE2-CB 3.36Å; S278-A280 VanDerWaalsContact C-N 3.27Å; S278-A280 PolarHBondContact O-N 3.43Å; A280-S284 WeakPolarHBondContact O-CB 3.22Å; A280-S284 PolarHBondContact O-N 3.27Å; A280-S284 VanDerWaalsContact O-N 3.08Å
281Q93.4Very high89.5Confident78 Ų7874.3 Ų74.336%0.36438%0.377SS..Hα-helixtrans-70-42.6175.8-169.7-177.125.600111.2I277 S278 K279 I285I277-Q281 HydrophobicContact CD1-CB 4.43Å; I277-Q281 HydrophobicContact CD1-CG 4.16Å; I277-Q281 HydrophobicContact CG1-CB 4.21Å; I277-Q281 HydrophobicContact CG1-CG 4.35Å; S278-Q281 WeakPolarHBondContact O-CB 3.46Å; S278-Q281 PolarHBondContact O-N 3.38Å; S278-Q281 VanDerWaalsContact OG-CB 3.31Å; S278-Q281 WeakPolarHBondContact OG-CB 3.26Å; K279-Q281 VanDerWaalsContact C-N 3.32Å; K279-Q281 PolarHBondContact O-N 3.46Å; Q281-I285 HydrophobicContact CG-CD1 4.13Å; Q281-I285 WeakPolarHBondContact O-CB 3.37Å; Q281-I285 VanDerWaalsContact O-CG1 3.26Å; Q281-I285 WeakPolarHBondContact O-CG1 3.31Å; Q281-I285 PolarHBondContact O-N 3.4Å
282L93.6Very high89.2Confident10 Ų1069.2 Ų69.25%0.05236%0.355CS..Hα-helixtrans-64.5-51.4177.6-177.458.6000111.7V267 L269 I277 S278 K279 S284 I285 L286 L300 F341V267-L282 HydrophobicContact CB-CD2 4.41Å; V267-L282 HydrophobicContact CG1-CD2 4.07Å; L269-L282 HydrophobicContact CD1-CD1 4.16Å; I277-L282 HydrophobicContact CD1-CB 4.41Å; I277-L282 HydrophobicContact CG1-CB 4.45Å; I277-L282 HydrophobicContact CG2-CB 4.03Å; I277-L282 HydrophobicContact CG2-CD1 4.34Å; I277-L282 HydrophobicContact CG2-CD2 4.03Å; I277-L282 HydrophobicContact CG2-CG 4.36Å; S278-L282 PolarHBondContact O-N 3.1Å; K279-L282 PolarHBondContact O-N 2.92Å; L282-S284 VanDerWaalsContact C-N 3.32Å; L282-S284 PolarHBondContact O-N 2.92Å; L282-I285 PolarHBondContact O-N 2.98Å; L282-I285 VanDerWaalsContact O-N 3.15Å; L282-L286 HydrophobicContact CD1-CD1 4.3Å; L282-L286 HydrophobicContact CD1-CG 4.26Å; L282-L286 HydrophobicContact CG-CD1 4.09Å; L282-L286 HydrophobicContact CG-CG 4.46Å; L282-L286 WeakPolarHBondContact O-CG 3.4Å; L282-L286 PolarHBondContact O-N 2.93Å; L282-L300 HydrophobicContact CD1-CD2 3.99Å; L282-F341 HydrophobicContact CD1-CE1 4.07Å; L282-F341 HydrophobicContact CD1-CZ 3.91Å
283D92Very high89Confident64 Ų6462.8 Ų62.834%0.34232%0.321SS..Hα-helixtrans-58.5-43.8178.3-72.3-16.7000111.1K279 I285 L286 V287K279-D283 WeakPolarHBondContact CG-OD2 3.35Å; K279-D283 IonicContact NZ-OD1 2.6Å; K279-D283 IonicContact NZ-OD2 2.64Å; K279-D283 PolarHBondContact NZ-OD2 2.99Å; K279-D283 WeakPolarHBondContact O-CB 3.16Å; K279-D283 VanDerWaalsContact O-CG 3.27Å; K279-D283 PolarHBondContact O-N 3.11Å; D283-I285 PolarHBondContact O-N 3.25Å; D283-L286 PolarHBondContact O-N 3.11Å; D283-V287 WeakPolarHBondContact O-CB 3.45Å; D283-V287 VanDerWaalsContact O-CG2 3.32Å; D283-V287 WeakPolarHBondContact O-CG2 3.33Å; D283-V287 PolarHBondContact O-N 3.16Å
284S93.2Very high88.6Confident68 Ų6861.1 Ų61.148%0.47632%0.318SS..Hα-helixtrans-60.6-42.6175.7-179.70000112.5A280 L282 N288A280-S284 WeakPolarHBondContact O-CB 3.22Å; A280-S284 PolarHBondContact O-N 3.27Å; A280-S284 VanDerWaalsContact O-N 3.08Å; L282-S284 VanDerWaalsContact C-N 3.32Å; L282-S284 PolarHBondContact O-N 2.92Å; S284-N288 PolarHBondContact O-N 3.49Å; S284-N288 PolarHBondContact O-ND2 2.77Å
285I91.5Very high88.4Confident17 Ų1759.4 Ų59.49%0.08731%0.308CS..Hα-helixtrans-66.6-43175.3-72.6168000111I277 Q281 L282 D283 Y289 L296 K299 L300 A303I277-I285 HydrophobicContact CD1-CD1 4.44Å; Q281-I285 HydrophobicContact CG-CD1 4.13Å; Q281-I285 WeakPolarHBondContact O-CB 3.37Å; Q281-I285 VanDerWaalsContact O-CG1 3.26Å; Q281-I285 WeakPolarHBondContact O-CG1 3.31Å; Q281-I285 PolarHBondContact O-N 3.4Å; L282-I285 PolarHBondContact O-N 2.98Å; L282-I285 VanDerWaalsContact O-N 3.15Å; D283-I285 PolarHBondContact O-N 3.25Å; I285-Y289 HydrophobicContact CG2-CD2 4.41Å; I285-Y289 WeakPolarHBondContact O-CB 3.28Å; I285-Y289 VanDerWaalsContact O-CD2 3.28Å; I285-Y289 WeakPolarHBondContact O-CD2 3.21Å; I285-Y289 PolarHBondContact O-N 2.87Å; I285-Y289 VanDerWaalsContact O-N 3.12Å; I285-L296 HydrophobicContact CG2-CD1 3.58Å; I285-K299 HydrophobicContact CG2-CB 4.05Å; I285-L300 HydrophobicContact CD1-CD2 4.3Å; I285-L300 HydrophobicContact CG2-CD2 4.09Å; I285-L300 HydrophobicContact CG2-CG 4.23Å; I285-A303 HydrophobicContact CD1-CB 3.82Å
286L90.3Very high88.3Confident29 Ų2959.1 Ų59.115%0.15231%0.307CS..Hα-helixtrans-61.8-55.3179.4-72.2175.8000111.1L282 D283 N288 Y289 T290 L296 F341 Y345L282-L286 HydrophobicContact CD1-CD1 4.3Å; L282-L286 HydrophobicContact CD1-CG 4.26Å; L282-L286 HydrophobicContact CG-CD1 4.09Å; L282-L286 HydrophobicContact CG-CG 4.46Å; L282-L286 WeakPolarHBondContact O-CG 3.4Å; L282-L286 PolarHBondContact O-N 2.93Å; D283-L286 PolarHBondContact O-N 3.11Å; L286-N288 PolarHBondContact O-N 2.76Å; L286-Y289 PolarHBondContact O-N 3.15Å; L286-Y289 VanDerWaalsContact O-N 3.09Å; L286-T290 WeakPolarHBondContact O-CG2 3.49Å; L286-T290 PolarHBondContact O-N 2.83Å; L286-L296 HydrophobicContact CD2-CD1 3.94Å; L286-L296 HydrophobicContact CD2-CD2 4.17Å; L286-F341 HydrophobicContact CD1-CZ 4.38Å; L286-F341 HydrophobicContact CD2-CE1 4.1Å; L286-F341 HydrophobicContact CD2-CZ 4.07Å; L286-Y345 HydrophobicContact CD2-CD2 3.95Å; L286-Y345 HydrophobicContact CD2-CE1 4.39Å; L286-Y345 HydrophobicContact CD2-CE2 3.59Å
287V89.1Confident88.1Confident111 Ų11154.3 Ų54.367%0.67329%0.286SS*.Hα-helixtrans-51.3-43.6179.91680000112D283D283-V287 WeakPolarHBondContact O-CB 3.45Å; D283-V287 VanDerWaalsContact O-CG2 3.32Å; D283-V287 WeakPolarHBondContact O-CG2 3.33Å; D283-V287 PolarHBondContact O-N 3.16Å
288N84.8Confident87.9Confident103 Ų10357.7 Ų57.755%0.55130%0.298SS*.Hα-helixtrans-80.1-21.2-176.6-76.5-79.8000114.7S284 L286S284-N288 PolarHBondContact O-N 3.49Å; S284-N288 PolarHBondContact O-ND2 2.77Å; L286-N288 PolarHBondContact O-N 2.76Å
289Y81.1Confident87.8Confident69 Ų6960.7 Ų60.727%0.27131%0.308SS..Hα-helixtrans-128.212.4-170-58.5-67.2000115.5I285 L286 R291 S292 L295 K299I285-Y289 HydrophobicContact CG2-CD2 4.41Å; I285-Y289 WeakPolarHBondContact O-CB 3.28Å; I285-Y289 VanDerWaalsContact O-CD2 3.28Å; I285-Y289 WeakPolarHBondContact O-CD2 3.21Å; I285-Y289 PolarHBondContact O-N 2.87Å; I285-Y289 VanDerWaalsContact O-N 3.12Å; L286-Y289 PolarHBondContact O-N 3.15Å; L286-Y289 VanDerWaalsContact O-N 3.09Å; Y289-R291 PolarHBondContact O-N 3.04Å; Y289-S292 PolarHBondContact O-N 2.9Å; Y289-L295 HydrophobicContact CD1-CB 4.16Å; Y289-K299 HydrophobicContact CD1-CG 4.41Å; Y289-K299 HydrophobicContact CD2-CB 4.06Å; Y289-K299 HydrophobicContact CD2-CD 4.05Å; Y289-K299 HydrophobicContact CD2-CG 3.65Å; Y289-K299 HydrophobicContact CE1-CG 4.34Å; Y289-K299 HydrophobicContact CE2-CB 4.33Å; Y289-K299 HydrophobicContact CE2-CD 3.44Å; Y289-K299 VanDerWaalsContact CE2-CD 3.44Å; Y289-K299 HydrophobicContact CE2-CG 3.55Å; Y289-K299 HydrophobicContact CG-CG 4.11Å; Y289-K299 VanDerWaalsContact CZ-CE 3.43Å; Y289-K299 WeakPolarHBondContact OH-CE 3.26Å; Y289-K299 PolarHBondContact OH-NZ 2.94Å
290T73.6Confident87.9Confident58 Ų5856.6 Ų56.636%0.35629%0.29SS..THydrogen-bonded Turntrans-40.7-37.7176.155.40000115.8L286 S292 I351L286-T290 WeakPolarHBondContact O-CG2 3.49Å; L286-T290 PolarHBondContact O-N 2.83Å; T290-S292 PolarHBondContact O-N 3.37Å; T290-I351 WeakPolarHBondContact O-CD1 3.49Å
291R74.7Confident87.9Confident230 Ų23054 Ų5487%0.86827%0.269SS*.THydrogen-bonded Turntrans-88.22.6-167.2-49.2-168.179.7-178.86.1115.5Y289Y289-R291 PolarHBondContact O-N 3.04Å
292S82.9Confident87.7Confident23 Ų2352.7 Ų52.716%0.16127%0.267CS..  trans-156.8116.2172.5-1740000112.8Y289 T290 S294 L295 L296Y289-S292 PolarHBondContact O-N 2.9Å; T290-S292 PolarHBondContact O-N 3.37Å; S292-S294 PolarHBondContact O-N 2.8Å; S292-S294 VanDerWaalsContact O-N 3.1Å; S292-S294 PolarHBondContact OG-N 3.3Å; S292-S294 PolarHBondContact OG-OG 2.96Å; S292-L295 PolarHBondContact O-N 3.21Å; S292-L296 PolarHBondContact O-N 3.35Å
293G84.9Confident87.7Confident1 Ų153.7 Ų53.71%0.0128%0.277CS..Hα-helixtrans-52.8-32.317200000113.7L295 F297 C346G293-L295 PolarHBondContact O-N 2.84Å; G293-F297 WeakPolarHBondContact O-CB 3.19Å; G293-F297 PolarHBondContact O-N 3.32Å; G293-C346 WeakPolarHBondContact CA-SG 3.45Å
294S83.7Confident87.7Confident22 Ų2252.9 Ų52.915%0.15427%0.27CS..Hα-helixtrans-68-32.3176.380.70000113.7S292 R298 Q363S292-S294 PolarHBondContact O-N 2.8Å; S292-S294 VanDerWaalsContact O-N 3.1Å; S292-S294 PolarHBondContact OG-N 3.3Å; S292-S294 PolarHBondContact OG-OG 2.96Å; S294-R298 VanDerWaalsContact O-CG 3.31Å; S294-R298 WeakPolarHBondContact O-CG 3.27Å; S294-R298 PolarHBondContact O-N 3.47Å; S294-R298 PolarHBondContact O-NE 2.87Å; S294-Q363 PolarHBondContact O-OE1 3.45Å
295L86.4Confident87.6Confident78 Ų7850.6 Ų50.641%0.40825%0.252SS..Hα-helixtrans-82.2-40.7176-66.6-179.6000111Y289 S292 G293 R298 K299Y289-L295 HydrophobicContact CD1-CB 4.16Å; S292-L295 PolarHBondContact O-N 3.21Å; G293-L295 PolarHBondContact O-N 2.84Å; L295-R298 PolarHBondContact O-N 3.21Å; L295-K299 WeakPolarHBondContact O-CB 3.17Å; L295-K299 WeakPolarHBondContact O-CG 3.21Å; L295-K299 PolarHBondContact O-N 3.28Å
296L90.5Very high87.5Confident1 Ų155.3 Ų55.31%0.00528%0.277CS..Hα-helixtrans-56.7-52.2173.1177.958.8000111.3I285 L286 S292 R298 K299 L300 T342 Y345I285-L296 HydrophobicContact CG2-CD1 3.58Å; L286-L296 HydrophobicContact CD2-CD1 3.94Å; L286-L296 HydrophobicContact CD2-CD2 4.17Å; S292-L296 PolarHBondContact O-N 3.35Å; L296-R298 PolarHBondContact O-N 2.77Å; L296-K299 PolarHBondContact O-N 3.12Å; L296-L300 HydrophobicContact CD1-CD1 3.98Å; L296-L300 HydrophobicContact CD1-CG 4.18Å; L296-L300 HydrophobicContact CG-CD1 4.02Å; L296-L300 PolarHBondContact O-N 3.49Å; L296-T342 HydrophobicContact CD2-CG2 4.06Å; L296-T342 HydrophobicContact CG-CG2 3.94Å; L296-Y345 HydrophobicContact CD2-CD1 3.49Å; L296-Y345 VanDerWaalsContact CD2-CD1 3.49Å; L296-Y345 HydrophobicContact CD2-CE1 3.88Å; L296-Y345 HydrophobicContact CD2-CG 4.06Å
297F90.9Very high87.4Confident6 Ų658.5 Ų58.53%0.02629%0.294CS..Hα-helixtrans-55.6-47.1175.6-176.5-89.6000111.9G293 K299 V301 I338 K339 T342 M364G293-F297 WeakPolarHBondContact O-CB 3.19Å; G293-F297 PolarHBondContact O-N 3.32Å; F297-K299 PolarHBondContact O-N 2.79Å; F297-V301 HydrophobicContact CD1-CG2 4.13Å; F297-V301 HydrophobicContact CE1-CG2 3.82Å; F297-V301 HydrophobicContact CZ-CG2 4.07Å; F297-V301 WeakPolarHBondContact O-CB 3.47Å; F297-V301 VanDerWaalsContact O-CG2 3.26Å; F297-V301 WeakPolarHBondContact O-CG2 3.43Å; F297-V301 PolarHBondContact O-N 3.19Å; F297-I338 HydrophobicContact CD2-CG2 3.69Å; F297-I338 HydrophobicContact CE2-CG2 3.86Å; F297-I338 HydrophobicContact CG-CG2 4.42Å; F297-K339 HydrophobicContact CE2-CB 4.35Å; F297-T342 HydrophobicContact CB-CG2 4.17Å; F297-T342 HydrophobicContact CD2-CG2 4.39Å; F297-M364 HydrophobicContact CE1-CG 4.13Å; F297-M364 HydrophobicContact CE1-SD 3.79Å
298R89.9Confident87.1Confident76 Ų7656 Ų5629%0.28729%0.286SS..Hα-helixtrans-60.8-28176-82.2-177.7-128.5-171.3-1.5114S294 L295 L296 Q363 K367S294-R298 VanDerWaalsContact O-CG 3.31Å; S294-R298 WeakPolarHBondContact O-CG 3.27Å; S294-R298 PolarHBondContact O-N 3.47Å; S294-R298 PolarHBondContact O-NE 2.87Å; L295-R298 PolarHBondContact O-N 3.21Å; L296-R298 PolarHBondContact O-N 2.77Å; R298-Q363 HydrophobicContact CG-CG 4.1Å; R298-K367 PolarHBondContact O-NZ 3.48Å
299K92.6Very high87.2Confident91 Ų9153.6 Ų53.640%0.39627%0.274SS..Hα-helixtrans-86-44.3-177.4-83.7-85.3173.6159.40111.4I285 Y289 L295 L296 F297 V301 C302 A303I285-K299 HydrophobicContact CG2-CB 4.05Å; Y289-K299 HydrophobicContact CD1-CG 4.41Å; Y289-K299 HydrophobicContact CD2-CB 4.06Å; Y289-K299 HydrophobicContact CD2-CD 4.05Å; Y289-K299 HydrophobicContact CD2-CG 3.65Å; Y289-K299 HydrophobicContact CE1-CG 4.34Å; Y289-K299 HydrophobicContact CE2-CB 4.33Å; Y289-K299 HydrophobicContact CE2-CD 3.44Å; Y289-K299 VanDerWaalsContact CE2-CD 3.44Å; Y289-K299 HydrophobicContact CE2-CG 3.55Å; Y289-K299 HydrophobicContact CG-CG 4.11Å; Y289-K299 VanDerWaalsContact CZ-CE 3.43Å; Y289-K299 WeakPolarHBondContact OH-CE 3.26Å; Y289-K299 PolarHBondContact OH-NZ 2.94Å; L295-K299 WeakPolarHBondContact O-CB 3.17Å; L295-K299 WeakPolarHBondContact O-CG 3.21Å; L295-K299 PolarHBondContact O-N 3.28Å; L296-K299 PolarHBondContact O-N 3.12Å; F297-K299 PolarHBondContact O-N 2.79Å; K299-V301 VanDerWaalsContact C-N 3.33Å; K299-V301 PolarHBondContact O-N 3.01Å; K299-C302 CarbonylContact O-C 3.51Å; K299-C302 PolarHBondContact O-N 3.39Å; K299-A303 PolarHBondContact O-N 2.9Å
300L93.4Very high87.6Confident0 Ų050.4 Ų50.40%026%0.262CS..Hα-helixtrans-57.3-44.8169.1-66.7168.4000111.3I277 L282 I285 L296 C302 A303 F304 I338 F341 T342I277-L300 HydrophobicContact CD1-CD2 4.3Å; L282-L300 HydrophobicContact CD1-CD2 3.99Å; I285-L300 HydrophobicContact CD1-CD2 4.3Å; I285-L300 HydrophobicContact CG2-CD2 4.09Å; I285-L300 HydrophobicContact CG2-CG 4.23Å; L296-L300 HydrophobicContact CD1-CD1 3.98Å; L296-L300 HydrophobicContact CD1-CG 4.18Å; L296-L300 HydrophobicContact CG-CD1 4.02Å; L296-L300 PolarHBondContact O-N 3.49Å; L300-C302 PolarHBondContact O-N 2.97Å; L300-C302 VanDerWaalsContact O-N 3.15Å; L300-A303 WeakPolarHBondContact O-CA 3.42Å; L300-A303 WeakPolarHBondContact O-CB 3.49Å; L300-A303 PolarHBondContact O-N 3.5Å; L300-F304 WeakPolarHBondContact O-CD2 3.46Å; L300-F304 PolarHBondContact O-N 3.45Å; L300-F304 VanDerWaalsContact O-N 3.12Å; L300-I338 HydrophobicContact CB-CD1 4.47Å; L300-I338 HydrophobicContact CB-CG1 4.27Å; L300-I338 HydrophobicContact CB-CG2 3.67Å; L300-I338 HydrophobicContact CD1-CG2 4.05Å; L300-F341 HydrophobicContact CD1-CD1 3.68Å; L300-F341 HydrophobicContact CD1-CE1 3.95Å; L300-T342 HydrophobicContact CD1-CG2 3.68Å
301V92.6Very high88Confident0 Ų047.7 Ų47.70%025%0.246CC..Hα-helixtrans-57.7-30.3174.9165.10000113.4F297 K299 F305 L310 I338 M364F297-V301 HydrophobicContact CD1-CG2 4.13Å; F297-V301 HydrophobicContact CE1-CG2 3.82Å; F297-V301 HydrophobicContact CZ-CG2 4.07Å; F297-V301 WeakPolarHBondContact O-CB 3.47Å; F297-V301 VanDerWaalsContact O-CG2 3.26Å; F297-V301 WeakPolarHBondContact O-CG2 3.43Å; F297-V301 PolarHBondContact O-N 3.19Å; K299-V301 VanDerWaalsContact C-N 3.33Å; K299-V301 PolarHBondContact O-N 3.01Å; V301-F305 HydrophobicContact CG1-CD2 4.34Å; V301-F305 WeakPolarHBondContact O-CB 3.29Å; V301-F305 PolarHBondContact O-N 2.92Å; V301-L310 HydrophobicContact CG1-CD1 4.11Å; V301-L310 HydrophobicContact CG1-CD2 3.6Å; V301-I338 HydrophobicContact CG2-CD1 4.14Å; V301-I338 HydrophobicContact CG2-CG2 4.33Å; V301-M364 HydrophobicContact CB-SD 4.47Å; V301-M364 HydrophobicContact CG1-CE 3.75Å; V301-M364 HydrophobicContact CG1-SD 3.81Å; V301-M364 HydrophobicContact CG2-CE 4.37Å; V301-M364 HydrophobicContact CG2-SD 4.03Å
302C90.8Very high88.3Confident50 Ų5040.9 Ų40.934%0.33823%0.226SC..Hα-helixtrans-91.3-4.7173.4-83.80000114.3K299 L300 L310 K367K299-C302 CarbonylContact O-C 3.51Å; K299-C302 PolarHBondContact O-N 3.39Å; L300-C302 PolarHBondContact O-N 2.97Å; L300-C302 VanDerWaalsContact O-N 3.15Å; C302-L310 VanDerWaalsContact SG-CD1 3.51Å; C302-K367 PolarHBondContact SG-NZ 3.37Å
303A92.3Very high88.2Confident30 Ų3040.3 Ų40.325%0.24822%0.223CC..Hα-helixtrans-83.1-32.4167.900000111I277 I285 K299 L300I277-A303 HydrophobicContact CD1-CB 4.12Å; I285-A303 HydrophobicContact CD1-CB 3.82Å; K299-A303 PolarHBondContact O-N 2.9Å; L300-A303 WeakPolarHBondContact O-CA 3.42Å; L300-A303 WeakPolarHBondContact O-CB 3.49Å; L300-A303 PolarHBondContact O-N 3.5Å
304F91.9Very high88Confident47 Ų4741.4 Ų41.421%0.20623%0.228CC..Hα-helixtrans-98.6-19.2-177.8-76.2-80.1000115.7L269 V275 F276 I277 L300 I334 I338L269-F304 HydrophobicContact CD2-CE2 3.68Å; L269-F304 HydrophobicContact CD2-CZ 3.93Å; V275-F304 HydrophobicContact CG1-CD1 4.15Å; V275-F304 HydrophobicContact CG1-CE1 3.39Å; V275-F304 HydrophobicContact CG1-CE2 4.47Å; V275-F304 HydrophobicContact CG1-CZ 3.58Å; F276-F304 VanDerWaalsContact O-CE1 3.24Å; F276-F304 WeakPolarHBondContact O-CE1 3.47Å; I277-F304 HydrophobicContact CB-CE2 4.31Å; I277-F304 HydrophobicContact CB-CZ 3.77Å; I277-F304 HydrophobicContact CD1-CE2 4.09Å; I277-F304 HydrophobicContact CD1-CZ 4.4Å; I277-F304 HydrophobicContact CG2-CZ 4.34Å; L300-F304 WeakPolarHBondContact O-CD2 3.46Å; L300-F304 PolarHBondContact O-N 3.45Å; L300-F304 VanDerWaalsContact O-N 3.12Å; F304-I334 HydrophobicContact CB-CG2 3.65Å; F304-I334 HydrophobicContact CD1-CG2 3.95Å; F304-I334 HydrophobicContact CD2-CG2 4.46Å; F304-I334 HydrophobicContact CG-CG2 3.78Å; F304-I338 HydrophobicContact CB-CD1 4.25Å; F304-I338 HydrophobicContact CD2-CD1 3.64Å; F304-I338 HydrophobicContact CD2-CG1 3.96Å; F304-I338 HydrophobicContact CE2-CD1 4.33Å; F304-I338 HydrophobicContact CE2-CG1 4.14Å; F304-I338 HydrophobicContact CG-CD1 4.18Å
305F91.5Very high87.3Confident20 Ų2041.6 Ų41.69%0.08823%0.229CC..SBendtrans-134.6128.4-178.2-59.3-73000111.9V301 T309 L310 L330 D331 I334 V335V301-F305 HydrophobicContact CG1-CD2 4.34Å; V301-F305 WeakPolarHBondContact O-CB 3.29Å; V301-F305 PolarHBondContact O-N 2.92Å; F305-T309 HydrophobicContact CB-CG2 4.46Å; F305-T309 HydrophobicContact CD1-CG2 4.06Å; F305-L310 HydrophobicContact CB-CD1 4.28Å; F305-L310 HydrophobicContact CB-CD2 3.7Å; F305-L310 HydrophobicContact CB-CG 3.76Å; F305-L310 HydrophobicContact CD2-CD2 4.21Å; F305-L310 HydrophobicContact CG-CD2 4.21Å; F305-L310 WeakPolarHBondContact O-CD1 3.45Å; F305-L330 HydrophobicContact CD1-CD2 3.97Å; F305-L330 HydrophobicContact CD2-CD2 4.48Å; F305-L330 HydrophobicContact CE1-CD2 4.05Å; F305-L330 HydrophobicContact CG-CD2 4.19Å; F305-L330 HydrophobicContact CZ-CB 4.26Å; F305-L330 HydrophobicContact CZ-CD2 4.32Å; F305-D331 HydrophobicContact CE1-CB 4.26Å; F305-D331 HydrophobicContact CZ-CB 4.25Å; F305-I334 HydrophobicContact CE1-CD1 4.28Å; F305-I334 HydrophobicContact CE1-CG2 4.39Å; F305-I334 HydrophobicContact CE2-CB 4.33Å; F305-I334 HydrophobicContact CE2-CG2 3.62Å; F305-I334 HydrophobicContact CZ-CB 3.82Å; F305-I334 HydrophobicContact CZ-CD1 4.33Å; F305-I334 HydrophobicContact CZ-CG2 3.56Å; F305-V335 HydrophobicContact CE2-CG2 3.86Å; F305-V335 HydrophobicContact CZ-CG2 4.07Å
306D89.3Confident86.4Confident117 Ų11741.6 Ų41.663%0.62623%0.229SC*.  trans-59.7150.8173.5-49.3-65000112.2A308 T309 L310D306-A308 PolarHBondContact O-N 2.86Å; D306-A308 VanDerWaalsContact O-N 3.16Å; D306-T309 CarbonylContact O-C 3.52Å; D306-T309 WeakPolarHBondContact O-CA 3.47Å; D306-T309 WeakPolarHBondContact O-CB 3.45Å; D306-T309 PolarHBondContact O-N 3.43Å; D306-L310 WeakPolarHBondContact O-CG 2.98Å; D306-L310 PolarHBondContact O-N 2.8Å
307D87.8Confident85.1Confident95 Ų9542.9 Ų42.951%0.50824%0.242SC..Hα-helixtrans-59-30.3176.1-80.7-47.5000113A311 N371D307-A311 VanDerWaalsContact O-CB 3.26Å; D307-A311 WeakPolarHBondContact O-CB 3.34Å; D307-A311 PolarHBondContact O-N 3.46Å; D307-N371 PolarHBondContact OD1-ND2 3.25Å
308A84.4Confident83.8Confident60 Ų6050.4 Ų50.450%0.49628%0.275SS..Hα-helixtrans-65.9-40.8172.400000112.2D306 N312D306-A308 PolarHBondContact O-N 2.86Å; D306-A308 VanDerWaalsContact O-N 3.16Å; A308-N312 WeakPolarHBondContact O-CB 3.48Å; A308-N312 PolarHBondContact O-N 3.23Å; A308-N312 VanDerWaalsContact O-N 3.11Å; A308-N312 PolarHBondContact O-ND2 3.39Å
309T86.8Confident82.5Confident51 Ų5153.3 Ų53.331%0.31329%0.286SS..Hα-helixtrans-69.7-40.7175.7-62.70000110.8F305 D306 A311 N312 S313 L330F305-T309 HydrophobicContact CB-CG2 4.46Å; F305-T309 HydrophobicContact CD1-CG2 4.06Å; D306-T309 CarbonylContact O-C 3.52Å; D306-T309 WeakPolarHBondContact O-CA 3.47Å; D306-T309 WeakPolarHBondContact O-CB 3.45Å; D306-T309 PolarHBondContact O-N 3.43Å; T309-A311 PolarHBondContact O-N 3.29Å; T309-N312 PolarHBondContact O-N 2.03Å; T309-S313 WeakPolarHBondContact O-CB 3.1Å; T309-S313 PolarHBondContact O-N 2.99Å; T309-S313 PolarHBondContact O-OG 3.19Å; T309-L330 HydrophobicContact CG2-CD2 3.94Å
310L87.9Confident81.1Confident3 Ų357.5 Ų57.52%0.01630%0.304CS..Hα-helixtrans-68.9-30.3176.9-67.6174.8000113.8V301 C302 F305 D306 L330 M364 T368V301-L310 HydrophobicContact CG1-CD1 4.11Å; V301-L310 HydrophobicContact CG1-CD2 3.6Å; C302-L310 VanDerWaalsContact SG-CD1 3.51Å; F305-L310 HydrophobicContact CB-CD1 4.28Å; F305-L310 HydrophobicContact CB-CD2 3.7Å; F305-L310 HydrophobicContact CB-CG 3.76Å; F305-L310 HydrophobicContact CD2-CD2 4.21Å; F305-L310 HydrophobicContact CG-CD2 4.21Å; F305-L310 WeakPolarHBondContact O-CD1 3.45Å; D306-L310 WeakPolarHBondContact O-CG 2.98Å; D306-L310 PolarHBondContact O-N 2.8Å; L310-L330 HydrophobicContact CD2-CD1 4.03Å; L310-L330 HydrophobicContact CD2-CD2 4.27Å; L310-M364 HydrophobicContact CD2-CE 4.28Å; L310-T368 WeakPolarHBondContact O-CA 3.35Å; L310-T368 WeakPolarHBondContact O-CB 3.3Å; L310-T368 WeakPolarHBondContact O-CG2 3.37Å; L310-T368 PolarHBondContact O-OG1 3.34Å
311A83.1Confident79.6Confident1 Ų169.9 Ų69.91%0.00835%0.351CS..Hα-helixtrans-75.9-34.7173.300000112.7D307 T309 R327 N371 V375D307-A311 VanDerWaalsContact O-CB 3.26Å; D307-A311 WeakPolarHBondContact O-CB 3.34Å; D307-A311 PolarHBondContact O-N 3.46Å; T309-A311 PolarHBondContact O-N 3.29Å; A311-R327 PolarHBondContact O-NH1 3.09Å; A311-N371 HydrophobicContact CB-CB 4Å; A311-V375 HydrophobicContact CB-CG2 4.4Å
312N80.7Confident78.2Confident86 Ų8674 Ų7446%0.4639%0.393SS..Hα-helixtrans-100.52.7-172.8-67.5-58.1000115.2A308 T309 R327A308-N312 WeakPolarHBondContact O-CB 3.48Å; A308-N312 PolarHBondContact O-N 3.23Å; A308-N312 VanDerWaalsContact O-N 3.11Å; A308-N312 PolarHBondContact O-ND2 3.39Å; T309-N312 PolarHBondContact O-N 2.03Å; N312-R327 WeakPolarHBondContact O-CB 3.29Å; N312-R327 WeakPolarHBondContact O-CG 3.3Å
313S81.9Confident77Confident12 Ų1277.6 Ų77.68%0.08441%0.408CS..EExtended strand (participates in β ladder)trans-117151.7177.7-65.70000113.3T309 K328 L330T309-S313 WeakPolarHBondContact O-CB 3.1Å; T309-S313 PolarHBondContact O-N 2.99Å; T309-S313 PolarHBondContact O-OG 3.19Å; S313-K328 CarbonylContact C-O 3.6Å; S313-K328 VanDerWaalsContact CA-O 3.27Å; S313-K328 WeakPolarHBondContact CA-O 3.41Å; S313-K328 WeakPolarHBondContact CB-O 3.33Å; S313-L330 VanDerWaalsContact CB-CD2 3.48Å
314L78.8Confident75.2Confident23 Ų2381.9 Ų81.912%0.1243%0.427CS..EExtended strand (participates in β ladder)trans-93141.9169.2-69.2172.2000110N316 G317 D325 R327 K328 G329 L330L314-N316 PolarHBondContact O-N 3.19Å; L314-G317 PolarHBondContact O-N 2.82Å; L314-D325 HydrophobicContact CD1-CB 4.34Å; L314-R327 HydrophobicContact CD1-CB 4.38Å; L314-R327 HydrophobicContact CG-CB 3.97Å; L314-K328 PolarHBondContact N-O 3.11Å; L314-G329 WeakPolarHBondContact O-CA 3.19Å; L314-L330 PolarHBondContact O-N 3.42Å
315P69.6Low74Confident27 Ų2781.6 Ų81.618%0.17543%0.428CS..THydrogen-bonded Turntrans-63.5-12.7-174.723-33.7000115.7Q332 M364P315-Q332 PolarHBondContact O-NE2 2.76Å; P315-Q332 VanDerWaalsContact O-NE2 3.11Å; P315-M364 HydrophobicContact CB-CB 3.89Å; P315-M364 HydrophobicContact CB-CG 4.36Å; P315-M364 HydrophobicContact CG-CB 4.32Å
316N67.3Low73Confident78 Ų7885.9 Ų85.942%0.41745%0.452SS..THydrogen-bonded Turntrans-140.54.2178.5-158.8-43.5000111.6L314 K318L314-N316 PolarHBondContact O-N 3.19Å; N316-K318 PolarHBondContact O-N 3.15Å; N316-K318 WeakPolarHBondContact OD1-CD 3.14Å; N316-K318 WeakPolarHBondContact OD1-CE 3.49Å
317G63.6Low72.4Confident27 Ų2783.7 Ų83.728%0.27844%0.435SS..SBendtrans63.2-19.5-16900000116.3L314 R319L314-G317 PolarHBondContact O-N 2.82Å; G317-R319 PolarHBondContact O-N 3.25Å; G317-R319 VanDerWaalsContact O-N 3.12Å
318K63.3Low72.1Confident165 Ų16587.2 Ų87.272%0.71745%0.445SS*.  trans-71.2105-175.6-67.4175.5-169.4177.60111.3N316N316-K318 PolarHBondContact O-N 3.15Å; N316-K318 WeakPolarHBondContact OD1-CD 3.14Å; N316-K318 WeakPolarHBondContact OD1-CE 3.49Å
319R63.4Low72Confident137 Ų13786.2 Ų86.252%0.51744%0.44SS..  trans-50.7137173.7-62.1175.3175.7127.5-8.1111.4G317 R321 D325 N326G317-R319 PolarHBondContact O-N 3.25Å; G317-R319 VanDerWaalsContact O-N 3.12Å; R319-R321 PolarHBondContact O-N 3.35Å; R319-D325 WeakPolarHBondContact CD-O 3.13Å; R319-D325 WeakPolarHBondContact CG-O 3.42Å; R319-D325 PolarHBondContact NE-O 2.92Å; R319-N326 PolarHBondContact NH2-OD1 3.24Å
320K63.8Low72.1Confident178 Ų17884.1 Ų84.177%0.77443%0.427SS*.  trans-66.3128.1162.6-88.3-170.2174.2-177.20108.9G322 L323K320-G322 PolarHBondContact O-N 2.8Å; K320-L323 PolarHBondContact O-N 3.44Å
321R60.3Low72.2Confident261 Ų26187.6 Ų87.699%0.98545%0.446SS*.THydrogen-bonded Turntrans-54.6108.5-175.7-158.6-177.2-153.7-175.57.5110.6R319R319-R321 PolarHBondContact O-N 3.35Å
322G62.8Low72.5Confident85 Ų8591.8 Ų91.888%0.87647%0.466SS*.THydrogen-bonded Turntrans120.8-13.3177.700000116.2K320K320-G322 PolarHBondContact O-N 2.8Å
323L66.4Low73Confident127 Ų12791 Ų9167%0.66546%0.461SS*.  trans-116.3126.1173.4-173.264.2000110.4K320 D325K320-L323 PolarHBondContact O-N 3.44Å; L323-D325 PolarHBondContact O-N 3.18Å
324N55Low73.5Confident119 Ų11992 Ų9264%0.63647%0.466SS*.  trans-81.667.7178.2-168.724.6000111.4N326N324-N326 PolarHBondContact OD1-OD1 3.45Å
325D67.3Low74.1Confident42 Ų4292.1 Ų92.123%0.22547%0.467CS..  trans-76.5128.9170.6-160.3-13.7000109.8L314 R319 L323 R327L314-D325 HydrophobicContact CD1-CB 4.34Å; R319-D325 WeakPolarHBondContact CD-O 3.13Å; R319-D325 WeakPolarHBondContact CG-O 3.42Å; R319-D325 PolarHBondContact NE-O 2.92Å; L323-D325 PolarHBondContact O-N 3.18Å; D325-R327 WeakPolarHBondContact OD1-CB 3.15Å; D325-R327 WeakPolarHBondContact OD1-CD 3.38Å; D325-R327 WeakPolarHBondContact OD1-CG 3.22Å; D325-R327 PolarHBondContact OD1-N 2.91Å; D325-R327 VanDerWaalsContact OD1-N 3.11Å; D325-R327 IonicContact OD1-NE 3.38Å; D325-R327 PolarHBondContact OD1-NE 3.15Å; D325-R327 IonicContact OD2-NE 3.75Å
326N69.4Low75.2Confident110 Ų11091.4 Ų91.459%0.58846%0.464SS*.  trans-107.46.7-179.7-68-48.5000112.8R319 N324R319-N326 PolarHBondContact NH2-OD1 3.24Å; N324-N326 PolarHBondContact OD1-OD1 3.45Å
327R77.9Confident76.4Confident71 Ų7187.7 Ų87.727%0.26844%0.444SS..PPolyproline II helixtrans-55.2135.2170-71.7173.9-151-112.2-6.2110.7A311 N312 L314 D325 H372A311-R327 PolarHBondContact O-NH1 3.09Å; N312-R327 WeakPolarHBondContact O-CB 3.29Å; N312-R327 WeakPolarHBondContact O-CG 3.3Å; L314-R327 HydrophobicContact CD1-CB 4.38Å; L314-R327 HydrophobicContact CG-CB 3.97Å; D325-R327 WeakPolarHBondContact OD1-CB 3.15Å; D325-R327 WeakPolarHBondContact OD1-CD 3.38Å; D325-R327 WeakPolarHBondContact OD1-CG 3.22Å; D325-R327 PolarHBondContact OD1-N 2.91Å; D325-R327 VanDerWaalsContact OD1-N 3.11Å; D325-R327 IonicContact OD1-NE 3.38Å; D325-R327 PolarHBondContact OD1-NE 3.15Å; D325-R327 IonicContact OD2-NE 3.75Å; R327-H372 PolarHBondContact NH1-CD2 3.04Å; R327-H372 VanDerWaalsContact NH1-CD2 3.35Å; R327-H372 PolarHBondContact NH2-NE2 2.97Å
328K80.4Confident77.9Confident169 Ų16986.4 Ų86.474%0.73543%0.431SS*.EExtended strand (participates in β ladder)trans-66.6162.8179.1-68.2-175.9178.5-179.20110.8S313 L314S313-K328 CarbonylContact C-O 3.6Å; S313-K328 VanDerWaalsContact CA-O 3.27Å; S313-K328 WeakPolarHBondContact CA-O 3.41Å; S313-K328 WeakPolarHBondContact CB-O 3.33Å; L314-K328 PolarHBondContact N-O 3.11Å
329G82.8Confident79.2Confident38 Ų3881.7 Ų81.739%0.39241%0.411SS..EExtended strand (participates in β ladder)trans-71.3146.4163.400000110.7L314L314-G329 WeakPolarHBondContact O-CA 3.19Å
330L88.6Confident80.6Confident7 Ų777.2 Ų77.24%0.03740%0.398CS..PPolyproline II helixtrans-64.6152.4158-70175000109.7F305 T309 L310 S313 L314 Q332 V335 M364F305-L330 HydrophobicContact CD1-CD2 3.97Å; F305-L330 HydrophobicContact CD2-CD2 4.48Å; F305-L330 HydrophobicContact CE1-CD2 4.05Å; F305-L330 HydrophobicContact CG-CD2 4.19Å; F305-L330 HydrophobicContact CZ-CB 4.26Å; F305-L330 HydrophobicContact CZ-CD2 4.32Å; T309-L330 HydrophobicContact CG2-CD2 3.94Å; L310-L330 HydrophobicContact CD2-CD1 4.03Å; L310-L330 HydrophobicContact CD2-CD2 4.27Å; S313-L330 VanDerWaalsContact CB-CD2 3.48Å; L314-L330 PolarHBondContact O-N 3.42Å; L330-Q332 PolarHBondContact O-N 3.01Å; L330-Q332 PolarHBondContact O-NE2 2.78Å; L330-V335 HydrophobicContact CB-CG2 4.14Å; L330-M364 HydrophobicContact CD1-CE 3.22Å
331D89.4Confident82Confident77 Ų7770.3 Ų70.341%0.41237%0.369SS..PPolyproline II helixtrans-60.4120.8176.4-175.60.7000110.5F305 N333 I334 V335F305-D331 HydrophobicContact CE1-CB 4.26Å; F305-D331 HydrophobicContact CZ-CB 4.25Å; D331-N333 VanDerWaalsContact C-N 3.32Å; D331-N333 VanDerWaalsContact OD1-CB 3.28Å; D331-N333 WeakPolarHBondContact OD1-CB 3.45Å; D331-N333 PolarHBondContact OD1-N 3.27Å; D331-I334 HydrophobicContact CB-CB 4.32Å; D331-I334 HydrophobicContact CB-CD1 4.19Å; D331-I334 HydrophobicContact CB-CG1 4.35Å; D331-I334 WeakPolarHBondContact OD2-CG1 3.33Å; D331-V335 WeakPolarHBondContact O-CB 3.16Å; D331-V335 VanDerWaalsContact O-CG2 3.22Å; D331-V335 WeakPolarHBondContact O-CG2 3.22Å; D331-V335 PolarHBondContact O-N 2.97Å
332Q89.8Confident83.5Confident89 Ų8958 Ų5842%0.41632%0.322SS..Hα-helixtrans-78-18.8-178.6-57.4-61.8-80.100112.1P315 L330 G336P315-Q332 PolarHBondContact O-NE2 2.76Å; P315-Q332 VanDerWaalsContact O-NE2 3.11Å; L330-Q332 PolarHBondContact O-N 3.01Å; L330-Q332 PolarHBondContact O-NE2 2.78Å; Q332-G336 WeakPolarHBondContact O-CA 3.49Å; Q332-G336 PolarHBondContact O-N 3.38Å
333N91.6Very high84.8Confident69 Ų6956.6 Ų56.637%0.36929%0.293SS..Hα-helixtrans-66-57.8171.3-168.832000109.4Y273 D331 V335 G336 A337Y273-N333 WeakPolarHBondContact CD1-O 3.34Å; Y273-N333 WeakPolarHBondContact CD1-OD1 3.44Å; Y273-N333 WeakPolarHBondContact CE1-O 3.41Å; D331-N333 VanDerWaalsContact C-N 3.32Å; D331-N333 VanDerWaalsContact OD1-CB 3.28Å; D331-N333 WeakPolarHBondContact OD1-CB 3.45Å; D331-N333 PolarHBondContact OD1-N 3.27Å; N333-V335 PolarHBondContact O-N 3.4Å; N333-G336 PolarHBondContact O-N 3.14Å; N333-A337 PolarHBondContact O-N 3.02Å
334I91.9Very high85.9Confident34 Ų3455.7 Ų55.717%0.17428%0.284CS..Hα-helixtrans-59.5-46.7176.1-63.7172.9000111.8V275 F304 F305 D331 G336 A337 I338V275-I334 HydrophobicContact CG1-CG1 4.3Å; V275-I334 HydrophobicContact CG2-CG1 4.1Å; F304-I334 HydrophobicContact CB-CG2 3.65Å; F304-I334 HydrophobicContact CD1-CG2 3.95Å; F304-I334 HydrophobicContact CD2-CG2 4.46Å; F304-I334 HydrophobicContact CG-CG2 3.78Å; F305-I334 HydrophobicContact CE1-CD1 4.28Å; F305-I334 HydrophobicContact CE1-CG2 4.39Å; F305-I334 HydrophobicContact CE2-CB 4.33Å; F305-I334 HydrophobicContact CE2-CG2 3.62Å; F305-I334 HydrophobicContact CZ-CB 3.82Å; F305-I334 HydrophobicContact CZ-CD1 4.33Å; F305-I334 HydrophobicContact CZ-CG2 3.56Å; D331-I334 HydrophobicContact CB-CB 4.32Å; D331-I334 HydrophobicContact CB-CD1 4.19Å; D331-I334 HydrophobicContact CB-CG1 4.35Å; D331-I334 WeakPolarHBondContact OD2-CG1 3.33Å; I334-G336 VanDerWaalsContact C-N 3.3Å; I334-G336 PolarHBondContact O-N 3.34Å; I334-A337 PolarHBondContact O-N 2.87Å; I334-I338 HydrophobicContact CG2-CD1 3.78Å; I334-I338 VanDerWaalsContact O-CG1 3.26Å; I334-I338 WeakPolarHBondContact O-CG1 3.17Å; I334-I338 PolarHBondContact O-N 3.47Å
335V91.5Very high87.5Confident25 Ų2551.4 Ų51.415%0.15226%0.259CS..Hα-helixtrans-64.8-34.3178.2170.70000112F305 L330 D331 N333 K339F305-V335 HydrophobicContact CE2-CG2 3.86Å; F305-V335 HydrophobicContact CZ-CG2 4.07Å; L330-V335 HydrophobicContact CB-CG2 4.14Å; D331-V335 WeakPolarHBondContact O-CB 3.16Å; D331-V335 VanDerWaalsContact O-CG2 3.22Å; D331-V335 WeakPolarHBondContact O-CG2 3.22Å; D331-V335 PolarHBondContact O-N 2.97Å; N333-V335 PolarHBondContact O-N 3.4Å; V335-K339 VanDerWaalsContact O-CB 3.3Å; V335-K339 WeakPolarHBondContact O-CB 3.34Å; V335-K339 PolarHBondContact O-N 3.28Å
336G91.8Very high88.5Confident11 Ų1149.5 Ų49.511%0.11325%0.249CC..Hα-helixtrans-66.3-48.8174.400000112.4Q332 N333 I334 I338 K339 V340Q332-G336 WeakPolarHBondContact O-CA 3.49Å; Q332-G336 PolarHBondContact O-N 3.38Å; N333-G336 PolarHBondContact O-N 3.14Å; I334-G336 VanDerWaalsContact C-N 3.3Å; I334-G336 PolarHBondContact O-N 3.34Å; G336-I338 PolarHBondContact O-N 2.87Å; G336-K339 WeakPolarHBondContact O-CB 3.42Å; G336-K339 PolarHBondContact O-N 3.29Å; G336-V340 WeakPolarHBondContact O-CG2 3.19Å; G336-V340 PolarHBondContact O-N 2.87Å
337A94.3Very high89.3Confident0 Ų048.9 Ų48.90%025%0.249CC..Hα-helixtrans-57.1-50.1176.700000111.9L269 A270 Y273 V275 N333 I334 K339 V340 F341L269-A337 HydrophobicContact CD2-CB 4.21Å; A270-A337 HydrophobicContact CB-CB 4.45Å; Y273-A337 HydrophobicContact CD1-CB 3.81Å; Y273-A337 HydrophobicContact CD2-CB 4.33Å; Y273-A337 HydrophobicContact CG-CB 3.66Å; V275-A337 HydrophobicContact CB-CB 3.71Å; V275-A337 HydrophobicContact CG1-CB 3.92Å; V275-A337 HydrophobicContact CG2-CB 3.78Å; N333-A337 PolarHBondContact O-N 3.02Å; I334-A337 PolarHBondContact O-N 2.87Å; A337-K339 VanDerWaalsContact C-N 3.32Å; A337-K339 PolarHBondContact O-N 2.9Å; A337-V340 PolarHBondContact O-N 3.25Å; A337-F341 VanDerWaalsContact O-CB 3.32Å; A337-F341 WeakPolarHBondContact O-CB 3.42Å; A337-F341 PolarHBondContact O-N 3.07Å
338I93.3Very high89.8Confident0 Ų052 Ų520%027%0.267CS..Hα-helixtrans-60.5-42.1177.8-63.3165000110.7L269 F297 L300 V301 F304 I334 G336 T342L269-I338 HydrophobicContact CD2-CB 4.28Å; L269-I338 HydrophobicContact CD2-CG1 3.61Å; F297-I338 HydrophobicContact CD2-CG2 3.69Å; F297-I338 HydrophobicContact CE2-CG2 3.86Å; F297-I338 HydrophobicContact CG-CG2 4.42Å; L300-I338 HydrophobicContact CB-CD1 4.47Å; L300-I338 HydrophobicContact CB-CG1 4.27Å; L300-I338 HydrophobicContact CB-CG2 3.67Å; L300-I338 HydrophobicContact CD1-CG2 4.05Å; V301-I338 HydrophobicContact CG2-CD1 4.14Å; V301-I338 HydrophobicContact CG2-CG2 4.33Å; F304-I338 HydrophobicContact CB-CD1 4.25Å; F304-I338 HydrophobicContact CD2-CD1 3.64Å; F304-I338 HydrophobicContact CD2-CG1 3.96Å; F304-I338 HydrophobicContact CE2-CD1 4.33Å; F304-I338 HydrophobicContact CE2-CG1 4.14Å; F304-I338 HydrophobicContact CG-CD1 4.18Å; I334-I338 HydrophobicContact CG2-CD1 3.78Å; I334-I338 VanDerWaalsContact O-CG1 3.26Å; I334-I338 WeakPolarHBondContact O-CG1 3.17Å; I334-I338 PolarHBondContact O-N 3.47Å; G336-I338 PolarHBondContact O-N 2.87Å; I338-T342 WeakPolarHBondContact O-CG2 3.28Å; I338-T342 PolarHBondContact O-N 3.31Å; I338-T342 PolarHBondContact O-OG1 2.86Å
339K91.5Very high90Very high67 Ų6748.8 Ų48.829%0.29125%0.254SS..Hα-helixtrans-58.7-58.8176.2176.8-168170.6-80.40110.6F297 V335 G336 A337 F341 T342 E343 W360F297-K339 HydrophobicContact CE2-CB 4.35Å; V335-K339 VanDerWaalsContact O-CB 3.3Å; V335-K339 WeakPolarHBondContact O-CB 3.34Å; V335-K339 PolarHBondContact O-N 3.28Å; G336-K339 WeakPolarHBondContact O-CB 3.42Å; G336-K339 PolarHBondContact O-N 3.29Å; A337-K339 VanDerWaalsContact C-N 3.32Å; A337-K339 PolarHBondContact O-N 2.9Å; K339-F341 VanDerWaalsContact C-N 3.33Å; K339-F341 PolarHBondContact O-N 3.26Å; K339-T342 PolarHBondContact O-N 3.19Å; K339-T342 VanDerWaalsContact O-N 3.1Å; K339-T342 PolarHBondContact O-OG1 3.1Å; K339-E343 WeakPolarHBondContact CE-OE1 3.24Å; K339-E343 HydrophobicContact CG-CG 4.46Å; K339-E343 IonicContact NZ-OE1 3.44Å; K339-E343 PolarHBondContact NZ-OE1 2.78Å; K339-E343 IonicContact NZ-OE2 3.55Å; K339-E343 PolarHBondContact NZ-OE2 3.13Å; K339-E343 WeakPolarHBondContact O-CG 3.35Å; K339-E343 PolarHBondContact O-N 3.36Å; K339-W360 HydrophobicContact CD-CE3 4.49Å; K339-W360 HydrophobicContact CD-CH2 4.23Å; K339-W360 HydrophobicContact CD-CZ3 4.08Å; K339-W360 VanDerWaalsContact CE-CH2 3.43Å; K339-W360 HydrophobicContact CG-CH2 4.2Å; K339-W360 HydrophobicContact CG-CZ2 4.21Å; K339-W360 HydrophobicContact CG-CZ3 4.42Å
340V92.6Very high89.8Confident43 Ų4357.9 Ų57.926%0.26128%0.276SS..Hα-helixtrans-58.7-44-176172.20000111.3A270 Y273 G336 A337 T342 E343 K344A270-V340 HydrophobicContact CB-CB 4.44Å; A270-V340 HydrophobicContact CB-CG1 4.27Å; Y273-V340 HydrophobicContact CE2-CB 4.46Å; Y273-V340 HydrophobicContact CE2-CG2 3.98Å; G336-V340 WeakPolarHBondContact O-CG2 3.19Å; G336-V340 PolarHBondContact O-N 2.87Å; A337-V340 PolarHBondContact O-N 3.25Å; V340-T342 PolarHBondContact O-N 2.67Å; V340-E343 PolarHBondContact O-N 2.98Å; V340-K344 WeakPolarHBondContact O-CB 3.34Å; V340-K344 PolarHBondContact O-N 3.5Å
341F93.3Very high89.4Confident33 Ų3358.5 Ų58.515%0.14528%0.28CS..Hα-helixtrans-57.8-48.7174.4178.5-100.8000112.4L269 L282 L286 L300 A337 K339 E343 K344 Y345L269-F341 HydrophobicContact CD1-CB 4.11Å; L269-F341 HydrophobicContact CD1-CD1 3.77Å; L269-F341 HydrophobicContact CD1-CD2 3.87Å; L269-F341 HydrophobicContact CD1-CE1 4.13Å; L269-F341 HydrophobicContact CD1-CE2 4.21Å; L269-F341 HydrophobicContact CD1-CG 3.62Å; L269-F341 HydrophobicContact CD1-CZ 4.34Å; L269-F341 HydrophobicContact CG-CB 3.86Å; L269-F341 HydrophobicContact CG-CD1 4.43Å; L269-F341 HydrophobicContact CG-CD2 4.32Å; L269-F341 HydrophobicContact CG-CG 3.95Å; L269-F341 WeakPolarHBondContact O-CB 3.48Å; L269-F341 WeakPolarHBondContact O-CD2 3.19Å; L282-F341 HydrophobicContact CD1-CE1 4.07Å; L282-F341 HydrophobicContact CD1-CZ 3.91Å; L286-F341 HydrophobicContact CD1-CZ 4.38Å; L286-F341 HydrophobicContact CD2-CE1 4.1Å; L286-F341 HydrophobicContact CD2-CZ 4.07Å; L300-F341 HydrophobicContact CD1-CD1 3.68Å; L300-F341 HydrophobicContact CD1-CE1 3.95Å; A337-F341 VanDerWaalsContact O-CB 3.32Å; A337-F341 WeakPolarHBondContact O-CB 3.42Å; A337-F341 PolarHBondContact O-N 3.07Å; K339-F341 VanDerWaalsContact C-N 3.33Å; K339-F341 PolarHBondContact O-N 3.26Å; F341-E343 VanDerWaalsContact C-N 3.35Å; F341-E343 PolarHBondContact O-N 3.2Å; F341-K344 PolarHBondContact O-N 2.97Å; F341-Y345 VanDerWaalsContact O-CB 3.28Å; F341-Y345 WeakPolarHBondContact O-CB 3.39Å; F341-Y345 PolarHBondContact O-N 3.23Å
342T91.1Very high87.9Confident2 Ų263.8 Ų63.81%0.01230%0.302CS..Hα-helixtrans-68.7-30.9179.658.40000113.5L296 F297 L300 I338 K339 V340 C346L296-T342 HydrophobicContact CD2-CG2 4.06Å; L296-T342 HydrophobicContact CG-CG2 3.94Å; F297-T342 HydrophobicContact CB-CG2 4.17Å; F297-T342 HydrophobicContact CD2-CG2 4.39Å; L300-T342 HydrophobicContact CD1-CG2 3.68Å; I338-T342 WeakPolarHBondContact O-CG2 3.28Å; I338-T342 PolarHBondContact O-N 3.31Å; I338-T342 PolarHBondContact O-OG1 2.86Å; K339-T342 PolarHBondContact O-N 3.19Å; K339-T342 VanDerWaalsContact O-N 3.1Å; K339-T342 PolarHBondContact O-OG1 3.1Å; V340-T342 PolarHBondContact O-N 2.67Å; T342-C346 VanDerWaalsContact O-CB 3.22Å; T342-C346 WeakPolarHBondContact O-CB 3.37Å; T342-C346 PolarHBondContact O-N 2.99Å; T342-C346 PolarHBondContact O-SG 3.39Å
343E90Very high86.4Confident56 Ų5667.2 Ų67.226%0.26232%0.316SS..Hα-helixtrans-66.4-48.1172-73171.6141.100111.3K339 V340 F341 C346 T347 W360K339-E343 WeakPolarHBondContact CE-OE1 3.24Å; K339-E343 HydrophobicContact CG-CG 4.46Å; K339-E343 IonicContact NZ-OE1 3.44Å; K339-E343 PolarHBondContact NZ-OE1 2.78Å; K339-E343 IonicContact NZ-OE2 3.55Å; K339-E343 PolarHBondContact NZ-OE2 3.13Å; K339-E343 WeakPolarHBondContact O-CG 3.35Å; K339-E343 PolarHBondContact O-N 3.36Å; V340-E343 PolarHBondContact O-N 2.98Å; F341-E343 VanDerWaalsContact C-N 3.35Å; F341-E343 PolarHBondContact O-N 3.2Å; E343-C346 PolarHBondContact O-N 3Å; E343-T347 WeakPolarHBondContact O-CB 3.5Å; E343-T347 PolarHBondContact O-N 2.9Å; E343-T347 PolarHBondContact O-OG1 3.45Å; E343-W360 HydrophobicContact CG-CZ2 4.18Å; E343-W360 WeakPolarHBondContact OE1-CH2 3.47Å
344K90.9Very high84.7Confident108 Ų10868.2 Ų68.247%0.4732%0.32SS..Hα-helixtrans-57-55175.7-168.6178.4-172.9-178.30110.6E271 V340 F341 C346 T347 E348E271-K344 IonicContact OE1-NZ 2.79Å; E271-K344 PolarHBondContact OE1-NZ 3.03Å; E271-K344 IonicContact OE2-NZ 2.62Å; V340-K344 WeakPolarHBondContact O-CB 3.34Å; V340-K344 PolarHBondContact O-N 3.5Å; F341-K344 PolarHBondContact O-N 2.97Å; K344-C346 PolarHBondContact O-N 3.04Å; K344-T347 PolarHBondContact O-N 3.21Å; K344-T347 VanDerWaalsContact O-N 3.14Å; K344-E348 WeakPolarHBondContact O-CB 3.49Å; K344-E348 PolarHBondContact O-N 3.02Å
345Y89.2Confident83Confident28 Ų2867.2 Ų67.211%0.1132%0.316CS..Hα-helixtrans-58.3-43.4179.6-173.9-90.6000113.2L286 L296 F341 T347 H349 I351L286-Y345 HydrophobicContact CD2-CD2 3.95Å; L286-Y345 HydrophobicContact CD2-CE1 4.39Å; L286-Y345 HydrophobicContact CD2-CE2 3.59Å; L296-Y345 HydrophobicContact CD2-CD1 3.49Å; L296-Y345 VanDerWaalsContact CD2-CD1 3.49Å; L296-Y345 HydrophobicContact CD2-CE1 3.88Å; L296-Y345 HydrophobicContact CD2-CG 4.06Å; F341-Y345 VanDerWaalsContact O-CB 3.28Å; F341-Y345 WeakPolarHBondContact O-CB 3.39Å; F341-Y345 PolarHBondContact O-N 3.23Å; Y345-T347 VanDerWaalsContact C-N 3.33Å; Y345-T347 PolarHBondContact O-N 3Å; Y345-H349 AromaticContact CD1-CD2 3.93Å; Y345-H349 AromaticContact CD2-CD2 3.5Å; Y345-H349 VanDerWaalsContact CD2-CD2 3.5Å; Y345-H349 WeakPolarHBondContact CD2-CD2 3.48Å; Y345-H349 AromaticContact CD2-NE2 3.7Å; Y345-H349 AromaticContact CE1-CD2 3.67Å; Y345-H349 AromaticContact CE2-CD2 3.19Å; Y345-H349 WeakPolarHBondContact CE2-CD2 3.48Å; Y345-H349 AromaticContact CE2-NE2 3.18Å; Y345-H349 WeakPolarHBondContact CE2-NE2 3.49Å; Y345-H349 AromaticContact CG-CD2 3.85Å; Y345-H349 AromaticContact CZ-CD2 3.27Å; Y345-H349 AromaticContact CZ-NE2 3.61Å; Y345-H349 WeakPolarHBondContact O-CB 3.39Å; Y345-H349 PolarHBondContact O-CD2 3.14Å; Y345-H349 PolarHBondContact O-N 3.24Å; Y345-I351 HydrophobicContact CD1-CD1 4.03Å; Y345-I351 HydrophobicContact CE1-CD1 3.88Å
346C87.4Confident81.2Confident2 Ų267.2 Ų67.21%0.01432%0.321CS..Hα-helixtrans-69.9-31.1178.4-69.90000113G293 T342 E343 K344 R350 I351 L354G293-C346 WeakPolarHBondContact CA-SG 3.45Å; T342-C346 VanDerWaalsContact O-CB 3.22Å; T342-C346 WeakPolarHBondContact O-CB 3.37Å; T342-C346 PolarHBondContact O-N 2.99Å; T342-C346 PolarHBondContact O-SG 3.39Å; E343-C346 PolarHBondContact O-N 3Å; K344-C346 PolarHBondContact O-N 3.04Å; C346-R350 PolarHBondContact O-N 3.48Å; C346-I351 HydrophobicContact CB-CB 3.98Å; C346-I351 HydrophobicContact CB-CD1 4.43Å; C346-I351 PolarHBondContact O-N 2.96Å; C346-L354 HydrophobicContact CB-CD2 3.48Å; C346-L354 VanDerWaalsContact CB-CD2 3.48Å; C346-L354 HydrophobicContact CB-CG 4.2Å
347T86.1Confident79.4Confident98 Ų9871.4 Ų71.460%0.60135%0.346SS*.Hα-helixtrans-70.6-48.8176.4-54.10000110.3E343 K344 Y345 R350E343-T347 WeakPolarHBondContact O-CB 3.5Å; E343-T347 PolarHBondContact O-N 2.9Å; E343-T347 PolarHBondContact O-OG1 3.45Å; K344-T347 PolarHBondContact O-N 3.21Å; K344-T347 VanDerWaalsContact O-N 3.14Å; Y345-T347 VanDerWaalsContact C-N 3.33Å; Y345-T347 PolarHBondContact O-N 3Å; T347-R350 PolarHBondContact O-N 3.28Å
348E88.6Confident77.1Confident136 Ų13681.3 Ų81.364%0.63638%0.384SS*.Hα-helixtrans-60.5-46.9179.7-173.2167.7-171.700112.3K344 R350K344-E348 WeakPolarHBondContact O-CB 3.49Å; K344-E348 PolarHBondContact O-N 3.02Å; E348-R350 VanDerWaalsContact C-N 3.31Å; E348-R350 PolarHBondContact O-N 3.34Å
349H84.3Confident75.4Confident102 Ų10285.2 Ų85.247%0.47240%0.404SS..THydrogen-bonded Turntrans-8813.4178.1-62.9-64.8000114.6Y345 I351Y345-H349 AromaticContact CD1-CD2 3.93Å; Y345-H349 AromaticContact CD2-CD2 3.5Å; Y345-H349 VanDerWaalsContact CD2-CD2 3.5Å; Y345-H349 WeakPolarHBondContact CD2-CD2 3.48Å; Y345-H349 AromaticContact CD2-NE2 3.7Å; Y345-H349 AromaticContact CE1-CD2 3.67Å; Y345-H349 AromaticContact CE2-CD2 3.19Å; Y345-H349 WeakPolarHBondContact CE2-CD2 3.48Å; Y345-H349 AromaticContact CE2-NE2 3.18Å; Y345-H349 WeakPolarHBondContact CE2-NE2 3.49Å; Y345-H349 AromaticContact CG-CD2 3.85Å; Y345-H349 AromaticContact CZ-CD2 3.27Å; Y345-H349 AromaticContact CZ-NE2 3.61Å; Y345-H349 WeakPolarHBondContact O-CB 3.39Å; Y345-H349 PolarHBondContact O-CD2 3.14Å; Y345-H349 PolarHBondContact O-N 3.24Å; H349-I351 VanDerWaalsContact C-N 3.28Å; H349-I351 HydrophobicContact CB-CD1 4.2Å; H349-I351 HydrophobicContact CB-CG1 4.05Å; H349-I351 PolarHBondContact O-N 2.81Å
350R79.6Confident73.9Confident228 Ų22883.7 Ų83.786%0.8640%0.397SS*.THydrogen-bonded Turntrans51.140.6177-56.6-175-179.5-170.90114.3C346 T347 E348 E352C346-R350 PolarHBondContact O-N 3.48Å; T347-R350 PolarHBondContact O-N 3.28Å; E348-R350 VanDerWaalsContact C-N 3.31Å; E348-R350 PolarHBondContact O-N 3.34Å; R350-E352 PolarHBondContact O-N 2.9Å
351I78.9Confident72.4Confident21 Ų2187.2 Ų87.211%0.10841%0.412CS..  trans-79.688.5-179.2-53.2175.9000109.1T290 Y345 C346 H349 K353 L354T290-I351 WeakPolarHBondContact O-CD1 3.49Å; Y345-I351 HydrophobicContact CD1-CD1 4.03Å; Y345-I351 HydrophobicContact CE1-CD1 3.88Å; C346-I351 HydrophobicContact CB-CB 3.98Å; C346-I351 HydrophobicContact CB-CD1 4.43Å; C346-I351 PolarHBondContact O-N 2.96Å; H349-I351 VanDerWaalsContact C-N 3.28Å; H349-I351 HydrophobicContact CB-CD1 4.2Å; H349-I351 HydrophobicContact CB-CG1 4.05Å; H349-I351 PolarHBondContact O-N 2.81Å; I351-K353 CarbonylContact O-C 3.59Å; I351-K353 PolarHBondContact O-N 2.79Å; I351-L354 PolarHBondContact O-N 3.4Å
352E57.9Low70.7Confident187 Ų18790.3 Ų90.387%0.87443%0.43SS*.SBendtrans-50.3-21.9-175.7-164.9-178.9-12200115.1R350 L354R350-E352 PolarHBondContact O-N 2.9Å; E352-L354 PolarHBondContact O-N 3.24Å
353K58.2Low69.3Low162 Ų16291.2 Ų91.270%0.70443%0.434SS*.  trans-97.460174-68-179.1-179.2172.30112.5I351I351-K353 CarbonylContact O-C 3.59Å; I351-K353 PolarHBondContact O-N 2.79Å
354L55.8Low67.8Low90 Ų9089.1 Ų89.147%0.47142%0.424SS..PPolyproline II helixtrans-53.7128.5156.4-78.9164.6000109C346 I351 E352 G356C346-L354 HydrophobicContact CB-CD2 3.48Å; C346-L354 VanDerWaalsContact CB-CD2 3.48Å; C346-L354 HydrophobicContact CB-CG 4.2Å; I351-L354 PolarHBondContact O-N 3.4Å; E352-L354 PolarHBondContact O-N 3.24Å; L354-G356 PolarHBondContact O-N 3.5Å
355P56.5Low66.1Low12 Ų1286.8 Ų86.88%0.07842%0.416CS..PPolyproline II helixtrans-72.3123.7173.4-3.920.3000108.3D359 W360P355-D359 HydrophobicContact CB-CB 4.14Å; P355-W360 VanDerWaalsContact O-CE2 3.27Å; P355-W360 VanDerWaalsContact O-CZ2 3.28Å; P355-W360 WeakPolarHBondContact O-CZ2 3.44Å
356G53.8Low64.6Low25 Ų2592.6 Ų92.626%0.25844%0.438SS..PPolyproline II helixtrans-65.7163.7179.300000112.3L354 R358 D359 W360L354-G356 PolarHBondContact O-N 3.5Å; G356-R358 PolarHBondContact O-N 3.24Å; G356-D359 PolarHBondContact N-OD2 3.1Å; G356-D359 WeakPolarHBondContact O-CA 3.33Å; G356-D359 WeakPolarHBondContact O-CB 3.31Å; G356-D359 PolarHBondContact O-N 3.43Å; G356-W360 PolarHBondContact O-N 3.46Å
357P53.2Low63.3Low100 Ų10094.8 Ų94.865%0.64945%0.447SS*.Hα-helixtrans-55.2-22.8179.3-29.336000115.7W360P357-W360 HydrophobicContact CB-CE3 4.32Å; P357-W360 HydrophobicContact CB-CZ3 4Å; P357-W360 HydrophobicContact CG-CH2 4.4Å; P357-W360 HydrophobicContact CG-CZ3 3.94Å
358R46.5Very low61.9Low208 Ų20890.4 Ų90.479%0.78542%0.42SS*.Hα-helixtrans-83.5-32.4173.7-53.4-177.4-140.4-92.60.2112.2G356 M361 L362G356-R358 PolarHBondContact O-N 3.24Å; R358-M361 PolarHBondContact O-N 3.41Å; R358-L362 WeakPolarHBondContact O-CB 3.46Å; R358-L362 WeakPolarHBondContact O-CG 3.48Å; R358-L362 PolarHBondContact O-N 2.89Å
359D58.9Low60.3Low81 Ų8188.8 Ų88.843%0.43341%0.413SS..Hα-helixtrans-71.3-41.9-179.9-71.8-53.5000112.2P355 G356 M361 L362 Q363P355-D359 HydrophobicContact CB-CB 4.14Å; G356-D359 PolarHBondContact N-OD2 3.1Å; G356-D359 WeakPolarHBondContact O-CA 3.33Å; G356-D359 WeakPolarHBondContact O-CB 3.31Å; G356-D359 PolarHBondContact O-N 3.43Å; D359-M361 VanDerWaalsContact C-N 3.26Å; D359-M361 PolarHBondContact O-N 2.97Å; D359-L362 PolarHBondContact O-N 2.89Å; D359-Q363 WeakPolarHBondContact O-CB 3.36Å; D359-Q363 PolarHBondContact O-N 2.85Å
360W60.3Low58.9Low36 Ų3689.6 Ų89.614%0.13642%0.418CS..Hα-helixtrans-53.4-48172.8-61.4-50.4000110.8K339 E343 P355 G356 P357 Q363 M364K339-W360 HydrophobicContact CD-CE3 4.49Å; K339-W360 HydrophobicContact CD-CH2 4.23Å; K339-W360 HydrophobicContact CD-CZ3 4.08Å; K339-W360 VanDerWaalsContact CE-CH2 3.43Å; K339-W360 HydrophobicContact CG-CH2 4.2Å; K339-W360 HydrophobicContact CG-CZ2 4.21Å; K339-W360 HydrophobicContact CG-CZ3 4.42Å; E343-W360 HydrophobicContact CG-CZ2 4.18Å; E343-W360 WeakPolarHBondContact OE1-CH2 3.47Å; P355-W360 VanDerWaalsContact O-CE2 3.27Å; P355-W360 VanDerWaalsContact O-CZ2 3.28Å; P355-W360 WeakPolarHBondContact O-CZ2 3.44Å; G356-W360 PolarHBondContact O-N 3.46Å; P357-W360 HydrophobicContact CB-CE3 4.32Å; P357-W360 HydrophobicContact CB-CZ3 4Å; P357-W360 HydrophobicContact CG-CH2 4.4Å; P357-W360 HydrophobicContact CG-CZ3 3.94Å; W360-Q363 PolarHBondContact O-N 3.34Å; W360-M364 WeakPolarHBondContact O-CB 3.39Å; W360-M364 VanDerWaalsContact O-CG 3.29Å; W360-M364 WeakPolarHBondContact O-CG 3.26Å; W360-M364 PolarHBondContact O-N 3.38Å
361M59.6Low57.8Low117 Ų11779.7 Ų79.758%0.57638%0.382SS*.Hα-helixtrans-64.1-45.9-179.5-166-168.2-55.700112.2R358 D359 Q363 L365R358-M361 PolarHBondContact O-N 3.41Å; D359-M361 VanDerWaalsContact C-N 3.26Å; D359-M361 PolarHBondContact O-N 2.97Å; M361-Q363 PolarHBondContact O-N 3.07Å; M361-L365 WeakPolarHBondContact O-CB 3.43Å; M361-L365 PolarHBondContact O-N 3.39Å
362L58.4Low56.7Low98 Ų9881.2 Ų81.251%0.51339%0.389SS..Hα-helixtrans-64.4-27.9176.1-74.7169.8000112.8R358 D359 R366R358-L362 WeakPolarHBondContact O-CB 3.46Å; R358-L362 WeakPolarHBondContact O-CG 3.48Å; R358-L362 PolarHBondContact O-N 2.89Å; D359-L362 PolarHBondContact O-N 2.89Å; L362-R366 VanDerWaalsContact O-CB 3.22Å; L362-R366 WeakPolarHBondContact O-CB 3.45Å; L362-R366 PolarHBondContact O-N 2.94Å
363Q60.9Low56.4Low21 Ų2177.3 Ų77.310%0.09837%0.373CS..Hα-helixtrans-87.5-40.1-174.4-165.3164.4131.800112.2S294 R298 D359 W360 M361 R366 K367S294-Q363 PolarHBondContact O-OE1 3.45Å; R298-Q363 HydrophobicContact CG-CG 4.1Å; D359-Q363 WeakPolarHBondContact O-CB 3.36Å; D359-Q363 PolarHBondContact O-N 2.85Å; W360-Q363 PolarHBondContact O-N 3.34Å; M361-Q363 PolarHBondContact O-N 3.07Å; Q363-R366 PolarHBondContact O-N 3.32Å; Q363-K367 PolarHBondContact O-N 3.33Å; Q363-K367 VanDerWaalsContact O-N 3.09Å
364M58.9Low56.3Low11 Ų1176.1 Ų76.15%0.05437%0.371CS..Hα-helixtrans-59.8-51.7165.3-68.3-61.2-75.800110.3F297 V301 L310 P315 L330 W360 R366 K367 T368F297-M364 HydrophobicContact CE1-CG 4.13Å; F297-M364 HydrophobicContact CE1-SD 3.79Å; V301-M364 HydrophobicContact CB-SD 4.47Å; V301-M364 HydrophobicContact CG1-CE 3.75Å; V301-M364 HydrophobicContact CG1-SD 3.81Å; V301-M364 HydrophobicContact CG2-CE 4.37Å; V301-M364 HydrophobicContact CG2-SD 4.03Å; L310-M364 HydrophobicContact CD2-CE 4.28Å; P315-M364 HydrophobicContact CB-CB 3.89Å; P315-M364 HydrophobicContact CB-CG 4.36Å; P315-M364 HydrophobicContact CG-CB 4.32Å; L330-M364 HydrophobicContact CD1-CE 3.22Å; W360-M364 WeakPolarHBondContact O-CB 3.39Å; W360-M364 VanDerWaalsContact O-CG 3.29Å; W360-M364 WeakPolarHBondContact O-CG 3.26Å; W360-M364 PolarHBondContact O-N 3.38Å; M364-R366 VanDerWaalsContact C-N 3.27Å; M364-R366 PolarHBondContact O-N 2.92Å; M364-K367 WeakPolarHBondContact O-CB 3.32Å; M364-K367 PolarHBondContact O-N 2.94Å; M364-T368 PolarHBondContact O-N 3.02Å; M364-T368 PolarHBondContact O-OG1 3.35Å
365L55.1Low56.3Low60 Ų6075 Ų7531%0.31437%0.367SS..Hα-helixtrans-59.9-37179.2-171.467.6000112.1M361 T368 Q369M361-L365 WeakPolarHBondContact O-CB 3.43Å; M361-L365 PolarHBondContact O-N 3.39Å; L365-T368 PolarHBondContact O-N 3.49Å; L365-Q369 HydrophobicContact CG-CG 4.47Å; L365-Q369 WeakPolarHBondContact O-CB 3.47Å; L365-Q369 WeakPolarHBondContact O-CG 3.16Å; L365-Q369 PolarHBondContact O-N 2.92Å
366R58.3Low56.1Low149 Ų14978.3 Ų78.356%0.56238%0.384SS*.Hα-helixtrans-66.1-37.8174.9-166.4-175.1-50.9-179.45.2112.4L362 Q363 M364 M370L362-R366 VanDerWaalsContact O-CB 3.22Å; L362-R366 WeakPolarHBondContact O-CB 3.45Å; L362-R366 PolarHBondContact O-N 2.94Å; Q363-R366 PolarHBondContact O-N 3.32Å; M364-R366 VanDerWaalsContact C-N 3.27Å; M364-R366 PolarHBondContact O-N 2.92Å; R366-M370 HydrophobicContact CG-CG 4.42Å; R366-M370 WeakPolarHBondContact O-CB 3.47Å; R366-M370 VanDerWaalsContact O-CG 3.22Å; R366-M370 WeakPolarHBondContact O-CG 3.22Å; R366-M370 PolarHBondContact O-N 2.95Å
367K58.7Low56Low48 Ų4881.2 Ų81.221%0.20940%0.396CS..Hα-helixtrans-63.5-53.8170.7-89.6-165.6164.1-166.30111.1R298 C302 Q363 M364 Q369 M370 N371R298-K367 PolarHBondContact O-NZ 3.48Å; C302-K367 PolarHBondContact SG-NZ 3.37Å; Q363-K367 PolarHBondContact O-N 3.33Å; Q363-K367 VanDerWaalsContact O-N 3.09Å; M364-K367 WeakPolarHBondContact O-CB 3.32Å; M364-K367 PolarHBondContact O-N 2.94Å; K367-Q369 PolarHBondContact O-N 2.97Å; K367-M370 PolarHBondContact O-N 2.98Å; K367-M370 VanDerWaalsContact O-N 3.15Å; K367-N371 WeakPolarHBondContact O-CB 3.28Å; K367-N371 PolarHBondContact O-N 3.35Å; K367-N371 PolarHBondContact O-OD1 2.81Å
368T57.9Low55.7Low6 Ų679.6 Ų79.64%0.03739%0.388CS..Hα-helixtrans-52.6-42.2177.9-56.60000112L310 M364 L365 H372L310-T368 WeakPolarHBondContact O-CA 3.35Å; L310-T368 WeakPolarHBondContact O-CB 3.3Å; L310-T368 WeakPolarHBondContact O-CG2 3.37Å; L310-T368 PolarHBondContact O-OG1 3.34Å; M364-T368 PolarHBondContact O-N 3.02Å; M364-T368 PolarHBondContact O-OG1 3.35Å; L365-T368 PolarHBondContact O-N 3.49Å; T368-H372 WeakPolarHBondContact O-CB 3.18Å; T368-H372 PolarHBondContact O-N 2.99Å
369Q54.3Low55.8Low103 Ų10374.2 Ų74.248%0.48137%0.371SS..Hα-helixtrans-70.8-45.2177.4-68.8-68.8-41.900113.5L365 K367 H372 L373L365-Q369 HydrophobicContact CG-CG 4.47Å; L365-Q369 WeakPolarHBondContact O-CB 3.47Å; L365-Q369 WeakPolarHBondContact O-CG 3.16Å; L365-Q369 PolarHBondContact O-N 2.92Å; K367-Q369 PolarHBondContact O-N 2.97Å; Q369-H372 WeakPolarHBondContact O-CB 3.31Å; Q369-H372 PolarHBondContact O-N 3.29Å; Q369-L373 PolarHBondContact O-N 3.42Å
370M55.3Low55.2Low118 Ų11876.1 Ų76.158%0.58138%0.378SS*.Hα-helixtrans-68.1-41.7179.3-69.9-67.9172.900112R366 K367 H372 L373 Q374R366-M370 HydrophobicContact CG-CG 4.42Å; R366-M370 WeakPolarHBondContact O-CB 3.47Å; R366-M370 VanDerWaalsContact O-CG 3.22Å; R366-M370 WeakPolarHBondContact O-CG 3.22Å; R366-M370 PolarHBondContact O-N 2.95Å; K367-M370 PolarHBondContact O-N 2.98Å; K367-M370 VanDerWaalsContact O-N 3.15Å; M370-H372 VanDerWaalsContact C-N 3.31Å; M370-H372 PolarHBondContact O-N 3.1Å; M370-L373 WeakPolarHBondContact O-CB 3.45Å; M370-L373 PolarHBondContact O-N 3.16Å; M370-L373 HydrophobicContact SD-CD1 4.41Å; M370-Q374 PolarHBondContact O-N 2.99Å
371N57.2Low54.5Low20 Ų2077.5 Ų77.511%0.10739%0.393CS..Hα-helixtrans-63.4-37.6172.5-70.432.7000110.9D307 A311 K367 Q374 V375D307-N371 PolarHBondContact OD1-ND2 3.25Å; A311-N371 HydrophobicContact CB-CB 4Å; K367-N371 WeakPolarHBondContact O-CB 3.28Å; K367-N371 PolarHBondContact O-N 3.35Å; K367-N371 PolarHBondContact O-OD1 2.81Å; N371-Q374 PolarHBondContact O-N 2.88Å; N371-V375 WeakPolarHBondContact O-CB 3.43Å; N371-V375 VanDerWaalsContact O-CG2 3.3Å; N371-V375 WeakPolarHBondContact O-CG2 3.42Å; N371-V375 PolarHBondContact O-N 3Å
372H55.6Low53.8Low54 Ų5474.2 Ų74.225%0.2538%0.384CS..Hα-helixtrans-64.4-38.4174.6-172.4-105.1000112.5R327 T368 Q369 M370 L376R327-H372 PolarHBondContact NH1-CD2 3.04Å; R327-H372 VanDerWaalsContact NH1-CD2 3.35Å; R327-H372 PolarHBondContact NH2-NE2 2.97Å; T368-H372 WeakPolarHBondContact O-CB 3.18Å; T368-H372 PolarHBondContact O-N 2.99Å; Q369-H372 WeakPolarHBondContact O-CB 3.31Å; Q369-H372 PolarHBondContact O-N 3.29Å; M370-H372 VanDerWaalsContact C-N 3.31Å; M370-H372 PolarHBondContact O-N 3.1Å; H372-L376 WeakPolarHBondContact O-CB 3.45Å; H372-L376 VanDerWaalsContact O-CG 3.24Å; H372-L376 WeakPolarHBondContact O-CG 3.45Å; H372-L376 PolarHBondContact O-N 3.47Å
373L51.3Low53.4Low104 Ų10477 Ų7755%0.54539%0.388SS..Hα-helixtrans-60.9-43.3169.9-87.7141.8000111.7Q369 M370 L376 T377Q369-L373 PolarHBondContact O-N 3.42Å; M370-L373 WeakPolarHBondContact O-CB 3.45Å; M370-L373 PolarHBondContact O-N 3.16Å; M370-L373 HydrophobicContact SD-CD1 4.41Å; L373-L376 PolarHBondContact O-N 3.26Å; L373-T377 WeakPolarHBondContact O-CG2 3.48Å; L373-T377 PolarHBondContact O-N 3.01Å; L373-T377 PolarHBondContact O-OG1 3.42Å
374Q55.8Low52.7Low138 Ų13881 Ų8165%0.64541%0.41SS*.Hα-helixtrans-71.3-34.5179.5-170171.9-9.800113.4M370 N371 T377 S378M370-Q374 PolarHBondContact O-N 2.99Å; N371-Q374 PolarHBondContact O-N 2.88Å; Q374-T377 PolarHBondContact O-OG1 3.08Å; Q374-T377 VanDerWaalsContact O-OG1 3.13Å; Q374-S378 WeakPolarHBondContact O-CB 3.4Å; Q374-S378 PolarHBondContact O-N 3.28Å; Q374-S378 VanDerWaalsContact O-N 3.1Å; Q374-S378 PolarHBondContact O-OG 2.97Å
375V56.8Low51.9Low65 Ų6584 Ų8439%0.39443%0.431SS..Hα-helixtrans-71.8-36.7173.3170.80000111.1A311 N371 S378 H379A311-V375 HydrophobicContact CB-CG2 4.4Å; N371-V375 WeakPolarHBondContact O-CB 3.43Å; N371-V375 VanDerWaalsContact O-CG2 3.3Å; N371-V375 WeakPolarHBondContact O-CG2 3.42Å; N371-V375 PolarHBondContact O-N 3Å; V375-S378 WeakPolarHBondContact CA-OG 3.5Å; V375-S378 PolarHBondContact O-OG 3.19Å; V375-H379 WeakPolarHBondContact O-CB 3.23Å; V375-H379 PolarHBondContact O-N 2.94Å
376L50.8Low51.5Low83 Ų8386.9 Ų86.944%0.43545%0.446SS..Hα-helixtrans-64.3-49.5172-76173.4000111.6H372 L373 S378 H379 E380H372-L376 WeakPolarHBondContact O-CB 3.45Å; H372-L376 VanDerWaalsContact O-CG 3.24Å; H372-L376 WeakPolarHBondContact O-CG 3.45Å; H372-L376 PolarHBondContact O-N 3.47Å; L373-L376 PolarHBondContact O-N 3.26Å; L376-S378 VanDerWaalsContact C-N 3.34Å; L376-S378 PolarHBondContact O-N 3.29Å; L376-H379 PolarHBondContact O-N 3.37Å; L376-E380 WeakPolarHBondContact O-CB 3.44Å; L376-E380 PolarHBondContact O-N 2.99Å
377T51.9Low51Low85 Ų8582.3 Ų82.352%0.52144%0.44SS..Hα-helixtrans-64.8-35.3-179.6530000113L373 Q374 S381L373-T377 WeakPolarHBondContact O-CG2 3.48Å; L373-T377 PolarHBondContact O-N 3.01Å; L373-T377 PolarHBondContact O-OG1 3.42Å; Q374-T377 PolarHBondContact O-OG1 3.08Å; Q374-T377 VanDerWaalsContact O-OG1 3.13Å; T377-S381 WeakPolarHBondContact O-CB 3.44Å; T377-S381 PolarHBondContact O-N 3.07Å
378S47.7Very low50.2Low67 Ų6786.6 Ų86.647%0.46946%0.459SS..Hα-helixtrans-72.7-38.2175.147.70000113.2Q374 V375 L376 A382Q374-S378 WeakPolarHBondContact O-CB 3.4Å; Q374-S378 PolarHBondContact O-N 3.28Å; Q374-S378 VanDerWaalsContact O-N 3.1Å; Q374-S378 PolarHBondContact O-OG 2.97Å; V375-S378 WeakPolarHBondContact CA-OG 3.5Å; V375-S378 PolarHBondContact O-OG 3.19Å; L376-S378 VanDerWaalsContact C-N 3.34Å; L376-S378 PolarHBondContact O-N 3.29Å; S378-A382 WeakPolarHBondContact O-CB 3.4Å; S378-A382 PolarHBondContact O-N 3.19Å
379H47.3Very low49.5Very low95 Ų9589.9 Ų89.944%0.4448%0.479SS..Hα-helixtrans-72.3-34.2174.6178.9-138.5000112.6V375 L376 R383V375-H379 WeakPolarHBondContact O-CB 3.23Å; V375-H379 PolarHBondContact O-N 2.94Å; L376-H379 PolarHBondContact O-N 3.37Å; H379-R383 PolarHBondContact CE1-NE 3.33Å; H379-R383 PolarHBondContact CE1-NH2 3.05Å; H379-R383 VanDerWaalsContact CE1-NH2 3.26Å; H379-R383 PolarHBondContact NE2-NE 2.87Å; H379-R383 PolarHBondContact NE2-NH2 3.2Å; H379-R383 WeakPolarHBondContact O-CB 3.23Å; H379-R383 VanDerWaalsContact O-CG 3.26Å; H379-R383 WeakPolarHBondContact O-CG 3.43Å; H379-R383 PolarHBondContact O-N 3.24Å
380E47.8Very low48.8Very low121 Ų12191.3 Ų91.357%0.56549%0.486SS*.Hα-helixtrans-69.8-41.5172.5-171.1162-149.100111L376 R383 N384L376-E380 WeakPolarHBondContact O-CB 3.44Å; L376-E380 PolarHBondContact O-N 2.99Å; E380-R383 PolarHBondContact O-N 2.89Å; E380-N384 WeakPolarHBondContact O-CB 3.47Å; E380-N384 PolarHBondContact O-N 3.21Å; E380-N384 PolarHBondContact O-ND2 2.94Å
381S45.6Very low48.4Very low65 Ų6589.3 Ų89.346%0.45548%0.48SS..Hα-helixtrans-58-50.3169.2-173.50000111.8T377 R383 N384 C385T377-S381 WeakPolarHBondContact O-CB 3.44Å; T377-S381 PolarHBondContact O-N 3.07Å; S381-R383 VanDerWaalsContact C-N 3.31Å; S381-R383 PolarHBondContact O-N 2.9Å; S381-N384 PolarHBondContact O-N 2.81Å; S381-N384 VanDerWaalsContact O-N 3.07Å; S381-C385 PolarHBondContact O-N 3.1Å; S381-C385 PolarHBondContact O-SG 3.18Å; S381-C385 VanDerWaalsContact O-SG 3.34Å
382A45.2Very low47.6Very low47 Ų4794.3 Ų94.339%0.38850%0.503SS..Hα-helixtrans-60.5-37.6178.100000113.1S378 L386S378-A382 WeakPolarHBondContact O-CB 3.4Å; S378-A382 PolarHBondContact O-N 3.19Å; A382-L386 WeakPolarHBondContact O-CB 3.5Å; A382-L386 WeakPolarHBondContact O-CG 3.44Å; A382-L386 PolarHBondContact O-N 3.04Å
383R49Very low46.7Very low156 Ų15699 Ų9959%0.58953%0.529SS*.Hα-helixtrans-65.9-40.8172.9-77.3171.2174.4-149.3-8.7112.3H379 E380 S381 L386 A387H379-R383 PolarHBondContact CE1-NE 3.33Å; H379-R383 PolarHBondContact CE1-NH2 3.05Å; H379-R383 VanDerWaalsContact CE1-NH2 3.26Å; H379-R383 PolarHBondContact NE2-NE 2.87Å; H379-R383 PolarHBondContact NE2-NH2 3.2Å; H379-R383 WeakPolarHBondContact O-CB 3.23Å; H379-R383 VanDerWaalsContact O-CG 3.26Å; H379-R383 WeakPolarHBondContact O-CG 3.43Å; H379-R383 PolarHBondContact O-N 3.24Å; E380-R383 PolarHBondContact O-N 2.89Å; S381-R383 VanDerWaalsContact C-N 3.31Å; S381-R383 PolarHBondContact O-N 2.9Å; R383-L386 PolarHBondContact O-N 3.28Å; R383-A387 WeakPolarHBondContact O-CB 3.45Å; R383-A387 PolarHBondContact O-N 3.25Å
384N47Very low46.1Very low106 Ų106101.7 Ų101.757%0.56754%0.539SS*.Hα-helixtrans-67-40.2176.6-68.1-21.6000111.4E380 S381 A387 F388E380-N384 WeakPolarHBondContact O-CB 3.47Å; E380-N384 PolarHBondContact O-N 3.21Å; E380-N384 PolarHBondContact O-ND2 2.94Å; S381-N384 PolarHBondContact O-N 2.81Å; S381-N384 VanDerWaalsContact O-N 3.07Å; N384-A387 PolarHBondContact O-N 2.93Å; N384-F388 VanDerWaalsContact O-CB 3.31Å; N384-F388 WeakPolarHBondContact O-CB 3.47Å; N384-F388 PolarHBondContact O-N 3Å
385C41.7Very low45.2Very low74 Ų74102.6 Ų102.650%0.554%0.543SS..Hα-helixtrans-61.2-47.4171.8-65.50000112S381 A387 F388 T389S381-C385 PolarHBondContact O-N 3.1Å; S381-C385 PolarHBondContact O-SG 3.18Å; S381-C385 VanDerWaalsContact O-SG 3.34Å; C385-A387 PolarHBondContact O-N 3.41Å; C385-F388 PolarHBondContact O-N 3.1Å; C385-T389 WeakPolarHBondContact O-CG2 3.48Å; C385-T389 PolarHBondContact O-N 2.92Å; C385-T389 PolarHBondContact O-OG1 3.41Å
386L45.5Very low44.1Very low121 Ų121102.3 Ų102.363%0.63455%0.553SS**Hα-helixtrans-61.7-44.8177.2-79.5167000111.9A382 R383 F388 T389 H390A382-L386 WeakPolarHBondContact O-CB 3.5Å; A382-L386 WeakPolarHBondContact O-CG 3.44Å; A382-L386 PolarHBondContact O-N 3.04Å; R383-L386 PolarHBondContact O-N 3.28Å; L386-F388 VanDerWaalsContact C-N 3.32Å; L386-F388 PolarHBondContact O-N 3.12Å; L386-T389 WeakPolarHBondContact CA-OG1 3.41Å; L386-T389 PolarHBondContact O-N 3.37Å; L386-T389 PolarHBondContact O-OG1 3.21Å; L386-H390 PolarHBondContact O-N 2.97Å
387A48.2Very low43.3Very low53 Ų53107.3 Ų107.344%0.43857%0.571SS.*Hα-helixtrans-58.9-43.2174.500000112R383 N384 C385 H390 T391R383-A387 WeakPolarHBondContact O-CB 3.45Å; R383-A387 PolarHBondContact O-N 3.25Å; N384-A387 PolarHBondContact O-N 2.93Å; C385-A387 PolarHBondContact O-N 3.41Å; A387-H390 PolarHBondContact O-N 2.96Å; A387-T391 PolarHBondContact O-N 3.39Å; A387-T391 PolarHBondContact O-OG1 3.04Å
388F42.2Very low42.3Very low137 Ų137112.4 Ų112.460%0.60159%0.586SS**Hα-helixtrans-64.3-41.8177.1-164.2-94.6000112.2N384 C385 L386 H390 T391 H392N384-F388 VanDerWaalsContact O-CB 3.31Å; N384-F388 WeakPolarHBondContact O-CB 3.47Å; N384-F388 PolarHBondContact O-N 3Å; C385-F388 PolarHBondContact O-N 3.1Å; L386-F388 VanDerWaalsContact C-N 3.32Å; L386-F388 PolarHBondContact O-N 3.12Å; F388-H390 VanDerWaalsContact C-N 3.31Å; F388-H390 PolarHBondContact O-N 3.2Å; F388-T391 PolarHBondContact O-N 3.17Å; F388-T391 PolarHBondContact O-OG1 3.38Å; F388-T391 VanDerWaalsContact O-OG1 3.08Å; F388-H392 AromaticContact CE1-CD2 3.93Å; F388-H392 VanDerWaalsContact O-CB 3.28Å; F388-H392 WeakPolarHBondContact O-CB 3.35Å; F388-H392 PolarHBondContact O-N 3.31Å
389T42.8Very low41.4Very low75 Ų75119.6 Ų119.646%0.4661%0.61SS.*Hα-helixtrans-64.2-35.6174.356.70000112.7C385 L386 L393C385-T389 WeakPolarHBondContact O-CG2 3.48Å; C385-T389 PolarHBondContact O-N 2.92Å; C385-T389 PolarHBondContact O-OG1 3.41Å; L386-T389 WeakPolarHBondContact CA-OG1 3.41Å; L386-T389 PolarHBondContact O-N 3.37Å; L386-T389 PolarHBondContact O-OG1 3.21Å; T389-L393 WeakPolarHBondContact O-CB 3.46Å; T389-L393 PolarHBondContact O-N 3.4Å; T389-L393 VanDerWaalsContact O-N 3.16Å
390H39.3Very low40.5Very low134 Ų134122.4 Ų122.462%0.6263%0.628SS**Hα-helixtrans-74.6-34.2179.9-165.2-56.3000112.8L386 A387 F388L386-H390 PolarHBondContact O-N 2.97Å; A387-H390 PolarHBondContact O-N 2.96Å; F388-H390 VanDerWaalsContact C-N 3.31Å; F388-H390 PolarHBondContact O-N 3.2Å
391T47.4Very low39.6Very low75 Ų75127.1 Ų127.146%0.4664%0.641SS.*Hα-helixtrans-73.1-41.5172.952.70000111.6A387 F388 L393 Q394 Q395A387-T391 PolarHBondContact O-N 3.39Å; A387-T391 PolarHBondContact O-OG1 3.04Å; F388-T391 PolarHBondContact O-N 3.17Å; F388-T391 PolarHBondContact O-OG1 3.38Å; F388-T391 VanDerWaalsContact O-OG1 3.08Å; T391-L393 VanDerWaalsContact C-N 3.35Å; T391-L393 PolarHBondContact O-N 3.12Å; T391-Q394 PolarHBondContact O-N 3.11Å; T391-Q394 VanDerWaalsContact O-N 3.1Å; T391-Q395 PolarHBondContact O-N 3.35Å
392H41.2Very low38.7Very low125 Ų125133.3 Ų133.358%0.57966%0.66SS**Hα-helixtrans-72.5-24.8-175.1-146.2-54000113.7F388 Q394F388-H392 AromaticContact CE1-CD2 3.93Å; F388-H392 VanDerWaalsContact O-CB 3.28Å; F388-H392 WeakPolarHBondContact O-CB 3.35Å; F388-H392 PolarHBondContact O-N 3.31Å; H392-Q394 VanDerWaalsContact C-N 3.34Å
393L36.3Very low38Very low153 Ų153139.4 Ų139.480%0.80168%0.68SS**THydrogen-bonded Turntrans-74.4-20.5169.8-89.1165.3000113.7T389 T391T389-L393 WeakPolarHBondContact O-CB 3.46Å; T389-L393 PolarHBondContact O-N 3.4Å; T389-L393 VanDerWaalsContact O-N 3.16Å; T391-L393 VanDerWaalsContact C-N 3.35Å; T391-L393 PolarHBondContact O-N 3.12Å
394Q37.7Very low37.2Very low161 Ų161137 Ų13775%0.75269%0.687SS**THydrogen-bonded Turntrans-97.1-9.4-179-150.7173.313.900113.7T391 H392T391-Q394 PolarHBondContact O-N 3.11Å; T391-Q394 VanDerWaalsContact O-N 3.1Å; H392-Q394 VanDerWaalsContact C-N 3.34Å
395Q38.8Very low36.4Very low157 Ų157138.9 Ų138.973%0.73470%0.698SS**  trans-105.320.6175.2-65.7-173.1-17.300113.3T391 F397T391-Q395 PolarHBondContact O-N 3.35Å; Q395-F397 PolarHBondContact O-N 3.35Å
396G33.2Very low35.9Very low58 Ų58144.9 Ų144.960%0.59872%0.718SS**  trans-71.414.217900000116.5
397F34Very low35.6Very low188 Ų188147.9 Ų147.983%0.82573%0.729SS**SBendtrans-143.6153.1174-85-84.6000110.1Q395Q395-F397 PolarHBondContact O-N 3.35Å
398F31.2Very low35.2Very low192 Ų192154.6 Ų154.684%0.84275%0.748SS**  trans68.368.7-172.3-65.5-85.8000116.3
399F27.9Very low35.1Very low218 Ų218155.9 Ų155.996%0.95676%0.76SS**  trans-12779.9143.5-115.8-81.2000111.3
400N28.1Very low34.8Very low155 Ų155159.8 Ų159.883%0.82978%0.778SS**SBendtrans-153.9133.3161.3-117.9-47.3000108
401R29.5Very low34.7Very low219 Ų219159.1 Ų159.183%0.82678%0.779SS**  trans61.689.9174.2-163.8-163.1-134.5160.55.8116.3
402F25.9Very low34Very low195 Ų195164.4 Ų164.486%0.85580%0.795SS**  -158.4160.6100.1-119.6-82.6000111.9
403E30.8Very low33.9Very low176 Ų176162.9 Ų162.982%0.82280%0.795SS**  trans-126.4144.4-170.8-177.4177.9-176.700110.4
404S33.3Very low33.8Very low105 Ų105159.1 Ų159.173%0.73478%0.776SS**  trans69.5160.1174.4-138.40000119.4
405D29.8Very low33.7Very low146 Ų146159.3 Ų159.378%0.78177%0.774SS**  trans67.167.4156-65.316.5000120
406E31.6Very low33.7Very low200 Ų200156.8 Ų156.894%0.93577%0.765SS**  -156.8102113.9-119.4-169.3171.100113.9
407Q39.5Very low33.9Very low183 Ų183157.7 Ų157.786%0.85576%0.762SS**  trans-92.695.7168-78.9-170.5-6.600111.7
408K38.9Very low33.8Very low195 Ų195152.3 Ų152.385%0.84875%0.747SS**  trans-165.7153.8149.8-96.4126.3-156.3159.30112.3
409L39.6Very low34.1Very low163 Ų163149.3 Ų149.385%0.85374%0.735SS**  trans64.358.5163.7-99.270000118.6
410L36.8Very low34.5Very low158 Ų158147.3 Ų147.383%0.82772%0.723SS**  trans-120.4152.5139.3-96.396.4000110.6
411N36.4Very low34.9Very low120 Ų120143.2 Ų143.264%0.64271%0.705SS**  trans-84.3149.1-171.2-86.3-48.6000112.7T413 D414N411-T413 PolarHBondContact O-N 3.5Å; N411-D414 WeakPolarHBondContact CB-OD2 3.46Å; N411-D414 PolarHBondContact N-OD2 2.94Å; N411-D414 PolarHBondContact O-N 3.09Å; N411-D414 VanDerWaalsContact O-N 3.09Å
412K34.5Very low35.6Very low185 Ų185138.1 Ų138.180%0.80469%0.694SS**THydrogen-bonded Turntrans-68-8.6-175.6-154.7168.7-174.2171.70113.9I416K412-I416 WeakPolarHBondContact O-CD1 3.46Å; K412-I416 WeakPolarHBondContact O-CG1 3.4Å
413T38.2Very low36.3Very low93 Ų93131.6 Ų131.657%0.57168%0.676SS**THydrogen-bonded Turntrans-73.8-39171.3380000112.7N411 I416 S417N411-T413 PolarHBondContact O-N 3.5Å; T413-I416 WeakPolarHBondContact O-CB 3.3Å; T413-I416 PolarHBondContact O-N 3.06Å; T413-I416 VanDerWaalsContact O-N 3.13Å; T413-S417 PolarHBondContact O-N 3.18Å; T413-S417 VanDerWaalsContact O-N 3.13Å
414D34.8Very low36.8Very low75 Ų75125.4 Ų125.440%0.40166%0.655SS.*Hα-helixtrans-79.7-35.1-159.7-44.3-27000109.9N411 I416 S417 C418N411-D414 WeakPolarHBondContact CB-OD2 3.46Å; N411-D414 PolarHBondContact N-OD2 2.94Å; N411-D414 PolarHBondContact O-N 3.09Å; N411-D414 VanDerWaalsContact O-N 3.09Å; D414-I416 VanDerWaalsContact C-N 3.28Å; D414-I416 PolarHBondContact O-N 3.37Å; D414-S417 WeakPolarHBondContact O-CB 3.5Å; D414-S417 PolarHBondContact O-N 3.35Å; D414-C418 PolarHBondContact O-N 2.85Å; D414-C418 VanDerWaalsContact O-N 3.09Å
415F35Very low37.3Very low164 Ų164125 Ų12572%0.71964%0.644SS**Hα-helixtrans-64.2-29.4170.6-150-85.2000113H419F415-H419 WeakPolarHBondContact O-CB 3.38Å; F415-H419 PolarHBondContact O-N 3.36Å
416I39.3Very low38Very low105 Ų105124.1 Ų124.154%0.53864%0.636SS.*Hα-helixtrans-75.4-39.1175.9-62.8173.1000110.1K412 T413 D414 Y420K412-I416 WeakPolarHBondContact O-CD1 3.46Å; K412-I416 WeakPolarHBondContact O-CG1 3.4Å; T413-I416 WeakPolarHBondContact O-CB 3.3Å; T413-I416 PolarHBondContact O-N 3.06Å; T413-I416 VanDerWaalsContact O-N 3.13Å; D414-I416 VanDerWaalsContact C-N 3.28Å; D414-I416 PolarHBondContact O-N 3.37Å; I416-Y420 HydrophobicContact CG2-CD2 4.27Å; I416-Y420 PolarHBondContact O-N 3.21Å; I416-Y420 VanDerWaalsContact O-N 3.17Å
417S37.4Very low38.3Very low76 Ų76121.5 Ų121.553%0.53162%0.621SS.*Hα-helixtrans-61-52.9176.6-164.30000111.6T413 D414 H419 Y420 C421T413-S417 PolarHBondContact O-N 3.18Å; T413-S417 VanDerWaalsContact O-N 3.13Å; D414-S417 WeakPolarHBondContact O-CB 3.5Å; D414-S417 PolarHBondContact O-N 3.35Å; S417-H419 VanDerWaalsContact C-N 3.32Å; S417-H419 PolarHBondContact O-N 3.08Å; S417-Y420 WeakPolarHBondContact O-CB 3.4Å; S417-Y420 PolarHBondContact O-N 3.37Å; S417-C421 PolarHBondContact O-N 3.11Å
418C32.6Very low38.8Very low76 Ų76117.6 Ų117.651%0.51461%0.605SS.*Hα-helixtrans-59.1-41.3-178.8-167.30000112.6D414 Y420 C421 L422D414-C418 PolarHBondContact O-N 2.85Å; D414-C418 VanDerWaalsContact O-N 3.09Å; C418-Y420 VanDerWaalsContact C-N 3.28Å; C418-Y420 PolarHBondContact O-N 2.77Å; C418-C421 PolarHBondContact O-N 3.44Å; C418-L422 PolarHBondContact O-N 3.37Å
419H35.4Very low39Very low128 Ų128115.1 Ų115.159%0.59360%0.595SS**Hα-helixtrans-72.9-19.3179.1-147.4-45.3000113.6F415 S417 A423F415-H419 WeakPolarHBondContact O-CB 3.38Å; F415-H419 PolarHBondContact O-N 3.36Å; S417-H419 VanDerWaalsContact C-N 3.32Å; S417-H419 PolarHBondContact O-N 3.08Å; H419-A423 WeakPolarHBondContact O-CB 3.44Å
420Y38Very low39.1Very low177 Ų177111.8 Ų111.869%0.69458%0.578SS**Hα-helixtrans-80.5-38.7170.4-109.6-86.4000112.4I416 S417 C418 A423 A424I416-Y420 HydrophobicContact CG2-CD2 4.27Å; I416-Y420 PolarHBondContact O-N 3.21Å; I416-Y420 VanDerWaalsContact O-N 3.17Å; S417-Y420 WeakPolarHBondContact O-CB 3.4Å; S417-Y420 PolarHBondContact O-N 3.37Å; C418-Y420 VanDerWaalsContact C-N 3.28Å; C418-Y420 PolarHBondContact O-N 2.77Å; Y420-A423 PolarHBondContact O-N 3.15Å; Y420-A424 WeakPolarHBondContact O-CB 3.49Å; Y420-A424 PolarHBondContact O-N 3.27Å
421C36.1Very low39.5Very low68 Ų68108.2 Ų108.246%0.45956%0.558SS.*Hα-helixtrans-59.7-53.7174.8-66.90000111.2S417 C418 A423 A424 D425S417-C421 PolarHBondContact O-N 3.11Å; C418-C421 PolarHBondContact O-N 3.44Å; C421-A423 PolarHBondContact O-N 3.08Å; C421-A424 WeakPolarHBondContact O-CA 3.15Å; C421-A424 WeakPolarHBondContact O-CB 3.28Å; C421-A424 PolarHBondContact O-N 3.29Å; C421-D425 PolarHBondContact O-N 3.41Å
422L42.9Very low39.7Very low112 Ų112105.6 Ų105.659%0.58655%0.55SS*.Hα-helixtrans-58.6-34.2178.6-68.6170.4000112.9C418 Q426C418-L422 PolarHBondContact O-N 3.37Å; L422-Q426 WeakPolarHBondContact O-CB 3.28Å; L422-Q426 PolarHBondContact O-N 3.13Å; L422-Q426 VanDerWaalsContact O-N 3.14Å
423A40.9Very low40Very low58 Ų58101 Ų10148%0.47953%0.534SS..Hα-helixtrans-72.3-35174.900000113H419 Y420 C421 F427H419-A423 WeakPolarHBondContact O-CB 3.44Å; Y420-A423 PolarHBondContact O-N 3.15Å; C421-A423 PolarHBondContact O-N 3.08Å; A423-F427 WeakPolarHBondContact O-CB 3.38Å; A423-F427 PolarHBondContact O-N 3.41Å
424A42.7Very low40.1Very low46 Ų4699.2 Ų99.238%0.3853%0.528SS..Hα-helixtrans-70-43.9175.300000111.6Y420 C421 Q426 F427 I428Y420-A424 WeakPolarHBondContact O-CB 3.49Å; Y420-A424 PolarHBondContact O-N 3.27Å; C421-A424 WeakPolarHBondContact O-CA 3.15Å; C421-A424 WeakPolarHBondContact O-CB 3.28Å; C421-A424 PolarHBondContact O-N 3.29Å; A424-Q426 PolarHBondContact O-N 3.35Å; A424-F427 WeakPolarHBondContact O-CB 3.48Å; A424-F427 PolarHBondContact O-N 3.24Å; A424-F427 VanDerWaalsContact O-N 3.1Å; A424-I428 WeakPolarHBondContact O-CG1 3.45Å; A424-I428 PolarHBondContact O-N 3.11Å
425D43.3Very low40.5Very low97 Ų97101.1 Ų101.152%0.51954%0.538SS..Hα-helixtrans-62.5-43.4177.6-65.9-36.9000111.1C421 F427 I428 F429C421-D425 PolarHBondContact O-N 3.41Å; D425-F427 PolarHBondContact O-N 3.09Å; D425-I428 PolarHBondContact O-N 3.13Å; D425-F429 WeakPolarHBondContact O-CB 3.27Å; D425-F429 PolarHBondContact O-N 2.85Å
426Q43.5Very low40.6Very low128 Ų128101.8 Ų101.860%0.59854%0.541SS*.Hα-helixtrans-61.6-31.4174.7-159.474.76600112.6L422 A424 N430L422-Q426 WeakPolarHBondContact O-CB 3.28Å; L422-Q426 PolarHBondContact O-N 3.13Å; L422-Q426 VanDerWaalsContact O-N 3.14Å; A424-Q426 PolarHBondContact O-N 3.35Å; Q426-N430 PolarHBondContact O-N 3.31Å; Q426-N430 PolarHBondContact O-ND2 3.19Å
427F39Very low40.8Very low144 Ų144103 Ų10363%0.63255%0.547SS*.Hα-helixtrans-77.7-43178-160.5-104.4000111.9A423 A424 D425 N430 I431A423-F427 WeakPolarHBondContact O-CB 3.38Å; A423-F427 PolarHBondContact O-N 3.41Å; A424-F427 WeakPolarHBondContact O-CB 3.48Å; A424-F427 PolarHBondContact O-N 3.24Å; A424-F427 VanDerWaalsContact O-N 3.1Å; D425-F427 PolarHBondContact O-N 3.09Å; F427-N430 PolarHBondContact O-N 2.87Å; F427-I431 HydrophobicContact CD1-CD1 3.73Å; F427-I431 HydrophobicContact CE1-CD1 3.65Å; F427-I431 WeakPolarHBondContact O-CG1 3.49Å; F427-I431 PolarHBondContact O-N 3.11Å
428I48.9Very low40.6Very low101 Ų101104.1 Ų104.152%0.51855%0.554SS.*Hα-helixtrans-62.4-44.7174.6-68.7169.7000110.2A424 D425 N430 I431 S432A424-I428 WeakPolarHBondContact O-CG1 3.45Å; A424-I428 PolarHBondContact O-N 3.11Å; D425-I428 PolarHBondContact O-N 3.13Å; I428-N430 VanDerWaalsContact C-N 3.32Å; I428-N430 PolarHBondContact O-N 3.5Å; I428-I431 PolarHBondContact O-N 3.37Å; I428-I431 VanDerWaalsContact O-N 3.14Å; I428-S432 PolarHBondContact O-N 3.07Å; I428-S432 PolarHBondContact O-OG 3.3Å
429F43.9Very low40.5Very low144 Ų144107.9 Ų107.963%0.63256%0.563SS**Hα-helixtrans-62.8-37.3178.5-151.4-83.5000112.3D425 L433D425-F429 WeakPolarHBondContact O-CB 3.27Å; D425-F429 PolarHBondContact O-N 2.85Å; F429-L433 VanDerWaalsContact O-CB 3.3Å; F429-L433 WeakPolarHBondContact O-CB 3.31Å; F429-L433 PolarHBondContact O-N 2.92Å
430N40.9Very low40.3Very low93 Ų93106.9 Ų106.950%0.49757%0.568SS.*Hα-helixtrans-67.3-39.2173.2-88.5-81.2000112.6Q426 F427 I428 L433 A434Q426-N430 PolarHBondContact O-N 3.31Å; Q426-N430 PolarHBondContact O-ND2 3.19Å; F427-N430 PolarHBondContact O-N 2.87Å; I428-N430 VanDerWaalsContact C-N 3.32Å; I428-N430 PolarHBondContact O-N 3.5Å; N430-L433 PolarHBondContact O-N 3.48Å; N430-A434 VanDerWaalsContact O-CB 3.29Å; N430-A434 WeakPolarHBondContact O-CB 3.3Å; N430-A434 PolarHBondContact O-N 2.86Å
431I46.6Very low40.1Very low82 Ų82103 Ų10342%0.42157%0.565SS.*Hα-helixtrans-64.9-44.7174.8-70.7169.1000110.7F427 I428 L433 A434 L435F427-I431 HydrophobicContact CD1-CD1 3.73Å; F427-I431 HydrophobicContact CE1-CD1 3.65Å; F427-I431 WeakPolarHBondContact O-CG1 3.49Å; F427-I431 PolarHBondContact O-N 3.11Å; I428-I431 PolarHBondContact O-N 3.37Å; I428-I431 VanDerWaalsContact O-N 3.14Å; I431-L433 PolarHBondContact O-N 2.97Å; I431-A434 PolarHBondContact O-N 3.24Å; I431-L435 HydrophobicContact CG2-CD1 4.07Å; I431-L435 WeakPolarHBondContact O-CG 3.47Å; I431-L435 PolarHBondContact O-N 3.43Å
432S40.5Very low39.8Very low66 Ų66105.6 Ų105.646%0.46258%0.583SS.*Hα-helixtrans-61.6-42.6175.7-63.80000112.1I428 L435 F436I428-S432 PolarHBondContact O-N 3.07Å; I428-S432 PolarHBondContact O-OG 3.3Å; S432-L435 PolarHBondContact O-N 2.86Å; S432-F436 PolarHBondContact O-N 3.36Å
433L39.9Very low39.2Very low88 Ų88109 Ų10946%0.46159%0.594SS.*Hα-helixtrans-67-40.4177.3-168.868.8000112F429 N430 I431 L435 F436 I437F429-L433 VanDerWaalsContact O-CB 3.3Å; F429-L433 WeakPolarHBondContact O-CB 3.31Å; F429-L433 PolarHBondContact O-N 2.92Å; N430-L433 PolarHBondContact O-N 3.48Å; I431-L433 PolarHBondContact O-N 2.97Å; L433-L435 VanDerWaalsContact C-N 3.35Å; L433-L435 PolarHBondContact O-N 3.42Å; L433-F436 PolarHBondContact O-N 2.9Å; L433-I437 HydrophobicContact CG-CD1 4.02Å; L433-I437 WeakPolarHBondContact O-CG1 3.47Å; L433-I437 PolarHBondContact O-N 3.34Å
434A41.3Very low38.5Very low55 Ų55114 Ų11446%0.45561%0.612SS.*Hα-helixtrans-63.8-38.4175.300000112.3N430 I431 C438N430-A434 VanDerWaalsContact O-CB 3.29Å; N430-A434 WeakPolarHBondContact O-CB 3.3Å; N430-A434 PolarHBondContact O-N 2.86Å; I431-A434 PolarHBondContact O-N 3.24Å; A434-C438 WeakPolarHBondContact O-CB 3.34Å; A434-C438 PolarHBondContact O-N 3.07Å; A434-C438 PolarHBondContact O-SG 3.06Å
435L41.8Very low37.8Very low116 Ų116122.2 Ų122.261%0.60763%0.634SS**Hα-helixtrans-67.3-35.3172.8-72.1168.3000112.3I431 S432 L433I431-L435 HydrophobicContact CG2-CD1 4.07Å; I431-L435 WeakPolarHBondContact O-CG 3.47Å; I431-L435 PolarHBondContact O-N 3.43Å; S432-L435 PolarHBondContact O-N 2.86Å; L433-L435 VanDerWaalsContact C-N 3.35Å; L433-L435 PolarHBondContact O-N 3.42Å
436F38.1Very low37Very low177 Ų177124.6 Ų124.678%0.77665%0.646SS**Hα-helixtrans-71.4-31.7177.7-136.1-88.6000113.2S432 L433S432-F436 PolarHBondContact O-N 3.36Å; L433-F436 PolarHBondContact O-N 2.9Å
437I43.6Very low36.2Very low131 Ų131123.7 Ų123.767%0.67265%0.653SS**Hα-helixtrans-78.1-25.5177.5-68.9167.7000111.8L433 H439L433-I437 HydrophobicContact CG-CD1 4.02Å; L433-I437 WeakPolarHBondContact O-CG1 3.47Å; L433-I437 PolarHBondContact O-N 3.34Å; I437-H439 VanDerWaalsContact C-N 3.34Å; I437-H439 PolarHBondContact O-N 3.1Å
438C32.5Very low35.6Very low100 Ų100123.6 Ų123.668%0.67666%0.66SS**THydrogen-bonded Turntrans-83.41.9-178.1-74.20000115.5A434A434-C438 WeakPolarHBondContact O-CB 3.34Å; A434-C438 PolarHBondContact O-N 3.07Å; A434-C438 PolarHBondContact O-SG 3.06Å
439H30.8Very low34.7Very low154 Ų154127.5 Ų127.571%0.71368%0.676SS**  trans-125.3107.8173.8-92.3-70000111.6I437I437-H439 VanDerWaalsContact C-N 3.34Å; I437-H439 PolarHBondContact O-N 3.1Å
440P31.8Very low33.9Very low107 Ų107129.3 Ų129.370%0.69569%0.686SS**  trans-70.1138.3164.730.2-32.8000109.6S442P440-S442 PolarHBondContact O-N 3.39Å
441P34.3Very low33.2Very low97 Ų97134.9 Ų134.963%0.6371%0.706SS**  trans-71.7118174.628.4-33.2000110.4F443P441-F443 HydrophobicContact CB-CD2 4.5Å; P441-F443 HydrophobicContact CB-CE2 4.37Å; P441-F443 HydrophobicContact CG-CD2 4.24Å; P441-F443 HydrophobicContact CG-CE2 3.81Å; P441-F443 PolarHBondContact O-N 2.65Å
442S29.1Very low32.2Very low121 Ų121138.2 Ų138.285%0.84672%0.72SS**  trans-67.892.6167.3-61.40000109.5P440 L444P440-S442 PolarHBondContact O-N 3.39Å; S442-L444 PolarHBondContact O-N 2.74Å
443F29.4Very low31.5Very low183 Ų183141.5 Ų141.580%0.80373%0.732SS**  trans-62116.5176.9-86.7-88.1000110.9P441 Y445P441-F443 HydrophobicContact CB-CD2 4.5Å; P441-F443 HydrophobicContact CB-CE2 4.37Å; P441-F443 HydrophobicContact CG-CD2 4.24Å; P441-F443 HydrophobicContact CG-CE2 3.81Å; P441-F443 PolarHBondContact O-N 2.65Å; F443-Y445 PolarHBondContact O-N 2.85Å
444L27.6Very low30.9Very low164 Ų164144.9 Ų144.986%0.85975%0.745SS**  trans-68.7112.7167.7-74.1167000109S442 I446S442-L444 PolarHBondContact O-N 2.74Å; L444-I446 PolarHBondContact O-N 3.28Å
445Y26.4Very low30.2Very low218 Ų218147.6 Ų147.686%0.85575%0.752SS**  trans-79.3107.4169.6-130.3-88.8000108.6F443 S447F443-Y445 PolarHBondContact O-N 2.85Å; Y445-S447 PolarHBondContact O-N 3.49Å
446I27.1Very low29.5Very low147 Ų147150.3 Ų150.375%0.75476%0.759SS**  trans-80116167.1-62.1175.5000106.8L444L444-I446 PolarHBondContact O-N 3.28Å
447S26.2Very low28.9Very low109 Ų109152.6 Ų152.676%0.76276%0.762SS**  trans-85128.8165.7-64.80000109.1Y445Y445-S447 PolarHBondContact O-N 3.49Å
448D27.3Very low28.1Very low143 Ų143151.1 Ų151.177%0.76576%0.763SS**  trans-135.6175.1164.9-143-29.9000110.2
449Q29.4Very low27.8Very low183 Ų183155.3 Ų155.386%0.85577%0.773SS**  trans-73.5169-145.7-72.5179.1-2.700118.7
450Q26.7Very low27.6Very low182 Ų182153.3 Ų153.385%0.8578%0.777SS**  trans-46.4153.5176.7-59.5176.8-27.200114.9
451F26.1Very low27.5Very low209 Ų209153.9 Ų153.992%0.91778%0.778SS**  -144.2174.8129.7-131-92000111.4
452E25.9Very low27.2Very low152 Ų152157 Ų15771%0.7178%0.784SS**  trans-101174.1-150.1-133.2-173.7137.400116.9
453L26.3Very low27Very low135 Ų135157.9 Ų157.971%0.70778%0.779SS**  trans77121.1151.7-74.9161.3000122.6
454H26.5Very low26.9Very low159 Ų159155.5 Ų155.574%0.73678%0.775SS**  trans60.3137.3143.2-105.7-106.9000118.8
455N26.4Very low26.9Very low113 Ų113159 Ų15960%0.60478%0.778SS**  cis-174.8133.847.5-170.228.5000112.4
456K27.9Very low27Very low173 Ų173155.8 Ų155.875%0.75278%0.775SS**  trans42.8114.8150.4-70.4170.8-168.4169.80123
457R25.8Very low27Very low224 Ų224156.7 Ų156.785%0.84578%0.781SS**  77.5105.5112.6-167.1-167.5-163.5173.97.7121.1
458S27.1Very low27Very low100 Ų100156.2 Ų156.270%0.69978%0.777SS**  167.9112.2122.1-71.30000109.6
459Q26.7Very low27Very low188 Ų188156.5 Ų156.588%0.87978%0.777SS**  56.9103.387.5-77.9-170.1-30.500116.1
460S25.7Very low26.9Very low113 Ų113154.6 Ų154.679%0.7977%0.773SS**  -171.1119125.2-163.30000114
461V29.2Very low26.9Very low118 Ų118153.8 Ų153.872%0.71577%0.769SS**  trans41.6115.5143.2-170.80000122
462Q27.7Very low27Very low163 Ų163149.1 Ų149.176%0.76276%0.758SS**  trans18.1142.5131.1-52.1174.9-53.900119.6
463N26.6Very low27Very low140 Ų140150.3 Ų150.375%0.74976%0.761SS**  -163.8169.355.9-117.4-42.2000114.6
464N27.3Very low27Very low133 Ų133153.6 Ų153.671%0.71177%0.765SS**  trans-80.8154.1176.5-61-75.7000113.2
465Y27.1Very low27Very low236 Ų236152 Ų15293%0.92577%0.771SS**  trans-159141.8131.8-101.4-69.1000110.9
466L27.7Very low27.2Very low152 Ų152152.7 Ų152.780%0.79678%0.779SS**  trans-85.2148.3169.1-80.572.8000110.1
467L27.6Very low27Very low166 Ų166155.1 Ų155.187%0.86979%0.785SS**  -156.7151.1120.2-134.274.5000111.5
468S25.6Very low27.3Very low98 Ų98150.5 Ų150.569%0.68578%0.781SS**  trans-105.3149169.8174.90000109.3
469I27.9Very low27.6Very low150 Ų150151 Ų15177%0.76978%0.783SS**  trans-161.7129.4151.6-102146.4000108.6
470N26.8Very low27.9Very low143 Ų143147.5 Ų147.577%0.76579%0.785SS**  trans-84.5147.7164.1-66.2-66.4000108.8
471H27.4Very low28Very low165 Ų165145.6 Ų145.676%0.76478%0.784SS**  trans-155122.9139.4-126.5-76000114.8F473H471-F473 HydrophobicContact CB-CE2 4.47Å
472T26.9Very low28.1Very low111 Ų111146.3 Ų146.368%0.68179%0.788SS**  trans-72.4143.7163.9-46.20000109.6Y474T472-Y474 HydrophobicContact CG2-CD2 4.48Å
473F26.6Very low28.3Very low177 Ų177149.7 Ų149.778%0.77680%0.795SS**  trans-127.1118.8166.7-96.4-84.6000111.6H471H471-F473 HydrophobicContact CB-CE2 4.47Å
474Y27.6Very low28.5Very low204 Ų204150.7 Ų150.780%0.880%0.799SS**  trans-84.1133.5161-83.7-104.1000108.7T472T472-Y474 HydrophobicContact CG2-CD2 4.48Å
475C25.2Very low28.6Very low126 Ų126154.7 Ų154.785%0.85180%0.804SS**  trans-107.190.7167.1-70.60000110.3
476T30.3Very low28.8Very low127 Ų127148.1 Ų148.178%0.77980%0.798SS**  trans-80.5133.1164.740.40000109.9
477Y25.2Very low29.1Very low224 Ų224148.3 Ų148.388%0.87880%0.795SS**  trans-104.3108.8-172.2-165.8-84.4000110.7
478V32Very low29.6Very low126 Ų126150.6 Ų150.676%0.76482%0.817SS**  trans-133.8133.1176.3-177.90000107.9
479P33.6Very low29.8Very low112 Ų112153.3 Ų153.373%0.72782%0.823SS**  trans-75.7154.1-164.729.6-36.4000114.2
480A31.1Very low29.9Very low113 Ų113153.4 Ų153.493%0.93483%0.826SS**  trans-74.4143.2-178.200000113.5
481G29Very low30.1Very low73 Ų73154 Ų15475%0.75383%0.829SS**  trans16292166.400000114.9
482V31.1Very low30.2Very low133 Ų133153.4 Ų153.481%0.80683%0.833SS**  trans169.2135.1140.8149.70000109.5I484V482-I484 HydrophobicContact CG1-CG1 4.25Å
483Y31.4Very low30.4Very low234 Ų234156 Ų15692%0.91884%0.843SS**  trans-82.9128.6170-104-105.6000110.4
484I30.7Very low30.7Very low162 Ų162154.6 Ų154.683%0.83185%0.847SS**  trans-135.7151.1152-65.8-171.3000109.1V482V482-I484 HydrophobicContact CG1-CG1 4.25Å
485R30.9Very low30.9Very low217 Ų217151.1 Ų151.182%0.81985%0.851SS**  trans-117.2125-166.7171.1-166.5-171.8177.23.7110.7
486A30.2Very low31.3Very low97 Ų97153 Ų15380%0.80285%0.851SS**  trans-144.5126157.200000105.7
487Q33.8Very low31.4Very low156 Ų156155.2 Ų155.273%0.72986%0.857SS**  cis81.7116.827.9-156.9169.6800113
488T38.3Very low32Very low215 Ų215148.9 Ų148.9100%1.31986%0.855SS**  trans52.30-167.858.50000114.4

Retrieved 488 of 488 residues in 210.1 ms (Link to these results)