A0A087X3P1_POEFO Loading...

Transcription initiation factor TFIID subunit 8

AlphaFold DB , UniProt , Accession A0A087X3P1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 306 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
1M35.3Very low29.9Very low253 Ų253121.8 Ų121.8100%1.24685%0.845SS**  0131.80-87.6-179166.300107.8
2G33.2Very low29.8Very low84 Ų84125.8 Ų125.887%0.86685%0.849SS**  trans102.1107.7158.700000115.2
3D27.9Very low29.6Very low158 Ų158127.2 Ų127.285%0.84584%0.843SS**  trans-84.2168.8-172.5-145.5-35.9000114.2
4S30.3Very low29.5Very low90 Ų90126.3 Ų126.363%0.62984%0.84SS**  trans92.9104138.9-63.20000123.3
5S30.6Very low29.6Very low115 Ų115124.5 Ų124.580%0.80483%0.83SS**  59.7124.3119.867.30000123.1
6A29.7Very low29.6Very low109 Ų109121.2 Ų121.290%0.90182%0.824SS**  -165.8142.1126.700000112.2
7A29.2Very low29.9Very low104 Ų104128.9 Ų128.986%0.8683%0.832SS**  trans-67139.2-163.700000117.1
8S29.7Very low30Very low107 Ų107125.3 Ų125.375%0.74882%0.822SS**  trans-93.1104.5159.455.10000109.9T10S8-T10 PolarHBondContact O-N 3.47Å
9G27.7Very low30.4Very low80 Ų80124.1 Ų124.183%0.82582%0.823SS**  trans-68.7109171.400000110.5
10T29.3Very low31Very low122 Ų122127.8 Ų127.875%0.74883%0.825SS**  trans-101.8112.7173.1-41.90000107.6S8 L12S8-T10 PolarHBondContact O-N 3.47Å; T10-L12 PolarHBondContact O-N 2.78Å
11S26.5Very low31.8Very low118 Ų118126 Ų12683%0.82582%0.821SS**  trans-61.6115.2179.8-57.30000110.9N13S11-N13 PolarHBondContact O-N 3.04Å
12L28.3Very low32.3Very low170 Ų170118.9 Ų118.989%0.8980%0.802SS**  trans-72.2115170.8-77.7152.8000109.1T10 S14T10-L12 PolarHBondContact O-N 2.78Å; L12-S14 PolarHBondContact O-N 3.07Å
13N27.8Very low33.6Very low144 Ų144117 Ų11777%0.7778%0.777SS**  trans-69.194.5172.2-169.433.5000109.5S11 S15S11-N13 PolarHBondContact O-N 3.04Å; N13-S15 VanDerWaalsContact C-N 3.32Å; N13-S15 PolarHBondContact O-N 2.89Å
14S27.3Very low35.7Very low114 Ų114111.9 Ų111.980%0.79775%0.753SS**  trans-7681.2174.160.10000110.4L12 G16L12-S14 PolarHBondContact O-N 3.07Å; S14-G16 PolarHBondContact O-N 3.37Å
15S32Very low37.6Very low100 Ų100111.4 Ų111.470%0.69975%0.748SS**  trans-78.467.4165.2-63.80000109.7N13 R17N13-S15 VanDerWaalsContact C-N 3.32Å; N13-S15 PolarHBondContact O-N 2.89Å; S15-R17 PolarHBondContact O-N 2.85Å
16G28.6Very low39.5Very low71 Ų71108.5 Ų108.573%0.73273%0.73SS**  trans-75.199.7168.800000109.5S14 G18S14-G16 PolarHBondContact O-N 3.37Å; G16-G18 PolarHBondContact O-N 3.02Å
17R35.8Very low41.6Very low253 Ų253108.3 Ų108.396%0.95571%0.711SS**  trans-70.681.1158.6-90.3-179169175.1-3.3107.5S15 A19S15-R17 PolarHBondContact O-N 2.85Å; R17-A19 PolarHBondContact O-N 3.45Å
18G30.4Very low43.9Very low63 Ų63107 Ų10765%0.64969%0.69SS**  trans-62.2115.6163.900000108.2G16 K20G16-G18 PolarHBondContact O-N 3.02Å; G18-K20 PolarHBondContact O-N 2.76Å
19A38.8Very low46.2Very low103 Ų103105 Ų10585%0.85167%0.666SS**  trans-56.7105.9160.900000106.2R17 A21R17-A19 PolarHBondContact O-N 3.45Å; A19-A21 PolarHBondContact O-N 2.87Å; A19-A21 VanDerWaalsContact O-N 3.11Å
20K42.2Very low48.7Very low198 Ų198107 Ų10786%0.86165%0.654SS**  trans-59.9119.1175.9-71.8-178.6177.6175.50106.1G18 A22G18-K20 PolarHBondContact O-N 2.76Å; K20-A22 PolarHBondContact O-N 3.42Å; K20-A22 VanDerWaalsContact O-N 3.15Å
21A47.3Very low51.3Low89 Ų89104.8 Ų104.874%0.73664%0.637SS**  trans-39.3126.4161.800000107.3A19 S23A19-A21 PolarHBondContact O-N 2.87Å; A19-A21 VanDerWaalsContact O-N 3.11Å; A21-S23 PolarHBondContact O-N 3.2Å
22A46.8Very low54Low104 Ų104101.5 Ų101.586%0.8662%0.617SS**  trans-63.188.7-178.900000107.6K20 S24K20-A22 PolarHBondContact O-N 3.42Å; K20-A22 VanDerWaalsContact O-N 3.15Å; A22-S24 PolarHBondContact O-N 3.02Å
23S60.7Low56.8Low46 Ų46100.7 Ų100.732%0.32260%0.602SS.*  trans-56.6131-179.155.20000107.4A21 E27 N28A21-S23 PolarHBondContact O-N 3.2Å; S23-E27 VanDerWaalsContact CA-OE2 3.28Å; S23-E27 WeakPolarHBondContact CA-OE2 3.3Å; S23-N28 PolarHBondContact O-ND2 3.23Å; S23-N28 VanDerWaalsContact O-ND2 3.13Å; S23-N28 PolarHBondContact OG-ND2 2.86Å; S23-N28 PolarHBondContact OG-OD1 3.35Å
24S71Confident59.7Low49 Ų4996.5 Ų96.534%0.34358%0.575SS.*  trans-54.5150.5-177.972.30000109.7A22 A26 E27 N28A22-S24 PolarHBondContact O-N 3.02Å; S24-A26 PolarHBondContact O-N 3.34Å; S24-E27 PolarHBondContact N-OE2 2.89Å; S24-E27 PolarHBondContact O-N 3.38Å; S24-E27 WeakPolarHBondContact OG-CG 3.33Å; S24-E27 PolarHBondContact OG-N 2.97Å; S24-E27 VanDerWaalsContact OG-N 3.13Å; S24-N28 PolarHBondContact O-N 3.14Å; S24-N28 VanDerWaalsContact O-N 3.07Å
25P69.8Low62.7Low81 Ų8198.2 Ų98.253%0.52656%0.564SS.*Hα-helixtrans-50.5-34.8174.7-28.335.3000112.2N28 Y29P25-N28 PolarHBondContact O-N 3.15Å; P25-Y29 HydrophobicContact CB-CE2 4.14Å; P25-Y29 WeakPolarHBondContact O-CD2 3.13Å; P25-Y29 VanDerWaalsContact O-CE2 3.3Å; P25-Y29 WeakPolarHBondContact O-CE2 3.49Å; P25-Y29 PolarHBondContact O-N 3.22Å; P25-Y29 VanDerWaalsContact O-N 3.13Å
26A71.1Confident65.4Low53 Ų5395 Ų9544%0.43854%0.541SS..Hα-helixtrans-64.2-45.3175.800000113.6S24 N28 Y29 Q30S24-A26 PolarHBondContact O-N 3.34Å; A26-N28 VanDerWaalsContact C-N 3.33Å; A26-N28 PolarHBondContact O-N 2.72Å; A26-Y29 PolarHBondContact O-N 3.23Å; A26-Q30 WeakPolarHBondContact O-CG 3.33Å; A26-Q30 PolarHBondContact O-N 2.99Å
27E73.6Confident68.4Low105 Ų10593.8 Ų93.849%0.49152%0.517SS..Hα-helixtrans-63.3-40.7176.7-75.2172.1159.400111.7S23 S24 Y29 Q30 L31S23-E27 VanDerWaalsContact CA-OE2 3.28Å; S23-E27 WeakPolarHBondContact CA-OE2 3.3Å; S24-E27 PolarHBondContact N-OE2 2.89Å; S24-E27 PolarHBondContact O-N 3.38Å; S24-E27 WeakPolarHBondContact OG-CG 3.33Å; S24-E27 PolarHBondContact OG-N 2.97Å; S24-E27 VanDerWaalsContact OG-N 3.13Å; E27-Y29 VanDerWaalsContact C-N 3.28Å; E27-Y29 PolarHBondContact O-N 3.35Å; E27-Q30 PolarHBondContact O-N 3.39Å; E27-L31 WeakPolarHBondContact O-CB 3.41Å; E27-L31 PolarHBondContact O-N 3.46Å
28N77.6Confident71.1Confident78 Ų7883.9 Ų83.942%0.41748%0.482SS..Hα-helixtrans-58.3-41.6174.2-81.5-46.3000111.8S23 S24 P25 A26 A32S23-N28 PolarHBondContact O-ND2 3.23Å; S23-N28 VanDerWaalsContact O-ND2 3.13Å; S23-N28 PolarHBondContact OG-ND2 2.86Å; S23-N28 PolarHBondContact OG-OD1 3.35Å; S24-N28 PolarHBondContact O-N 3.14Å; S24-N28 VanDerWaalsContact O-N 3.07Å; P25-N28 PolarHBondContact O-N 3.15Å; A26-N28 VanDerWaalsContact C-N 3.33Å; A26-N28 PolarHBondContact O-N 2.72Å; N28-A32 WeakPolarHBondContact O-CB 3.48Å; N28-A32 PolarHBondContact O-N 3.4Å
29Y77.6Confident74Confident65 Ų6584.8 Ų84.826%0.25547%0.474SS..Hα-helixtrans-68.2-40.6176.8-59.4-38000113P25 A26 E27 A32 R33 T125P25-Y29 HydrophobicContact CB-CE2 4.14Å; P25-Y29 WeakPolarHBondContact O-CD2 3.13Å; P25-Y29 VanDerWaalsContact O-CE2 3.3Å; P25-Y29 WeakPolarHBondContact O-CE2 3.49Å; P25-Y29 PolarHBondContact O-N 3.22Å; P25-Y29 VanDerWaalsContact O-N 3.13Å; A26-Y29 PolarHBondContact O-N 3.23Å; E27-Y29 VanDerWaalsContact C-N 3.28Å; E27-Y29 PolarHBondContact O-N 3.35Å; Y29-A32 PolarHBondContact O-N 2.88Å; Y29-R33 PolarHBondContact O-N 3.46Å; Y29-R33 VanDerWaalsContact O-N 3.12Å; Y29-T125 HydrophobicContact CD1-CG2 3.38Å; Y29-T125 HydrophobicContact CE1-CG2 3.01Å
30Q81.3Confident76.5Confident121 Ų12181.4 Ų81.457%0.56544%0.443SS*.Hα-helixtrans-62.7-45.2175.9-70.2177.87.900111A26 E27 A32 R33 R34A26-Q30 WeakPolarHBondContact O-CG 3.33Å; A26-Q30 PolarHBondContact O-N 2.99Å; E27-Q30 PolarHBondContact O-N 3.39Å; Q30-A32 VanDerWaalsContact C-N 3.35Å; Q30-A32 PolarHBondContact O-N 3.31Å; Q30-R33 PolarHBondContact O-N 3.37Å; Q30-R34 PolarHBondContact O-N 3.4Å
31L83.3Confident78.9Confident76 Ų7672.4 Ų72.440%0.39841%0.405SS..Hα-helixtrans-65.3-37.1178.6-170.762.6000112.2E27 R34 R35E27-L31 WeakPolarHBondContact O-CB 3.41Å; E27-L31 PolarHBondContact O-N 3.46Å; L31-R34 PolarHBondContact O-N 3.14Å; L31-R35 WeakPolarHBondContact O-CG 3.26Å; L31-R35 PolarHBondContact O-N 2.98Å
32A83.8Confident81Confident48 Ų4870.7 Ų70.740%0.39739%0.387SS..Hα-helixtrans-63.5-43.7175.300000112.4N28 Y29 Q30 R35 T36N28-A32 WeakPolarHBondContact O-CB 3.48Å; N28-A32 PolarHBondContact O-N 3.4Å; Y29-A32 PolarHBondContact O-N 2.88Å; Q30-A32 VanDerWaalsContact C-N 3.35Å; Q30-A32 PolarHBondContact O-N 3.31Å; A32-R35 PolarHBondContact O-N 2.88Å; A32-T36 PolarHBondContact O-N 3.06Å; A32-T36 PolarHBondContact O-OG1 3.36Å
33R85.9Confident83.1Confident154 Ų15466.3 Ų66.358%0.58135%0.351SS*.Hα-helixtrans-63.2-43174.7-73.3-172.8-70.7-105.11.3111.7Y29 Q30 R35 T36 L37Y29-R33 PolarHBondContact O-N 3.46Å; Y29-R33 VanDerWaalsContact O-N 3.12Å; Q30-R33 PolarHBondContact O-N 3.37Å; R33-R35 PolarHBondContact O-N 2.92Å; R33-T36 VanDerWaalsContact O-CB 3.29Å; R33-T36 WeakPolarHBondContact O-CB 3.49Å; R33-T36 PolarHBondContact O-N 2.99Å; R33-T36 VanDerWaalsContact O-N 3.12Å; R33-L37 PolarHBondContact O-N 3.29Å; R33-L37 VanDerWaalsContact O-N 3.09Å
34R89.8Confident84.6Confident55 Ų5567 Ų6721%0.20835%0.351CS..Hα-helixtrans-57.3-47.3174177.4-17917977.4-10.4112.1Q30 L31 T36 L37 Q38 E63Q30-R34 PolarHBondContact O-N 3.4Å; L31-R34 PolarHBondContact O-N 3.14Å; R34-T36 PolarHBondContact O-N 3.47Å; R34-L37 WeakPolarHBondContact O-CB 2.99Å; R34-L37 PolarHBondContact O-N 3.23Å; R34-L37 VanDerWaalsContact O-N 3.09Å; R34-Q38 PolarHBondContact O-N 3.13Å; R34-E63 IonicContact CZ-OE1 2.63Å; R34-E63 IonicContact NH1-OE1 2.84Å; R34-E63 PolarHBondContact NH1-OE1 3.38Å; R34-E63 IonicContact NH2-OE1 3.72Å; R34-E63 PolarHBondContact NH2-OE1 3.43Å
35R88.6Confident85.6Confident150 Ų15066.3 Ų66.357%0.56634%0.343SS*.Hα-helixtrans-59.8-35.6176.5-74.1176.4-176.9172.33.8112.1L31 A32 R33 Q38 V39L31-R35 WeakPolarHBondContact O-CG 3.26Å; L31-R35 PolarHBondContact O-N 2.98Å; A32-R35 PolarHBondContact O-N 2.88Å; R33-R35 PolarHBondContact O-N 2.92Å; R35-Q38 WeakPolarHBondContact O-CB 3.4Å; R35-Q38 PolarHBondContact O-N 2.74Å; R35-V39 WeakPolarHBondContact O-CG2 3.3Å; R35-V39 PolarHBondContact O-N 3.43Å
36T89.4Confident86.5Confident34 Ų3466.3 Ų66.321%0.20934%0.342CS..Hα-helixtrans-63.1-42.8174.9-51.10000111.1A32 R33 R34 Q38 V39 V40 P122A32-T36 PolarHBondContact O-N 3.06Å; A32-T36 PolarHBondContact O-OG1 3.36Å; R33-T36 VanDerWaalsContact O-CB 3.29Å; R33-T36 WeakPolarHBondContact O-CB 3.49Å; R33-T36 PolarHBondContact O-N 2.99Å; R33-T36 VanDerWaalsContact O-N 3.12Å; R34-T36 PolarHBondContact O-N 3.47Å; T36-Q38 VanDerWaalsContact C-N 3.33Å; T36-Q38 PolarHBondContact O-N 3.24Å; T36-V39 WeakPolarHBondContact O-CB 3.31Å; T36-V39 PolarHBondContact O-N 3.45Å; T36-V40 VanDerWaalsContact O-CG2 3.26Å; T36-V40 WeakPolarHBondContact O-CG2 3.46Å; T36-V40 PolarHBondContact O-N 2.96Å; T36-P122 HydrophobicContact CG2-CB 4.38Å; T36-P122 HydrophobicContact CG2-CG 4.26Å
37L91.3Very high87.4Confident44 Ų4466.3 Ų66.323%0.2333%0.333CS..Hα-helixtrans-63.2-37.9173.9-63.6175.3000112R33 R34 V39 V40 V41 T62 M65 Q66 I69R33-L37 PolarHBondContact O-N 3.29Å; R33-L37 VanDerWaalsContact O-N 3.09Å; R34-L37 WeakPolarHBondContact O-CB 2.99Å; R34-L37 PolarHBondContact O-N 3.23Å; R34-L37 VanDerWaalsContact O-N 3.09Å; L37-V39 VanDerWaalsContact C-N 3.33Å; L37-V39 PolarHBondContact O-N 2.98Å; L37-V40 WeakPolarHBondContact O-CB 3.49Å; L37-V40 PolarHBondContact O-N 2.94Å; L37-V40 VanDerWaalsContact O-N 3.16Å; L37-V41 WeakPolarHBondContact O-CG2 3.41Å; L37-V41 PolarHBondContact O-N 2.88Å; L37-T62 HydrophobicContact CB-CG2 3.69Å; L37-M65 HydrophobicContact CB-CE 3.78Å; L37-M65 HydrophobicContact CD2-CE 3.55Å; L37-M65 HydrophobicContact CG-CE 4.2Å; L37-Q66 HydrophobicContact CD1-CB 4.02Å; L37-I69 HydrophobicContact CD2-CD1 4.5Å
38Q92.5Very high88.1Confident46 Ų4665.4 Ų65.422%0.21534%0.338CS..Hα-helixtrans-62.2-39.3174.1-67.2176.6-26.900112.3R34 R35 T36 V40 V41 S42 T62R34-Q38 PolarHBondContact O-N 3.13Å; R35-Q38 WeakPolarHBondContact O-CB 3.4Å; R35-Q38 PolarHBondContact O-N 2.74Å; T36-Q38 VanDerWaalsContact C-N 3.33Å; T36-Q38 PolarHBondContact O-N 3.24Å; Q38-V40 VanDerWaalsContact C-N 3.32Å; Q38-V41 PolarHBondContact O-N 3.36Å; Q38-S42 WeakPolarHBondContact O-CB 3.25Å; Q38-S42 PolarHBondContact O-N 2.92Å; Q38-S42 PolarHBondContact O-OG 3.02Å; Q38-T62 HydrophobicContact CG-CG2 3.77Å; Q38-T62 WeakPolarHBondContact CG-OG1 3.41Å
39V91.3Very high88.8Confident82 Ų8264.8 Ų64.850%0.49735%0.35SS..Hα-helixtrans-62.6-41.1173.6172.30000110.6R35 T36 L37 S42 A43 I119R35-V39 WeakPolarHBondContact O-CG2 3.3Å; R35-V39 PolarHBondContact O-N 3.43Å; T36-V39 WeakPolarHBondContact O-CB 3.31Å; T36-V39 PolarHBondContact O-N 3.45Å; L37-V39 VanDerWaalsContact C-N 3.33Å; L37-V39 PolarHBondContact O-N 2.98Å; V39-S42 PolarHBondContact O-N 2.99Å; V39-A43 WeakPolarHBondContact O-CB 3.4Å; V39-A43 PolarHBondContact O-N 3.31Å; V39-I119 HydrophobicContact CG1-CG2 4.41Å
40V91.4Very high89.5Confident31 Ų3167.7 Ų67.719%0.18837%0.365CS..Hα-helixtrans-61.3-49175.9175.90000111T36 L37 Q38 S42 A43 L44 M65 I119T36-V40 VanDerWaalsContact O-CG2 3.26Å; T36-V40 WeakPolarHBondContact O-CG2 3.46Å; T36-V40 PolarHBondContact O-N 2.96Å; L37-V40 WeakPolarHBondContact O-CB 3.49Å; L37-V40 PolarHBondContact O-N 2.94Å; L37-V40 VanDerWaalsContact O-N 3.16Å; Q38-V40 VanDerWaalsContact C-N 3.32Å; V40-S42 VanDerWaalsContact C-N 3.32Å; V40-S42 PolarHBondContact O-N 3.39Å; V40-A43 WeakPolarHBondContact O-CB 3.31Å; V40-A43 PolarHBondContact O-N 2.96Å; V40-L44 HydrophobicContact CG1-CD1 4.35Å; V40-L44 WeakPolarHBondContact O-CG 3.27Å; V40-L44 PolarHBondContact O-N 3.21Å; V40-M65 HydrophobicContact CB-CE 4.05Å; V40-M65 HydrophobicContact CG1-CE 3.95Å; V40-M65 HydrophobicContact CG1-SD 4.3Å; V40-I119 HydrophobicContact CB-CD1 3.97Å; V40-I119 HydrophobicContact CG1-CD1 3.92Å; V40-I119 HydrophobicContact CG2-CD1 3.52Å; V40-I119 HydrophobicContact CG2-CG1 4.41Å; V40-I119 HydrophobicContact CG2-CG2 4.14Å
41V93.4Very high90.1Very high10 Ų1071.4 Ų71.46%0.06138%0.382CS..Hα-helixtrans-59.6-44.9177.6173.60000110.7L37 Q38 A43 L44 L45 V58 L61 M65L37-V41 WeakPolarHBondContact O-CG2 3.41Å; L37-V41 PolarHBondContact O-N 2.88Å; Q38-V41 PolarHBondContact O-N 3.36Å; V41-A43 VanDerWaalsContact C-N 3.33Å; V41-A43 PolarHBondContact O-N 2.79Å; V41-L44 PolarHBondContact O-N 3.43Å; V41-L45 HydrophobicContact CG1-CD1 4.14Å; V41-L45 HydrophobicContact CG1-CG 4.48Å; V41-L45 WeakPolarHBondContact O-CG 3.42Å; V41-L45 PolarHBondContact O-N 3.34Å; V41-V58 HydrophobicContact CG1-CG1 4.21Å; V41-L61 HydrophobicContact CG1-CB 4.07Å; V41-L61 HydrophobicContact CG1-CD1 4.46Å; V41-M65 HydrophobicContact CG2-CE 3.88Å; V41-M65 HydrophobicContact CG2-SD 3.84Å
42S91.6Very high90.6Very high52 Ų5272.8 Ų72.836%0.36440%0.398SS..Hα-helixtrans-63.5-38.3178.9-55.30000112.2Q38 V39 V40 L45 T46Q38-S42 WeakPolarHBondContact O-CB 3.25Å; Q38-S42 PolarHBondContact O-N 2.92Å; Q38-S42 PolarHBondContact O-OG 3.02Å; V39-S42 PolarHBondContact O-N 2.99Å; V40-S42 VanDerWaalsContact C-N 3.32Å; V40-S42 PolarHBondContact O-N 3.39Å; S42-L45 PolarHBondContact O-N 2.86Å; S42-T46 WeakPolarHBondContact O-CB 3.29Å; S42-T46 PolarHBondContact O-N 3.16Å; S42-T46 PolarHBondContact O-OG1 3.18Å
43A90.5Very high91.1Very high13 Ų1373.5 Ų73.511%0.10740%0.403CS..Hα-helixtrans-64.4-41175.100000111.9V39 V40 V41 T46 E47 M117V39-A43 WeakPolarHBondContact O-CB 3.4Å; V39-A43 PolarHBondContact O-N 3.31Å; V40-A43 WeakPolarHBondContact O-CB 3.31Å; V40-A43 PolarHBondContact O-N 2.96Å; V41-A43 VanDerWaalsContact C-N 3.33Å; V41-A43 PolarHBondContact O-N 2.79Å; A43-T46 PolarHBondContact O-N 3.16Å; A43-E47 WeakPolarHBondContact O-CB 3.38Å; A43-E47 PolarHBondContact O-N 2.94Å; A43-M117 HydrophobicContact CB-CB 4.05Å; A43-M117 HydrophobicContact CB-SD 4.06Å
44L91.1Very high91.7Very high60 Ų6073 Ų7331%0.31441%0.408SS..Hα-helixtrans-66.7-37.9175.6-67.6173.9000112.5V40 V41 E47 S48V40-L44 HydrophobicContact CG1-CD1 4.35Å; V40-L44 WeakPolarHBondContact O-CG 3.27Å; V40-L44 PolarHBondContact O-N 3.21Å; V41-L44 PolarHBondContact O-N 3.43Å; L44-E47 PolarHBondContact O-N 3Å; L44-S48 WeakPolarHBondContact O-CB 3.23Å; L44-S48 PolarHBondContact O-N 3.47Å; L44-S48 PolarHBondContact O-OG 3.36Å
45L91.9Very high91.9Very high35 Ų3577.9 Ų77.918%0.18343%0.43CS..Hα-helixtrans-66.5-40.7174.4-69.7173.6000111.6V41 S42 S48 G49 F50 A53 V58V41-L45 HydrophobicContact CG1-CD1 4.14Å; V41-L45 HydrophobicContact CG1-CG 4.48Å; V41-L45 WeakPolarHBondContact O-CG 3.42Å; V41-L45 PolarHBondContact O-N 3.34Å; S42-L45 PolarHBondContact O-N 2.86Å; L45-S48 CarbonylContact O-C 3.59Å; L45-S48 WeakPolarHBondContact O-CB 3.42Å; L45-S48 PolarHBondContact O-N 3.4Å; L45-S48 VanDerWaalsContact O-N 3.15Å; L45-G49 PolarHBondContact O-N 3.42Å; L45-F50 HydrophobicContact CB-CB 4.43Å; L45-F50 HydrophobicContact CB-CD2 4.27Å; L45-F50 HydrophobicContact CD2-CD2 3.78Å; L45-F50 HydrophobicContact CD2-CE2 4.06Å; L45-F50 HydrophobicContact CD2-CG 4.49Å; L45-F50 WeakPolarHBondContact O-CD2 3.15Å; L45-F50 PolarHBondContact O-N 2.91Å; L45-F50 VanDerWaalsContact O-N 3.1Å; L45-A53 HydrophobicContact CD1-CB 4.29Å; L45-V58 HydrophobicContact CD1-CG2 4.01Å
46T90.2Very high92.2Very high81 Ų8173 Ų7350%0.49742%0.422SS..Hα-helixtrans-63.9-43.1176.6-55.90000110.9S42 A43 S48 G49 M117S42-T46 WeakPolarHBondContact O-CB 3.29Å; S42-T46 PolarHBondContact O-N 3.16Å; S42-T46 PolarHBondContact O-OG1 3.18Å; A43-T46 PolarHBondContact O-N 3.16Å; T46-S48 VanDerWaalsContact C-N 3.25Å; T46-S48 PolarHBondContact O-N 2.9Å; T46-G49 PolarHBondContact O-N 3.28Å; T46-M117 HydrophobicContact CG2-CE 4.46Å; T46-M117 HydrophobicContact CG2-SD 3.79Å
47E88.7Confident92.5Very high52 Ų5273.5 Ų73.524%0.24343%0.43CS..Hα-helixtrans-62.1-33.6173.6175.7173.2-163.100112.8A43 L44 G49 R113 Q115A43-E47 WeakPolarHBondContact O-CB 3.38Å; A43-E47 PolarHBondContact O-N 2.94Å; L44-E47 PolarHBondContact O-N 3Å; E47-G49 PolarHBondContact O-N 3.46Å; E47-R113 WeakPolarHBondContact OE1-CD 3.49Å; E47-R113 IonicContact OE1-CZ 2.83Å; E47-R113 IonicContact OE1-NE 2.74Å; E47-R113 IonicContact OE1-NH1 2.59Å; E47-R113 PolarHBondContact OE1-NH1 2.96Å; E47-R113 IonicContact OE2-CZ 3.35Å; E47-R113 IonicContact OE2-NH1 3.65Å; E47-R113 PolarHBondContact OE2-NH1 3.46Å; E47-R113 IonicContact OE2-NH2 2.64Å; E47-R113 PolarHBondContact OE2-NH2 3.43Å; E47-Q115 VanDerWaalsContact CD-O 3.31Å; E47-Q115 HydrophobicContact CG-CB 3.82Å
48S89.4Confident92.7Very high86 Ų8672.4 Ų72.460%0.60143%0.425SS*.THydrogen-bonded Turntrans-75.1-6.9175.7-54.70000113.1L44 L45 T46L44-S48 WeakPolarHBondContact O-CB 3.23Å; L44-S48 PolarHBondContact O-N 3.47Å; L44-S48 PolarHBondContact O-OG 3.36Å; L45-S48 CarbonylContact O-C 3.59Å; L45-S48 WeakPolarHBondContact O-CB 3.42Å; L45-S48 PolarHBondContact O-N 3.4Å; L45-S48 VanDerWaalsContact O-N 3.15Å; T46-S48 VanDerWaalsContact C-N 3.25Å; T46-S48 PolarHBondContact O-N 2.9Å
49G91.1Very high92.8Very high66 Ų6673.6 Ų73.668%0.6843%0.43SS*.THydrogen-bonded Turntrans89.216.1177.100000115.3L45 T46 E47L45-G49 PolarHBondContact O-N 3.42Å; T46-G49 PolarHBondContact O-N 3.28Å; E47-G49 PolarHBondContact O-N 3.46Å
50F93.8Very high93.1Very high126 Ų12673.5 Ų73.555%0.55343%0.43SS*.  trans-77.1125174.7-67.6-81.3000111L45L45-F50 HydrophobicContact CB-CB 4.43Å; L45-F50 HydrophobicContact CB-CD2 4.27Å; L45-F50 HydrophobicContact CD2-CD2 3.78Å; L45-F50 HydrophobicContact CD2-CE2 4.06Å; L45-F50 HydrophobicContact CD2-CG 4.49Å; L45-F50 WeakPolarHBondContact O-CD2 3.15Å; L45-F50 PolarHBondContact O-N 2.91Å; L45-F50 VanDerWaalsContact O-N 3.1Å
51E93.8Very high93.3Very high199 Ų19975.6 Ų75.693%0.9344%0.44SS*.SBendtrans-82.6-33.3176.3-174.1174.8-175.800112.6
52S93.7Very high93.4Very high105 Ų10575.1 Ų75.173%0.73444%0.437SS*.  trans-142.7147.3-178.965.90000111.3
53A94.7Very high93.6Very high62 Ų6276.1 Ų76.151%0.51244%0.436SS..  trans-140.714917500000110.7L45 V58L45-A53 HydrophobicContact CD1-CB 4.29Å; A53-V58 HydrophobicContact CB-CG2 3.74Å
54E96.6Very high93.9Very high143 Ų14381.2 Ų81.267%0.66846%0.459SS*.  trans-69.3132172.8-173.5-178.4170.300110.3A56 A57 V58E54-A56 VanDerWaalsContact C-N 3.32Å; E54-A56 HydrophobicContact CG-CB 4.4Å; E54-A56 PolarHBondContact O-N 2.9Å; E54-A57 HydrophobicContact CB-CB 4.15Å; E54-A57 PolarHBondContact O-N 3.23Å; E54-A57 VanDerWaalsContact O-N 3.16Å; E54-V58 PolarHBondContact O-N 2.97Å; E54-V58 VanDerWaalsContact O-N 3.09Å
55K94.2Very high94.1Very high158 Ų15880.4 Ų80.469%0.68745%0.454SS*.Hα-helixtrans-58.2-43.1-177.5-173.1-175.1175.2-158.80112.5A57 V58 E59K55-A57 VanDerWaalsContact C-N 3.34Å; K55-A57 PolarHBondContact O-N 3.03Å; K55-V58 PolarHBondContact O-N 3.16Å; K55-E59 WeakPolarHBondContact CE-OE1 3.18Å; K55-E59 IonicContact NZ-OE1 3.8Å; K55-E59 WeakPolarHBondContact O-CG 3.5Å; K55-E59 PolarHBondContact O-N 3.49Å
56A95.6Very high94.2Very high48 Ų4881.7 Ų81.740%0.39746%0.459SS..Hα-helixtrans-62-42.1178.900000111.5E54 V58 E59 T60E54-A56 VanDerWaalsContact C-N 3.32Å; E54-A56 HydrophobicContact CG-CB 4.4Å; E54-A56 PolarHBondContact O-N 2.9Å; A56-V58 PolarHBondContact O-N 3.09Å; A56-E59 PolarHBondContact O-N 3Å; A56-T60 PolarHBondContact O-N 3.05Å; A56-T60 PolarHBondContact O-OG1 3.1Å; A56-T60 VanDerWaalsContact O-OG1 3.05Å
57A95.8Very high94.5Very high44 Ų4481 Ų8136%0.36446%0.458SS..Hα-helixtrans-63.2-42.1176.900000112.3E54 K55 E59 T60 L61E54-A57 HydrophobicContact CB-CB 4.15Å; E54-A57 PolarHBondContact O-N 3.23Å; E54-A57 VanDerWaalsContact O-N 3.16Å; K55-A57 VanDerWaalsContact C-N 3.34Å; K55-A57 PolarHBondContact O-N 3.03Å; A57-E59 VanDerWaalsContact C-N 3.32Å; A57-E59 PolarHBondContact O-N 3.2Å; A57-T60 PolarHBondContact O-N 3.35Å; A57-L61 WeakPolarHBondContact O-CB 3.27Å; A57-L61 WeakPolarHBondContact O-CG 3.24Å; A57-L61 PolarHBondContact O-N 3.33Å
58V95.6Very high94.9Very high21 Ų2183.5 Ų83.513%0.12747%0.466CS..Hα-helixtrans-63.3-39.5175.6176.70000111.3V41 L45 A53 E54 K55 A56 L61 T62V41-V58 HydrophobicContact CG1-CG1 4.21Å; L45-V58 HydrophobicContact CD1-CG2 4.01Å; A53-V58 HydrophobicContact CB-CG2 3.74Å; E54-V58 PolarHBondContact O-N 2.97Å; E54-V58 VanDerWaalsContact O-N 3.09Å; K55-V58 PolarHBondContact O-N 3.16Å; A56-V58 PolarHBondContact O-N 3.09Å; V58-L61 PolarHBondContact O-N 3.37Å; V58-T62 WeakPolarHBondContact O-CB 3.22Å; V58-T62 PolarHBondContact O-N 3.15Å; V58-T62 PolarHBondContact O-OG1 3.01Å
59E94.6Very high95.2Very high71 Ų7183.8 Ų83.833%0.33246%0.46SS..Hα-helixtrans-63.9-44.8174.8-72.5178.9177.800111.6K55 A56 A57 T62 E63K55-E59 WeakPolarHBondContact CE-OE1 3.18Å; K55-E59 IonicContact NZ-OE1 3.8Å; K55-E59 WeakPolarHBondContact O-CG 3.5Å; K55-E59 PolarHBondContact O-N 3.49Å; A56-E59 PolarHBondContact O-N 3Å; A57-E59 VanDerWaalsContact C-N 3.32Å; A57-E59 PolarHBondContact O-N 3.2Å; E59-T62 WeakPolarHBondContact O-CB 3.42Å; E59-T62 PolarHBondContact O-N 3.39Å; E59-E63 WeakPolarHBondContact O-CG 3.44Å; E59-E63 PolarHBondContact O-N 3.07Å
60T96.6Very high95.4Very high80 Ų8084.1 Ų84.149%0.49145%0.448SS..Hα-helixtrans-63.4-42.8175.3-54.70000112.2A56 A57 T62 E63 M64A56-T60 PolarHBondContact O-N 3.05Å; A56-T60 PolarHBondContact O-OG1 3.1Å; A56-T60 VanDerWaalsContact O-OG1 3.05Å; A57-T60 PolarHBondContact O-N 3.35Å; T60-T62 PolarHBondContact O-N 2.96Å; T60-E63 WeakPolarHBondContact O-CB 3.47Å; T60-E63 PolarHBondContact O-N 2.9Å; T60-E63 VanDerWaalsContact O-N 3.13Å; T60-M64 HydrophobicContact CG2-SD 4.34Å; T60-M64 WeakPolarHBondContact O-CG 3.45Å; T60-M64 PolarHBondContact O-N 2.95Å
61L96.3Very high95.5Very high76 Ų7682 Ų8240%0.39844%0.44SS..Hα-helixtrans-62.7-34.6175.1-73.7173.7000111.8V41 A57 V58 M64 M65V41-L61 HydrophobicContact CG1-CB 4.07Å; V41-L61 HydrophobicContact CG1-CD1 4.46Å; A57-L61 WeakPolarHBondContact O-CB 3.27Å; A57-L61 WeakPolarHBondContact O-CG 3.24Å; A57-L61 PolarHBondContact O-N 3.33Å; V58-L61 PolarHBondContact O-N 3.37Å; L61-M64 HydrophobicContact CD2-SD 4.42Å; L61-M64 PolarHBondContact O-N 3.38Å; L61-M65 WeakPolarHBondContact O-CB 3.41Å; L61-M65 PolarHBondContact O-N 2.92Å
62T95.9Very high95.5Very high0 Ų074.3 Ų74.30%041%0.405CS..Hα-helixtrans-65.3-42.8173.5-54.20000111.2L37 Q38 V58 E59 T60 M65 Q66L37-T62 HydrophobicContact CB-CG2 3.69Å; Q38-T62 HydrophobicContact CG-CG2 3.77Å; Q38-T62 WeakPolarHBondContact CG-OG1 3.41Å; V58-T62 WeakPolarHBondContact O-CB 3.22Å; V58-T62 PolarHBondContact O-N 3.15Å; V58-T62 PolarHBondContact O-OG1 3.01Å; E59-T62 WeakPolarHBondContact O-CB 3.42Å; E59-T62 PolarHBondContact O-N 3.39Å; T60-T62 PolarHBondContact O-N 2.96Å; T62-M65 PolarHBondContact O-N 3.45Å; T62-Q66 WeakPolarHBondContact O-CG 3.47Å; T62-Q66 PolarHBondContact O-N 3.06Å
63E95.6Very high95.6Very high73 Ų7371.3 Ų71.334%0.34139%0.391SS..Hα-helixtrans-59.5-44.6173.2-70.6-65.615500112.2R34 E59 T60 Q66 S67R34-E63 IonicContact CZ-OE1 2.63Å; R34-E63 IonicContact NH1-OE1 2.84Å; R34-E63 PolarHBondContact NH1-OE1 3.38Å; R34-E63 IonicContact NH2-OE1 3.72Å; R34-E63 PolarHBondContact NH2-OE1 3.43Å; E59-E63 WeakPolarHBondContact O-CG 3.44Å; E59-E63 PolarHBondContact O-N 3.07Å; T60-E63 WeakPolarHBondContact O-CB 3.47Å; T60-E63 PolarHBondContact O-N 2.9Å; T60-E63 VanDerWaalsContact O-N 3.13Å; E63-Q66 WeakPolarHBondContact O-CG 3.48Å; E63-Q66 PolarHBondContact OE2-NE2 3.11Å; E63-S67 WeakPolarHBondContact O-CB 3.19Å; E63-S67 PolarHBondContact O-N 3.24Å; E63-S67 PolarHBondContact O-OG 3.15Å
64M96.7Very high95.5Very high119 Ų11975.8 Ų75.859%0.58640%0.395SS*.Hα-helixtrans-65.1-42.2177.1-68.5177.471.100111.2T60 L61 S67 Y68T60-M64 HydrophobicContact CG2-SD 4.34Å; T60-M64 WeakPolarHBondContact O-CG 3.45Å; T60-M64 PolarHBondContact O-N 2.95Å; L61-M64 HydrophobicContact CD2-SD 4.42Å; L61-M64 PolarHBondContact O-N 3.38Å; M64-S67 PolarHBondContact O-N 2.93Å; M64-Y68 WeakPolarHBondContact O-CB 3.38Å; M64-Y68 PolarHBondContact O-N 2.78Å
65M95.1Very high95.4Very high43 Ų4370.5 Ų70.521%0.21237%0.373CS..Hα-helixtrans-63.4-44.6178.7-171170.885.300111.9L37 V40 V41 L61 T62 S67 Y68 I69L37-M65 HydrophobicContact CB-CE 3.78Å; L37-M65 HydrophobicContact CD2-CE 3.55Å; L37-M65 HydrophobicContact CG-CE 4.2Å; V40-M65 HydrophobicContact CB-CE 4.05Å; V40-M65 HydrophobicContact CG1-CE 3.95Å; V40-M65 HydrophobicContact CG1-SD 4.3Å; V41-M65 HydrophobicContact CG2-CE 3.88Å; V41-M65 HydrophobicContact CG2-SD 3.84Å; L61-M65 WeakPolarHBondContact O-CB 3.41Å; L61-M65 PolarHBondContact O-N 2.92Å; T62-M65 PolarHBondContact O-N 3.45Å; M65-S67 VanDerWaalsContact C-N 3.34Å; M65-S67 PolarHBondContact O-N 3.39Å; M65-Y68 PolarHBondContact O-N 3.1Å; M65-I69 HydrophobicContact CG-CD1 4.23Å; M65-I69 VanDerWaalsContact O-CG1 3.29Å; M65-I69 WeakPolarHBondContact O-CG1 3.5Å; M65-I69 PolarHBondContact O-N 2.96Å
66Q95.1Very high95.4Very high63 Ų6363.4 Ų63.429%0.29434%0.344SS..Hα-helixtrans-66.1-37.117666.5174.118.900112.4L37 T62 E63 Y68 I69 T70L37-Q66 HydrophobicContact CD1-CB 4.02Å; T62-Q66 WeakPolarHBondContact O-CG 3.47Å; T62-Q66 PolarHBondContact O-N 3.06Å; E63-Q66 WeakPolarHBondContact O-CG 3.48Å; E63-Q66 PolarHBondContact OE2-NE2 3.11Å; Q66-Y68 VanDerWaalsContact C-N 3.35Å; Q66-I69 PolarHBondContact O-N 2.76Å; Q66-T70 WeakPolarHBondContact O-CB 3.45Å; Q66-T70 PolarHBondContact O-N 3.35Å; Q66-T70 PolarHBondContact O-OG1 3.46Å
67S96.4Very high95.3Very high67 Ų6766.7 Ų66.747%0.46935%0.349SS..Hα-helixtrans-65.1-42.4176.9-59.30000110.4E63 M64 M65 T70 E71E63-S67 WeakPolarHBondContact O-CB 3.19Å; E63-S67 PolarHBondContact O-N 3.24Å; E63-S67 PolarHBondContact O-OG 3.15Å; M64-S67 PolarHBondContact O-N 2.93Å; M65-S67 VanDerWaalsContact C-N 3.34Å; M65-S67 PolarHBondContact O-N 3.39Å; S67-T70 WeakPolarHBondContact O-CB 3.4Å; S67-T70 PolarHBondContact O-N 3.22Å; S67-E71 WeakPolarHBondContact O-CB 3.46Å; S67-E71 PolarHBondContact O-N 3.46Å
68Y96.2Very high95.1Very high103 Ų10367.9 Ų67.940%0.40435%0.352SS..Hα-helixtrans-64.1-43.5177-172-110.1000112.7M64 M65 Q66 T70 E71 I72 M100M64-Y68 WeakPolarHBondContact O-CB 3.38Å; M64-Y68 PolarHBondContact O-N 2.78Å; M65-Y68 PolarHBondContact O-N 3.1Å; Q66-Y68 VanDerWaalsContact C-N 3.35Å; Y68-T70 VanDerWaalsContact C-N 3.29Å; Y68-T70 PolarHBondContact O-N 3.23Å; Y68-E71 PolarHBondContact O-N 3.43Å; Y68-I72 HydrophobicContact CD1-CD1 3.79Å; Y68-I72 HydrophobicContact CE1-CD1 3.53Å; Y68-I72 HydrophobicContact CE1-CG1 4.29Å; Y68-I72 WeakPolarHBondContact O-CG1 3.36Å; Y68-I72 PolarHBondContact O-N 3.04Å; Y68-M100 HydrophobicContact CD2-CE 3.78Å; Y68-M100 HydrophobicContact CE2-CE 3.4Å; Y68-M100 HydrophobicContact CE2-SD 4.48Å
69I95.3Very high94.8Very high92 Ų9270.3 Ų70.347%0.47236%0.359SS..Hα-helixtrans-60-42174-67.7164.5000110.8L37 M65 Q66 E71 G73L37-I69 HydrophobicContact CD2-CD1 4.5Å; M65-I69 HydrophobicContact CG-CD1 4.23Å; M65-I69 VanDerWaalsContact O-CG1 3.29Å; M65-I69 WeakPolarHBondContact O-CG1 3.5Å; M65-I69 PolarHBondContact O-N 2.96Å; Q66-I69 PolarHBondContact O-N 2.76Å; I69-E71 VanDerWaalsContact C-N 3.34Å; I69-G73 PolarHBondContact O-N 2.88Å; I69-G73 VanDerWaalsContact O-N 3.15Å
70T95.8Very high94.8Very high73 Ų7366.9 Ų66.945%0.44834%0.343SS..Hα-helixtrans-65.3-40.4178.2-55.30000111.2Q66 S67 Y68 G73 R74Q66-T70 WeakPolarHBondContact O-CB 3.45Å; Q66-T70 PolarHBondContact O-N 3.35Å; Q66-T70 PolarHBondContact O-OG1 3.46Å; S67-T70 WeakPolarHBondContact O-CB 3.4Å; S67-T70 PolarHBondContact O-N 3.22Å; Y68-T70 VanDerWaalsContact C-N 3.29Å; Y68-T70 PolarHBondContact O-N 3.23Å; T70-G73 PolarHBondContact O-N 3.43Å; T70-R74 WeakPolarHBondContact O-CG 3.41Å; T70-R74 PolarHBondContact O-N 3.12Å
71E95.6Very high94.6Very high82 Ų8268 Ų6838%0.38334%0.343SS..Hα-helixtrans-67.1-42.3179.4-16165.2-174.200111.9S67 Y68 I69 G73 R74 C75 M100S67-E71 WeakPolarHBondContact O-CB 3.46Å; S67-E71 PolarHBondContact O-N 3.46Å; Y68-E71 PolarHBondContact O-N 3.43Å; I69-E71 VanDerWaalsContact C-N 3.34Å; E71-G73 VanDerWaalsContact C-N 3.26Å; E71-G73 PolarHBondContact O-N 3.41Å; E71-R74 PolarHBondContact O-N 3.41Å; E71-R74 VanDerWaalsContact O-N 3.14Å; E71-R74 IonicContact OE2-NH1 3.83Å; E71-C75 PolarHBondContact O-N 3.45Å; E71-C75 PolarHBondContact O-SG 3.39Å; E71-M100 HydrophobicContact CB-CE 3.97Å; E71-M100 HydrophobicContact CG-CE 3.93Å
72I95.2Very high94.4Very high38 Ų3871.3 Ų71.320%0.19536%0.356CS..Hα-helixtrans-54.2-46.3170.5-67.8164000110.2Y68 R74 C75 A76 T96 L97 M100Y68-I72 HydrophobicContact CD1-CD1 3.79Å; Y68-I72 HydrophobicContact CE1-CD1 3.53Å; Y68-I72 HydrophobicContact CE1-CG1 4.29Å; Y68-I72 WeakPolarHBondContact O-CG1 3.36Å; Y68-I72 PolarHBondContact O-N 3.04Å; I72-R74 PolarHBondContact O-N 3.36Å; I72-C75 PolarHBondContact O-N 2.96Å; I72-A76 WeakPolarHBondContact O-CB 3.34Å; I72-A76 PolarHBondContact O-N 2.76Å; I72-T96 HydrophobicContact CG2-CG2 4.38Å; I72-L97 HydrophobicContact CD1-CD2 4.35Å; I72-M100 HydrophobicContact CB-SD 4.25Å; I72-M100 HydrophobicContact CG1-CE 3.93Å; I72-M100 HydrophobicContact CG1-SD 3.48Å; I72-M100 WeakPolarHBondContact CG1-SD 3.4Å
73G94.3Very high94.1Very high42 Ų4274.9 Ų74.943%0.43338%0.378SS..Hα-helixtrans-63.1-39.9178.900000113.3I69 T70 E71 K77I69-G73 PolarHBondContact O-N 2.88Å; I69-G73 VanDerWaalsContact O-N 3.15Å; T70-G73 PolarHBondContact O-N 3.43Å; E71-G73 VanDerWaalsContact C-N 3.26Å; E71-G73 PolarHBondContact O-N 3.41Å; G73-K77 VanDerWaalsContact O-CB 3.26Å; G73-K77 WeakPolarHBondContact O-CB 3.36Å; G73-K77 PolarHBondContact O-N 3.38Å
74R93.8Very high93.9Very high156 Ų15676.2 Ų76.259%0.58940%0.401SS*.Hα-helixtrans-65.2-50.9176-74.1175179.5-177.3-0.8111.4T70 E71 I72 A76 K77 T78T70-R74 WeakPolarHBondContact O-CG 3.41Å; T70-R74 PolarHBondContact O-N 3.12Å; E71-R74 PolarHBondContact O-N 3.41Å; E71-R74 VanDerWaalsContact O-N 3.14Å; E71-R74 IonicContact OE2-NH1 3.83Å; I72-R74 PolarHBondContact O-N 3.36Å; R74-A76 PolarHBondContact O-N 3.47Å; R74-K77 WeakPolarHBondContact O-CB 3.4Å; R74-K77 PolarHBondContact O-N 2.95Å; R74-T78 PolarHBondContact O-N 3.01Å; R74-T78 PolarHBondContact O-OG1 2.89Å
75C93.9Very high93.7Very high32 Ų3274.7 Ų74.722%0.21639%0.389CS..Hα-helixtrans-60.6-47178.5-680000111.4E71 I72 K77 T78 Y79 T96E71-C75 PolarHBondContact O-N 3.45Å; E71-C75 PolarHBondContact O-SG 3.39Å; I72-C75 PolarHBondContact O-N 2.96Å; C75-K77 VanDerWaalsContact C-N 3.29Å; C75-K77 PolarHBondContact O-N 3.37Å; C75-T78 PolarHBondContact O-N 2.78Å; C75-Y79 WeakPolarHBondContact O-CD2 3.44Å; C75-Y79 PolarHBondContact O-N 3.49Å; C75-T96 HydrophobicContact CB-CG2 3.44Å; C75-T96 VanDerWaalsContact CB-CG2 3.44Å
76A94.3Very high93.5Very high8 Ų877.9 Ų77.97%0.06642%0.416CS..Hα-helixtrans-61.4-37.9178.700000112.4I72 R74 Y79 C80 P88 T96I72-A76 WeakPolarHBondContact O-CB 3.34Å; I72-A76 PolarHBondContact O-N 2.76Å; R74-A76 PolarHBondContact O-N 3.47Å; A76-Y79 PolarHBondContact O-N 2.85Å; A76-C80 PolarHBondContact O-N 3.47Å; A76-P88 HydrophobicContact CB-CB 4.34Å; A76-P88 HydrophobicContact CB-CG 4.38Å; A76-T96 WeakPolarHBondContact CA-OG1 3.42Å; A76-T96 HydrophobicContact CB-CG2 4.39Å
77K93.4Very high93.4Very high117 Ų11779.9 Ų79.951%0.50943%0.432SS..Hα-helixtrans-63.7-49.2173.7177.9-177.3169.8-174.70111.5G73 R74 C75 Y79 C80 E81G73-K77 VanDerWaalsContact O-CB 3.26Å; G73-K77 WeakPolarHBondContact O-CB 3.36Å; G73-K77 PolarHBondContact O-N 3.38Å; R74-K77 WeakPolarHBondContact O-CB 3.4Å; R74-K77 PolarHBondContact O-N 2.95Å; C75-K77 VanDerWaalsContact C-N 3.29Å; C75-K77 PolarHBondContact O-N 3.37Å; K77-Y79 VanDerWaalsContact C-N 3.27Å; K77-Y79 PolarHBondContact O-N 3.31Å; K77-C80 PolarHBondContact O-N 3.05Å; K77-C80 PolarHBondContact O-SG 3.36Å; K77-E81 WeakPolarHBondContact CE-OE1 3.32Å; K77-E81 HydrophobicContact CG-CG 4.4Å; K77-E81 IonicContact NZ-OE1 3.74Å; K77-E81 WeakPolarHBondContact O-CB 3.46Å; K77-E81 VanDerWaalsContact O-CG 3.31Å; K77-E81 WeakPolarHBondContact O-CG 3.46Å; K77-E81 PolarHBondContact O-N 3.03Å
78T91.5Very high93.3Very high69 Ų6979.4 Ų79.442%0.42343%0.427SS..Hα-helixtrans-58.5-41.7177.6-60.70000111.3R74 C75 E81 H82R74-T78 PolarHBondContact O-N 3.01Å; R74-T78 PolarHBondContact O-OG1 2.89Å; C75-T78 PolarHBondContact O-N 2.78Å; T78-E81 PolarHBondContact O-N 3.32Å; T78-H82 PolarHBondContact O-CD2 3.42Å; T78-H82 PolarHBondContact O-N 3.24Å; T78-H82 VanDerWaalsContact O-N 3.14Å
79Y89.9Confident93.2Very high72 Ų7277.3 Ų77.328%0.28243%0.425SS..Hα-helixtrans-62.6-43.6175.7-90.2-70.3000113.7C75 A76 K77 H82 V95 E99C75-Y79 WeakPolarHBondContact O-CD2 3.44Å; C75-Y79 PolarHBondContact O-N 3.49Å; A76-Y79 PolarHBondContact O-N 2.85Å; K77-Y79 VanDerWaalsContact C-N 3.27Å; K77-Y79 PolarHBondContact O-N 3.31Å; Y79-H82 PolarHBondContact O-N 3.47Å; Y79-V95 HydrophobicContact CD1-CG1 4.23Å; Y79-V95 HydrophobicContact CE1-CG1 3.75Å; Y79-V95 HydrophobicContact CE2-CG1 4.34Å; Y79-E99 HydrophobicContact CE2-CB 4.38Å; Y79-E99 HydrophobicContact CE2-CG 4.34Å
80C93.2Very high93.1Very high0 Ų079.7 Ų79.70%044%0.438CS..Hα-helixtrans-70.6-34.3178.575.50000111.9A76 K77 H82 T83 A84 R85 P88A76-C80 PolarHBondContact O-N 3.47Å; K77-C80 PolarHBondContact O-N 3.05Å; K77-C80 PolarHBondContact O-SG 3.36Å; C80-H82 VanDerWaalsContact C-N 3.32Å; C80-H82 PolarHBondContact O-N 2.64Å; C80-T83 CarbonylContact O-C 3.23Å; C80-T83 PolarHBondContact O-N 3.21Å; C80-T83 PolarHBondContact O-OG1 3.48Å; C80-A84 PolarHBondContact O-N 2.74Å; C80-R85 CarbonylContact C-O 3.59Å; C80-R85 VanDerWaalsContact C-O 3.23Å; C80-R85 HydrophobicContact CB-CB 4.37Å; C80-R85 PolarHBondContact O-N 3.46Å; C80-R85 VanDerWaalsContact O-N 3.07Å; C80-R85 PolarHBondContact SG-O 2.9Å; C80-P88 HydrophobicContact CB-CG 4.39Å
81E93.6Very high92.9Very high102 Ų10280.2 Ų80.248%0.47745%0.445SS..Hα-helixtrans-64.1-32.9176.5-74.9177.4167.800112.7K77 T78 T83 A84 R85K77-E81 WeakPolarHBondContact CE-OE1 3.32Å; K77-E81 HydrophobicContact CG-CG 4.4Å; K77-E81 IonicContact NZ-OE1 3.74Å; K77-E81 WeakPolarHBondContact O-CB 3.46Å; K77-E81 VanDerWaalsContact O-CG 3.31Å; K77-E81 WeakPolarHBondContact O-CG 3.46Å; K77-E81 PolarHBondContact O-N 3.03Å; T78-E81 PolarHBondContact O-N 3.32Å; E81-T83 PolarHBondContact O-N 2.97Å; E81-T83 VanDerWaalsContact O-N 3.11Å; E81-A84 PolarHBondContact O-N 3.02Å; E81-R85 PolarHBondContact N-O 3.11Å
82H91.3Very high92.8Very high146 Ų14677.1 Ų77.168%0.67643%0.431SS*.THydrogen-bonded Turntrans-58.2-24.4172-73.6-54.5000113.5T78 Y79 C80T78-H82 PolarHBondContact O-CD2 3.42Å; T78-H82 PolarHBondContact O-N 3.24Å; T78-H82 VanDerWaalsContact O-N 3.14Å; Y79-H82 PolarHBondContact O-N 3.47Å; C80-H82 VanDerWaalsContact C-N 3.32Å; C80-H82 PolarHBondContact O-N 2.64Å
83T89.7Confident92.6Very high76 Ų7677.7 Ų77.747%0.46644%0.436SS..THydrogen-bonded Turntrans-10315177610000113.1C80 E81 R85C80-T83 CarbonylContact O-C 3.23Å; C80-T83 PolarHBondContact O-N 3.21Å; C80-T83 PolarHBondContact O-OG1 3.48Å; E81-T83 PolarHBondContact O-N 2.97Å; E81-T83 VanDerWaalsContact O-N 3.11Å; T83-R85 PolarHBondContact O-N 3.43Å; T83-R85 VanDerWaalsContact OG1-CZ 3.3Å; T83-R85 PolarHBondContact OG1-NE 2.58Å; T83-R85 PolarHBondContact OG1-NH2 3.03Å
84A92.3Very high92.6Very high100 Ų10078.2 Ų78.283%0.82643%0.431SS*.THydrogen-bonded Turntrans56.425.3-174.900000114.5C80 E81C80-A84 PolarHBondContact O-N 2.74Å; E81-A84 PolarHBondContact O-N 3.02Å
85R92.2Very high92.6Very high87 Ų8774 Ų7433%0.32842%0.422SS..  trans-101.1144.9174.5-68.6179.5-68.6148.78.2110.1C80 E81 T83 T89 D92C80-R85 CarbonylContact C-O 3.59Å; C80-R85 VanDerWaalsContact C-O 3.23Å; C80-R85 HydrophobicContact CB-CB 4.37Å; C80-R85 PolarHBondContact O-N 3.46Å; C80-R85 VanDerWaalsContact O-N 3.07Å; C80-R85 PolarHBondContact SG-O 2.9Å; E81-R85 PolarHBondContact N-O 3.11Å; T83-R85 PolarHBondContact O-N 3.43Å; T83-R85 VanDerWaalsContact OG1-CZ 3.3Å; T83-R85 PolarHBondContact OG1-NE 2.58Å; T83-R85 PolarHBondContact OG1-NH2 3.03Å; R85-T89 PolarHBondContact NH1-OG1 2.94Å; R85-D92 IonicContact CZ-OD1 3.46Å; R85-D92 IonicContact CZ-OD2 2.58Å; R85-D92 IonicContact NH1-OD1 3.17Å; R85-D92 IonicContact NH1-OD2 3.05Å; R85-D92 PolarHBondContact NH1-OD2 3.48Å; R85-D92 VanDerWaalsContact NH1-OD2 3.17Å; R85-D92 IonicContact NH2-OD1 3.98Å; R85-D92 PolarHBondContact NH2-OD1 3Å; R85-D92 IonicContact NH2-OD2 3.15Å; R85-D92 PolarHBondContact NH2-OD2 3.46Å; R85-D92 VanDerWaalsContact NH2-OD2 3.15Å
86S91.4Very high92.6Very high111 Ų11172.4 Ų72.478%0.77641%0.412SS*.SBendtrans-95.7-15.1175.355.60000113.9
87V93.1Very high92.6Very high104 Ų10473.4 Ų73.463%0.6342%0.416SS*.SBendtrans-114.4117-177.1-1770000109.3
88P93.9Very high92.7Very high57 Ų5772.5 Ų72.537%0.3742%0.415SS..  trans-62.5135.8173.5-21.832.6000111.8A76 C80A76-P88 HydrophobicContact CB-CB 4.34Å; A76-P88 HydrophobicContact CB-CG 4.38Å; C80-P88 HydrophobicContact CB-CG 4.39Å
89T93.1Very high92.8Very high59 Ų5975.5 Ų75.536%0.36243%0.425SS..  trans-95.4170.617260.40000111.5R85 S91 D92 T93R85-T89 PolarHBondContact NH1-OG1 2.94Å; T89-S91 VanDerWaalsContact C-N 3.28Å; T89-S91 PolarHBondContact O-N 3.45Å; T89-D92 WeakPolarHBondContact CA-OD2 3.33Å; T89-D92 WeakPolarHBondContact CB-OD2 3.33Å; T89-D92 PolarHBondContact N-OD2 3.41Å; T89-D92 WeakPolarHBondContact O-CB 3.47Å; T89-D92 PolarHBondContact O-N 3.22Å; T89-D92 VanDerWaalsContact O-N 3.14Å; T89-D92 VanDerWaalsContact OG1-CG 3.24Å; T89-D92 PolarHBondContact OG1-OD2 3.03Å; T89-T93 PolarHBondContact O-N 3.23Å; T89-T93 VanDerWaalsContact O-N 3.15Å; T89-T93 PolarHBondContact O-OG1 3.09Å
90L93Very high93Very high142 Ų14274.7 Ų74.774%0.74342%0.424SS*.Hα-helixtrans-56.5-42.8178.2-178.462.5000111.9D92 T93 V94L90-D92 VanDerWaalsContact C-N 3.32Å; L90-D92 PolarHBondContact O-N 3.16Å; L90-T93 WeakPolarHBondContact O-CB 3.35Å; L90-T93 PolarHBondContact O-N 3Å; L90-T93 VanDerWaalsContact O-N 3.14Å; L90-V94 WeakPolarHBondContact O-CG2 3.22Å; L90-V94 PolarHBondContact O-N 3.12Å
91S91.5Very high93Very high85 Ų8578 Ų7859%0.59446%0.459SS*.Hα-helixtrans-61.6-39.8178-53.80000112.3T89 T93 V94 V95T89-S91 VanDerWaalsContact C-N 3.28Å; T89-S91 PolarHBondContact O-N 3.45Å; S91-T93 VanDerWaalsContact C-N 3.26Å; S91-T93 PolarHBondContact O-N 3.2Å; S91-V94 PolarHBondContact O-N 3.06Å; S91-V95 WeakPolarHBondContact O-CG2 3.38Å; S91-V95 PolarHBondContact O-N 2.93Å
92D93.5Very high93.1Very high16 Ų1676.5 Ų76.59%0.08645%0.451CS..Hα-helixtrans-63.3-37176.9-52.1-45.5000110.6R85 T89 L90 T96R85-D92 IonicContact CZ-OD1 3.46Å; R85-D92 IonicContact CZ-OD2 2.58Å; R85-D92 IonicContact NH1-OD1 3.17Å; R85-D92 IonicContact NH1-OD2 3.05Å; R85-D92 PolarHBondContact NH1-OD2 3.48Å; R85-D92 VanDerWaalsContact NH1-OD2 3.17Å; R85-D92 IonicContact NH2-OD1 3.98Å; R85-D92 PolarHBondContact NH2-OD1 3Å; R85-D92 IonicContact NH2-OD2 3.15Å; R85-D92 PolarHBondContact NH2-OD2 3.46Å; R85-D92 VanDerWaalsContact NH2-OD2 3.15Å; T89-D92 WeakPolarHBondContact CA-OD2 3.33Å; T89-D92 WeakPolarHBondContact CB-OD2 3.33Å; T89-D92 PolarHBondContact N-OD2 3.41Å; T89-D92 WeakPolarHBondContact O-CB 3.47Å; T89-D92 PolarHBondContact O-N 3.22Å; T89-D92 VanDerWaalsContact O-N 3.14Å; T89-D92 VanDerWaalsContact OG1-CG 3.24Å; T89-D92 PolarHBondContact OG1-OD2 3.03Å; L90-D92 VanDerWaalsContact C-N 3.32Å; L90-D92 PolarHBondContact O-N 3.16Å; D92-T96 VanDerWaalsContact O-CB 3.29Å; D92-T96 WeakPolarHBondContact O-CB 3.48Å; D92-T96 PolarHBondContact O-N 3.39Å; D92-T96 PolarHBondContact O-OG1 2.91Å
93T92.5Very high93.3Very high50 Ų5073.9 Ų73.931%0.30744%0.442SS..Hα-helixtrans-69.6-40.7177.1-48.80000111.6T89 L90 S91 T96 L97T89-T93 PolarHBondContact O-N 3.23Å; T89-T93 VanDerWaalsContact O-N 3.15Å; T89-T93 PolarHBondContact O-OG1 3.09Å; L90-T93 WeakPolarHBondContact O-CB 3.35Å; L90-T93 PolarHBondContact O-N 3Å; L90-T93 VanDerWaalsContact O-N 3.14Å; S91-T93 VanDerWaalsContact C-N 3.26Å; S91-T93 PolarHBondContact O-N 3.2Å; T93-T96 PolarHBondContact O-N 2.77Å; T93-L97 WeakPolarHBondContact O-CG 3.14Å; T93-L97 PolarHBondContact O-N 3.09Å
94V94.1Very high93.5Very high54 Ų5471.6 Ų71.633%0.32743%0.428SS..Hα-helixtrans-62.7-48176170.10000110.8L90 S91 T96 L97 I98 V104L90-V94 WeakPolarHBondContact O-CG2 3.22Å; L90-V94 PolarHBondContact O-N 3.12Å; S91-V94 PolarHBondContact O-N 3.06Å; V94-T96 VanDerWaalsContact C-N 3.31Å; V94-T96 PolarHBondContact O-N 3.32Å; V94-L97 PolarHBondContact O-N 3.45Å; V94-I98 HydrophobicContact CG1-CD1 3.86Å; V94-I98 WeakPolarHBondContact O-CG1 3.48Å; V94-I98 PolarHBondContact O-N 3.12Å; V94-V104 HydrophobicContact CG1-CG1 4.38Å; V94-V104 HydrophobicContact CG1-CG2 4.34Å
95V92.9Very high93.6Very high66 Ų6673 Ų7340%0.442%0.422SS..Hα-helixtrans-61.2-42.4176.5173.50000110.7Y79 S91 L97 I98 E99Y79-V95 HydrophobicContact CD1-CG1 4.23Å; Y79-V95 HydrophobicContact CE1-CG1 3.75Å; Y79-V95 HydrophobicContact CE2-CG1 4.34Å; S91-V95 WeakPolarHBondContact O-CG2 3.38Å; S91-V95 PolarHBondContact O-N 2.93Å; V95-L97 PolarHBondContact O-N 3.34Å; V95-I98 PolarHBondContact O-N 3.43Å; V95-E99 WeakPolarHBondContact O-CB 3.13Å; V95-E99 PolarHBondContact O-N 3.21Å
96T94.7Very high93.7Very high0 Ų071.8 Ų71.80%042%0.424CS..Hα-helixtrans-58.8-45.4176.2-620000112.1I72 C75 A76 D92 T93 V94 E99 M100I72-T96 HydrophobicContact CG2-CG2 4.38Å; C75-T96 HydrophobicContact CB-CG2 3.44Å; C75-T96 VanDerWaalsContact CB-CG2 3.44Å; A76-T96 WeakPolarHBondContact CA-OG1 3.42Å; A76-T96 HydrophobicContact CB-CG2 4.39Å; D92-T96 VanDerWaalsContact O-CB 3.29Å; D92-T96 WeakPolarHBondContact O-CB 3.48Å; D92-T96 PolarHBondContact O-N 3.39Å; D92-T96 PolarHBondContact O-OG1 2.91Å; T93-T96 PolarHBondContact O-N 2.77Å; V94-T96 VanDerWaalsContact C-N 3.31Å; V94-T96 PolarHBondContact O-N 3.32Å; T96-E99 PolarHBondContact O-N 3.13Å; T96-M100 HydrophobicContact CG2-SD 4.11Å; T96-M100 VanDerWaalsContact O-CG 3.27Å; T96-M100 WeakPolarHBondContact O-CG 3.41Å; T96-M100 PolarHBondContact O-N 3.5Å
97L94.5Very high93.8Very high29 Ų2970.2 Ų70.215%0.15241%0.406CS..Hα-helixtrans-64.8-40.1178.3-71.9173.9000112.1I72 T93 V94 V95 M100 G101 F102 V104I72-L97 HydrophobicContact CD1-CD2 4.35Å; T93-L97 WeakPolarHBondContact O-CG 3.14Å; T93-L97 PolarHBondContact O-N 3.09Å; V94-L97 PolarHBondContact O-N 3.45Å; V95-L97 PolarHBondContact O-N 3.34Å; L97-M100 PolarHBondContact O-N 3.46Å; L97-G101 PolarHBondContact O-N 3.07Å; L97-F102 HydrophobicContact CB-CB 4.37Å; L97-F102 HydrophobicContact CB-CD1 4.25Å; L97-F102 HydrophobicContact CD1-CD1 4.45Å; L97-F102 WeakPolarHBondContact O-CB 3.44Å; L97-F102 PolarHBondContact O-N 2.97Å; L97-V104 HydrophobicContact CB-CG1 3.91Å; L97-V104 HydrophobicContact CD1-CG1 4.17Å
98I94.8Very high93.7Very high97 Ų9768.9 Ų68.950%0.49740%0.399SS..Hα-helixtrans-64.2-43.8176.5-66.9166.6000110.5V94 V95 M100 G101 V104V94-I98 HydrophobicContact CG1-CD1 3.86Å; V94-I98 WeakPolarHBondContact O-CG1 3.48Å; V94-I98 PolarHBondContact O-N 3.12Å; V95-I98 PolarHBondContact O-N 3.43Å; I98-M100 VanDerWaalsContact C-N 3.29Å; I98-M100 PolarHBondContact O-N 2.99Å; I98-G101 WeakPolarHBondContact O-CA 3.38Å; I98-G101 PolarHBondContact O-N 3.37Å; I98-V104 HydrophobicContact CD1-CG2 4.31Å; I98-V104 HydrophobicContact CG1-CG1 4.21Å; I98-V104 HydrophobicContact CG1-CG2 4.35Å
99E93.3Very high93.6Very high133 Ų13371.4 Ų71.462%0.62141%0.414SS*.Hα-helixtrans-61-38.4176.5-173.463.9-16200111.8Y79 V95 T96 G101Y79-E99 HydrophobicContact CE2-CB 4.38Å; Y79-E99 HydrophobicContact CE2-CG 4.34Å; V95-E99 WeakPolarHBondContact O-CB 3.13Å; V95-E99 PolarHBondContact O-N 3.21Å; T96-E99 PolarHBondContact O-N 3.13Å; E99-G101 PolarHBondContact O-N 2.95Å
100M93.6Very high93.4Very high54 Ų5474.4 Ų74.427%0.26642%0.419SS..THydrogen-bonded Turntrans-74.85174.1-65.3-178.484.300113.7Y68 E71 I72 T96 L97 I98Y68-M100 HydrophobicContact CD2-CE 3.78Å; Y68-M100 HydrophobicContact CE2-CE 3.4Å; Y68-M100 HydrophobicContact CE2-SD 4.48Å; E71-M100 HydrophobicContact CB-CE 3.97Å; E71-M100 HydrophobicContact CG-CE 3.93Å; I72-M100 HydrophobicContact CB-SD 4.25Å; I72-M100 HydrophobicContact CG1-CE 3.93Å; I72-M100 HydrophobicContact CG1-SD 3.48Å; I72-M100 WeakPolarHBondContact CG1-SD 3.4Å; T96-M100 HydrophobicContact CG2-SD 4.11Å; T96-M100 VanDerWaalsContact O-CG 3.27Å; T96-M100 WeakPolarHBondContact O-CG 3.41Å; T96-M100 PolarHBondContact O-N 3.5Å; L97-M100 PolarHBondContact O-N 3.46Å; I98-M100 VanDerWaalsContact C-N 3.29Å; I98-M100 PolarHBondContact O-N 2.99Å
101G94.8Very high93.2Very high71 Ų7169.8 Ų69.873%0.73240%0.402SS*.THydrogen-bonded Turntrans82.219.7175.800000115.1L97 I98 E99L97-G101 PolarHBondContact O-N 3.07Å; I98-G101 WeakPolarHBondContact O-CA 3.38Å; I98-G101 PolarHBondContact O-N 3.37Å; E99-G101 PolarHBondContact O-N 2.95Å
102F95.1Very high93.1Very high70 Ų7074.3 Ų74.331%0.30741%0.411SS..  trans-98.3130.9-179.5-177.9-95.4000112.6L97 V104 L107L97-F102 HydrophobicContact CB-CB 4.37Å; L97-F102 HydrophobicContact CB-CD1 4.25Å; L97-F102 HydrophobicContact CD1-CD1 4.45Å; L97-F102 WeakPolarHBondContact O-CB 3.44Å; L97-F102 PolarHBondContact O-N 2.97Å; F102-V104 HydrophobicContact CD1-CG1 4.17Å; F102-V104 PolarHBondContact O-N 2.68Å; F102-L107 HydrophobicContact CE1-CD1 3.97Å; F102-L107 HydrophobicContact CE1-CD2 3.83Å; F102-L107 HydrophobicContact CE1-CG 3.67Å; F102-L107 HydrophobicContact CZ-CD2 3.84Å; F102-L107 HydrophobicContact CZ-CG 4.05Å
103N95.6Very high92.7Very high91 Ų9176.5 Ų76.549%0.48742%0.418SS..  trans-83100.8176.3-175.2-10.9000111.5D105 T106N103-D105 PolarHBondContact O-N 3.3Å; N103-D105 WeakPolarHBondContact OD1-CB 3.44Å; N103-D105 PolarHBondContact OD1-N 3.12Å; N103-T106 HydrophobicContact CB-CG2 4.23Å; N103-T106 PolarHBondContact O-N 2.97Å; N103-T106 PolarHBondContact O-OG1 2.84Å
104V94.3Very high91.8Very high28 Ų2879.6 Ų79.617%0.1744%0.441CS..G310 helixtrans-63.3-23.4-178-64.60000114.5V94 L97 I98 F102 T106 L107V94-V104 HydrophobicContact CG1-CG1 4.38Å; V94-V104 HydrophobicContact CG1-CG2 4.34Å; L97-V104 HydrophobicContact CB-CG1 3.91Å; L97-V104 HydrophobicContact CD1-CG1 4.17Å; I98-V104 HydrophobicContact CD1-CG2 4.31Å; I98-V104 HydrophobicContact CG1-CG1 4.21Å; I98-V104 HydrophobicContact CG1-CG2 4.35Å; F102-V104 HydrophobicContact CD1-CG1 4.17Å; F102-V104 PolarHBondContact O-N 2.68Å; V104-T106 PolarHBondContact O-N 3.13Å; V104-L107 HydrophobicContact CB-CD1 4.31Å; V104-L107 HydrophobicContact CG1-CD1 4.47Å; V104-L107 WeakPolarHBondContact O-CB 3.26Å; V104-L107 PolarHBondContact O-N 3.08Å; V104-L107 VanDerWaalsContact O-N 3.11Å
105D94.4Very high90.8Very high130 Ų13083.2 Ų83.270%0.69546%0.455SS*.G310 helixtrans-67.4-18.4179.6-61.9-38.7000112.4N103 P108N103-D105 PolarHBondContact O-N 3.3Å; N103-D105 WeakPolarHBondContact OD1-CB 3.44Å; N103-D105 PolarHBondContact OD1-N 3.12Å; D105-P108 WeakPolarHBondContact O-CD 3.44Å
106T94.6Very high90Very high61 Ų6186.8 Ų86.837%0.37446%0.461SS..G310 helixtrans-80.4-17177.268.20000113.1N103 V104 V109 Y110N103-T106 HydrophobicContact CB-CG2 4.23Å; N103-T106 PolarHBondContact O-N 2.97Å; N103-T106 PolarHBondContact O-OG1 2.84Å; V104-T106 PolarHBondContact O-N 3.13Å; T106-V109 PolarHBondContact O-N 3.44Å; T106-V109 VanDerWaalsContact O-N 3.15Å; T106-Y110 PolarHBondContact O-N 3.25Å
107L91.8Very high89.1Confident77 Ų7791.5 Ų91.540%0.40348%0.484SS..Hα-helixtrans-59-45.2-177-74.4166.9000113.6F102 V104 V109 Y110 A111F102-L107 HydrophobicContact CE1-CD1 3.97Å; F102-L107 HydrophobicContact CE1-CD2 3.83Å; F102-L107 HydrophobicContact CE1-CG 3.67Å; F102-L107 HydrophobicContact CZ-CD2 3.84Å; F102-L107 HydrophobicContact CZ-CG 4.05Å; V104-L107 HydrophobicContact CB-CD1 4.31Å; V104-L107 HydrophobicContact CG1-CD1 4.47Å; V104-L107 WeakPolarHBondContact O-CB 3.26Å; V104-L107 PolarHBondContact O-N 3.08Å; V104-L107 VanDerWaalsContact O-N 3.11Å; L107-V109 VanDerWaalsContact C-N 3.26Å; L107-V109 PolarHBondContact O-N 3.13Å; L107-Y110 PolarHBondContact O-N 3.07Å; L107-A111 VanDerWaalsContact O-CB 3.23Å; L107-A111 WeakPolarHBondContact O-CB 3.29Å; L107-A111 PolarHBondContact O-N 3.33Å
108P92.1Very high88.1Confident76 Ų7696.7 Ų96.749%0.49452%0.517SS..Hα-helixtrans-63.3-32.7178-22.635.1000112.9D105 A111 K112D105-P108 WeakPolarHBondContact O-CD 3.44Å; P108-A111 PolarHBondContact O-N 3.4Å; P108-K112 WeakPolarHBondContact O-CG 3.44Å; P108-K112 PolarHBondContact O-N 2.9Å
109V91.8Very high87.3Confident110 Ų11095.5 Ų95.567%0.66751%0.511SS*.Hα-helixtrans-71.4-49.8176.9-1790000109.8T106 L107 A111 K112T106-V109 PolarHBondContact O-N 3.44Å; T106-V109 VanDerWaalsContact O-N 3.15Å; L107-V109 VanDerWaalsContact C-N 3.26Å; L107-V109 PolarHBondContact O-N 3.13Å; V109-A111 PolarHBondContact O-N 3.44Å; V109-K112 PolarHBondContact O-N 3.07Å
110Y89Confident86.2Confident122 Ų12295 Ų9548%0.47852%0.517SS..Hα-helixtrans-59.3-31.5174.2-170.4-99.9000111.6T106 L107 K112 R113T106-Y110 PolarHBondContact O-N 3.25Å; L107-Y110 PolarHBondContact O-N 3.07Å; Y110-K112 VanDerWaalsContact C-N 3.3Å; Y110-K112 PolarHBondContact O-N 2.97Å; Y110-R113 VanDerWaalsContact CE1-NE 3.32Å; Y110-R113 WeakPolarHBondContact O-CD 3.28Å; Y110-R113 WeakPolarHBondContact O-CG 3.4Å; Y110-R113 PolarHBondContact O-N 3.48Å; Y110-R113 PolarHBondContact OH-NE 2.9Å; Y110-R113 PolarHBondContact OH-NH2 3Å; Y110-R113 VanDerWaalsContact OH-NH2 3.11Å
111A88.3Confident84.9Confident46 Ų4696.2 Ų96.238%0.3854%0.535SS..Hα-helixtrans-69.3-24.3176.400000113.7L107 P108 V109 R116L107-A111 VanDerWaalsContact O-CB 3.23Å; L107-A111 WeakPolarHBondContact O-CB 3.29Å; L107-A111 PolarHBondContact O-N 3.33Å; P108-A111 PolarHBondContact O-N 3.4Å; V109-A111 PolarHBondContact O-N 3.44Å; A111-R116 PolarHBondContact O-NE 3.27Å; A111-R116 PolarHBondContact O-NH2 3.32Å
112K88.7Confident83.6Confident180 Ų18096 Ų9678%0.78352%0.521SS*.THydrogen-bonded Turntrans-90.32.4-179.5-71.5174.6-178.3179.70114P108 V109 Y110P108-K112 WeakPolarHBondContact O-CG 3.44Å; P108-K112 PolarHBondContact O-N 2.9Å; V109-K112 PolarHBondContact O-N 3.07Å; Y110-K112 VanDerWaalsContact C-N 3.3Å; Y110-K112 PolarHBondContact O-N 2.97Å
113R86.4Confident82.1Confident62 Ų6298.4 Ų98.423%0.23454%0.544CS..  trans-58.7138.4-179.570.2-165.4173.279.8-22.8112.1E47 Y110 R116E47-R113 WeakPolarHBondContact OE1-CD 3.49Å; E47-R113 IonicContact OE1-CZ 2.83Å; E47-R113 IonicContact OE1-NE 2.74Å; E47-R113 IonicContact OE1-NH1 2.59Å; E47-R113 PolarHBondContact OE1-NH1 2.96Å; E47-R113 IonicContact OE2-CZ 3.35Å; E47-R113 IonicContact OE2-NH1 3.65Å; E47-R113 PolarHBondContact OE2-NH1 3.46Å; E47-R113 IonicContact OE2-NH2 2.64Å; E47-R113 PolarHBondContact OE2-NH2 3.43Å; Y110-R113 VanDerWaalsContact CE1-NE 3.32Å; Y110-R113 WeakPolarHBondContact O-CD 3.28Å; Y110-R113 WeakPolarHBondContact O-CG 3.4Å; Y110-R113 PolarHBondContact O-N 3.48Å; Y110-R113 PolarHBondContact OH-NE 2.9Å; Y110-R113 PolarHBondContact OH-NH2 3Å; Y110-R113 VanDerWaalsContact OH-NH2 3.11Å; R113-R116 HydrophobicContact CG-CG 3.87Å; R113-R116 WeakPolarHBondContact O-CG 3.41Å
114S72.4Confident80.6Confident115 Ų115100.3 Ų100.380%0.80456%0.559SS**SBendtrans-83.1-28.1-174.353.20000113.8R116S114-R116 PolarHBondContact O-N 2.95Å
115Q74.6Confident79.1Confident130 Ų130102.9 Ų102.961%0.60757%0.574SS**  trans-84.738.6-177.4-63.7-65-16.500113E47 M117E47-Q115 VanDerWaalsContact CD-O 3.31Å; E47-Q115 HydrophobicContact CG-CB 3.82Å; Q115-M117 PolarHBondContact O-N 3.49Å
116R75.2Confident77.6Confident141 Ų141103.1 Ų103.153%0.53258%0.576SS.*  trans-72.3104.1177.7-77.8174.7167.4-146.4-13.7110.1A111 R113 S114 V118A111-R116 PolarHBondContact O-NE 3.27Å; A111-R116 PolarHBondContact O-NH2 3.32Å; R113-R116 HydrophobicContact CG-CG 3.87Å; R113-R116 WeakPolarHBondContact O-CG 3.41Å; S114-R116 PolarHBondContact O-N 2.95Å; R116-V118 PolarHBondContact O-N 3.42Å
117M75.5Confident76.4Confident99 Ų99104 Ų10449%0.48859%0.589SS.*  trans-70.8125.9165.6-63.4-164.573.800109.7A43 T46 Q115 I119A43-M117 HydrophobicContact CB-CB 4.05Å; A43-M117 HydrophobicContact CB-SD 4.06Å; T46-M117 HydrophobicContact CG2-CE 4.46Å; T46-M117 HydrophobicContact CG2-SD 3.79Å; Q115-M117 PolarHBondContact O-N 3.49Å; M117-I119 PolarHBondContact O-N 3.35Å
118V73.9Confident75.2Confident137 Ų137104.9 Ų104.983%0.8360%0.599SS**  trans-77.8113.9176.1178.90000108.7R116 T120R116-V118 PolarHBondContact O-N 3.42Å; V118-T120 PolarHBondContact O-N 3.38Å
119I77.1Confident74.3Confident72 Ų72107.6 Ų107.637%0.36961%0.614SS.*PPolyproline II helixtrans-80.9118.2175-58.1160.5000107.2V39 V40 M117 A121V39-I119 HydrophobicContact CG1-CG2 4.41Å; V40-I119 HydrophobicContact CB-CD1 3.97Å; V40-I119 HydrophobicContact CG1-CD1 3.92Å; V40-I119 HydrophobicContact CG2-CD1 3.52Å; V40-I119 HydrophobicContact CG2-CG1 4.41Å; V40-I119 HydrophobicContact CG2-CG2 4.14Å; M117-I119 PolarHBondContact O-N 3.35Å; I119-A121 PolarHBondContact O-N 3.2Å
120T70.9Confident73.5Confident123 Ų123108 Ų10876%0.75562%0.617SS**PPolyproline II helixtrans-65129.8176-58.70000108.8V118V118-T120 PolarHBondContact O-N 3.38Å
121A66.7Low72.6Confident79 Ų79108 Ų10865%0.65363%0.632SS**PPolyproline II helixtrans-56.4139.5178.700000110.1I119I119-A121 PolarHBondContact O-N 3.2Å
122P66.9Low71.7Confident67 Ų67115.4 Ų115.444%0.43566%0.656SS.*PPolyproline II helixtrans-58.2139.517722-30.2000109.5T36 V124T36-P122 HydrophobicContact CG2-CB 4.38Å; T36-P122 HydrophobicContact CG2-CG 4.26Å; P122-V124 PolarHBondContact O-N 3.41Å; P122-V124 VanDerWaalsContact O-N 3.12Å
123P64.9Low70.6Confident121 Ų121111.9 Ų111.979%0.78665%0.653SS**PPolyproline II helixtrans-58.6122.1177.821.9-30.4000109.1T125P123-T125 PolarHBondContact O-N 2.86Å
124V62.3Low69.6Low131 Ų131116.4 Ų116.479%0.79468%0.681SS**  trans-69.4101.2173.2-173.40000106.7P122 N126P122-V124 PolarHBondContact O-N 3.41Å; P122-V124 VanDerWaalsContact O-N 3.12Å; V124-N126 PolarHBondContact O-N 3.13Å
125T63.2Low69.1Low81 Ų81114.6 Ų114.650%0.49767%0.669SS.*  trans-71.6114.3169.6-179.80000108.3Y29 P123 A127Y29-T125 HydrophobicContact CD1-CG2 3.38Å; Y29-T125 HydrophobicContact CE1-CG2 3.01Å; P123-T125 PolarHBondContact O-N 2.86Å; T125-A127 PolarHBondContact O-N 2.98Å
126N63.9Low68.5Low136 Ų136110.8 Ų110.873%0.72766%0.659SS**PPolyproline II helixtrans-58137.7174.2-68.1-46.1000109V124V124-N126 PolarHBondContact O-N 3.13Å
127A68.1Low68.1Low79 Ų79106.9 Ų106.965%0.65366%0.663SS**PPolyproline II helixtrans-54.6140170.100000108.6T125 V129T125-A127 PolarHBondContact O-N 2.98Å; A127-V129 PolarHBondContact O-N 3.33Å
128P68Low67.8Low95 Ų95109.8 Ų109.862%0.61768%0.675SS**PPolyproline II helixtrans-52122.3175.5-22.331000108.8T130P128-T130 PolarHBondContact O-N 2.87Å
129V73.4Confident67.7Low134 Ų134107.4 Ų107.481%0.81265%0.654SS**  trans-65.1108.2173.3178.60000105.8A127 P131A127-V129 PolarHBondContact O-N 3.33Å; V129-P131 WeakPolarHBondContact O-CD 3.49Å; V129-P131 VanDerWaalsContact O-N 3.12Å
130T74Confident67.7Low118 Ų118112 Ų11272%0.72467%0.667SS**PPolyproline II helixtrans-58.6118.8171.950.20000107P128 K132P128-T130 PolarHBondContact O-N 2.87Å; T130-K132 PolarHBondContact O-N 3.48Å
131P70.4Confident68.2Low121 Ų121112.1 Ų112.179%0.78667%0.667SS**PPolyproline II helixtrans-56.9131-179.822.8-31.9000108.5V129 S133V129-P131 WeakPolarHBondContact O-CD 3.49Å; V129-P131 VanDerWaalsContact O-N 3.12Å; P131-S133 PolarHBondContact O-N 3.01Å
132K69.8Low69.1Low203 Ų203110.6 Ų110.688%0.88365%0.647SS**PPolyproline II helixtrans-60116.7175.2-73.3-178.6179.7178.60107.4T130 L134T130-K132 PolarHBondContact O-N 3.48Å; K132-L134 PolarHBondContact O-N 3.4Å
133S65.8Low70Confident105 Ų105109.9 Ų109.973%0.73464%0.642SS**PPolyproline II helixtrans-55.8137173-173.20000109.2P131 S135P131-S133 PolarHBondContact O-N 3.01Å; S133-S135 PolarHBondContact O-N 3.23Å; S133-S135 VanDerWaalsContact O-N 3.14Å
134L64.6Low71.1Confident157 Ų157110.5 Ų110.582%0.82265%0.649SS**  trans-64114.6171.7-62.2174.6000107K132K132-L134 PolarHBondContact O-N 3.4Å
135S62Low72.5Confident77 Ų77111.5 Ų111.554%0.53865%0.645SS.*  trans-82.5120.8174.7-170.30000108.9S133 D155S133-S135 PolarHBondContact O-N 3.23Å; S133-S135 VanDerWaalsContact O-N 3.14Å; S135-D155 PolarHBondContact OG-OD1 2.99Å
136A62.1Low73.7Confident50 Ų50109.9 Ų109.941%0.41363%0.633SS.*  trans-113.2115.1179.300000110D155 P156 H157A136-D155 PolarHBondContact N-OD1 2.96Å; A136-D155 PolarHBondContact N-OD2 3.13Å; A136-P156 WeakPolarHBondContact O-CD 3.35Å; A136-H157 HydrophobicContact CB-CB 4.47Å
137G66.3Low75Confident59 Ų59106.2 Ų106.261%0.60862%0.617SS**SBendtrans86.5-175.3177.700000113.9
138Q70.3Confident75.8Confident160 Ų160106 Ų10675%0.74862%0.621SS**  trans-86.1114.8178.9-165.5814.400108.6R140Q138-R140 PolarHBondContact O-N 3.34Å
139K71Confident76.8Confident88 Ų88108.7 Ų108.738%0.38363%0.626SS.*PPolyproline II helixtrans-57.4134.2171.4-65.3-167.9-175.7-168.50109.8T141 E152K139-T141 PolarHBondContact O-N 2.77Å; K139-E152 IonicContact NZ-OE2 3.16Å; K139-E152 PolarHBondContact NZ-OE2 3.36Å
140R76.3Confident77.5Confident168 Ų168107.3 Ų107.363%0.63461%0.609SS**PPolyproline II helixtrans-69.8129.5174.7-62.4-175.584.5176.26.2108.4Q138 F153 Y159Q138-R140 PolarHBondContact O-N 3.34Å; R140-F153 HydrophobicContact CB-CD2 4.34Å; R140-Y159 VanDerWaalsContact CD-OH 3.3Å; R140-Y159 WeakPolarHBondContact CD-OH 3.49Å
141T81.4Confident78.1Confident125 Ų125106.9 Ų106.977%0.76761%0.608SS**PPolyproline II helixtrans-73.2151.9170.6550000109.7K139K139-T141 PolarHBondContact O-N 2.77Å
142H85.8Confident78.8Confident47 Ų47107.6 Ų107.622%0.21860%0.601CS.*PPolyproline II helixtrans-56.4130.5173-74.3-40.3000111.1I146 F150 P151 F153H142-I146 HydrophobicContact CB-CB 4.09Å; H142-I146 HydrophobicContact CB-CG2 4.21Å; H142-F150 PolarHBondContact NE2-O 3.31Å; H142-P151 PolarHBondContact CE1-O 3.44Å; H142-P151 PolarHBondContact NE2-O 2.9Å; H142-F153 AromaticContact ND1-CD2 3.63Å; H142-F153 AromaticContact ND1-CE2 3.3Å; H142-F153 VanDerWaalsContact ND1-CE2 3.3Å; H142-F153 WeakPolarHBondContact ND1-CE2 3.45Å; H142-F153 AromaticContact ND1-CZ 3.83Å
143P86.6Confident79.5Confident53 Ų53101.5 Ų101.534%0.34458%0.575SS.*PPolyproline II helixtrans-54157.2165.2-26.933.9000111.7H145 I146P143-H145 WeakPolarHBondContact CB-CE1 3.39Å; P143-H145 WeakPolarHBondContact CB-ND1 3.47Å; P143-H145 PolarHBondContact O-N 3Å; P143-I146 HydrophobicContact CG-CD1 4.39Å; P143-I146 PolarHBondContact O-N 2.83Å
144S88.3Confident80.3Confident134 Ų13499.8 Ų99.894%0.93756%0.561SS**THydrogen-bonded Turntrans-59.1-22.1-177.753.10000115.1I146S144-I146 VanDerWaalsContact C-N 3.35Å
145H90.6Very high81Confident151 Ų15193.3 Ų93.370%0.69953%0.527SS*.THydrogen-bonded Turntrans-84.1-7176.764.4-95.6000113.7P143P143-H145 WeakPolarHBondContact CB-CE1 3.39Å; P143-H145 WeakPolarHBondContact CB-ND1 3.47Å; P143-H145 PolarHBondContact O-N 3Å
146I89.8Confident81.8Confident47 Ų4789.8 Ų89.824%0.24150%0.503CS..SBendtrans-106.4117.5177.3-55.1-171.6000108.6H142 P143 S144 F150 F153H142-I146 HydrophobicContact CB-CB 4.09Å; H142-I146 HydrophobicContact CB-CG2 4.21Å; P143-I146 HydrophobicContact CG-CD1 4.39Å; P143-I146 PolarHBondContact O-N 2.83Å; S144-I146 VanDerWaalsContact C-N 3.35Å; I146-F150 HydrophobicContact CG2-CB 4.2Å; I146-F150 HydrophobicContact CG2-CD2 4.21Å; I146-F150 HydrophobicContact CG2-CG 4.41Å; I146-F153 HydrophobicContact CD1-CZ 3.8Å
147P89.8Confident82.3Confident60 Ų6093.2 Ų93.239%0.3951%0.51SS..  trans-59.5141.5177-26.535.4000113.1H149 F150P147-H149 WeakPolarHBondContact CB-CE1 3.45Å; P147-H149 WeakPolarHBondContact CB-ND1 3.31Å; P147-H149 PolarHBondContact O-N 2.59Å; P147-F150 HydrophobicContact CB-CD2 3.86Å; P147-F150 HydrophobicContact CB-CE2 4Å; P147-F150 HydrophobicContact CG-CD2 4.07Å; P147-F150 HydrophobicContact CG-CE2 3.8Å; P147-F150 WeakPolarHBondContact O-CD2 3.19Å; P147-F150 PolarHBondContact O-N 2.99Å; P147-F150 VanDerWaalsContact O-N 3.16Å
148G85Confident82.9Confident73 Ų7395.3 Ų95.375%0.75351%0.511SS*.THydrogen-bonded Turntrans-67.5-6.6-177.500000116F150G148-F150 VanDerWaalsContact C-N 3.32Å
149H88.9Confident83.2Confident153 Ų15392.7 Ų92.771%0.70850%0.495SS*.THydrogen-bonded Turntrans-83.7-8.5175.164.2-100.4000113.2P147P147-H149 WeakPolarHBondContact CB-CE1 3.45Å; P147-H149 WeakPolarHBondContact CB-ND1 3.31Å; P147-H149 PolarHBondContact O-N 2.59Å
150F88.6Confident83.4Confident105 Ų10589.7 Ų89.746%0.46148%0.483SS..SBendtrans-72.7151173.4-78.9-82.5000111H142 I146 P147 G148 E152H142-F150 PolarHBondContact NE2-O 3.31Å; I146-F150 HydrophobicContact CG2-CB 4.2Å; I146-F150 HydrophobicContact CG2-CD2 4.21Å; I146-F150 HydrophobicContact CG2-CG 4.41Å; P147-F150 HydrophobicContact CB-CD2 3.86Å; P147-F150 HydrophobicContact CB-CE2 4Å; P147-F150 HydrophobicContact CG-CD2 4.07Å; P147-F150 HydrophobicContact CG-CE2 3.8Å; P147-F150 WeakPolarHBondContact O-CD2 3.19Å; P147-F150 PolarHBondContact O-N 2.99Å; P147-F150 VanDerWaalsContact O-N 3.16Å; G148-F150 VanDerWaalsContact C-N 3.32Å; F150-E152 PolarHBondContact O-N 3.24Å
151P87.5Confident83.2Confident108 Ų10888.6 Ų88.670%0.70148%0.482SS*.PPolyproline II helixtrans-49.4140.6174-25.533.9000111.6H142H142-P151 PolarHBondContact CE1-O 3.44Å; H142-P151 PolarHBondContact NE2-O 2.9Å
152E84.7Confident82.6Confident137 Ų13786 Ų8664%0.6447%0.466SS*.PPolyproline II helixtrans-57.8150.1173.9-65.8-178.117600110.6K139 F150K139-E152 IonicContact NZ-OE2 3.16Å; K139-E152 PolarHBondContact NZ-OE2 3.36Å; F150-E152 PolarHBondContact O-N 3.24Å
153F83.9Confident81.6Confident75 Ų7587 Ų8733%0.32948%0.477SS..PPolyproline II helixtrans-57.5146.2169.1-73.1-61.8000110.8R140 H142 I146R140-F153 HydrophobicContact CB-CD2 4.34Å; H142-F153 AromaticContact ND1-CD2 3.63Å; H142-F153 AromaticContact ND1-CE2 3.3Å; H142-F153 VanDerWaalsContact ND1-CE2 3.3Å; H142-F153 WeakPolarHBondContact ND1-CE2 3.45Å; H142-F153 AromaticContact ND1-CZ 3.83Å; I146-F153 HydrophobicContact CD1-CZ 3.8Å
154P83.4Confident80.7Confident68 Ų6888 Ų8844%0.44248%0.483SS..PPolyproline II helixtrans-57.7159.9174.424.2-32.7000110.9T158 Y159P154-T158 HydrophobicContact CB-CG2 4.04Å; P154-Y159 HydrophobicContact CG-CD1 4.04Å; P154-Y159 HydrophobicContact CG-CE1 4.32Å; P154-Y159 WeakPolarHBondContact O-CE1 3.47Å
155D79Confident79.7Confident21 Ų2188 Ų8811%0.11247%0.466CS..PPolyproline II helixtrans-61143.5-179.3-159.145.9000109.9S135 A136 H157 T158S135-D155 PolarHBondContact OG-OD1 2.99Å; A136-D155 PolarHBondContact N-OD1 2.96Å; A136-D155 PolarHBondContact N-OD2 3.13Å; D155-H157 PolarHBondContact O-N 3.5Å; D155-T158 PolarHBondContact N-OG1 2.77Å; D155-T158 WeakPolarHBondContact O-CB 3.41Å; D155-T158 PolarHBondContact O-N 3.13Å; D155-T158 PolarHBondContact O-OG1 2.97Å
156P79Confident78.7Confident4 Ų490.8 Ų90.83%0.02647%0.47CS..Hα-helixtrans-50.2-36.8-176.7-31.237.1000114A136 T158 Y159 I160A136-P156 WeakPolarHBondContact O-CD 3.35Å; P156-T158 PolarHBondContact O-N 3.38Å; P156-T158 VanDerWaalsContact O-N 3.1Å; P156-Y159 PolarHBondContact O-N 2.99Å; P156-I160 HydrophobicContact CB-CD1 4.01Å; P156-I160 HydrophobicContact CB-CG1 4.45Å; P156-I160 WeakPolarHBondContact O-CA 3.33Å; P156-I160 WeakPolarHBondContact O-CB 3.46Å; P156-I160 VanDerWaalsContact O-CG1 3.31Å; P156-I160 WeakPolarHBondContact O-CG1 3.33Å; P156-I160 PolarHBondContact O-N 3.04Å
157H71.9Confident77.5Confident122 Ų12294.4 Ų94.457%0.56549%0.486SS*.Hα-helixtrans-63.5-16.4178.2-165.668.2000114.3A136 D155 T162A136-H157 HydrophobicContact CB-CB 4.47Å; D155-H157 PolarHBondContact O-N 3.5Å; H157-T162 PolarHBondContact ND1-OG1 3.27Å
158T79.3Confident76.5Confident102 Ų10296 Ų9663%0.62650%0.496SS*.Hα-helixtrans-70.7-34.7177.1-42.90000112P154 D155 P156P154-T158 HydrophobicContact CB-CG2 4.04Å; D155-T158 PolarHBondContact N-OG1 2.77Å; D155-T158 WeakPolarHBondContact O-CB 3.41Å; D155-T158 PolarHBondContact O-N 3.13Å; D155-T158 PolarHBondContact O-OG1 2.97Å; P156-T158 PolarHBondContact O-N 3.38Å; P156-T158 VanDerWaalsContact O-N 3.1Å
159Y76.6Confident75.8Confident106 Ų10696.9 Ų96.942%0.41649%0.487SS..Hα-helixtrans-129.7-4.1-17463.9-90000113.6R140 P154 P156R140-Y159 VanDerWaalsContact CD-OH 3.3Å; R140-Y159 WeakPolarHBondContact CD-OH 3.49Å; P154-Y159 HydrophobicContact CG-CD1 4.04Å; P154-Y159 HydrophobicContact CG-CE1 4.32Å; P154-Y159 WeakPolarHBondContact O-CE1 3.47Å; P156-Y159 PolarHBondContact O-N 2.99Å
160I75.8Confident75Confident25 Ų2593.7 Ų93.713%0.12848%0.482CS..SBendtrans-111.8110.5176.1-54.3-171000108.4P156 T162 Y293P156-I160 HydrophobicContact CB-CD1 4.01Å; P156-I160 HydrophobicContact CB-CG1 4.45Å; P156-I160 WeakPolarHBondContact O-CA 3.33Å; P156-I160 WeakPolarHBondContact O-CB 3.46Å; P156-I160 VanDerWaalsContact O-CG1 3.31Å; P156-I160 WeakPolarHBondContact O-CG1 3.33Å; P156-I160 PolarHBondContact O-N 3.04Å; I160-T162 PolarHBondContact O-N 2.79Å; I160-Y293 HydrophobicContact CD1-CD1 4.05Å; I160-Y293 HydrophobicContact CD1-CD2 3.52Å; I160-Y293 HydrophobicContact CD1-CE1 4.35Å; I160-Y293 HydrophobicContact CD1-CE2 3.85Å; I160-Y293 HydrophobicContact CD1-CG 3.63Å; I160-Y293 HydrophobicContact CG2-CD1 4Å; I160-Y293 HydrophobicContact CG2-CG 3.86Å
161K71Confident74.9Confident145 Ų14593.9 Ų93.963%0.6349%0.488SS*.  trans-57.3112170-170.1-179.7-168.5-178.40108.4P163 E167K161-P163 WeakPolarHBondContact O-CD 3.41Å; K161-E167 IonicContact NZ-OE1 3.43Å; K161-E167 PolarHBondContact NZ-OE1 3.17Å
162T70.1Confident74.6Confident70 Ų7096 Ų9643%0.42948%0.483SS..  trans-73.4115.8175.9-590000108H157 I160 T164H157-T162 PolarHBondContact ND1-OG1 3.27Å; I160-T162 PolarHBondContact O-N 2.79Å; T162-T164 PolarHBondContact O-N 3.31Å
163P64.8Low74.8Confident67 Ų6796.8 Ų96.844%0.43549%0.487SS..  trans-64.4112.8-178.5-22.636.5000109.5K161 V297K161-P163 WeakPolarHBondContact O-CD 3.41Å; P163-V297 HydrophobicContact CB-CG2 3.25Å; P163-V297 WeakPolarHBondContact O-CG2 3.23Å
164T66.3Low75Confident76 Ų7696.2 Ų96.247%0.46649%0.489SS..  trans-97.9150.3178.354.50000110.3T162 R166T162-T164 PolarHBondContact O-N 3.31Å; T164-R166 VanDerWaalsContact C-N 3.34Å; T164-R166 PolarHBondContact O-N 3.44Å; T164-R166 PolarHBondContact OG1-O 3.23Å
165F67.6Low75.2Confident133 Ų13396.6 Ų96.658%0.58349%0.49SS*.SBendtrans-67.6-34.9-177.7173-104.3000113.1K299F165-K299 HydrophobicContact CE2-CD 4.42Å; F165-K299 HydrophobicContact CE2-CG 4.1Å
166R70.1Confident75.7Confident210 Ų210103.1 Ų103.179%0.79251%0.513SS*.SBendtrans-109.598.8168.6-72.7-174.3178.1176.8-0.6106.3T164 P168T164-R166 VanDerWaalsContact C-N 3.34Å; T164-R166 PolarHBondContact O-N 3.44Å; T164-R166 PolarHBondContact OG1-O 3.23Å; R166-P168 WeakPolarHBondContact O-CD 3.33Å
167E65.2Low76.3Confident122 Ų122108.6 Ų108.657%0.5754%0.538SS*.  trans-60.5127.1172.9-163.3159.7-15500107.9K161 V169K161-E167 IonicContact NZ-OE1 3.43Å; K161-E167 PolarHBondContact NZ-OE1 3.17Å; E167-V169 PolarHBondContact O-N 3.14Å
168P67.6Low77.3Confident94 Ų94110.2 Ų110.261%0.6154%0.544SS*.  trans-54138.2168.8-21.332000108.3R166 S170R166-P168 WeakPolarHBondContact O-CD 3.33Å; P168-S170 PolarHBondContact O-N 3.49Å
169V70.8Confident77.7Confident91 Ų91108 Ų10855%0.55254%0.535SS*.  trans-62.9101.8174.7-178.50000107.3E167 D171 V174 V175E167-V169 PolarHBondContact O-N 3.14Å; V169-D171 HydrophobicContact CG1-CB 4.26Å; V169-V174 HydrophobicContact CG1-CB 3.7Å; V169-V174 HydrophobicContact CG1-CG1 3.66Å; V169-V174 HydrophobicContact CG1-CG2 4.36Å; V169-V175 WeakPolarHBondContact O-CG2 3.3Å
170S71.4Confident78.4Confident87 Ų87105.8 Ų105.861%0.60854%0.54SS*.  trans-92.9-2.9178.257.10000112.4P168 Y172P168-S170 PolarHBondContact O-N 3.49Å; S170-Y172 PolarHBondContact O-N 3.05Å
171D85.9Confident79.4Confident108 Ų108107.8 Ų107.858%0.57855%0.553SS**  trans-65.2108175.8-71.7-19.8000109.4V169 Q173 V174 V175V169-D171 HydrophobicContact CG1-CB 4.26Å; D171-Q173 PolarHBondContact O-N 2.84Å; D171-Q173 VanDerWaalsContact O-N 3.14Å; D171-V174 HydrophobicContact CB-CB 4.16Å; D171-V174 HydrophobicContact CB-CG2 3.82Å; D171-V174 PolarHBondContact O-N 3.04Å; D171-V175 PolarHBondContact O-N 3.24Å
172Y81.5Confident80.5Confident152 Ų152107 Ų10760%0.59655%0.551SS**Hα-helixtrans-50.1-41.9-177.2-176.1-100.1000113.1S170 V174 V175 R176S170-Y172 PolarHBondContact O-N 3.05Å; Y172-V174 PolarHBondContact O-N 3.03Å; Y172-V175 PolarHBondContact O-N 3.14Å; Y172-R176 HydrophobicContact CD1-CG 4.48Å; Y172-R176 VanDerWaalsContact CE1-CD 3.49Å; Y172-R176 HydrophobicContact CE1-CG 4.26Å; Y172-R176 WeakPolarHBondContact O-CB 2.93Å; Y172-R176 PolarHBondContact O-N 2.73Å; Y172-R176 PolarHBondContact OH-NE 3.15Å; Y172-R176 VanDerWaalsContact OH-NE 3.17Å; Y172-R176 PolarHBondContact OH-NH1 2.92Å; Y172-R176 PolarHBondContact OH-NH2 3.24Å
173Q88.6Confident81.5Confident155 Ų155112.7 Ų112.772%0.72457%0.565SS**Hα-helixtrans-60.6-45.6177.9-175.1174-1.500111.8D171 R176 E177D171-Q173 PolarHBondContact O-N 2.84Å; D171-Q173 VanDerWaalsContact O-N 3.14Å; Q173-R176 PolarHBondContact O-N 2.91Å; Q173-E177 VanDerWaalsContact O-CB 3.31Å; Q173-E177 WeakPolarHBondContact O-CB 3.48Å; Q173-E177 PolarHBondContact O-N 3.18Å
174V89.1Confident83Confident63 Ų63116.3 Ų116.338%0.38257%0.57SS.*Hα-helixtrans-70.3-39-178.4-176.20000111.1V169 D171 Y172 E177 K178V169-V174 HydrophobicContact CG1-CB 3.7Å; V169-V174 HydrophobicContact CG1-CG1 3.66Å; V169-V174 HydrophobicContact CG1-CG2 4.36Å; D171-V174 HydrophobicContact CB-CB 4.16Å; D171-V174 HydrophobicContact CB-CG2 3.82Å; D171-V174 PolarHBondContact O-N 3.04Å; Y172-V174 PolarHBondContact O-N 3.03Å; V174-E177 PolarHBondContact O-N 3.34Å; V174-K178 WeakPolarHBondContact O-CB 3.34Å; V174-K178 PolarHBondContact O-N 2.85Å
175V87Confident84.4Confident76 Ų76116.7 Ų116.746%0.46157%0.569SS.*Hα-helixtrans-62.4-47.9176.1176.10000110.5V169 D171 Y172 K178 A179V169-V175 WeakPolarHBondContact O-CG2 3.3Å; D171-V175 PolarHBondContact O-N 3.24Å; Y172-V175 PolarHBondContact O-N 3.14Å; V175-K178 PolarHBondContact O-N 3.29Å; V175-A179 WeakPolarHBondContact O-CB 3.34Å; V175-A179 PolarHBondContact O-N 3Å
176R89.4Confident85.7Confident157 Ų157114.6 Ų114.659%0.59257%0.567SS**Hα-helixtrans-64.2-41.7177-80.2-163.1164.5-174.1-5.1112.7Y172 Q173 K178 A179 A180Y172-R176 HydrophobicContact CD1-CG 4.48Å; Y172-R176 VanDerWaalsContact CE1-CD 3.49Å; Y172-R176 HydrophobicContact CE1-CG 4.26Å; Y172-R176 WeakPolarHBondContact O-CB 2.93Å; Y172-R176 PolarHBondContact O-N 2.73Å; Y172-R176 PolarHBondContact OH-NE 3.15Å; Y172-R176 VanDerWaalsContact OH-NE 3.17Å; Y172-R176 PolarHBondContact OH-NH1 2.92Å; Y172-R176 PolarHBondContact OH-NH2 3.24Å; Q173-R176 PolarHBondContact O-N 2.91Å; R176-K178 VanDerWaalsContact C-N 3.34Å; R176-K178 PolarHBondContact O-N 2.76Å; R176-A179 PolarHBondContact O-N 3.11Å; R176-A180 WeakPolarHBondContact O-CB 3.33Å; R176-A180 PolarHBondContact O-N 3.01Å
177E92.3Very high86.7Confident120 Ų120110.4 Ų110.456%0.56156%0.556SS**Hα-helixtrans-61.2-43.4176.5-176.4179.2178.900111.5Q173 V174 A180 T181Q173-E177 VanDerWaalsContact O-CB 3.31Å; Q173-E177 WeakPolarHBondContact O-CB 3.48Å; Q173-E177 PolarHBondContact O-N 3.18Å; V174-E177 PolarHBondContact O-N 3.34Å; E177-A180 PolarHBondContact O-N 3.38Å; E177-T181 WeakPolarHBondContact O-CB 3.35Å; E177-T181 PolarHBondContact O-N 3.5Å; E177-T181 PolarHBondContact O-OG1 2.8Å
178K92.4Very high88Confident155 Ų155110 Ų11067%0.67455%0.55SS*.Hα-helixtrans-65.6-43.9177.8-172.8180179-174.80111.9V174 V175 R176 T181 Q182V174-K178 WeakPolarHBondContact O-CB 3.34Å; V174-K178 PolarHBondContact O-N 2.85Å; V175-K178 PolarHBondContact O-N 3.29Å; R176-K178 VanDerWaalsContact C-N 3.34Å; R176-K178 PolarHBondContact O-N 2.76Å; K178-T181 PolarHBondContact O-N 3.01Å; K178-Q182 WeakPolarHBondContact O-CB 3.07Å; K178-Q182 PolarHBondContact O-N 2.61Å
179A89Confident89.2Confident55 Ų55108.3 Ų108.346%0.45554%0.544SS..Hα-helixtrans-62.6-44.5176.300000111.8V175 R176 Q182 R183V175-A179 WeakPolarHBondContact O-CB 3.34Å; V175-A179 PolarHBondContact O-N 3Å; R176-A179 PolarHBondContact O-N 3.11Å; A179-Q182 PolarHBondContact O-N 3.47Å; A179-R183 WeakPolarHBondContact O-CB 3.23Å; A179-R183 PolarHBondContact O-N 3.19Å
180A91.6Very high90.2Very high61 Ų61108.7 Ų108.750%0.50454%0.542SS..Hα-helixtrans-63.9-41.2176.400000112.1R176 E177 R183 R184R176-A180 WeakPolarHBondContact O-CB 3.33Å; R176-A180 PolarHBondContact O-N 3.01Å; E177-A180 PolarHBondContact O-N 3.38Å; A180-R183 PolarHBondContact O-N 2.78Å; A180-R184 WeakPolarHBondContact O-CB 3.38Å; A180-R184 PolarHBondContact O-N 3.2Å
181T95.3Very high91.1Very high66 Ų66107.8 Ų107.841%0.40553%0.533SS..Hα-helixtrans-62.2-47.4175.3-58.70000110.9E177 K178 R183 R184 D185E177-T181 WeakPolarHBondContact O-CB 3.35Å; E177-T181 PolarHBondContact O-N 3.5Å; E177-T181 PolarHBondContact O-OG1 2.8Å; K178-T181 PolarHBondContact O-N 3.01Å; T181-R183 VanDerWaalsContact C-N 3.35Å; T181-R183 PolarHBondContact O-N 3.49Å; T181-R184 PolarHBondContact O-N 3.47Å; T181-D185 PolarHBondContact O-N 3.1Å
182Q94.3Very high91.3Very high128 Ų128111.7 Ų111.760%0.59854%0.54SS*.Hα-helixtrans-59.5-44175.9-175.9177.2-0.500111.7K178 A179 R184 D185 V186K178-Q182 WeakPolarHBondContact O-CB 3.07Å; K178-Q182 PolarHBondContact O-N 2.61Å; A179-Q182 PolarHBondContact O-N 3.47Å; Q182-R184 PolarHBondContact O-N 3.46Å; Q182-D185 PolarHBondContact O-N 3.46Å; Q182-V186 VanDerWaalsContact O-CG2 3.29Å; Q182-V186 WeakPolarHBondContact O-CG2 3.14Å; Q182-V186 PolarHBondContact O-N 2.83Å
183R91.6Very high91.8Very high190 Ų190110.6 Ų110.672%0.71754%0.538SS*.Hα-helixtrans-58.1-47.2175.8-177175.5177.5137.2-0.4111.5A179 A180 T181 D185 V186 E187A179-R183 WeakPolarHBondContact O-CB 3.23Å; A179-R183 PolarHBondContact O-N 3.19Å; A180-R183 PolarHBondContact O-N 2.78Å; T181-R183 VanDerWaalsContact C-N 3.35Å; T181-R183 PolarHBondContact O-N 3.49Å; R183-D185 VanDerWaalsContact C-N 3.35Å; R183-D185 PolarHBondContact O-N 2.74Å; R183-V186 PolarHBondContact O-N 2.78Å; R183-E187 WeakPolarHBondContact O-CB 3.31Å; R183-E187 PolarHBondContact O-N 3.21Å
184R95.7Very high92Very high143 Ų143107.4 Ų107.454%0.5452%0.524SS..Hα-helixtrans-62.6-40.2177.8-174-177.3179.9105.2-4112.2A180 T181 Q182 R188A180-R184 WeakPolarHBondContact O-CB 3.38Å; A180-R184 PolarHBondContact O-N 3.2Å; T181-R184 PolarHBondContact O-N 3.47Å; Q182-R184 PolarHBondContact O-N 3.46Å; R184-R188 VanDerWaalsContact NE-CZ 3.26Å; R184-R188 WeakPolarHBondContact O-CB 3.11Å; R184-R188 WeakPolarHBondContact O-CD 3.48Å; R184-R188 VanDerWaalsContact O-CG 3.23Å; R184-R188 WeakPolarHBondContact O-CG 3.29Å; R184-R188 PolarHBondContact O-N 2.99Å
185D95.7Very high92Very high85 Ų85104.9 Ų104.946%0.45551%0.51SS..Hα-helixtrans-69.4-40.7179.4-73.3-19.4000111.8T181 Q182 R183 R188 A189T181-D185 PolarHBondContact O-N 3.1Å; Q182-D185 PolarHBondContact O-N 3.46Å; R183-D185 VanDerWaalsContact C-N 3.35Å; R183-D185 PolarHBondContact O-N 2.74Å; D185-R188 PolarHBondContact O-N 2.63Å; D185-A189 VanDerWaalsContact O-CB 3.27Å; D185-A189 WeakPolarHBondContact O-CB 3.4Å; D185-A189 PolarHBondContact O-N 3.06Å
186V95.1Very high92.1Very high88 Ų88110.2 Ų110.253%0.53353%0.527SS..Hα-helixtrans-61.9-47.7173.4170.80000110.8Q182 R183 R188 A189 L190Q182-V186 VanDerWaalsContact O-CG2 3.29Å; Q182-V186 WeakPolarHBondContact O-CG2 3.14Å; Q182-V186 PolarHBondContact O-N 2.83Å; R183-V186 PolarHBondContact O-N 2.78Å; V186-R188 PolarHBondContact O-N 3.05Å; V186-A189 PolarHBondContact O-N 2.78Å; V186-L190 WeakPolarHBondContact O-CB 3.49Å; V186-L190 PolarHBondContact O-N 3.25Å
187E91.4Very high92.2Very high122 Ų122107.1 Ų107.157%0.5753%0.526SS*.Hα-helixtrans-58.5-46.5177.7-175.1-172.4158.200111.5R183 L190 T191R183-E187 WeakPolarHBondContact O-CB 3.31Å; R183-E187 PolarHBondContact O-N 3.21Å; E187-L190 PolarHBondContact O-N 3.28Å; E187-T191 VanDerWaalsContact O-CB 3.31Å; E187-T191 WeakPolarHBondContact O-CB 3.16Å; E187-T191 PolarHBondContact O-N 3.23Å; E187-T191 PolarHBondContact O-OG1 2.86Å
188R92.1Very high91.9Very high114 Ų114103 Ų10343%0.4352%0.515SS..Hα-helixtrans-63.5-42.7176.5-76.4169.7166.9-170.7-12.2112.3R184 D185 V186 R192R184-R188 VanDerWaalsContact NE-CZ 3.26Å; R184-R188 WeakPolarHBondContact O-CB 3.11Å; R184-R188 WeakPolarHBondContact O-CD 3.48Å; R184-R188 VanDerWaalsContact O-CG 3.23Å; R184-R188 WeakPolarHBondContact O-CG 3.29Å; R184-R188 PolarHBondContact O-N 2.99Å; D185-R188 PolarHBondContact O-N 2.63Å; V186-R188 PolarHBondContact O-N 3.05Å; R188-R192 WeakPolarHBondContact O-CB 3.38Å; R188-R192 VanDerWaalsContact O-CG 3.25Å; R188-R192 WeakPolarHBondContact O-CG 3.33Å; R188-R192 PolarHBondContact O-N 2.93Å
189A93.6Very high91.8Very high59 Ų59101.8 Ų101.849%0.48851%0.512SS..Hα-helixtrans-63.8-45.917900000111.1D185 V186 R192 F193D185-A189 VanDerWaalsContact O-CB 3.27Å; D185-A189 WeakPolarHBondContact O-CB 3.4Å; D185-A189 PolarHBondContact O-N 3.06Å; V186-A189 PolarHBondContact O-N 2.78Å; A189-R192 PolarHBondContact O-N 3.22Å; A189-F193 WeakPolarHBondContact O-CB 3.37Å; A189-F193 PolarHBondContact O-N 3.24Å
190L92.3Very high91.8Very high99 Ų99102.1 Ų102.152%0.51851%0.509SS..Hα-helixtrans-64.1-45.4177.2-179.459.9000111.6V186 E187 R192 F193 M194V186-L190 WeakPolarHBondContact O-CB 3.49Å; V186-L190 PolarHBondContact O-N 3.25Å; E187-L190 PolarHBondContact O-N 3.28Å; L190-R192 VanDerWaalsContact C-N 3.33Å; L190-R192 PolarHBondContact O-N 2.89Å; L190-F193 WeakPolarHBondContact O-CB 3.38Å; L190-F193 PolarHBondContact O-N 2.95Å; L190-F193 VanDerWaalsContact O-N 3.14Å; L190-M194 HydrophobicContact CD1-CG 4.22Å; L190-M194 HydrophobicContact CD1-SD 4.48Å; L190-M194 HydrophobicContact CG-SD 4.47Å; L190-M194 WeakPolarHBondContact O-CG 3.48Å; L190-M194 PolarHBondContact O-N 3.41Å
191T90.3Very high91.6Very high67 Ų67105.1 Ų105.141%0.41151%0.512SS..Hα-helixtrans-57.8-46.8176.9-58.40000111E187 F193 M194 A195E187-T191 VanDerWaalsContact O-CB 3.31Å; E187-T191 WeakPolarHBondContact O-CB 3.16Å; E187-T191 PolarHBondContact O-N 3.23Å; E187-T191 PolarHBondContact O-OG1 2.86Å; T191-F193 VanDerWaalsContact C-N 3.34Å; T191-F193 PolarHBondContact O-N 3.41Å; T191-M194 PolarHBondContact O-N 3.44Å; T191-A195 VanDerWaalsContact O-CB 3.26Å; T191-A195 WeakPolarHBondContact O-CB 3.44Å; T191-A195 PolarHBondContact O-N 3.04Å
192R89.7Confident91.1Very high190 Ų190104 Ų10472%0.71751%0.507SS*.Hα-helixtrans-63.3-39.1176.4-74.4172.4177.9176.8-0.9112.3R188 A189 L190 K196R188-R192 WeakPolarHBondContact O-CB 3.38Å; R188-R192 VanDerWaalsContact O-CG 3.25Å; R188-R192 WeakPolarHBondContact O-CG 3.33Å; R188-R192 PolarHBondContact O-N 2.93Å; A189-R192 PolarHBondContact O-N 3.22Å; L190-R192 VanDerWaalsContact C-N 3.33Å; L190-R192 PolarHBondContact O-N 2.89Å; R192-K196 VanDerWaalsContact O-CB 3.31Å; R192-K196 WeakPolarHBondContact O-CB 3.45Å; R192-K196 PolarHBondContact O-N 3.06Å
193F92.4Very high90.7Very high130 Ų130103.2 Ų103.257%0.5751%0.506SS*.Hα-helixtrans-64-48.8177.1175.1-98.1000111.5A189 L190 T191 K196 T197A189-F193 WeakPolarHBondContact O-CB 3.37Å; A189-F193 PolarHBondContact O-N 3.24Å; L190-F193 WeakPolarHBondContact O-CB 3.38Å; L190-F193 PolarHBondContact O-N 2.95Å; L190-F193 VanDerWaalsContact O-N 3.14Å; T191-F193 VanDerWaalsContact C-N 3.34Å; T191-F193 PolarHBondContact O-N 3.41Å; F193-K196 PolarHBondContact O-N 3.15Å; F193-T197 HydrophobicContact CD2-CG2 4.21Å; F193-T197 HydrophobicContact CE1-CG2 4.32Å; F193-T197 HydrophobicContact CE2-CG2 3.82Å; F193-T197 HydrophobicContact CZ-CG2 3.88Å; F193-T197 WeakPolarHBondContact O-CB 3.3Å; F193-T197 WeakPolarHBondContact O-CG2 3.32Å; F193-T197 PolarHBondContact O-N 3.36Å; F193-T197 PolarHBondContact O-OG1 2.94Å
194M92.4Very high90.4Very high88 Ų8899.1 Ų99.143%0.43349%0.494SS..Hα-helixtrans-63.7-42.2177.4-70.4-169.474.600111.9L190 T191 K196 T197 G198 I214L190-M194 HydrophobicContact CD1-CG 4.22Å; L190-M194 HydrophobicContact CD1-SD 4.48Å; L190-M194 HydrophobicContact CG-SD 4.47Å; L190-M194 WeakPolarHBondContact O-CG 3.48Å; L190-M194 PolarHBondContact O-N 3.41Å; T191-M194 PolarHBondContact O-N 3.44Å; M194-K196 VanDerWaalsContact C-N 3.28Å; M194-K196 PolarHBondContact O-N 3.08Å; M194-T197 PolarHBondContact O-N 3.29Å; M194-T197 PolarHBondContact O-OG1 3.41Å; M194-G198 PolarHBondContact O-N 3.26Å; M194-I214 HydrophobicContact CB-CD1 3.64Å; M194-I214 HydrophobicContact CB-CG1 4.21Å; M194-I214 HydrophobicContact CE-CD1 4.32Å; M194-I214 HydrophobicContact SD-CD1 4.15Å
195A88.9Confident89.7Confident9 Ų9101.8 Ų101.87%0.07451%0.509CS..Hα-helixtrans-62.6-33.817500000112.5T191 T200 P212T191-A195 VanDerWaalsContact O-CB 3.26Å; T191-A195 WeakPolarHBondContact O-CB 3.44Å; T191-A195 PolarHBondContact O-N 3.04Å; A195-T200 HydrophobicContact CB-CG2 4.02Å; A195-T200 WeakPolarHBondContact O-CG2 3.47Å; A195-P212 HydrophobicContact CB-CB 4.18Å; A195-P212 HydrophobicContact CB-CG 4.11Å; A195-P212 WeakPolarHBondContact CB-O 3.44Å
196K88.5Confident89Confident189 Ų189105.7 Ų105.782%0.82253%0.53SS*.Hα-helixtrans-79.3-26.8178.6-170.1171.6-178.1-179.90113.7R192 F193 M194R192-K196 VanDerWaalsContact O-CB 3.31Å; R192-K196 WeakPolarHBondContact O-CB 3.45Å; R192-K196 PolarHBondContact O-N 3.06Å; F193-K196 PolarHBondContact O-N 3.15Å; M194-K196 VanDerWaalsContact C-N 3.28Å; M194-K196 PolarHBondContact O-N 3.08Å
197T91.1Very high88.2Confident92 Ų92104.8 Ų104.856%0.56452%0.522SS*.Hα-helixtrans-101-24.3-17451.90000113.6F193 M194F193-T197 HydrophobicContact CD2-CG2 4.21Å; F193-T197 HydrophobicContact CE1-CG2 4.32Å; F193-T197 HydrophobicContact CE2-CG2 3.82Å; F193-T197 HydrophobicContact CZ-CG2 3.88Å; F193-T197 WeakPolarHBondContact O-CB 3.3Å; F193-T197 WeakPolarHBondContact O-CG2 3.32Å; F193-T197 PolarHBondContact O-N 3.36Å; F193-T197 PolarHBondContact O-OG1 2.94Å; M194-T197 PolarHBondContact O-N 3.29Å; M194-T197 PolarHBondContact O-OG1 3.41Å
198G87.6Confident87.3Confident33 Ų33104.8 Ų104.834%0.3453%0.525SS..SBendtrans-103.3-177.4-177.400000114.1M194M194-G198 PolarHBondContact O-N 3.26Å
199E89.1Confident86.5Confident129 Ų129104.1 Ų104.160%0.60354%0.538SS*.  trans-69.7134.6169.5-69.5168.8-155.400109.7A215E199-A215 HydrophobicContact CB-CB 3.77Å; E199-A215 VanDerWaalsContact O-CB 3.3Å; E199-A215 WeakPolarHBondContact O-CB 3.29Å; E199-A215 PolarHBondContact O-N 3.04Å
200T88.8Confident85.9Confident63 Ų63103.3 Ų103.339%0.38753%0.531SS..EExtended strand (participates in β ladder)trans-125.5151.2-179.447.20000112.2A195 P212 L213A195-T200 HydrophobicContact CB-CG2 4.02Å; A195-T200 WeakPolarHBondContact O-CG2 3.47Å; T200-P212 HydrophobicContact CG2-CB 4.17Å; T200-L213 CarbonylContact C-O 3.48Å; T200-L213 WeakPolarHBondContact CA-O 3.32Å; T200-L213 WeakPolarHBondContact CB-O 3.27Å; T200-L213 WeakPolarHBondContact CG2-O 3.37Å
201Q86.9Confident85.4Confident123 Ų123104.1 Ų104.158%0.57553%0.531SS*.EExtended strand (participates in β ladder)trans-120.5127.8169.3-64.7-178.314.900107.8L213 A215Q201-L213 PolarHBondContact N-O 2.96Å; Q201-L213 WeakPolarHBondContact O-CB 3.37Å; Q201-L213 PolarHBondContact O-N 3.18Å; Q201-A215 HydrophobicContact CG-CB 3.98Å
202S86.3Confident85.2Confident43 Ų43103.4 Ų103.430%0.30153%0.527SS..EExtended strand (participates in β ladder)trans-84.4142.3176.3-176.20000110.5F204 D207S202-F204 VanDerWaalsContact C-N 3.33Å; S202-F204 WeakPolarHBondContact CB-O 3.18Å; S202-F204 PolarHBondContact OG-N 3.34Å; S202-F204 PolarHBondContact OG-O 3.34Å; S202-D207 PolarHBondContact OG-O 2.99Å
203L84.6Confident85.1Confident111 Ų11198.7 Ų98.758%0.58152%0.516SS*.SBendtrans-69.1-34.1171.2-159.289.2000111.8F211 L213L203-F211 HydrophobicContact CB-CB 4.44Å; L203-L213 HydrophobicContact CD1-CD1 4.01Å
204F87.1Confident85Confident104 Ų10496.6 Ų96.646%0.45651%0.51SS..  trans-115.5136.1-178.1-58-67.2000110.6S202 D206 F211S202-F204 VanDerWaalsContact C-N 3.33Å; S202-F204 WeakPolarHBondContact CB-O 3.18Å; S202-F204 PolarHBondContact OG-N 3.34Å; S202-F204 PolarHBondContact OG-O 3.34Å; F204-D206 VanDerWaalsContact C-N 3.29Å; F204-D206 PolarHBondContact O-N 3.37Å; F204-F211 AromaticContact CD2-CD2 3.98Å; F204-F211 HydrophobicContact CD2-CD2 3.98Å; F204-F211 AromaticContact CE2-CD2 3.69Å; F204-F211 HydrophobicContact CE2-CD2 3.69Å; F204-F211 AromaticContact CE2-CE2 3.91Å; F204-F211 HydrophobicContact CE2-CE2 3.91Å
205K80.1Confident84.8Confident199 Ų19992.9 Ų92.987%0.86549%0.493SS*.SBendtrans-69-31.2179.4-64.4-176.1176.11790112.3
206D81.3Confident84.7Confident167 Ų16796.5 Ų96.589%0.89352%0.523SS*.SBendtrans-95-17.8-172.9-52.5-41.3000113.1F204F204-D206 VanDerWaalsContact C-N 3.29Å; F204-D206 PolarHBondContact O-N 3.37Å
207D78.1Confident84.7Confident69 Ų6996.3 Ų96.337%0.36952%0.517SS..  trans-130.387.2177.1-165.9-13.3000111.2S202 S209 A210S202-D207 PolarHBondContact OG-O 2.99Å; D207-S209 PolarHBondContact O-N 2.89Å; D207-S209 PolarHBondContact OD1-N 2.97Å; D207-S209 VanDerWaalsContact OD1-N 3.07Å; D207-S209 PolarHBondContact OD1-OG 3.27Å; D207-A210 HydrophobicContact CB-CB 4.41Å; D207-A210 PolarHBondContact OD1-N 3.44Å; D207-A210 VanDerWaalsContact OD2-CB 3.3Å; D207-A210 WeakPolarHBondContact OD2-CB 3.46Å
208I71.3Confident84.4Confident122 Ų12298.4 Ų98.463%0.62653%0.533SS*.THydrogen-bonded Turntrans-72.6-14.6-179.5-45.8170.4000110.9
209S77.1Confident84.4Confident100 Ų100100.1 Ų100.170%0.69954%0.539SS*.THydrogen-bonded Turntrans-99.3-26.9-170.773.90000114.3D207D207-S209 PolarHBondContact O-N 2.89Å; D207-S209 PolarHBondContact OD1-N 2.97Å; D207-S209 VanDerWaalsContact OD1-N 3.07Å; D207-S209 PolarHBondContact OD1-OG 3.27Å
210A79.3Confident84.4Confident43 Ų43100.7 Ų100.736%0.35555%0.552SS.*THydrogen-bonded Turntrans-69.2-39.7-175.700000113.3D207D207-A210 HydrophobicContact CB-CB 4.41Å; D207-A210 PolarHBondContact OD1-N 3.44Å; D207-A210 VanDerWaalsContact OD2-CB 3.3Å; D207-A210 WeakPolarHBondContact OD2-CB 3.46Å
211F83.1Confident84.5Confident116 Ų116100.9 Ų100.951%0.50955%0.549SS..  trans-141.771.9-175.1-58.8-78.4000112.6L203 F204 L213L203-F211 HydrophobicContact CB-CB 4.44Å; F204-F211 AromaticContact CD2-CD2 3.98Å; F204-F211 HydrophobicContact CD2-CD2 3.98Å; F204-F211 AromaticContact CE2-CD2 3.69Å; F204-F211 HydrophobicContact CE2-CD2 3.69Å; F204-F211 AromaticContact CE2-CE2 3.91Å; F204-F211 HydrophobicContact CE2-CE2 3.91Å; F211-L213 PolarHBondContact O-N 3.45Å; F211-L213 VanDerWaalsContact O-N 3.14Å
212P85.1Confident84.5Confident52 Ų5298.7 Ų98.734%0.33855%0.546SS..EExtended strand (participates in β ladder)trans-76101.3176.231.4-33.8000110.1A195 T200A195-P212 HydrophobicContact CB-CB 4.18Å; A195-P212 HydrophobicContact CB-CG 4.11Å; A195-P212 WeakPolarHBondContact CB-O 3.44Å; T200-P212 HydrophobicContact CG2-CB 4.17Å
213L88.9Confident84.7Confident91 Ų91103.5 Ų103.548%0.47656%0.559SS.*EExtended strand (participates in β ladder)trans-83.6142.9176.8-58.4174.1000110.1T200 Q201 L203 F211 A215T200-L213 CarbonylContact C-O 3.48Å; T200-L213 WeakPolarHBondContact CA-O 3.32Å; T200-L213 WeakPolarHBondContact CB-O 3.27Å; T200-L213 WeakPolarHBondContact CG2-O 3.37Å; Q201-L213 PolarHBondContact N-O 2.96Å; Q201-L213 WeakPolarHBondContact O-CB 3.37Å; Q201-L213 PolarHBondContact O-N 3.18Å; L203-L213 HydrophobicContact CD1-CD1 4.01Å; F211-L213 PolarHBondContact O-N 3.45Å; F211-L213 VanDerWaalsContact O-N 3.14Å; L213-A215 PolarHBondContact O-N 3.36Å
214I89.7Confident84.8Confident85 Ų85102 Ų10244%0.43655%0.551SS.*EExtended strand (participates in β ladder)trans-66.9126175.7-58.8167.5000108.4M194M194-I214 HydrophobicContact CB-CD1 3.64Å; M194-I214 HydrophobicContact CB-CG1 4.21Å; M194-I214 HydrophobicContact CE-CD1 4.32Å; M194-I214 HydrophobicContact SD-CD1 4.15Å
215A88.9Confident84.7Confident10 Ų10101.5 Ų101.58%0.08356%0.56CS.*PPolyproline II helixtrans-65.8140.3-179.500000111.4E199 Q201 L213 R217E199-A215 HydrophobicContact CB-CB 3.77Å; E199-A215 VanDerWaalsContact O-CB 3.3Å; E199-A215 WeakPolarHBondContact O-CB 3.29Å; E199-A215 PolarHBondContact O-N 3.04Å; Q201-A215 HydrophobicContact CG-CB 3.98Å; L213-A215 PolarHBondContact O-N 3.36Å; A215-R217 PolarHBondContact O-N 2.68Å
216A86.9Confident85Confident86 Ų8696 Ų9671%0.71155%0.552SS**PPolyproline II helixtrans-65.2127.6177.200000110.7
217R86.8Confident85.4Confident185 Ų18594.7 Ų94.770%0.69854%0.544SS*.  trans-101.7111.7172.7-74.1-174.4171.8166.7-1.4109.8A215 S219A215-R217 PolarHBondContact O-N 2.68Å; R217-S219 PolarHBondContact O-N 2.92Å
218P86.3Confident85.8Confident136 Ų13696.5 Ų96.588%0.88355%0.553SS**  trans-65.1126.2177.224.6-30.4000110.1
219S86.4Confident86.4Confident68 Ų6894 Ų9448%0.47655%0.545SS..  trans-98.3142.7173.3176.10000109.8R217 I221R217-S219 PolarHBondContact O-N 2.92Å; S219-I221 PolarHBondContact O-N 3.44Å; S219-I221 PolarHBondContact OG-N 2.89Å
220T89.6Confident86.5Confident142 Ų14291.8 Ų91.887%0.87153%0.53SS*.SBendtrans-69-21.7175.751.60000112.5
221I90.8Very high86.4Confident66 Ų6698 Ų9834%0.33855%0.551SS.*  trans-136.274.3-178.4-45.3-179.9000109.8S219 Y223 L224S219-I221 PolarHBondContact O-N 3.44Å; S219-I221 PolarHBondContact OG-N 2.89Å; I221-Y223 VanDerWaalsContact C-N 3.33Å; I221-Y223 HydrophobicContact CG2-CD1 3.95Å; I221-Y223 HydrophobicContact CG2-CD2 4.24Å; I221-Y223 HydrophobicContact CG2-CE1 3.36Å; I221-Y223 HydrophobicContact CG2-CE2 3.7Å; I221-Y223 HydrophobicContact CG2-CG 4.35Å; I221-Y223 WeakPolarHBondContact CG2-OH 3.22Å; I221-Y223 PolarHBondContact O-N 3.5Å; I221-L224 HydrophobicContact CB-CD1 4.39Å; I221-L224 HydrophobicContact CD1-CD1 4.41Å; I221-L224 HydrophobicContact CG2-CB 4.17Å; I221-L224 HydrophobicContact CG2-CD1 3.68Å; I221-L224 HydrophobicContact CG2-CG 3.67Å; I221-L224 PolarHBondContact O-N 3.32Å
222P87.5Confident86Confident78 Ų7898.6 Ų98.651%0.50656%0.559SS.*Hα-helixtrans-68.9-28.8-170.827-35000113.6L224 S225 A226P222-L224 VanDerWaalsContact C-N 3.32Å; P222-L224 PolarHBondContact O-N 3.14Å; P222-S225 PolarHBondContact O-OG 3.14Å; P222-S225 VanDerWaalsContact O-OG 3.13Å; P222-A226 PolarHBondContact O-N 3.39Å
223Y89.1Confident85.7Confident143 Ų143101 Ų10156%0.56157%0.566SS**Hα-helixtrans-69.1-29.1-177.659.7-96.8000112.8I221 L227I221-Y223 VanDerWaalsContact C-N 3.33Å; I221-Y223 HydrophobicContact CG2-CD1 3.95Å; I221-Y223 HydrophobicContact CG2-CD2 4.24Å; I221-Y223 HydrophobicContact CG2-CE1 3.36Å; I221-Y223 HydrophobicContact CG2-CE2 3.7Å; I221-Y223 HydrophobicContact CG2-CG 4.35Å; I221-Y223 WeakPolarHBondContact CG2-OH 3.22Å; I221-Y223 PolarHBondContact O-N 3.5Å; Y223-L227 VanDerWaalsContact O-CB 3.24Å; Y223-L227 WeakPolarHBondContact O-CB 3.47Å; Y223-L227 VanDerWaalsContact O-CG 3.27Å; Y223-L227 WeakPolarHBondContact O-CG 3.42Å; Y223-L227 PolarHBondContact O-N 3.15Å
224L88.1Confident85.3Confident81 Ų81100.7 Ų100.742%0.42456%0.564SS.*Hα-helixtrans-67-47.4178.6-76.1-178.7000111.3I221 P222 A226 L228I221-L224 HydrophobicContact CB-CD1 4.39Å; I221-L224 HydrophobicContact CD1-CD1 4.41Å; I221-L224 HydrophobicContact CG2-CB 4.17Å; I221-L224 HydrophobicContact CG2-CD1 3.68Å; I221-L224 HydrophobicContact CG2-CG 3.67Å; I221-L224 PolarHBondContact O-N 3.32Å; P222-L224 VanDerWaalsContact C-N 3.32Å; P222-L224 PolarHBondContact O-N 3.14Å; L224-A226 VanDerWaalsContact C-N 3.29Å; L224-A226 PolarHBondContact O-N 2.96Å; L224-L228 HydrophobicContact CB-CD1 4.37Å; L224-L228 HydrophobicContact CD2-CD1 4.29Å; L224-L228 WeakPolarHBondContact O-CB 3.26Å; L224-L228 WeakPolarHBondContact O-CG 3.49Å; L224-L228 PolarHBondContact O-N 3.27Å
225S85Confident84.6Confident92 Ų92101.8 Ų101.864%0.64357%0.567SS**Hα-helixtrans-70.4-24.2179.453.50000113.8P222P222-S225 PolarHBondContact O-OG 3.14Å; P222-S225 VanDerWaalsContact O-OG 3.13Å
226A86.8Confident84Confident84 Ų84104.1 Ų104.169%0.69458%0.581SS**Hα-helixtrans-86.7-27.2179.900000113.2P222 L224P222-A226 PolarHBondContact O-N 3.39Å; L224-A226 VanDerWaalsContact C-N 3.29Å; L224-A226 PolarHBondContact O-N 2.96Å
227L88.7Confident83.3Confident140 Ų140105.1 Ų105.173%0.73357%0.573SS**Hα-helixtrans-99.6-22.3-178.4-66.8171.4000113.5Y223Y223-L227 VanDerWaalsContact O-CB 3.24Å; Y223-L227 WeakPolarHBondContact O-CB 3.47Å; Y223-L227 VanDerWaalsContact O-CG 3.27Å; Y223-L227 WeakPolarHBondContact O-CG 3.42Å; Y223-L227 PolarHBondContact O-N 3.15Å
228L86.3Confident82.6Confident107 Ų107102.6 Ų102.656%0.5657%0.57SS**SBendtrans-86.8131.5176.5-64.4176.9000109.6L224 S230L224-L228 HydrophobicContact CB-CD1 4.37Å; L224-L228 HydrophobicContact CD2-CD1 4.29Å; L224-L228 WeakPolarHBondContact O-CB 3.26Å; L224-L228 WeakPolarHBondContact O-CG 3.49Å; L224-L228 PolarHBondContact O-N 3.27Å; L228-S230 PolarHBondContact O-N 3.33Å
229P83.4Confident81.7Confident69 Ų69102 Ų10245%0.44856%0.555SS.*PPolyproline II helixtrans-52.4134.2170-24.533.8000109.8L234P229-L234 HydrophobicContact CB-CD1 4.45Å; P229-L234 HydrophobicContact CB-CD2 3.68Å; P229-L234 HydrophobicContact CB-CG 3.79Å; P229-L234 HydrophobicContact CG-CD2 4.11Å
230S80.1Confident80.5Confident54 Ų54102.3 Ų102.338%0.37855%0.554SS.*PPolyproline II helixtrans-64.9152.2169.263.30000109.9L228 L232 E233 L234L228-S230 PolarHBondContact O-N 3.33Å; S230-L232 PolarHBondContact O-N 2.74Å; S230-L232 VanDerWaalsContact O-N 3.16Å; S230-E233 PolarHBondContact N-OE2 3.42Å; S230-E233 WeakPolarHBondContact O-CB 3.3Å; S230-E233 PolarHBondContact O-N 3.16Å; S230-E233 WeakPolarHBondContact OG-CB 3.42Å; S230-E233 VanDerWaalsContact OG-CD 3.29Å; S230-E233 WeakPolarHBondContact OG-CG 3.37Å; S230-E233 PolarHBondContact OG-N 3.49Å; S230-E233 PolarHBondContact OG-OE2 3.03Å; S230-L234 PolarHBondContact O-N 2.9Å
231E77.6Confident78.7Confident172 Ų172100.5 Ų100.580%0.80454%0.539SS*.Hα-helixtrans-56.8-32176.2-170.3161.9-158.200111.7Q235E231-Q235 PolarHBondContact O-N 3.49Å; E231-Q235 VanDerWaalsContact O-N 3.16Å
232L73.9Confident76.9Confident130 Ų130101 Ų10168%0.68155%0.549SS*.Hα-helixtrans-67.9-40.6173.2-17465000112.7S230 Q235 T236S230-L232 PolarHBondContact O-N 2.74Å; S230-L232 VanDerWaalsContact O-N 3.16Å; L232-Q235 PolarHBondContact O-N 2.84Å; L232-T236 WeakPolarHBondContact O-CG2 3.48Å; L232-T236 PolarHBondContact O-N 3.03Å; L232-T236 PolarHBondContact O-OG1 3.49Å
233E78.6Confident75.2Confident102 Ų102100.4 Ų100.448%0.47755%0.546SS..Hα-helixtrans-67.1-40.2177-79.5164154.700111.9S230 Q235 T236 L237S230-E233 PolarHBondContact N-OE2 3.42Å; S230-E233 WeakPolarHBondContact O-CB 3.3Å; S230-E233 PolarHBondContact O-N 3.16Å; S230-E233 WeakPolarHBondContact OG-CB 3.42Å; S230-E233 VanDerWaalsContact OG-CD 3.29Å; S230-E233 WeakPolarHBondContact OG-CG 3.37Å; S230-E233 PolarHBondContact OG-N 3.49Å; S230-E233 PolarHBondContact OG-OE2 3.03Å; E233-Q235 VanDerWaalsContact C-N 3.3Å; E233-Q235 PolarHBondContact O-N 3.46Å; E233-T236 WeakPolarHBondContact CA-OG1 3.32Å; E233-T236 PolarHBondContact O-N 2.91Å; E233-T236 PolarHBondContact O-OG1 3.01Å; E233-L237 WeakPolarHBondContact O-CG 3.49Å; E233-L237 PolarHBondContact O-N 3.23Å
234L80.1Confident73.2Confident84 Ų84100.2 Ų100.244%0.4455%0.551SS.*Hα-helixtrans-58.5-45.3174.6-68.7174.1000110.9P229 S230 T236 L237 E238P229-L234 HydrophobicContact CB-CD1 4.45Å; P229-L234 HydrophobicContact CB-CD2 3.68Å; P229-L234 HydrophobicContact CB-CG 3.79Å; P229-L234 HydrophobicContact CG-CD2 4.11Å; S230-L234 PolarHBondContact O-N 2.9Å; L234-T236 VanDerWaalsContact C-N 3.34Å; L234-T236 PolarHBondContact O-N 2.95Å; L234-L237 PolarHBondContact O-N 3.09Å; L234-E238 WeakPolarHBondContact O-CG 3.31Å; L234-E238 PolarHBondContact O-N 3.11Å; L234-E238 VanDerWaalsContact O-N 3.1Å
235Q75.6Confident71.3Confident108 Ų108103.1 Ų103.151%0.50556%0.562SS.*Hα-helixtrans-64.8-37.6178.1-167.2149.710.100112.6E231 L232 E233 E238 E239E231-Q235 PolarHBondContact O-N 3.49Å; E231-Q235 VanDerWaalsContact O-N 3.16Å; L232-Q235 PolarHBondContact O-N 2.84Å; E233-Q235 VanDerWaalsContact C-N 3.3Å; E233-Q235 PolarHBondContact O-N 3.46Å; Q235-E238 PolarHBondContact O-N 3.14Å; Q235-E239 WeakPolarHBondContact O-CG 3.44Å; Q235-E239 PolarHBondContact O-N 3.22Å; Q235-E239 VanDerWaalsContact O-N 3.12Å
236T76.5Confident69.4Low60 Ų60104.6 Ų104.637%0.36856%0.563SS.*Hα-helixtrans-68-34.6174.8540000113.4L232 E233 L234 E239 T240L232-T236 WeakPolarHBondContact O-CG2 3.48Å; L232-T236 PolarHBondContact O-N 3.03Å; L232-T236 PolarHBondContact O-OG1 3.49Å; E233-T236 WeakPolarHBondContact CA-OG1 3.32Å; E233-T236 PolarHBondContact O-N 2.91Å; E233-T236 PolarHBondContact O-OG1 3.01Å; L234-T236 VanDerWaalsContact C-N 3.34Å; L234-T236 PolarHBondContact O-N 2.95Å; T236-E239 PolarHBondContact O-N 3.34Å; T236-T240 WeakPolarHBondContact O-CG2 2.79Å; T236-T240 PolarHBondContact O-N 3.35Å; T236-T240 PolarHBondContact O-OG1 3.05Å; T236-T240 VanDerWaalsContact O-OG1 3.13Å
237L72.6Confident67.4Low106 Ų106106.3 Ų106.356%0.55556%0.56SS**Hα-helixtrans-66.8-40.4177-73.2168.7000111.3E233 L234 T240 D241E233-L237 WeakPolarHBondContact O-CG 3.49Å; E233-L237 PolarHBondContact O-N 3.23Å; L234-L237 PolarHBondContact O-N 3.09Å; L237-T240 WeakPolarHBondContact CA-OG1 3.38Å; L237-T240 PolarHBondContact O-N 2.92Å; L237-T240 PolarHBondContact O-OG1 3.19Å; L237-D241 WeakPolarHBondContact O-CB 3.42Å; L237-D241 PolarHBondContact O-N 2.96Å; L237-D241 VanDerWaalsContact O-N 3.08Å
238E71.8Confident65.3Low132 Ų132107.1 Ų107.162%0.61756%0.56SS**Hα-helixtrans-63.9-39.5175.3-70174.9177.600112.3L234 Q235 S242L234-E238 WeakPolarHBondContact O-CG 3.31Å; L234-E238 PolarHBondContact O-N 3.11Å; L234-E238 VanDerWaalsContact O-N 3.1Å; Q235-E238 PolarHBondContact O-N 3.14Å; E238-S242 PolarHBondContact O-N 2.97Å; E238-S242 PolarHBondContact O-OG 3.13Å
239E67.4Low63.3Low125 Ų125107 Ų10758%0.58456%0.564SS**Hα-helixtrans-68.1-38.2176.6-73.7178.8174.800112.4Q235 T236 S243Q235-E239 WeakPolarHBondContact O-CG 3.44Å; Q235-E239 PolarHBondContact O-N 3.22Å; Q235-E239 VanDerWaalsContact O-N 3.12Å; T236-E239 PolarHBondContact O-N 3.34Å; E239-S243 PolarHBondContact O-N 3.27Å
240T60.7Low61.5Low74 Ų74110 Ų11045%0.45458%0.576SS.*Hα-helixtrans-70.6-40.717848.30000113T236 L237 S242 S243 E244T236-T240 WeakPolarHBondContact O-CG2 2.79Å; T236-T240 PolarHBondContact O-N 3.35Å; T236-T240 PolarHBondContact O-OG1 3.05Å; T236-T240 VanDerWaalsContact O-OG1 3.13Å; L237-T240 WeakPolarHBondContact CA-OG1 3.38Å; L237-T240 PolarHBondContact O-N 2.92Å; L237-T240 PolarHBondContact O-OG1 3.19Å; T240-S242 VanDerWaalsContact C-N 3.26Å; T240-S242 PolarHBondContact O-N 3.17Å; T240-S243 PolarHBondContact O-N 3.15Å; T240-S243 VanDerWaalsContact O-N 3.13Å; T240-S243 PolarHBondContact O-OG 3.17Å; T240-E244 PolarHBondContact O-N 3.28Å
241D52Low59.7Low103 Ų103111.6 Ų111.655%0.55159%0.588SS**Hα-helixtrans-64.1-34.1177.8-169.730.6000111.5L237 S243L237-D241 WeakPolarHBondContact O-CB 3.42Å; L237-D241 PolarHBondContact O-N 2.96Å; L237-D241 VanDerWaalsContact O-N 3.08Å; D241-S243 PolarHBondContact O-N 2.6Å
242S52.7Low58Low77 Ų77111.9 Ų111.954%0.53859%0.589SS.*Hα-helixtrans-68.7-32.4175.1-57.80000112.9E238 T240E238-S242 PolarHBondContact O-N 2.97Å; E238-S242 PolarHBondContact O-OG 3.13Å; T240-S242 VanDerWaalsContact C-N 3.26Å; T240-S242 PolarHBondContact O-N 3.17Å
243S52Low56.4Low65 Ų65113.4 Ų113.446%0.45560%0.598SS.*Hα-helixtrans-79.4-28.6-17864.50000114.2E239 T240 D241 Q245 D246E239-S243 PolarHBondContact O-N 3.27Å; T240-S243 PolarHBondContact O-N 3.15Å; T240-S243 VanDerWaalsContact O-N 3.13Å; T240-S243 PolarHBondContact O-OG 3.17Å; D241-S243 PolarHBondContact O-N 2.6Å; S243-Q245 VanDerWaalsContact C-N 3.3Å; S243-Q245 PolarHBondContact O-N 3.16Å; S243-D246 PolarHBondContact O-N 3.05Å
244E46.8Very low54.5Low140 Ų140113 Ų11365%0.65461%0.612SS**Hα-helixtrans-76-16.3179.5-66.4-167.1147.900113.2T240T240-E244 PolarHBondContact O-N 3.28Å
245Q48.6Very low52.4Low142 Ų142113.8 Ų113.866%0.66463%0.631SS**Hα-helixtrans-79.8-28.8172.9-75.9-177.67.100113.5S243S243-Q245 VanDerWaalsContact C-N 3.3Å; S243-Q245 PolarHBondContact O-N 3.16Å
246D46.1Very low50.5Low123 Ų123111.8 Ų111.866%0.65864%0.638SS**Hα-helixtrans-81.2-29.1-179-87-13.9000112.8S243 T249S243-D246 PolarHBondContact O-N 3.05Å; D246-T249 PolarHBondContact O-OG1 3.04Å
247D44.2Very low48.4Very low120 Ų120115.5 Ų115.564%0.64266%0.656SS**THydrogen-bonded Turntrans-80.5-16.1-176.6-107.2-19.4000114.2T249 S251D247-T249 VanDerWaalsContact C-N 3.35Å; D247-S251 PolarHBondContact O-OG 3.07Å
248Q44.4Very low46.5Very low156 Ų156117.6 Ų117.673%0.72967%0.673SS**THydrogen-bonded Turntrans-77.5-16.6178.1-80.6-175.23.700113.7
249T43.7Very low44.6Very low105 Ų105117.5 Ų117.564%0.64468%0.675SS**THydrogen-bonded Turntrans-87.2-17.4-179.9500000114.5D246 D247D246-T249 PolarHBondContact O-OG1 3.04Å; D247-T249 VanDerWaalsContact C-N 3.35Å
250D45.2Very low42.9Very low131 Ų131115.7 Ų115.770%0.70168%0.682SS**THydrogen-bonded Turntrans-98.9-13.2-174.5-83.7-13.3000114.4
251S44.1Very low41.4Very low89 Ų89120 Ų12062%0.62270%0.702SS**SBendtrans-89.5-24.7-171.4-60.40000115D247D247-S251 PolarHBondContact O-OG 3.07Å
252E40.9Very low40.4Very low178 Ų178122.2 Ų122.283%0.83271%0.714SS**THydrogen-bonded Turntrans-88.7-9.8-172.8-69.7-161.6127.900115
253N39.7Very low39.5Very low162 Ų162123.8 Ų123.887%0.86672%0.722SS**THydrogen-bonded Turntrans-98.42.5-177.7-98.4-20.3000115.4
254A39.1Very low38.4Very low94 Ų94126.6 Ų126.678%0.77774%0.742SS**SBendtrans-104.6-6.5-176.200000115
255A35.8Very low37.6Very low100 Ų100124.8 Ų124.883%0.82675%0.751SS**SBendtrans-112.767.3-177.400000111.9
256G36.7Very low36.7Very low65 Ų65125.7 Ų125.767%0.6776%0.761SS**  trans179.863.8177.600000115
257N32.2Very low36.1Very low139 Ų139128.4 Ų128.474%0.74377%0.767SS**  trans-173.480.6146-107.87.8000110.7
258V32.8Very low35.2Very low149 Ų149130.5 Ų130.590%0.90377%0.773SS**  trans-102.786.4151.5-178.20000105.4
259I32.4Very low34.4Very low130 Ų130130.2 Ų130.267%0.66778%0.776SS**  trans-88.7104.3165-61.8176.9000105.3D261I259-D261 PolarHBondContact O-N 3.45Å
260A31.1Very low33.7Very low88 Ų88130.1 Ų130.173%0.72778%0.78SS**  trans-68.6118.9163.900000107.7
261D30Very low32.9Very low164 Ų164130.5 Ų130.588%0.87779%0.786SS**  trans-78.3114172.3-135.4-5.4000107.5I259I259-D261 PolarHBondContact O-N 3.45Å
262D29.1Very low32.2Very low149 Ų149133.9 Ų133.980%0.79780%0.796SS**  trans-106122.2174.3-170.924.5000108.4
263P35.6Very low32Very low110 Ų110130.7 Ų130.771%0.71479%0.791SS**  trans-84.7135.8-179.432.4-30.5000111.9
264S28.4Very low31.8Very low125 Ų125128.8 Ų128.887%0.87479%0.788SS**  trans-39.2143.1175-59.40000116.4
265A29.8Very low31.1Very low102 Ų102128.2 Ų128.284%0.84379%0.791SS**  trans-147.4109.5152.700000112
266D30.1Very low30.5Very low161 Ų161126.8 Ų126.886%0.86179%0.786SS**  trans-70.4152.7157.4-88.7-52.8000111.1
267K32.4Very low30Very low180 Ų180130.7 Ų130.778%0.78380%0.796SS**  trans-22.8141.6175.8-74.8173.2177.4176.20121.3
268E26.3Very low30.1Very low164 Ų164130.4 Ų130.477%0.76680%0.8SS**  trans82.5128.9133.7-75.7-173.8114.800122.4
269N26.2Very low30Very low150 Ų150129 Ų12980%0.80279%0.793SS**  trans64.9109.7150.1-84.7-12000120.1
270S29.5Very low30.4Very low103 Ų103128.3 Ų128.372%0.7280%0.8SS**  156.8116.595-178.10000112.1
271V28.7Very low30.2Very low139 Ų139130.2 Ų130.284%0.84280%0.803SS**  trans71.8133.8144.5-179.60000119.6
272L28.4Very low30.2Very low159 Ų159132 Ų13283%0.83280%0.803SS**  trans-74.4-166.4-176-58.6155.6000113.6
273P37.1Very low30.8Very low112 Ų112130 Ų13073%0.72781%0.807SS**  -117.6-143.3-110.140.4-16.2000109.1
274P36.5Very low30.6Very low121 Ų121129.4 Ų129.479%0.78681%0.806SS**  cis-133170.9-20.235.4-16.6000114.6
275G23.4Very low31.2Very low82 Ų82132.7 Ų132.785%0.84581%0.807SS**  trans112.4125.2140.300000118.4
276G24Very low31.8Very low70 Ų70134.7 Ų134.772%0.72280%0.804SS**  trans120.6104.1139.600000119.2
277V25.4Very low32.8Very low147 Ų147134.1 Ų134.189%0.89180%0.801SS**  trans74.8124.6137.5-160.60000119.6
278V33.9Very low33.9Very low134 Ų134131.6 Ų131.681%0.81280%0.8SS**  trans-67.8149.4170.9-154.10000111.4
279P31.9Very low35.6Very low119 Ų119127.5 Ų127.577%0.77378%0.782SS**  -143.7157.5125.431.9-13.8000116.2
280S39.7Very low37.3Very low115 Ų115127.1 Ų127.180%0.80478%0.78SS**  trans-76.3144.4-178.3-176.30000114.2
281T28.2Very low39Very low129 Ų129125.3 Ų125.379%0.79176%0.763SS**  trans-152.9113159.540.10000109.7
282K30.4Very low40.7Very low200 Ų200122.4 Ų122.487%0.8775%0.747SS**  75.3126.295.8-81.9-171178.3179.60116
283A40Very low42.2Very low107 Ų107118.7 Ų118.788%0.88472%0.722SS**  trans-66.3139.8-178.200000113.9
284S31.3Very low43.5Very low99 Ų99118.4 Ų118.469%0.69271%0.714SS**  trans-114.8133.5176-55.30000111.3D286S284-D286 VanDerWaalsContact C-N 3.28Å; S284-D286 PolarHBondContact O-N 3.14Å; S284-D286 VanDerWaalsContact O-N 3.11Å
285E41.3Very low45.2Very low194 Ų194119.1 Ų119.191%0.90770%0.701SS**  trans-77.940.4-176-65.7-175.112000114.8
286D42.7Very low47.3Very low143 Ų143120.6 Ų120.677%0.76570%0.696SS**  trans-117.447.9-173.2-78.1-40.2000114.5S284S284-D286 VanDerWaalsContact C-N 3.28Å; S284-D286 PolarHBondContact O-N 3.14Å; S284-D286 VanDerWaalsContact O-N 3.11Å
287N51Low49.3Very low150 Ų150120.4 Ų120.480%0.80268%0.681SS**  trans-110.352.3168.9-77.1-63.5000111.5I289N287-I289 PolarHBondContact O-N 3.41Å; N287-I289 VanDerWaalsContact O-N 3.09Å
288V55.9Low51.4Low126 Ų126122.7 Ų122.776%0.76468%0.679SS**  trans-75.395.4164-179.10000107D290V288-D290 PolarHBondContact O-N 2.96Å
289I61.5Low52.9Low78 Ų78124.3 Ų124.340%0.468%0.675SS.*  trans-65.3105.7173.9-55.3170000107.8N287 N291 L294N287-I289 PolarHBondContact O-N 3.41Å; N287-I289 VanDerWaalsContact O-N 3.09Å; I289-N291 HydrophobicContact CG2-CB 4.06Å; I289-N291 PolarHBondContact O-N 3.38Å; I289-L294 HydrophobicContact CG2-CB 3.55Å; I289-L294 HydrophobicContact CG2-CD1 4.05Å; I289-L294 HydrophobicContact CG2-CG 4.43Å
290D63.4Low54.6Low142 Ų142123.4 Ų123.476%0.75967%0.669SS**  trans-60.5-31.6-179-172.523.2000111.3V288 P292V288-D290 PolarHBondContact O-N 2.96Å; D290-P292 WeakPolarHBondContact O-CD 3.4Å; D290-P292 VanDerWaalsContact O-N 3.12Å
291N64Low56Low65 Ų65127.7 Ų127.735%0.34867%0.673SS.*  trans-65.9110.6176.3-171.6-14.2000111.4I289 Y293 L294I289-N291 HydrophobicContact CG2-CB 4.06Å; I289-N291 PolarHBondContact O-N 3.38Å; N291-Y293 PolarHBondContact O-N 3.2Å; N291-Y293 WeakPolarHBondContact OD1-CB 3.28Å; N291-Y293 VanDerWaalsContact OD1-CD2 3.32Å; N291-Y293 WeakPolarHBondContact OD1-CD2 3.46Å; N291-Y293 PolarHBondContact OD1-N 3.07Å; N291-L294 HydrophobicContact CB-CB 4.24Å; N291-L294 HydrophobicContact CB-CD1 3.94Å; N291-L294 HydrophobicContact CB-CG 4.09Å; N291-L294 PolarHBondContact O-N 2.79Å; N291-L294 VanDerWaalsContact O-N 3.08Å
292P65.6Low57.7Low79 Ų79127.9 Ų127.951%0.51367%0.674SS.*G310 helixtrans-61.4-21.9-177.926.2-34.5000113.1D290D290-P292 WeakPolarHBondContact O-CD 3.4Å; D290-P292 VanDerWaalsContact O-N 3.12Å
293Y59.8Low59Low81 Ų81129.5 Ų129.532%0.31867%0.674SS.*G310 helixtrans-83.7-14.8-179.3-60.1-71.3000114.5I160 N291I160-Y293 HydrophobicContact CD1-CD1 4.05Å; I160-Y293 HydrophobicContact CD1-CD2 3.52Å; I160-Y293 HydrophobicContact CD1-CE1 4.35Å; I160-Y293 HydrophobicContact CD1-CE2 3.85Å; I160-Y293 HydrophobicContact CD1-CG 3.63Å; I160-Y293 HydrophobicContact CG2-CD1 4Å; I160-Y293 HydrophobicContact CG2-CG 3.86Å; N291-Y293 PolarHBondContact O-N 3.2Å; N291-Y293 WeakPolarHBondContact OD1-CB 3.28Å; N291-Y293 VanDerWaalsContact OD1-CD2 3.32Å; N291-Y293 WeakPolarHBondContact OD1-CD2 3.46Å; N291-Y293 PolarHBondContact OD1-N 3.07Å
294L63.5Low59.9Low106 Ų106135.6 Ų135.656%0.55568%0.675SS**G310 helixtrans-1005.3177.6-66.2178.9000112.3I289 N291I289-L294 HydrophobicContact CG2-CB 3.55Å; I289-L294 HydrophobicContact CG2-CD1 4.05Å; I289-L294 HydrophobicContact CG2-CG 4.43Å; N291-L294 HydrophobicContact CB-CB 4.24Å; N291-L294 HydrophobicContact CB-CD1 3.94Å; N291-L294 HydrophobicContact CB-CG 4.09Å; N291-L294 PolarHBondContact O-N 2.79Å; N291-L294 VanDerWaalsContact O-N 3.08Å
295R72.9Confident61.2Low135 Ų135140.9 Ų140.951%0.50969%0.685SS.*SBendtrans-72.4136.2179.9-65.2-177.8-175.8174.46.2110.1
296P67.4Low61.5Low113 Ų113144.8 Ų144.873%0.73470%0.699SS**PPolyproline II helixtrans-56.5141.2176.4-2633.8000112.9K298P296-K298 PolarHBondContact O-N 3.49Å
297V64.7Low62.4Low67 Ų67144.9 Ų144.941%0.40670%0.696SS.*PPolyproline II helixtrans-61.6120.8176.7-177.60000110.1P163 K299P163-V297 HydrophobicContact CB-CG2 3.25Å; P163-V297 WeakPolarHBondContact O-CG2 3.23Å; V297-K299 PolarHBondContact O-N 2.93Å
298K70.8Confident63Low194 Ų194144.6 Ų144.684%0.84369%0.69SS**PPolyproline II helixtrans-75.1118.7172.1-68.8-176.3179.5178.30109.5P296P296-K298 PolarHBondContact O-N 3.49Å
299K65.5Low63.4Low168 Ų168145.7 Ų145.773%0.7369%0.686SS**PPolyproline II helixtrans-62.3132.7173.8-62-172.3179.6177.20109.7F165 V297 K301F165-K299 HydrophobicContact CE2-CD 4.42Å; F165-K299 HydrophobicContact CE2-CG 4.1Å; V297-K299 PolarHBondContact O-N 2.93Å; K299-K301 PolarHBondContact O-N 2.74Å
300P67.1Low63.6Low101 Ų101149.6 Ų149.666%0.65670%0.703SS**PPolyproline II helixtrans-56.2132.7171-22.332000110V302P300-V302 PolarHBondContact O-N 3.04Å
301K69.8Low63.6Low204 Ų204150.1 Ų150.189%0.88770%0.699SS**  trans-64.9108.5175.9-72.6-176.1179.5179.90108.6K299 R303K299-K301 PolarHBondContact O-N 2.74Å; K301-R303 PolarHBondContact O-N 3.48Å
302V63.3Low63.5Low133 Ų133155.8 Ų155.881%0.80672%0.723SS**  trans-64105.4170.9-176.80000107.3P300 R304P300-V302 PolarHBondContact O-N 3.04Å; V302-R304 PolarHBondContact O-N 3.11Å
303R57.9Low63.4Low234 Ų234161.3 Ų161.388%0.88374%0.738SS**  trans-66.6103.4169.2-74.2177.969.1-172.12.2107.2K301 K305K301-R303 PolarHBondContact O-N 3.48Å; R303-K305 PolarHBondContact O-N 2.92Å
304R59.2Low63.7Low236 Ų236167.5 Ų167.589%0.89177%0.77SS**  trans-60.5110.9163-78.3176.870.5156.7-0.2106.6V302 K306V302-R304 PolarHBondContact O-N 3.11Å; R304-K306 PolarHBondContact O-N 3.45Å
305K57.2Low63.7Low210 Ų210172.6 Ų172.691%0.91379%0.788SS**  trans-61.2126.2163.9-77.6-174.8175.4-1790106.6R303R303-K305 PolarHBondContact O-N 2.92Å
306K48.4Very low62.8Low276 Ų276176 Ų176100%1.281%0.814SS**  trans-77.70174.9-163.3-180-177-176.20109.1R304R304-K306 PolarHBondContact O-N 3.45Å

Retrieved 306 of 306 residues in 323 ms (Link to these results)