A0A087WZ11_HUMAN Loading...

DExH-box helicase 57

AlphaFold DB , UniProt , Accession A0A087WZ11, Species HUMAN (Homo sapiens, Human), Gene DHX57, Length 472 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
1M51.3Low81.1Confident176 Ų176105 Ų10587%0.86755%0.547SS*.  0112.80-77.1-63.5-79.600107.9N5M1-N5 HydrophobicContact CE-CB 3.9Å; M1-N5 HydrophobicContact SD-CB 4.45Å
2T81.2Confident81.6Confident78 Ų78105.4 Ų105.448%0.47955%0.549SS..  trans-71.7151.5177.946.80000110E4 N5 Q6T2-E4 PolarHBondContact O-N 3.4Å; T2-N5 WeakPolarHBondContact O-CB 3.46Å; T2-N5 PolarHBondContact O-N 3.07Å; T2-N5 PolarHBondContact OG1-ND2 3.29Å; T2-N5 PolarHBondContact OG1-OD1 3.34Å; T2-Q6 PolarHBondContact O-N 3.26Å
3S80.2Confident81.6Confident99 Ų99104.8 Ų104.869%0.69255%0.546SS*.Hα-helixtrans-54.2-36.3176.448.60000111.9N5 Q6 E7S3-N5 VanDerWaalsContact C-N 3.32Å; S3-N5 PolarHBondContact O-N 3.5Å; S3-Q6 PolarHBondContact O-N 3.46Å; S3-E7 PolarHBondContact O-N 3.4Å
4E83.6Confident81.7Confident108 Ų108109.9 Ų109.951%0.50555%0.554SS.*Hα-helixtrans-61-37.2175.1-165.6-172.1158.400112.8T2 E7 K8T2-E4 PolarHBondContact O-N 3.4Å; E4-E7 PolarHBondContact O-N 3.47Å; E4-K8 WeakPolarHBondContact O-CG 3.47Å; E4-K8 PolarHBondContact O-N 3.35Å; E4-K8 WeakPolarHBondContact OE1-CE 3.44Å; E4-K8 IonicContact OE1-NZ 3.89Å; E4-K8 PolarHBondContact OE1-NZ 3.01Å
5N74.6Confident81.8Confident67 Ų67109.3 Ų109.336%0.35855%0.554SS.*Hα-helixtrans-71.5-34.2177.3-72.71.7000111.5M1 T2 S3 E7 V9M1-N5 HydrophobicContact CE-CB 3.9Å; M1-N5 HydrophobicContact SD-CB 4.45Å; T2-N5 WeakPolarHBondContact O-CB 3.46Å; T2-N5 PolarHBondContact O-N 3.07Å; T2-N5 PolarHBondContact OG1-ND2 3.29Å; T2-N5 PolarHBondContact OG1-OD1 3.34Å; S3-N5 VanDerWaalsContact C-N 3.32Å; S3-N5 PolarHBondContact O-N 3.5Å; N5-E7 VanDerWaalsContact C-N 3.34Å; N5-V9 VanDerWaalsContact O-CG2 3.26Å; N5-V9 WeakPolarHBondContact O-CG2 3.33Å; N5-V9 PolarHBondContact O-N 3.09Å; N5-V9 VanDerWaalsContact O-N 3.12Å
6Q82.2Confident81.3Confident112 Ų112108.4 Ų108.452%0.52355%0.55SS.*Hα-helixtrans-68.1-36.7174.8-73.3-178.2-21.300111.8T2 S3 V9 K10T2-Q6 PolarHBondContact O-N 3.26Å; S3-Q6 PolarHBondContact O-N 3.46Å; Q6-V9 PolarHBondContact O-N 2.91Å; Q6-K10 WeakPolarHBondContact O-CB 3.48Å; Q6-K10 WeakPolarHBondContact O-CG 3.36Å; Q6-K10 PolarHBondContact O-N 3.25Å
7E87.7Confident80.8Confident144 Ų144110.1 Ų110.167%0.67356%0.556SS**Hα-helixtrans-69.8-39.9178.6-161.4166.7-162.300111.9S3 E4 N5 K10 A11S3-E7 PolarHBondContact O-N 3.4Å; E4-E7 PolarHBondContact O-N 3.47Å; N5-E7 VanDerWaalsContact C-N 3.34Å; E7-K10 PolarHBondContact O-N 3.01Å; E7-A11 WeakPolarHBondContact O-CB 3.4Å; E7-A11 PolarHBondContact O-N 2.99Å
8K86.5Confident80.1Confident111 Ų111111.8 Ų111.848%0.48356%0.561SS.*Hα-helixtrans-63.5-40.2173.5-72.8174-175168.80112.8E4 A11 L12E4-K8 WeakPolarHBondContact O-CG 3.47Å; E4-K8 PolarHBondContact O-N 3.35Å; E4-K8 WeakPolarHBondContact OE1-CE 3.44Å; E4-K8 IonicContact OE1-NZ 3.89Å; E4-K8 PolarHBondContact OE1-NZ 3.01Å; K8-A11 PolarHBondContact O-N 3.43Å; K8-L12 PolarHBondContact O-N 3.35Å
9V87.4Confident78.9Confident74 Ų74113.3 Ų113.345%0.44857%0.566SS.*Hα-helixtrans-67.2-42.1175.9171.50000110.9N5 Q6 A11 L12 L13N5-V9 VanDerWaalsContact O-CG2 3.26Å; N5-V9 WeakPolarHBondContact O-CG2 3.33Å; N5-V9 PolarHBondContact O-N 3.09Å; N5-V9 VanDerWaalsContact O-N 3.12Å; Q6-V9 PolarHBondContact O-N 2.91Å; V9-A11 VanDerWaalsContact C-N 3.31Å; V9-A11 PolarHBondContact O-N 3.48Å; V9-L12 PolarHBondContact O-N 2.88Å; V9-L13 HydrophobicContact CG1-CD1 4.06Å; V9-L13 WeakPolarHBondContact O-CG 3.34Å; V9-L13 PolarHBondContact O-N 3.02Å
10K89.8Confident77.4Confident141 Ų141114.1 Ų114.161%0.61357%0.572SS**Hα-helixtrans-65-33.6175.2-75.3178.8179.4-177.40112.8Q6 E7 R14Q6-K10 WeakPolarHBondContact O-CB 3.48Å; Q6-K10 WeakPolarHBondContact O-CG 3.36Å; Q6-K10 PolarHBondContact O-N 3.25Å; E7-K10 PolarHBondContact O-N 3.01Å; K10-R14 PolarHBondContact O-N 3.35Å
11A88Confident76.1Confident45 Ų45112.1 Ų112.137%0.37257%0.574SS.*Hα-helixtrans-67.3-46.917400000111.5E7 K8 V9 L13 R14 D15E7-A11 WeakPolarHBondContact O-CB 3.4Å; E7-A11 PolarHBondContact O-N 2.99Å; K8-A11 PolarHBondContact O-N 3.43Å; V9-A11 VanDerWaalsContact C-N 3.31Å; V9-A11 PolarHBondContact O-N 3.48Å; A11-L13 VanDerWaalsContact C-N 3.32Å; A11-L13 PolarHBondContact O-N 2.63Å; A11-R14 PolarHBondContact O-N 3.11Å; A11-R14 VanDerWaalsContact O-N 3.12Å; A11-D15 PolarHBondContact O-N 3.23Å; A11-D15 VanDerWaalsContact O-N 3.1Å
12L86.5Confident75.8Confident110 Ų110111 Ų11158%0.57657%0.571SS**Hα-helixtrans-59.9-38.9176.3-86.1161.1000113.2K8 V9 R14 D15 L16K8-L12 PolarHBondContact O-N 3.35Å; V9-L12 PolarHBondContact O-N 2.88Å; L12-R14 VanDerWaalsContact C-N 3.31Å; L12-R14 PolarHBondContact O-N 3.33Å; L12-D15 PolarHBondContact O-N 3.35Å; L12-L16 WeakPolarHBondContact O-CG 3.27Å; L12-L16 PolarHBondContact O-N 3.34Å
13L82.1Confident74.3Confident98 Ų98111.9 Ų111.951%0.51359%0.586SS.*Hα-helixtrans-68.3-29.5177.1-71.9171.2000112.7V9 A11 Q17V9-L13 HydrophobicContact CG1-CD1 4.06Å; V9-L13 WeakPolarHBondContact O-CG 3.34Å; V9-L13 PolarHBondContact O-N 3.02Å; A11-L13 VanDerWaalsContact C-N 3.32Å; A11-L13 PolarHBondContact O-N 2.63Å; L13-Q17 WeakPolarHBondContact O-CG 3.26Å; L13-Q17 PolarHBondContact O-N 3.02Å
14R82.6Confident72.4Confident175 Ų175110.1 Ų110.166%0.6658%0.583SS**Hα-helixtrans-74.1-41.4174.6-76.2-161.7-69.8176.9-1.2112.3K10 A11 L12 L16 Q17 E18K10-R14 PolarHBondContact O-N 3.35Å; A11-R14 PolarHBondContact O-N 3.11Å; A11-R14 VanDerWaalsContact O-N 3.12Å; L12-R14 VanDerWaalsContact C-N 3.31Å; L12-R14 PolarHBondContact O-N 3.33Å; R14-L16 VanDerWaalsContact C-N 3.3Å; R14-L16 PolarHBondContact O-N 3.4Å; R14-Q17 PolarHBondContact O-N 3.39Å; R14-E18 PolarHBondContact O-N 3.11Å
15D82.8Confident70.3Confident102 Ų102110.4 Ų110.455%0.54560%0.597SS.*Hα-helixtrans-61.4-38.1175.9-86.219.5000112.1A11 L12 E18 Q19A11-D15 PolarHBondContact O-N 3.23Å; A11-D15 VanDerWaalsContact O-N 3.1Å; L12-D15 PolarHBondContact O-N 3.35Å; D15-E18 PolarHBondContact O-N 2.81Å; D15-Q19 PolarHBondContact O-N 2.92Å
16L74.1Confident68.3Low94 Ų94115.9 Ų115.949%0.49262%0.621SS.*Hα-helixtrans-67.5-40.2176.3-74.4168.4000112.1L12 R14 E18 Q19 D20L12-L16 WeakPolarHBondContact O-CG 3.27Å; L12-L16 PolarHBondContact O-N 3.34Å; R14-L16 VanDerWaalsContact C-N 3.3Å; R14-L16 PolarHBondContact O-N 3.4Å; L16-E18 VanDerWaalsContact C-N 3.34Å; L16-Q19 PolarHBondContact O-N 3.49Å; L16-D20 PolarHBondContact O-N 3.4Å; L16-D20 VanDerWaalsContact O-N 3.09Å
17Q73.8Confident66.1Low138 Ų138121.7 Ų121.765%0.64564%0.638SS**Hα-helixtrans-68-32175.7-77.3179-2700112.9L13 R14 A21L13-Q17 WeakPolarHBondContact O-CG 3.26Å; L13-Q17 PolarHBondContact O-N 3.02Å; R14-Q17 PolarHBondContact O-N 3.39Å; Q17-A21 WeakPolarHBondContact O-CB 3.13Å; Q17-A21 PolarHBondContact O-N 2.95Å
18E68.4Low63.4Low141 Ų141118.1 Ų118.166%0.65964%0.639SS**Hα-helixtrans-71.1-31.9172.3-81.4-176.9173.200112.3R14 D15 L16 A21 D22R14-E18 PolarHBondContact O-N 3.11Å; D15-E18 PolarHBondContact O-N 2.81Å; L16-E18 VanDerWaalsContact C-N 3.34Å; E18-A21 PolarHBondContact O-N 3.19Å; E18-D22 PolarHBondContact O-N 3.24Å
19Q55.7Low60.8Low139 Ų139120.1 Ų120.165%0.6566%0.655SS**Hα-helixtrans-69.1-35.8172.9-79-177.4-6.800113D15 L16 A21D15-Q19 PolarHBondContact O-N 2.92Å; L16-Q19 PolarHBondContact O-N 3.49Å; Q19-A21 VanDerWaalsContact C-N 3.31Å
20D48.8Very low58.3Low130 Ų130122 Ų12270%0.69567%0.671SS**Hα-helixtrans-74.5-22.8176-70.3-31000112.5L16L16-D20 PolarHBondContact O-N 3.4Å; L16-D20 VanDerWaalsContact O-N 3.09Å
21A51.3Low55.4Low72 Ų72119 Ų11960%0.59568%0.681SS**Hα-helixtrans-80.1-20.1177.600000114Q17 E18 Q19Q17-A21 WeakPolarHBondContact O-CB 3.13Å; Q17-A21 PolarHBondContact O-N 2.95Å; E18-A21 PolarHBondContact O-N 3.19Å; Q19-A21 VanDerWaalsContact C-N 3.31Å
22D45.7Very low52.8Low154 Ų154126 Ų12682%0.82471%0.705SS**THydrogen-bonded Turntrans-87.9-4.7-178.8-153.829.5000113.5E18E18-D22 PolarHBondContact O-N 3.24Å
23A48.2Very low50.2Low96 Ų96128.8 Ų128.879%0.79372%0.715SS**THydrogen-bonded Turntrans-103.53.7176.100000114.5
24G41Very low47.8Very low61 Ų61132 Ų13263%0.62973%0.728SS**  trans-144.355.6-171.900000114.5E26G24-E26 PolarHBondContact O-N 3.4Å
25S38.5Very low45.6Very low114 Ų114130.4 Ų130.480%0.79773%0.733SS**  trans-85.899.8169.8-167.70000111.5
26E33.5Very low43.2Very low183 Ų183133.3 Ų133.386%0.85575%0.748SS**  trans-150.894.3133.6-70.6-150.316800106.1G24G24-E26 PolarHBondContact O-N 3.4Å
27R35.3Very low41.6Very low234 Ų234137.6 Ų137.688%0.88377%0.765SS**  39.5117.391.8-163.4176.8-150.9-1584.5111.9
28G32.1Very low40.2Very low68 Ų68136.4 Ų136.470%0.70177%0.77SS**  cis-174.1-171.22.300000104.3
29L30.8Very low38.5Very low154 Ų154137 Ų13781%0.80678%0.777SS**  cis-166.3121.524.9-81.9166000103.3
30S36Very low37.2Very low114 Ų114135 Ų13580%0.79778%0.778SS**  50.8117.2104.973.30000116
31G28Very low36.2Very low78 Ų78134.3 Ų134.380%0.80478%0.782SS**  trans-176.984.716300000109.2
32E33.2Very low35.1Very low191 Ų191136.8 Ų136.889%0.89379%0.785SS**  trans-69.1136.9160.3-63.6178.9161.500107.9
33E31.8Very low34.5Very low168 Ų168137 Ų13779%0.78579%0.786SS**  174.8132122.2-92.4-177.7-160.400111.8
34E33.3Very low33.8Very low165 Ų165140.5 Ų140.577%0.77179%0.786SS**  trans65.9125.4141.6-60.3-173.9167.300122.9
35D35.5Very low33.3Very low143 Ų143149.6 Ų149.677%0.76580%0.801SS**  trans24.3121.4137.6-72.3-24.8000119.8
36D33.4Very low32.9Very low162 Ų162153 Ų15387%0.86680%0.798SS**  168.7147.2106.3-92-35.7000111.9
37E39.3Very low32.8Very low184 Ų184156 Ų15686%0.8680%0.802SS**  trans-61161.9178.5-84.6-139.5152.400114.8
38P44Very low32.9Very low113 Ų113149.2 Ų149.273%0.73479%0.788SS**  trans-91.1134.2-166.834.7-29000111.9
39D32.9Very low33Very low154 Ų154151.1 Ų151.182%0.82480%0.797SS**  trans-151.7136.7159.4-123.6-23.1000115.1
40C29.5Very low32.9Very low98 Ų98147.3 Ų147.366%0.66280%0.795SS**  trans74.6107.2152.4-69.10000122
41C27.4Very low32.5Very low114 Ų114151.3 Ų151.377%0.7780%0.801SS**  78.2137.5116.2-70.60000122.7
42N28.6Very low32.6Very low124 Ų124156 Ų15666%0.66380%0.802SS**  trans76.2112.7150.6-86.35.6000119.7
43D31.8Very low32.5Very low158 Ų158153 Ų15385%0.84580%0.799SS**  -157.3105.994.9-96.3-20.4000112.1
44E34.4Very low32.3Very low171 Ų171149.2 Ų149.280%0.79979%0.791SS**  trans-68.4130.8162.8-65.7-179.8128.600110.1
45R30.4Very low32.2Very low252 Ų252149.4 Ų149.495%0.95180%0.797SS**  trans-96.4101.2161.6-73.1-171.8-173.2178.94.1110.4
46Y29.8Very low32.1Very low184 Ų184148.9 Ų148.972%0.72280%0.798SS**  trans-29.2135.5163.8-147.7-107000118.3P48Y46-P48 HydrophobicContact CD1-CB 4.38Å; Y46-P48 HydrophobicContact CD1-CG 4.32Å; Y46-P48 HydrophobicContact CE1-CB 3.62Å; Y46-P48 HydrophobicContact CE1-CG 3.82Å
47W31.3Very low32.6Very low247 Ų247146.1 Ų146.194%0.93679%0.789SS**  trans-136.6132.7137-69.1114.5000108.4
48P38.5Very low32Very low92 Ų92145.1 Ų145.160%0.59779%0.789SS**  trans-87.7152-172.732.9-30.6000113.1Y46Y46-P48 HydrophobicContact CD1-CB 4.38Å; Y46-P48 HydrophobicContact CD1-CG 4.32Å; Y46-P48 HydrophobicContact CE1-CB 3.62Å; Y46-P48 HydrophobicContact CE1-CG 3.82Å
49A32.8Very low31.3Very low108 Ų108147.1 Ų147.189%0.89379%0.793SS**  trans-98.4152.1172.200000112.3
50G30.1Very low31.2Very low73 Ų73147 Ų14775%0.75379%0.793SS**  trans123.7107.8140.600000117.7
51Q27.4Very low31.9Very low198 Ų198147.5 Ų147.593%0.92580%0.795SS**  -170.5122.2121.1-114.31721400111.7
52E29.5Very low32.1Very low177 Ų177150.5 Ų150.583%0.82780%0.802SS**  trans-72.1159.4157.9-67.9-175.7145.900110.2
53P31.4Very low32.3Very low128 Ų128153.2 Ų153.283%0.83181%0.811SS**  -140.614110130.3-13.2000115.6
54S27.6Very low32.3Very low88 Ų88156.6 Ų156.662%0.61581%0.813SS**  trans-37.7138156.11710000115.3
55L30.7Very low32.3Very low170 Ų170152.6 Ų152.689%0.8981%0.81SS**  -158.3139.9129.8-79.3-168.6000110.7
56V33.3Very low32.3Very low131 Ų131144.5 Ų144.579%0.79480%0.804SS**  trans-86.9-173.6-174.9-136.80000111.4
57P43.4Very low32.8Very low104 Ų104144.7 Ų144.768%0.67582%0.817SS**  trans-117.4155-130.835.7-14.2000114.4
58D27Very low32.6Very low163 Ų163137 Ų13787%0.87281%0.806SS**  trans-131.9104.7168.6-84.9-36.6000112.4
59L30.5Very low32.4Very low155 Ų155138.2 Ų138.281%0.81282%0.817SS**  trans15.5116.4143.5-58.5167.4000120.5
60D30.7Very low32.4Very low153 Ų153139.8 Ų139.882%0.81882%0.815SS**  trans11.5169.1131.7-77.3-34.1000121.9
61P43.3Very low32.6Very low108 Ų108144.1 Ų144.170%0.70182%0.815SS**  cis-140.9162.10.820.25.8000116.6
62L31.6Very low33Very low177 Ų177140.2 Ų140.293%0.92781%0.808SS**  trans-161.8116.5139.1-115154.6000112.9
63E32.2Very low33.2Very low180 Ų180141.6 Ų141.684%0.84181%0.807SS**  trans-63.8142.8177.4-58.1175.214000113.2
64Y32.2Very low33.6Very low229 Ų229140.9 Ų140.990%0.89880%0.799SS**  -167111.5126.9-151.3-110.8000113.1
65A35.2Very low34.2Very low88 Ų88140.9 Ų140.973%0.72780%0.798SS**  trans61.1118.114700000122.4
66G30.5Very low34.6Very low81 Ų81140.8 Ų140.884%0.83579%0.793SS**  trans116.692.4131.300000117.2A68G66-A68 PolarHBondContact O-N 3.18Å
67L39Very low35.3Very low188 Ų188141.8 Ų141.898%0.98479%0.786SS**  trans-63121.7165.7-73.9161.1000111.2
68A28.5Very low35.8Very low87 Ų87143.1 Ų143.172%0.71979%0.793SS**  trans-135.2111.8150.800000107.3G66 V70G66-A68 PolarHBondContact O-N 3.18Å; A68-V70 PolarHBondContact O-N 2.89Å
69S32.9Very low37.7Very low117 Ų117136.8 Ų136.882%0.81876%0.76SS**  trans-57.2107.2172.544.30000109.4E71S69-E71 PolarHBondContact O-N 3.18Å
70V33.1Very low40Very low140 Ų140132.3 Ų132.385%0.84874%0.742SS**  trans-74.2103.7166.9177.50000106.3A68A68-V70 PolarHBondContact O-N 2.89Å
71E35.5Very low42.1Very low164 Ų164130.1 Ų130.177%0.76674%0.736SS**  trans-55.4141164.5-77.1178.915300109.1S69 Y73S69-E71 PolarHBondContact O-N 3.18Å; E71-Y73 PolarHBondContact O-N 3.24Å; E71-Y73 VanDerWaalsContact O-N 3.11Å
72P35.4Very low43.8Very low117 Ų117131.5 Ų131.576%0.7673%0.731SS**  trans-60.4119.3172.523.6-29.8000109.1V74P72-V74 PolarHBondContact O-N 3.41Å
73Y33.9Very low46.1Very low206 Ų206123.4 Ų123.481%0.80869%0.689SS**  trans-60.297.8177.6-168.7-100000109.5E71E71-Y73 PolarHBondContact O-N 3.24Å; E71-Y73 VanDerWaalsContact O-N 3.11Å
74V39.5Very low48.3Very low112 Ų112115.9 Ų115.968%0.67966%0.656SS**  trans-72.1127.3171.1-174.50000107P72 E76P72-V74 PolarHBondContact O-N 3.41Å; V74-E76 PolarHBondContact O-N 3.01Å; V74-E76 VanDerWaalsContact O-N 3.08Å
75P39.8Very low50.5Low89 Ų89109.8 Ų109.858%0.57864%0.636SS**  trans-54.1120.3173.6-22.632.2000109.3F77P75-F77 VanDerWaalsContact C-N 3.25Å; P75-F77 PolarHBondContact O-N 3.32Å
76E38Very low52.7Low168 Ų168109 Ų10979%0.78562%0.616SS**  trans-63.188.8175.2-74.7-176.815500109V74 T78V74-E76 PolarHBondContact O-N 3.01Å; V74-E76 VanDerWaalsContact O-N 3.08Å; E76-T78 PolarHBondContact O-N 3.38Å
77F48.5Very low55.1Low151 Ų151105.1 Ų105.166%0.66258%0.576SS**  trans-61.6108.4161.2-92-88.1000106.8P75 V79P75-F77 VanDerWaalsContact C-N 3.25Å; P75-F77 PolarHBondContact O-N 3.32Å; F77-V79 VanDerWaalsContact C-N 3.29Å; F77-V79 PolarHBondContact O-N 3Å
78T55.3Low57.1Low132 Ų13297.2 Ų97.281%0.8154%0.537SS*.  trans-62.695.1172.452.90000107.6E76 S80E76-T78 PolarHBondContact O-N 3.38Å; T78-S80 PolarHBondContact O-N 3.34Å
79V66.8Low59.6Low30 Ų3096.9 Ų96.918%0.18252%0.517CS..  trans-55.5125.9178.6-177.10000108.5F77 P81 V84 Q98 L101 R102F77-V79 VanDerWaalsContact C-N 3.29Å; F77-V79 PolarHBondContact O-N 3Å; V79-P81 WeakPolarHBondContact O-CD 3.38Å; V79-V84 HydrophobicContact CG1-CG2 3.71Å; V79-Q98 HydrophobicContact CB-CG 4.2Å; V79-Q98 HydrophobicContact CG1-CG 4.25Å; V79-Q98 HydrophobicContact CG2-CG 3.96Å; V79-L101 HydrophobicContact CG1-CB 3.75Å; V79-L101 HydrophobicContact CG1-CD1 3.7Å; V79-L101 HydrophobicContact CG1-CG 4.36Å; V79-R102 HydrophobicContact CG2-CG 3.56Å
80S77.3Confident61.8Low61 Ų6191.5 Ų91.543%0.42748%0.479SS..  trans-59.8121.1-179.2176.30000110.1T78 F82 A83 V84T78-S80 PolarHBondContact O-N 3.34Å; S80-F82 PolarHBondContact O-N 3.11Å; S80-A83 WeakPolarHBondContact O-CB 3.5Å; S80-A83 PolarHBondContact O-N 2.79Å; S80-V84 PolarHBondContact O-N 3.13Å
81P75.6Confident63.7Low108 Ų10884.9 Ų84.970%0.70144%0.438SS*.Hα-helixtrans-62.8-26.9-179.825.1-33.6000111.8V79 V84 Q85V79-P81 WeakPolarHBondContact O-CD 3.38Å; P81-V84 PolarHBondContact O-N 3.23Å; P81-Q85 WeakPolarHBondContact O-CB 3.38Å; P81-Q85 PolarHBondContact O-N 3.46Å
82F78.9Confident65.8Low137 Ų13777.1 Ų77.160%0.60140%0.402SS*.Hα-helixtrans-67.1-39.6175.1-176.5-98.3000112.3S80 Q85 K86S80-F82 PolarHBondContact O-N 3.11Å; F82-Q85 PolarHBondContact O-N 3.36Å; F82-K86 PolarHBondContact O-N 2.96Å
83A79.3Confident67.7Low6 Ų672.4 Ų72.45%0.0537%0.37CS..Hα-helixtrans-63.3-44.3176.200000111.4S80 K86 L87 L101 V108S80-A83 WeakPolarHBondContact O-CB 3.5Å; S80-A83 PolarHBondContact O-N 2.79Å; A83-K86 PolarHBondContact O-N 3.43Å; A83-L87 WeakPolarHBondContact O-CG 3.34Å; A83-L87 PolarHBondContact O-N 3.41Å; A83-L101 HydrophobicContact CB-CD1 3.84Å; A83-L101 HydrophobicContact CB-CD2 4.09Å; A83-V108 HydrophobicContact CB-CG2 3.61Å
84V80Confident69.8Low22 Ų2266 Ų6613%0.13335%0.353CS..Hα-helixtrans-63-43.9176.3-179.70000110.7V79 S80 P81 K86 L87 S88 T94 C97 L101V79-V84 HydrophobicContact CG1-CG2 3.71Å; S80-V84 PolarHBondContact O-N 3.13Å; P81-V84 PolarHBondContact O-N 3.23Å; V84-K86 VanDerWaalsContact C-N 3.34Å; V84-K86 PolarHBondContact O-N 3.06Å; V84-L87 PolarHBondContact O-N 3.47Å; V84-S88 WeakPolarHBondContact O-CB 3.42Å; V84-S88 PolarHBondContact O-N 3.26Å; V84-T94 HydrophobicContact CG1-CG2 4.09Å; V84-C97 HydrophobicContact CG1-CB 4.28Å; V84-L101 HydrophobicContact CG2-CD1 3.68Å
85Q78.2Confident71.6Confident101 Ų10165.9 Ų65.947%0.47235%0.345SS..Hα-helixtrans-62.1-42.1177.5-167.4-178.715.500111.3P81 F82 S88 R89P81-Q85 WeakPolarHBondContact O-CB 3.38Å; P81-Q85 PolarHBondContact O-N 3.46Å; F82-Q85 PolarHBondContact O-N 3.36Å; Q85-S88 PolarHBondContact O-N 3.46Å; Q85-S88 PolarHBondContact O-OG 3.04Å; Q85-R89 WeakPolarHBondContact O-CG 3.41Å; Q85-R89 PolarHBondContact O-N 3.47Å
86K80.8Confident73.4Confident71 Ų7164.4 Ų64.431%0.30933%0.328SS..Hα-helixtrans-63.1-45.3176.6-170.9172.2177.2-178.80111.9F82 A83 V84 S88 R89 Y90 V108F82-K86 PolarHBondContact O-N 2.96Å; A83-K86 PolarHBondContact O-N 3.43Å; V84-K86 VanDerWaalsContact C-N 3.34Å; V84-K86 PolarHBondContact O-N 3.06Å; K86-S88 VanDerWaalsContact C-N 3.34Å; K86-S88 PolarHBondContact O-N 3.42Å; K86-R89 WeakPolarHBondContact O-CB 3.44Å; K86-R89 PolarHBondContact O-N 2.86Å; K86-R89 VanDerWaalsContact O-N 3.12Å; K86-Y90 HydrophobicContact CG-CE2 4.32Å; K86-Y90 VanDerWaalsContact O-CD2 3.26Å; K86-Y90 WeakPolarHBondContact O-CD2 3.35Å; K86-Y90 WeakPolarHBondContact O-CE2 3.11Å; K86-V108 HydrophobicContact CD-CG1 4.26Å
87L81.8Confident75.4Confident0 Ų056.4 Ų56.40%029%0.29CS..Hα-helixtrans-64.4-37.6176.9-68.7178.1000112.7A83 V84 R89 Y90 C97 L101 V108 L112 L115A83-L87 WeakPolarHBondContact O-CG 3.34Å; A83-L87 PolarHBondContact O-N 3.41Å; V84-L87 PolarHBondContact O-N 3.47Å; L87-R89 PolarHBondContact O-N 2.89Å; L87-Y90 PolarHBondContact O-N 3.35Å; L87-Y90 VanDerWaalsContact O-N 3.09Å; L87-C97 HydrophobicContact CB-CB 3.95Å; L87-C97 WeakPolarHBondContact CB-SG 3.43Å; L87-C97 HydrophobicContact CD1-CB 3.98Å; L87-L101 HydrophobicContact CD1-CD1 3.7Å; L87-L101 HydrophobicContact CD1-CD2 4.08Å; L87-L101 HydrophobicContact CD1-CG 3.73Å; L87-V108 HydrophobicContact CD2-CG1 3.87Å; L87-V108 HydrophobicContact CG-CG1 4.09Å; L87-L112 HydrophobicContact CD2-CB 3.79Å; L87-L112 HydrophobicContact CD2-CD1 4.11Å; L87-L112 HydrophobicContact CD2-CG 4.45Å; L87-L115 HydrophobicContact CD1-CD1 4.34Å
88S80.8Confident76.9Confident23 Ų2352.7 Ų52.716%0.16128%0.275CS..Hα-helixtrans-62.3-26.2175.277.20000112.8V84 Q85 K86 Y90 G91 L281V84-S88 WeakPolarHBondContact O-CB 3.42Å; V84-S88 PolarHBondContact O-N 3.26Å; Q85-S88 PolarHBondContact O-N 3.46Å; Q85-S88 PolarHBondContact O-OG 3.04Å; K86-S88 VanDerWaalsContact C-N 3.34Å; K86-S88 PolarHBondContact O-N 3.42Å; S88-Y90 VanDerWaalsContact C-N 3.26Å; S88-Y90 PolarHBondContact O-N 3.46Å; S88-G91 PolarHBondContact O-N 3.19Å; S88-L281 WeakPolarHBondContact O-CD2 3.42Å
89R80.8Confident78.1Confident79 Ų7948.6 Ų48.630%0.29826%0.255SS..Hα-helixtrans-66.5-25.8176.1-70.2177.6-176.6170.82.3112.9Q85 K86 L87 G91 Y273 R284Q85-R89 WeakPolarHBondContact O-CG 3.41Å; Q85-R89 PolarHBondContact O-N 3.47Å; K86-R89 WeakPolarHBondContact O-CB 3.44Å; K86-R89 PolarHBondContact O-N 2.86Å; K86-R89 VanDerWaalsContact O-N 3.12Å; L87-R89 PolarHBondContact O-N 2.89Å; R89-G91 VanDerWaalsContact C-N 3.25Å; R89-G91 PolarHBondContact O-N 3.35Å; R89-Y273 HydrophobicContact CB-CD2 3.91Å; R89-Y273 HydrophobicContact CB-CE2 3.5Å; R89-Y273 VanDerWaalsContact CB-CE2 3.5Å; R89-Y273 VanDerWaalsContact CD-OH 3.31Å; R89-Y273 WeakPolarHBondContact CD-OH 3.27Å; R89-Y273 HydrophobicContact CG-CE2 4.2Å; R89-Y273 PolarHBondContact NH1-OH 3.06Å; R89-R284 WeakPolarHBondContact O-CD 3.31Å; R89-R284 PolarHBondContact O-NH1 3.29Å
90Y77.9Confident78.8Confident5 Ų547.7 Ų47.72%0.0225%0.249CC..THydrogen-bonded Turntrans-77.4-7.4172.7-60.7-90.4000113.4K86 L87 S88 L112 E254 A271 Y273 R284 L285K86-Y90 HydrophobicContact CG-CE2 4.32Å; K86-Y90 VanDerWaalsContact O-CD2 3.26Å; K86-Y90 WeakPolarHBondContact O-CD2 3.35Å; K86-Y90 WeakPolarHBondContact O-CE2 3.11Å; L87-Y90 PolarHBondContact O-N 3.35Å; L87-Y90 VanDerWaalsContact O-N 3.09Å; S88-Y90 VanDerWaalsContact C-N 3.26Å; S88-Y90 PolarHBondContact O-N 3.46Å; Y90-L112 HydrophobicContact CD1-CD1 4.35Å; Y90-L112 HydrophobicContact CD1-CD2 4.29Å; Y90-L112 HydrophobicContact CD2-CD1 4.08Å; Y90-L112 HydrophobicContact CD2-CD2 4.35Å; Y90-L112 HydrophobicContact CE1-CD2 3.86Å; Y90-L112 HydrophobicContact CE2-CD1 4.49Å; Y90-L112 HydrophobicContact CE2-CD2 3.96Å; Y90-L112 HydrophobicContact CG-CD1 4Å; Y90-L112 HydrophobicContact CG-CD2 4.5Å; Y90-E254 HydrophobicContact CE1-CB 4.47Å; Y90-E254 PolarHBondContact OH-OE2 3.33Å; Y90-A271 HydrophobicContact CD1-CB 3.76Å; Y90-A271 HydrophobicContact CE1-CB 3.99Å; Y90-Y273 HydrophobicContact CD1-CD2 4.3Å; Y90-Y273 HydrophobicContact CD2-CD2 4.3Å; Y90-Y273 AromaticContact CE1-CD2 3.94Å; Y90-Y273 HydrophobicContact CE1-CD2 3.94Å; Y90-Y273 HydrophobicContact CE1-CG 4.29Å; Y90-Y273 AromaticContact CE2-CD2 3.9Å; Y90-Y273 HydrophobicContact CE2-CD2 3.9Å; Y90-Y273 HydrophobicContact CE2-CE2 4.44Å; Y90-Y273 HydrophobicContact CG-CD2 4.49Å; Y90-Y273 AromaticContact CZ-CD2 3.72Å; Y90-R284 WeakPolarHBondContact O-CB 3.4Å; Y90-L285 WeakPolarHBondContact O-CD2 3.34Å
91G73.1Confident79Confident0 Ų044.9 Ų44.90%023%0.229CC..THydrogen-bonded Turntrans107.62175.700000115.6S88 R89 L281 L285 S331S88-G91 PolarHBondContact O-N 3.19Å; R89-G91 VanDerWaalsContact C-N 3.25Å; R89-G91 PolarHBondContact O-N 3.35Å; G91-L281 WeakPolarHBondContact CA-O 3.36Å; G91-L285 VanDerWaalsContact O-CD1 3.3Å; G91-L285 WeakPolarHBondContact O-CD1 3.18Å; G91-S331 PolarHBondContact O-OG 2.95Å
92F79.4Confident79.4Confident1 Ų146.9 Ų46.90%0.00422%0.223CC..  trans-81.2148177.9-63.5-75.4000112.7C97 L112 L115 L116 L285F92-C97 WeakPolarHBondContact CB-SG 3.44Å; F92-L112 HydrophobicContact CD2-CD1 4.42Å; F92-L112 HydrophobicContact CE2-CD1 3.81Å; F92-L115 HydrophobicContact CD1-CB 4.29Å; F92-L115 HydrophobicContact CD1-CD1 4.5Å; F92-L115 HydrophobicContact CD1-CD2 4.4Å; F92-L115 HydrophobicContact CD2-CD1 4.24Å; F92-L115 HydrophobicContact CE1-CB 3.91Å; F92-L115 HydrophobicContact CE2-CB 4.21Å; F92-L115 HydrophobicContact CG-CD1 4.18Å; F92-L115 HydrophobicContact CZ-CB 3.86Å; F92-L116 HydrophobicContact CE2-CD2 4.23Å; F92-L116 HydrophobicContact CE2-CG 4.48Å; F92-L116 HydrophobicContact CZ-CD2 3.85Å; F92-L116 HydrophobicContact CZ-CG 4.19Å; F92-L285 HydrophobicContact CD1-CD1 4.15Å; F92-L285 HydrophobicContact CD1-CD2 4.09Å; F92-L285 HydrophobicContact CD2-CD2 4.25Å; F92-L285 HydrophobicContact CE1-CD1 4.3Å; F92-L285 HydrophobicContact CE1-CD2 3.73Å; F92-L285 HydrophobicContact CE2-CD2 3.9Å; F92-L285 HydrophobicContact CG-CD2 4.34Å; F92-L285 HydrophobicContact CZ-CD2 3.62Å
93N76.9Confident79.4Confident18 Ų1846.6 Ų46.610%0.09623%0.225CC..  trans-65.9141.2173.4-175.6-80.3000111.8E95 R96 C97 Y330N93-E95 VanDerWaalsContact C-N 3.3Å; N93-E95 PolarHBondContact O-N 2.92Å; N93-E95 WeakPolarHBondContact OD1-CB 3.35Å; N93-E95 PolarHBondContact OD1-N 3.08Å; N93-R96 PolarHBondContact O-N 3.45Å; N93-C97 PolarHBondContact O-N 3.45Å; N93-C97 PolarHBondContact O-SG 2.97Å; N93-Y330 WeakPolarHBondContact CB-O 3.25Å; N93-Y330 PolarHBondContact N-O 3.44Å
94T77.9Confident79.3Confident72 Ų7247.8 Ų47.844%0.44223%0.233SC..Hα-helixtrans-59.5-34.6-177.446.90000113.8V84 Q98V84-T94 HydrophobicContact CG1-CG2 4.09Å; T94-Q98 WeakPolarHBondContact O-CB 3.42Å; T94-Q98 PolarHBondContact O-N 3.43Å
95E76.6Confident79.1Confident109 Ų10953.2 Ų53.251%0.50926%0.261SS..Hα-helixtrans-71.3-41.5179.8-61.4177.8178.400111.5N93 Q98 A99N93-E95 VanDerWaalsContact C-N 3.3Å; N93-E95 PolarHBondContact O-N 2.92Å; N93-E95 WeakPolarHBondContact OD1-CB 3.35Å; N93-E95 PolarHBondContact OD1-N 3.08Å; E95-Q98 PolarHBondContact O-N 3.23Å; E95-A99 PolarHBondContact O-N 3.09Å
96R78Confident78.8Confident58 Ų5850.6 Ų50.622%0.21926%0.261CS..Hα-helixtrans-66.3-41.8174.6-65.9-172.2-175.3-146.12.5111.2N93 Q98 A99 V100 K329N93-R96 PolarHBondContact O-N 3.45Å; R96-Q98 VanDerWaalsContact C-N 3.3Å; R96-Q98 PolarHBondContact O-N 3.4Å; R96-A99 PolarHBondContact O-N 3.26Å; R96-V100 WeakPolarHBondContact O-CG2 3.35Å; R96-V100 PolarHBondContact O-N 3.07Å; R96-K329 PolarHBondContact NH2-O 3.49Å
97C79.8Confident78.9Confident0 Ų051.5 Ų51.50%027%0.269CS..Hα-helixtrans-59.1-43.1174.4-64.10000111.3V84 L87 F92 N93 L101V84-C97 HydrophobicContact CG1-CB 4.28Å; L87-C97 HydrophobicContact CB-CB 3.95Å; L87-C97 WeakPolarHBondContact CB-SG 3.43Å; L87-C97 HydrophobicContact CD1-CB 3.98Å; F92-C97 WeakPolarHBondContact CB-SG 3.44Å; N93-C97 PolarHBondContact O-N 3.45Å; N93-C97 PolarHBondContact O-SG 2.97Å; C97-L101 VanDerWaalsContact O-CB 3.3Å; C97-L101 WeakPolarHBondContact O-CB 3.45Å; C97-L101 WeakPolarHBondContact O-CD1 3.36Å; C97-L101 VanDerWaalsContact O-CG 3.24Å; C97-L101 WeakPolarHBondContact O-CG 3.44Å; C97-L101 PolarHBondContact O-N 3.18Å
98Q79.1Confident78.9Confident74 Ų7453.3 Ų53.335%0.34628%0.28SS..Hα-helixtrans-67.4-40.2179.1-167.2179.512.800112.1V79 T94 E95 R96 R102V79-Q98 HydrophobicContact CB-CG 4.2Å; V79-Q98 HydrophobicContact CG1-CG 4.25Å; V79-Q98 HydrophobicContact CG2-CG 3.96Å; T94-Q98 WeakPolarHBondContact O-CB 3.42Å; T94-Q98 PolarHBondContact O-N 3.43Å; E95-Q98 PolarHBondContact O-N 3.23Å; R96-Q98 VanDerWaalsContact C-N 3.3Å; R96-Q98 PolarHBondContact O-N 3.4Å; Q98-R102 WeakPolarHBondContact O-CG 3.39Å; Q98-R102 PolarHBondContact O-N 3.28Å; Q98-R102 VanDerWaalsContact O-N 3.16Å
99A80.9Confident78.9Confident46 Ų4652.7 Ų52.738%0.3828%0.278SS..Hα-helixtrans-62.2-4717700000111.9E95 R96 R102 M103E95-A99 PolarHBondContact O-N 3.09Å; R96-A99 PolarHBondContact O-N 3.26Å; A99-R102 WeakPolarHBondContact O-CB 3.35Å; A99-R102 PolarHBondContact O-N 3.18Å; A99-M103 PolarHBondContact O-N 3.1Å
100V81.3Confident79Confident10 Ų1050.6 Ų50.66%0.06128%0.277CS..Hα-helixtrans-69.7-38.3179.7178.90000111.6R96 R102 M103 C104 H114 L115R96-V100 WeakPolarHBondContact O-CG2 3.35Å; R96-V100 PolarHBondContact O-N 3.07Å; V100-R102 PolarHBondContact O-N 3.48Å; V100-M103 WeakPolarHBondContact O-CA 3.5Å; V100-M103 WeakPolarHBondContact O-CB 3.46Å; V100-M103 PolarHBondContact O-N 3.48Å; V100-C104 PolarHBondContact O-N 3.35Å; V100-H114 HydrophobicContact CG1-CB 4.03Å; V100-L115 HydrophobicContact CB-CD2 4.36Å; V100-L115 HydrophobicContact CB-CG 4.28Å; V100-L115 HydrophobicContact CG1-CG 4.31Å; V100-L115 HydrophobicContact CG2-CD2 3.63Å; V100-L115 HydrophobicContact CG2-CG 4.01Å
101L82.8Confident79.4Confident2 Ų250.4 Ų50.41%0.0128%0.276CS..Hα-helixtrans-61.2-31175.1-79.9166.1000113.1V79 A83 V84 L87 C97 M103 D105 G106 S111V79-L101 HydrophobicContact CG1-CB 3.75Å; V79-L101 HydrophobicContact CG1-CD1 3.7Å; V79-L101 HydrophobicContact CG1-CG 4.36Å; A83-L101 HydrophobicContact CB-CD1 3.84Å; A83-L101 HydrophobicContact CB-CD2 4.09Å; V84-L101 HydrophobicContact CG2-CD1 3.68Å; L87-L101 HydrophobicContact CD1-CD1 3.7Å; L87-L101 HydrophobicContact CD1-CD2 4.08Å; L87-L101 HydrophobicContact CD1-CG 3.73Å; C97-L101 VanDerWaalsContact O-CB 3.3Å; C97-L101 WeakPolarHBondContact O-CB 3.45Å; C97-L101 WeakPolarHBondContact O-CD1 3.36Å; C97-L101 VanDerWaalsContact O-CG 3.24Å; C97-L101 WeakPolarHBondContact O-CG 3.44Å; C97-L101 PolarHBondContact O-N 3.18Å; L101-M103 VanDerWaalsContact C-N 3.33Å; L101-D105 PolarHBondContact O-N 3.38Å; L101-G106 PolarHBondContact O-N 2.68Å; L101-S111 WeakPolarHBondContact CD2-OG 3.24Å
102R82.8Confident79.9Confident150 Ų15050.4 Ų50.457%0.56628%0.277SS*.Hα-helixtrans-70.5-29.9172.3-69.6173.8-166.9164.44.4112.4V79 Q98 A99 V100V79-R102 HydrophobicContact CG2-CG 3.56Å; Q98-R102 WeakPolarHBondContact O-CG 3.39Å; Q98-R102 PolarHBondContact O-N 3.28Å; Q98-R102 VanDerWaalsContact O-N 3.16Å; A99-R102 WeakPolarHBondContact O-CB 3.35Å; A99-R102 PolarHBondContact O-N 3.18Å; V100-R102 PolarHBondContact O-N 3.48Å
103M79.3Confident80.2Confident132 Ų13252.6 Ų52.665%0.6529%0.287SS*.Hα-helixtrans-80.2-27.4177.8-67.2179.255.200113A99 V100 L101A99-M103 PolarHBondContact O-N 3.1Å; V100-M103 WeakPolarHBondContact O-CA 3.5Å; V100-M103 WeakPolarHBondContact O-CB 3.46Å; V100-M103 PolarHBondContact O-N 3.48Å; L101-M103 VanDerWaalsContact C-N 3.33Å
104C77.6Confident80.6Confident31 Ų3155.9 Ų55.921%0.20930%0.301CS..THydrogen-bonded Turntrans-10423.7-177.7-61.40000113.2V100 G106 D107 A110 S111V100-C104 PolarHBondContact O-N 3.35Å; C104-G106 PolarHBondContact O-N 3.01Å; C104-D107 PolarHBondContact O-N 3.12Å; C104-A110 HydrophobicContact CB-CB 4.4Å; C104-S111 WeakPolarHBondContact CB-OG 3.23Å
105D75.1Confident80.8Confident135 Ų13552.5 Ų52.572%0.72228%0.281SS*.THydrogen-bonded Turntrans50.432176.6-59.9-36.9000114.7L101L101-D105 PolarHBondContact O-N 3.38Å
106G71.9Confident81.2Confident46 Ų4647.4 Ų47.447%0.47426%0.257SS..THydrogen-bonded Turntrans854.2178.700000116.6L101 C104 V108L101-G106 PolarHBondContact O-N 2.68Å; C104-G106 PolarHBondContact O-N 3.01Å; G106-V108 PolarHBondContact O-N 2.9Å
107D82.9Confident81.4Confident91 Ų9147.2 Ų47.249%0.48726%0.262SS..  trans-74.7115173.1-173.6-15.4000111.2C104 G109 A110 S111C104-D107 PolarHBondContact O-N 3.12Å; D107-G109 PolarHBondContact OD1-N 2.98Å; D107-A110 HydrophobicContact CB-CB 4.06Å; D107-A110 PolarHBondContact OD1-N 3.33Å; D107-S111 VanDerWaalsContact O-CB 3.24Å; D107-S111 WeakPolarHBondContact O-CB 3.01Å; D107-S111 PolarHBondContact O-N 3.14Å; D107-S111 VanDerWaalsContact O-N 3.1Å; D107-S111 PolarHBondContact O-OG 3.16Å
108V81.6Confident81.5Confident37 Ų3750.5 Ų50.522%0.22428%0.278CS..Hα-helixtrans-66.7-36.8179.8-172.90000112A83 K86 L87 G106 L112A83-V108 HydrophobicContact CB-CG2 3.61Å; K86-V108 HydrophobicContact CD-CG1 4.26Å; L87-V108 HydrophobicContact CD2-CG1 3.87Å; L87-V108 HydrophobicContact CG-CG1 4.09Å; G106-V108 PolarHBondContact O-N 2.9Å; V108-L112 WeakPolarHBondContact O-CB 3.38Å; V108-L112 PolarHBondContact O-N 2.97Å
109G81.9Confident81.5Confident11 Ų1147 Ų4711%0.11326%0.261CS..Hα-helixtrans-71.2-50.5-176.900000111.9D107 S111 L112 E113D107-G109 PolarHBondContact OD1-N 2.98Å; G109-S111 VanDerWaalsContact C-N 3.3Å; G109-S111 PolarHBondContact O-N 3.23Å; G109-L112 PolarHBondContact O-N 3.2Å; G109-E113 WeakPolarHBondContact O-CG 3.3Å; G109-E113 PolarHBondContact O-N 2.49Å
110A82.8Confident81.4Confident35 Ų3545 Ų4529%0.28924%0.244SC..Hα-helixtrans-61.9-38.8176.100000111.8C104 D107 L112 E113 H114C104-A110 HydrophobicContact CB-CB 4.4Å; D107-A110 HydrophobicContact CB-CB 4.06Å; D107-A110 PolarHBondContact OD1-N 3.33Å; A110-L112 PolarHBondContact O-N 3.42Å; A110-E113 PolarHBondContact O-N 3.31Å; A110-H114 WeakPolarHBondContact O-CB 3.45Å; A110-H114 PolarHBondContact O-N 3.23Å
111S85.3Confident81.1Confident0 Ų047 Ų470%026%0.258CS..Hα-helixtrans-63.3-40.9175.7-61.30000112.5L101 C104 D107 G109 H114 L115L101-S111 WeakPolarHBondContact CD2-OG 3.24Å; C104-S111 WeakPolarHBondContact CB-OG 3.23Å; D107-S111 VanDerWaalsContact O-CB 3.24Å; D107-S111 WeakPolarHBondContact O-CB 3.01Å; D107-S111 PolarHBondContact O-N 3.14Å; D107-S111 VanDerWaalsContact O-N 3.1Å; D107-S111 PolarHBondContact O-OG 3.16Å; G109-S111 VanDerWaalsContact C-N 3.3Å; G109-S111 PolarHBondContact O-N 3.23Å; S111-H114 PolarHBondContact O-N 3.3Å; S111-L115 WeakPolarHBondContact O-CB 3.47Å; S111-L115 VanDerWaalsContact O-CG 3.32Å; S111-L115 WeakPolarHBondContact O-CG 3.33Å; S111-L115 PolarHBondContact O-N 3.2Å
112L84.4Confident80.5Confident1 Ų152.4 Ų52.41%0.00528%0.283CS..Hα-helixtrans-65.9-43.8177-178.861.2000111.4L87 Y90 F92 V108 G109 A110 H114 L115 L116L87-L112 HydrophobicContact CD2-CB 3.79Å; L87-L112 HydrophobicContact CD2-CD1 4.11Å; L87-L112 HydrophobicContact CD2-CG 4.45Å; Y90-L112 HydrophobicContact CD1-CD1 4.35Å; Y90-L112 HydrophobicContact CD1-CD2 4.29Å; Y90-L112 HydrophobicContact CD2-CD1 4.08Å; Y90-L112 HydrophobicContact CD2-CD2 4.35Å; Y90-L112 HydrophobicContact CE1-CD2 3.86Å; Y90-L112 HydrophobicContact CE2-CD1 4.49Å; Y90-L112 HydrophobicContact CE2-CD2 3.96Å; Y90-L112 HydrophobicContact CG-CD1 4Å; Y90-L112 HydrophobicContact CG-CD2 4.5Å; F92-L112 HydrophobicContact CD2-CD1 4.42Å; F92-L112 HydrophobicContact CE2-CD1 3.81Å; V108-L112 WeakPolarHBondContact O-CB 3.38Å; V108-L112 PolarHBondContact O-N 2.97Å; G109-L112 PolarHBondContact O-N 3.2Å; A110-L112 PolarHBondContact O-N 3.42Å; L112-H114 VanDerWaalsContact C-N 3.3Å; L112-H114 PolarHBondContact O-N 3.36Å; L112-L115 PolarHBondContact O-N 3.1Å; L112-L116 HydrophobicContact CD1-CD1 3.93Å; L112-L116 HydrophobicContact CD1-CG 4.1Å; L112-L116 HydrophobicContact CD2-CD1 4.47Å; L112-L116 HydrophobicContact CG-CD1 3.76Å; L112-L116 HydrophobicContact CG-CG 4.38Å; L112-L116 WeakPolarHBondContact O-CB 3.39Å; L112-L116 VanDerWaalsContact O-CG 3.29Å; L112-L116 WeakPolarHBondContact O-CG 3.44Å; L112-L116 PolarHBondContact O-N 3.25Å
113E86.1Confident79.4Confident47 Ų4748.4 Ų48.422%0.2228%0.276CS..Hα-helixtrans-59.4-42.5176-73.2169.1-156.700111.6G109 A110 T117 R256 L269G109-E113 WeakPolarHBondContact O-CG 3.3Å; G109-E113 PolarHBondContact O-N 2.49Å; A110-E113 PolarHBondContact O-N 3.31Å; E113-T117 WeakPolarHBondContact O-CB 3.36Å; E113-T117 PolarHBondContact O-N 3.32Å; E113-T117 PolarHBondContact O-OG1 3.41Å; E113-R256 IonicContact OE1-CZ 3.51Å; E113-R256 VanDerWaalsContact OE1-CZ 3.28Å; E113-R256 IonicContact OE1-NE 3.83Å; E113-R256 PolarHBondContact OE1-NE 3.4Å; E113-R256 IonicContact OE1-NH2 3.06Å; E113-R256 PolarHBondContact OE1-NH2 3.04Å; E113-L269 HydrophobicContact CB-CD1 4.13Å; E113-L269 HydrophobicContact CG-CD1 4.04Å
114H84.2Confident78.8Confident87 Ų8743.6 Ų43.640%0.40325%0.252SS..Hα-helixtrans-64.3-46177-166.376.1000112V100 A110 S111 L112 T117 Q118V100-H114 HydrophobicContact CG1-CB 4.03Å; A110-H114 WeakPolarHBondContact O-CB 3.45Å; A110-H114 PolarHBondContact O-N 3.23Å; S111-H114 PolarHBondContact O-N 3.3Å; L112-H114 VanDerWaalsContact C-N 3.3Å; L112-H114 PolarHBondContact O-N 3.36Å; H114-T117 PolarHBondContact O-N 2.94Å; H114-Q118 WeakPolarHBondContact O-CB 3.44Å; H114-Q118 PolarHBondContact O-N 3.02Å
115L83.7Confident77.9Confident1 Ų143.6 Ų43.61%0.00526%0.256CS..Hα-helixtrans-62.5-44177.9-75.9169000112.6L87 F92 V100 S111 L112 Q118 C119L87-L115 HydrophobicContact CD1-CD1 4.34Å; F92-L115 HydrophobicContact CD1-CB 4.29Å; F92-L115 HydrophobicContact CD1-CD1 4.5Å; F92-L115 HydrophobicContact CD1-CD2 4.4Å; F92-L115 HydrophobicContact CD2-CD1 4.24Å; F92-L115 HydrophobicContact CE1-CB 3.91Å; F92-L115 HydrophobicContact CE2-CB 4.21Å; F92-L115 HydrophobicContact CG-CD1 4.18Å; F92-L115 HydrophobicContact CZ-CB 3.86Å; V100-L115 HydrophobicContact CB-CD2 4.36Å; V100-L115 HydrophobicContact CB-CG 4.28Å; V100-L115 HydrophobicContact CG1-CG 4.31Å; V100-L115 HydrophobicContact CG2-CD2 3.63Å; V100-L115 HydrophobicContact CG2-CG 4.01Å; S111-L115 WeakPolarHBondContact O-CB 3.47Å; S111-L115 VanDerWaalsContact O-CG 3.32Å; S111-L115 WeakPolarHBondContact O-CG 3.33Å; S111-L115 PolarHBondContact O-N 3.2Å; L112-L115 PolarHBondContact O-N 3.1Å; L115-Q118 PolarHBondContact O-N 3.34Å; L115-C119 WeakPolarHBondContact O-CB 3.45Å; L115-C119 PolarHBondContact O-N 2.92Å
116L84.2Confident77.2Confident1 Ų145.4 Ų45.41%0.00526%0.261CS..Hα-helixtrans-66.9-44.6177.6-71.5167000111.1F92 L112 Q118 C119 F120 L269 A271F92-L116 HydrophobicContact CE2-CD2 4.23Å; F92-L116 HydrophobicContact CE2-CG 4.48Å; F92-L116 HydrophobicContact CZ-CD2 3.85Å; F92-L116 HydrophobicContact CZ-CG 4.19Å; L112-L116 HydrophobicContact CD1-CD1 3.93Å; L112-L116 HydrophobicContact CD1-CG 4.1Å; L112-L116 HydrophobicContact CD2-CD1 4.47Å; L112-L116 HydrophobicContact CG-CD1 3.76Å; L112-L116 HydrophobicContact CG-CG 4.38Å; L112-L116 WeakPolarHBondContact O-CB 3.39Å; L112-L116 VanDerWaalsContact O-CG 3.29Å; L112-L116 WeakPolarHBondContact O-CG 3.44Å; L112-L116 PolarHBondContact O-N 3.25Å; L116-Q118 VanDerWaalsContact C-N 3.29Å; L116-Q118 PolarHBondContact O-N 3.2Å; L116-C119 WeakPolarHBondContact O-CB 3.26Å; L116-C119 PolarHBondContact O-N 2.96Å; L116-F120 HydrophobicContact CB-CD2 4.22Å; L116-F120 HydrophobicContact CB-CE2 3.82Å; L116-F120 HydrophobicContact CB-CZ 4.44Å; L116-F120 HydrophobicContact CD2-CE2 3.95Å; L116-F120 HydrophobicContact CD2-CZ 3.75Å; L116-F120 HydrophobicContact CG-CE2 4.41Å; L116-F120 WeakPolarHBondContact O-CB 3.21Å; L116-F120 WeakPolarHBondContact O-CD2 3.29Å; L116-F120 WeakPolarHBondContact O-CG 3.5Å; L116-F120 PolarHBondContact O-N 3.25Å; L116-L269 HydrophobicContact CB-CD2 4.44Å; L116-A271 HydrophobicContact CD1-CB 3.82Å; L116-A271 HydrophobicContact CD2-CB 4.32Å
117T82.9Confident76.6Confident54 Ų5448.6 Ų48.633%0.33126%0.258SS..Hα-helixtrans-59.5-43.1175.8-59.60000110.8E113 H114 S121 M128E113-T117 WeakPolarHBondContact O-CB 3.36Å; E113-T117 PolarHBondContact O-N 3.32Å; E113-T117 PolarHBondContact O-OG1 3.41Å; H114-T117 PolarHBondContact O-N 2.94Å; T117-S121 WeakPolarHBondContact O-CB 3.31Å; T117-S121 PolarHBondContact O-N 2.84Å; T117-S121 PolarHBondContact O-OG 2.92Å; T117-M128 HydrophobicContact CG2-CE 3.91Å
118Q81.7Confident75.8Confident70 Ų7046.5 Ų46.533%0.32725%0.246SC..Hα-helixtrans-61.8-47.9175.6-167.7-177-1400111.2H114 L115 L116 F120 S121 E122 Y330H114-Q118 WeakPolarHBondContact O-CB 3.44Å; H114-Q118 PolarHBondContact O-N 3.02Å; L115-Q118 PolarHBondContact O-N 3.34Å; L116-Q118 VanDerWaalsContact C-N 3.29Å; L116-Q118 PolarHBondContact O-N 3.2Å; Q118-F120 PolarHBondContact O-N 3.06Å; Q118-S121 PolarHBondContact O-N 3.35Å; Q118-S121 PolarHBondContact O-OG 2.92Å; Q118-E122 PolarHBondContact O-N 3.28Å; Q118-Y330 HydrophobicContact CG-CE1 4.37Å
119C78.6Confident74.8Confident1 Ų152.5 Ų52.51%0.00727%0.269CS..Hα-helixtrans-58.7-47.9178.5-1630000112.3L115 L116 T123 E289 H328 Y330L115-C119 WeakPolarHBondContact O-CB 3.45Å; L115-C119 PolarHBondContact O-N 2.92Å; L116-C119 WeakPolarHBondContact O-CB 3.26Å; L116-C119 PolarHBondContact O-N 2.96Å; C119-T123 PolarHBondContact O-N 3.48Å; C119-T123 PolarHBondContact O-OG1 3.48Å; C119-E289 PolarHBondContact SG-OE1 3.25Å; C119-H328 VanDerWaalsContact SG-CE1 3.57Å; C119-Y330 HydrophobicContact CB-CE2 4.38Å
120F78.6Confident73.7Confident2 Ų255.3 Ų55.31%0.00928%0.281CS..Hα-helixtrans-76.6-29.9-177.6-58.5-32.3000113L116 Q118 E122 T123 F124 M128 L269 V270 E289 Y292L116-F120 HydrophobicContact CB-CD2 4.22Å; L116-F120 HydrophobicContact CB-CE2 3.82Å; L116-F120 HydrophobicContact CB-CZ 4.44Å; L116-F120 HydrophobicContact CD2-CE2 3.95Å; L116-F120 HydrophobicContact CD2-CZ 3.75Å; L116-F120 HydrophobicContact CG-CE2 4.41Å; L116-F120 WeakPolarHBondContact O-CB 3.21Å; L116-F120 WeakPolarHBondContact O-CD2 3.29Å; L116-F120 WeakPolarHBondContact O-CG 3.5Å; L116-F120 PolarHBondContact O-N 3.25Å; Q118-F120 PolarHBondContact O-N 3.06Å; F120-E122 VanDerWaalsContact C-N 3.33Å; F120-T123 WeakPolarHBondContact CA-OG1 3.35Å; F120-T123 PolarHBondContact O-N 3Å; F120-T123 PolarHBondContact O-OG1 3.45Å; F120-F124 HydrophobicContact CB-CD2 4.42Å; F120-F124 WeakPolarHBondContact O-CA 3.26Å; F120-F124 WeakPolarHBondContact O-CB 3.17Å; F120-F124 PolarHBondContact O-N 3.39Å; F120-M128 HydrophobicContact CB-SD 4.46Å; F120-L269 HydrophobicContact CD2-CD2 3.79Å; F120-L269 HydrophobicContact CE2-CD2 4.02Å; F120-V270 WeakPolarHBondContact CZ-O 3.43Å; F120-E289 HydrophobicContact CD1-CG 4.37Å; F120-E289 HydrophobicContact CE1-CG 4.13Å; F120-Y292 HydrophobicContact CB-CD1 3.89Å; F120-Y292 HydrophobicContact CB-CE1 3.68Å; F120-Y292 AromaticContact CD1-CD1 3.94Å; F120-Y292 HydrophobicContact CD1-CD1 3.94Å; F120-Y292 HydrophobicContact CD1-CG 4.09Å; F120-Y292 AromaticContact CD2-CD1 3.93Å; F120-Y292 HydrophobicContact CD2-CD1 3.93Å; F120-Y292 AromaticContact CD2-CD2 3.82Å; F120-Y292 HydrophobicContact CD2-CD2 3.82Å; F120-Y292 HydrophobicContact CD2-CE1 4.06Å; F120-Y292 AromaticContact CD2-CE2 3.97Å; F120-Y292 HydrophobicContact CD2-CE2 3.97Å; F120-Y292 AromaticContact CD2-CG 3.8Å; F120-Y292 HydrophobicContact CD2-CG 3.8Å; F120-Y292 HydrophobicContact CE1-CD1 4.46Å; F120-Y292 HydrophobicContact CE1-CG 4.18Å; F120-Y292 HydrophobicContact CE2-CD1 4.45Å; F120-Y292 AromaticContact CE2-CD2 3.81Å; F120-Y292 HydrophobicContact CE2-CD2 3.81Å; F120-Y292 HydrophobicContact CE2-CE2 4.32Å; F120-Y292 AromaticContact CE2-CG 3.88Å; F120-Y292 HydrophobicContact CE2-CG 3.88Å; F120-Y292 AromaticContact CG-CD1 3.65Å; F120-Y292 HydrophobicContact CG-CD1 3.65Å; F120-Y292 HydrophobicContact CG-CD2 4.39Å; F120-Y292 AromaticContact CG-CE1 3.88Å; F120-Y292 HydrophobicContact CG-CE1 3.88Å; F120-Y292 AromaticContact CG-CG 3.91Å; F120-Y292 HydrophobicContact CG-CG 3.91Å; F120-Y292 HydrophobicContact CZ-CD2 4.37Å; F120-Y292 HydrophobicContact CZ-CG 4.07Å
121S74.5Confident72.5Confident52 Ų5257.5 Ų57.536%0.36429%0.294SS..Hα-helixtrans-67.8-34.5175.7690000112.2T117 Q118 T123 G125T117-S121 WeakPolarHBondContact O-CB 3.31Å; T117-S121 PolarHBondContact O-N 2.84Å; T117-S121 PolarHBondContact O-OG 2.92Å; Q118-S121 PolarHBondContact O-N 3.35Å; Q118-S121 PolarHBondContact O-OG 2.92Å; S121-T123 VanDerWaalsContact C-N 3.35Å; S121-G125 WeakPolarHBondContact O-CA 3.41Å; S121-G125 PolarHBondContact O-N 2.92Å
122E69.7Low71.1Confident116 Ų11665.7 Ų65.754%0.54233%0.332SS..Hα-helixtrans-72.1-28.7176.6-74.8-175.8-178.200113Q118 F120 Y330Q118-E122 PolarHBondContact O-N 3.28Å; F120-E122 VanDerWaalsContact C-N 3.33Å; E122-Y330 PolarHBondContact OE1-OH 3.3Å; E122-Y330 WeakPolarHBondContact OE2-CE2 3.5Å; E122-Y330 PolarHBondContact OE2-OH 3.16Å
123T61.3Low69.8Low66 Ų6669 Ų6941%0.40536%0.36SS..Hα-helixtrans-96-31.5-178.245.10000113.5C119 F120 S121 E289C119-T123 PolarHBondContact O-N 3.48Å; C119-T123 PolarHBondContact O-OG1 3.48Å; F120-T123 WeakPolarHBondContact CA-OG1 3.35Å; F120-T123 PolarHBondContact O-N 3Å; F120-T123 PolarHBondContact O-OG1 3.45Å; S121-T123 VanDerWaalsContact C-N 3.35Å; T123-E289 WeakPolarHBondContact CG2-OE1 2.97Å
124F65.8Low68.6Low32 Ų3267.6 Ų67.614%0.1436%0.355CS..Hα-helixtrans-132.712.5-169.5-54.2-62.7000114.2F120 E126 R127 M128 E289 Y292 D293 L296F120-F124 HydrophobicContact CB-CD2 4.42Å; F120-F124 WeakPolarHBondContact O-CA 3.26Å; F120-F124 WeakPolarHBondContact O-CB 3.17Å; F120-F124 PolarHBondContact O-N 3.39Å; F124-E126 PolarHBondContact O-N 2.99Å; F124-R127 PolarHBondContact O-N 2.88Å; F124-M128 PolarHBondContact O-N 3.33Å; F124-E289 HydrophobicContact CE2-CB 4.47Å; F124-Y292 AromaticContact CD2-CD1 3.75Å; F124-Y292 HydrophobicContact CD2-CD1 3.75Å; F124-Y292 HydrophobicContact CD2-CE1 4.16Å; F124-Y292 HydrophobicContact CE2-CD1 4.14Å; F124-D293 HydrophobicContact CE1-CB 4.14Å; F124-D293 HydrophobicContact CZ-CB 3.86Å; F124-L296 HydrophobicContact CB-CD1 4.06Å; F124-L296 HydrophobicContact CG-CD1 4.17Å
125G59.3Low67.5Low30 Ų3068 Ų6831%0.30936%0.359SS..THydrogen-bonded Turntrans-48.6-23.9-164.400000119S121S121-G125 WeakPolarHBondContact O-CA 3.41Å; S121-G125 PolarHBondContact O-N 2.92Å
126E59.8Low66.5Low174 Ų17476.3 Ų76.381%0.81340%0.398SS*.THydrogen-bonded Turntrans-84.1-33.9173-69.1-178.2168.300113.3F124 M128F124-E126 PolarHBondContact O-N 2.99Å; E126-M128 VanDerWaalsContact C-N 3.33Å
127R59.8Low66Low112 Ų11278 Ų7842%0.42341%0.407SS..THydrogen-bonded Turntrans-78.4-16.7177.9-66.2-166.7-75.6155.2-8113.5F124 K129 D293 L296F124-R127 PolarHBondContact O-N 2.88Å; R127-K129 VanDerWaalsContact C-N 3.33Å; R127-D293 IonicContact CZ-OD1 3.68Å; R127-D293 IonicContact NH1-OD1 2.71Å; R127-D293 PolarHBondContact NH1-OD1 3.49Å; R127-D293 IonicContact NH2-OD1 2.74Å; R127-D293 PolarHBondContact NH2-OD1 3.12Å; R127-L296 HydrophobicContact CB-CD1 4.08Å
128M65.3Low65.7Low47 Ų4777.7 Ų77.723%0.23241%0.407CS..THydrogen-bonded Turntrans-79-16.4176-170167.5-169.100112.9T117 F120 F124 E126 I130 L269 Y292T117-M128 HydrophobicContact CG2-CE 3.91Å; F120-M128 HydrophobicContact CB-SD 4.46Å; F124-M128 PolarHBondContact O-N 3.33Å; E126-M128 VanDerWaalsContact C-N 3.33Å; M128-I130 PolarHBondContact O-N 3.06Å; M128-L269 HydrophobicContact CE-CD2 4.26Å; M128-Y292 WeakPolarHBondContact CG-OH 3.42Å
129K60.7Low65.5Low163 Ų16378.2 Ų78.271%0.70941%0.412SS*.SBendtrans-73.2117.8-179.8-69.2-178.6-177.7175.80109.8R127 S131R127-K129 VanDerWaalsContact C-N 3.33Å; K129-S131 PolarHBondContact O-N 3.42Å
130I59.8Low65.5Low71 Ų7184.2 Ų84.236%0.36444%0.444SS..PPolyproline II helixtrans-60.6126.4176.5-55.1168.8000108.6M128 V134 Q266M128-I130 PolarHBondContact O-N 3.06Å; I130-V134 HydrophobicContact CG2-CB 3.68Å; I130-V134 HydrophobicContact CG2-CG1 3.89Å; I130-V134 HydrophobicContact CG2-CG2 4.41Å; I130-Q266 VanDerWaalsContact CD1-CD 3.5Å; I130-Q266 HydrophobicContact CD1-CG 4.38Å; I130-Q266 VanDerWaalsContact CD1-NE2 3.34Å; I130-Q266 HydrophobicContact CG1-CG 4.1Å
131S57.6Low65.7Low81 Ų8189.1 Ų89.157%0.56647%0.467SS*.PPolyproline II helixtrans-67.6140.8174.1-172.70000110.2K129 A133 V134K129-S131 PolarHBondContact O-N 3.42Å; S131-A133 PolarHBondContact O-N 3.05Å; S131-V134 WeakPolarHBondContact O-CB 3.48Å; S131-V134 PolarHBondContact O-N 3.4Å
132E56.1Low66.1Low171 Ų17186.8 Ų86.880%0.79945%0.45SS*.Hα-helixtrans-54.5-26.4-177.6-67.8176.9168.800113.2V134 N135E132-V134 VanDerWaalsContact C-N 3.28Å; E132-V134 PolarHBondContact O-N 2.96Å; E132-N135 WeakPolarHBondContact O-CB 3.41Å; E132-N135 PolarHBondContact O-N 3.19Å
133A56.4Low66.8Low71 Ų7184.6 Ų84.659%0.58744%0.441SS*.Hα-helixtrans-61.9-32.717500000113.5S131 N135 Q136S131-A133 PolarHBondContact O-N 3.05Å; A133-N135 VanDerWaalsContact C-N 3.33Å; A133-Q136 PolarHBondContact O-N 3.22Å
134V60.5Low68.1Low18 Ų1887.6 Ų87.611%0.10945%0.45CS..Hα-helixtrans-75-27.6-179.7-178.80000110.5I130 S131 E132 Q136 I137 K262I130-V134 HydrophobicContact CG2-CB 3.68Å; I130-V134 HydrophobicContact CG2-CG1 3.89Å; I130-V134 HydrophobicContact CG2-CG2 4.41Å; S131-V134 WeakPolarHBondContact O-CB 3.48Å; S131-V134 PolarHBondContact O-N 3.4Å; E132-V134 VanDerWaalsContact C-N 3.28Å; E132-V134 PolarHBondContact O-N 2.96Å; V134-Q136 PolarHBondContact O-N 3.34Å; V134-I137 HydrophobicContact CG1-CD1 4.4Å; V134-I137 PolarHBondContact O-N 3.44Å; V134-K262 HydrophobicContact CG1-CB 3.7Å; V134-K262 HydrophobicContact CG1-CD 3.68Å; V134-K262 HydrophobicContact CG1-CG 4.33Å; V134-K262 WeakPolarHBondContact O-CD 3.35Å; V134-K262 WeakPolarHBondContact O-CE 3.46Å; V134-K262 PolarHBondContact O-NZ 2.92Å
135N62.3Low69Low94 Ų9489.3 Ų89.350%0.50346%0.459SS..Hα-helixtrans-65.4-22.7177.7-71.9-22.6000113.3E132 A133 K262E132-N135 WeakPolarHBondContact O-CB 3.41Å; E132-N135 PolarHBondContact O-N 3.19Å; A133-N135 VanDerWaalsContact C-N 3.33Å; N135-K262 VanDerWaalsContact CA-NZ 3.34Å; N135-K262 PolarHBondContact O-NZ 2.88Å
136Q62.1Low70.4Confident176 Ų17688.2 Ų88.282%0.82245%0.445SS*.THydrogen-bonded Turntrans-84.6-13.5179.3-154.663.929.100114.2A133 V134A133-Q136 PolarHBondContact O-N 3.22Å; V134-Q136 PolarHBondContact O-N 3.34Å
137I73.6Confident71.7Confident38 Ų3884.3 Ų84.320%0.19543%0.427CS..SBendtrans-72.8137.6-178.7-55.2173.7000109.9V134 K262 Y265V134-I137 HydrophobicContact CG1-CD1 4.4Å; V134-I137 PolarHBondContact O-N 3.44Å; I137-K262 PolarHBondContact O-NZ 2.49Å; I137-Y265 HydrophobicContact CD1-CD1 3.8Å; I137-Y265 HydrophobicContact CD1-CD2 3.62Å; I137-Y265 HydrophobicContact CD1-CE1 3.98Å; I137-Y265 HydrophobicContact CD1-CE2 3.81Å; I137-Y265 HydrophobicContact CD1-CG 3.62Å; I137-Y265 HydrophobicContact CG2-CD2 4.39Å; I137-Y265 HydrophobicContact CG2-CE2 4.02Å
138S76.9Confident73.2Confident46 Ų4685.4 Ų85.432%0.32244%0.437SS..  trans-64.8139.1178.377.50000110.5D140 E141 C142S138-D140 PolarHBondContact O-N 2.79Å; S138-E141 WeakPolarHBondContact OG-CB 3.46Å; S138-E141 WeakPolarHBondContact OG-CG 3.47Å; S138-E141 PolarHBondContact OG-N 3.38Å; S138-E141 PolarHBondContact OG-OE2 2.93Å; S138-C142 PolarHBondContact O-SG 3.19Å; S138-C142 VanDerWaalsContact O-SG 3.4Å
139L77.5Confident74.4Confident82 Ų8284 Ų8443%0.42943%0.43SS..Hα-helixtrans-67.7-30.6178.3-70.1172.6000111C142 M143 K262L139-C142 WeakPolarHBondContact O-CB 3.36Å; L139-C142 PolarHBondContact O-N 3.31Å; L139-M143 VanDerWaalsContact O-CG 3.23Å; L139-M143 WeakPolarHBondContact O-CG 3.38Å; L139-M143 PolarHBondContact O-N 3.32Å; L139-K262 HydrophobicContact CD2-CG 4.23Å
140D79.3Confident75.8Confident126 Ų12676.4 Ų76.467%0.67440%0.397SS*.Hα-helixtrans-66.9-43.9-176.9-60.8-27.7000112S138 C142 M143 E144S138-D140 PolarHBondContact O-N 2.79Å; D140-C142 VanDerWaalsContact C-N 3.29Å; D140-C142 PolarHBondContact O-N 3.3Å; D140-M143 WeakPolarHBondContact O-CB 3.25Å; D140-M143 PolarHBondContact O-N 2.97Å; D140-M143 VanDerWaalsContact O-N 3.1Å; D140-E144 PolarHBondContact O-N 3.41Å
141E82.4Confident77.2Confident106 Ų10680.2 Ų80.250%0.49541%0.412SS..Hα-helixtrans-61.5-37.2174.8-71.9164.8157.100111.9S138 M143 E144 Q145S138-E141 WeakPolarHBondContact OG-CB 3.46Å; S138-E141 WeakPolarHBondContact OG-CG 3.47Å; S138-E141 PolarHBondContact OG-N 3.38Å; S138-E141 PolarHBondContact OG-OE2 2.93Å; E141-M143 VanDerWaalsContact C-N 3.3Å; E141-M143 PolarHBondContact O-N 3.26Å; E141-E144 PolarHBondContact O-N 3.35Å; E141-Q145 WeakPolarHBondContact O-CG 3.34Å; E141-Q145 PolarHBondContact O-N 3.46Å; E141-Q145 VanDerWaalsContact O-N 3.1Å
142C83.1Confident78.8Confident2 Ų278.3 Ų78.31%0.01440%0.401CS..Hα-helixtrans-66.4-35.6176.3-64.50000111.6S138 L139 D140 R146 Y263S138-C142 PolarHBondContact O-SG 3.19Å; S138-C142 VanDerWaalsContact O-SG 3.4Å; L139-C142 WeakPolarHBondContact O-CB 3.36Å; L139-C142 PolarHBondContact O-N 3.31Å; D140-C142 VanDerWaalsContact C-N 3.29Å; D140-C142 PolarHBondContact O-N 3.3Å; C142-R146 VanDerWaalsContact O-CB 3.31Å; C142-R146 WeakPolarHBondContact O-CB 3.4Å; C142-R146 PolarHBondContact O-N 3.18Å; C142-Y263 VanDerWaalsContact CB-O 3.31Å; C142-Y263 WeakPolarHBondContact CB-O 3.43Å
143M84.1Confident80.4Confident71 Ų7170.2 Ų70.235%0.3536%0.363SS..Hα-helixtrans-71-39.6177.9-69.1-68.3-66.300111.5L139 D140 E141 R146 Q147 N167L139-M143 VanDerWaalsContact O-CG 3.23Å; L139-M143 WeakPolarHBondContact O-CG 3.38Å; L139-M143 PolarHBondContact O-N 3.32Å; D140-M143 WeakPolarHBondContact O-CB 3.25Å; D140-M143 PolarHBondContact O-N 2.97Å; D140-M143 VanDerWaalsContact O-N 3.1Å; E141-M143 VanDerWaalsContact C-N 3.3Å; E141-M143 PolarHBondContact O-N 3.26Å; M143-R146 PolarHBondContact O-N 3.31Å; M143-Q147 WeakPolarHBondContact O-CB 3.35Å; M143-Q147 PolarHBondContact O-N 2.97Å; M143-N167 HydrophobicContact CE-CB 3.67Å; M143-N167 WeakPolarHBondContact CE-ND2 3.39Å; M143-N167 HydrophobicContact SD-CB 4.43Å
144E87.2Confident81.8Confident128 Ų12873.6 Ų73.660%0.59836%0.364SS*.Hα-helixtrans-60.4-50.7173.5-71-177167.400111.2D140 E141 R146 Q147 E148D140-E144 PolarHBondContact O-N 3.41Å; E141-E144 PolarHBondContact O-N 3.35Å; E144-R146 VanDerWaalsContact C-N 3.3Å; E144-R146 PolarHBondContact O-N 2.87Å; E144-Q147 PolarHBondContact O-N 3.32Å; E144-E148 WeakPolarHBondContact O-CG 3.38Å; E144-E148 PolarHBondContact O-N 3.14Å
145Q85.9Confident83.3Confident68 Ų6877.4 Ų77.432%0.31839%0.392SS..Hα-helixtrans-60.5-39.3178-70.7179.10.500112.6E141 E148 E149E141-Q145 WeakPolarHBondContact O-CG 3.34Å; E141-Q145 PolarHBondContact O-N 3.46Å; E141-Q145 VanDerWaalsContact O-N 3.1Å; Q145-E148 PolarHBondContact O-N 3.3Å; Q145-E149 PolarHBondContact O-N 3.46Å; Q145-E149 VanDerWaalsContact O-N 3.07Å
146R88.3Confident84.5Confident7 Ų777.4 Ų77.43%0.02639%0.391CS..Hα-helixtrans-62.2-42.9174.1-178.6178.5-60.1169.413.7111.4C142 M143 E144 E149 A150 N167 W170 H261 Y263C142-R146 VanDerWaalsContact O-CB 3.31Å; C142-R146 WeakPolarHBondContact O-CB 3.4Å; C142-R146 PolarHBondContact O-N 3.18Å; M143-R146 PolarHBondContact O-N 3.31Å; E144-R146 VanDerWaalsContact C-N 3.3Å; E144-R146 PolarHBondContact O-N 2.87Å; R146-E149 PolarHBondContact O-N 3.46Å; R146-A150 WeakPolarHBondContact O-CB 3.46Å; R146-A150 PolarHBondContact O-N 3Å; R146-N167 PolarHBondContact NH1-O 3.46Å; R146-W170 HydrophobicContact CG-CH2 3.63Å; R146-W170 HydrophobicContact CG-CZ2 3.37Å; R146-W170 VanDerWaalsContact O-CH2 3.28Å; R146-W170 WeakPolarHBondContact O-CH2 3.36Å; R146-W170 WeakPolarHBondContact O-CZ2 3.3Å; R146-H261 PolarHBondContact NH2-O 3.19Å; R146-Y263 HydrophobicContact CB-CD1 4.32Å
147Q87.8Confident85.3Confident93 Ų9370.1 Ų70.144%0.43536%0.359SS..Hα-helixtrans-70.2-37.4-179.1-172.958.770.700112.3M143 E144 A150 F151M143-Q147 WeakPolarHBondContact O-CB 3.35Å; M143-Q147 PolarHBondContact O-N 2.97Å; E144-Q147 PolarHBondContact O-N 3.32Å; Q147-A150 PolarHBondContact O-N 3.04Å; Q147-F151 WeakPolarHBondContact O-CB 3.25Å; Q147-F151 PolarHBondContact O-N 3.29Å
148E90.5Very high85.8Confident135 Ų13570 Ų7063%0.63137%0.367SS*.Hα-helixtrans-61.5-46173.7-73.7-179.4177.300111.3E144 Q145 F151 A152E144-E148 WeakPolarHBondContact O-CG 3.38Å; E144-E148 PolarHBondContact O-N 3.14Å; Q145-E148 PolarHBondContact O-N 3.3Å; E148-F151 PolarHBondContact O-N 3.05Å; E148-A152 PolarHBondContact O-N 2.79Å
149E91.5Very high85.9Confident16 Ų1676.4 Ų76.48%0.07539%0.392CS..Hα-helixtrans-65.7-42.5176.3-169.8-176-164.700111.7Q145 R146 F151 A152 L153 W170 Y263 P304 V305 V306Q145-E149 PolarHBondContact O-N 3.46Å; Q145-E149 VanDerWaalsContact O-N 3.07Å; R146-E149 PolarHBondContact O-N 3.46Å; E149-F151 PolarHBondContact O-N 2.84Å; E149-A152 PolarHBondContact O-N 3.28Å; E149-A152 VanDerWaalsContact O-N 3.15Å; E149-L153 HydrophobicContact CG-CD1 4.05Å; E149-L153 HydrophobicContact CG-CG 4.22Å; E149-L153 WeakPolarHBondContact O-CB 3.34Å; E149-L153 VanDerWaalsContact O-CG 3.3Å; E149-L153 WeakPolarHBondContact O-CG 3.4Å; E149-L153 PolarHBondContact O-N 2.92Å; E149-W170 HydrophobicContact CB-CH2 4.49Å; E149-Y263 PolarHBondContact OE1-OH 3.36Å; E149-Y263 WeakPolarHBondContact OE2-CE1 3.46Å; E149-Y263 PolarHBondContact OE2-OH 3.46Å; E149-P304 HydrophobicContact CB-CB 4.44Å; E149-P304 HydrophobicContact CG-CB 3.93Å; E149-P304 VanDerWaalsContact OE1-CB 3.28Å; E149-P304 WeakPolarHBondContact OE1-CB 3.35Å; E149-V305 PolarHBondContact OE1-N 2.88Å; E149-V306 VanDerWaalsContact OE1-CB 3.28Å; E149-V306 WeakPolarHBondContact OE1-CB 3.46Å; E149-V306 WeakPolarHBondContact OE1-CG2 3.12Å; E149-V306 PolarHBondContact OE1-N 3.29Å
150A89Confident86.1Confident4 Ų475.8 Ų75.83%0.03339%0.386CS..Hα-helixtrans-56.9-41.1175.500000111.8R146 Q147 L153 K154 F161 W170R146-A150 WeakPolarHBondContact O-CB 3.46Å; R146-A150 PolarHBondContact O-N 3Å; Q147-A150 PolarHBondContact O-N 3.04Å; A150-L153 PolarHBondContact O-N 3.13Å; A150-K154 WeakPolarHBondContact O-CB 3.5Å; A150-K154 PolarHBondContact O-N 3.35Å; A150-F161 HydrophobicContact CB-CZ 4.25Å; A150-W170 HydrophobicContact CB-CH2 3.97Å; A150-W170 HydrophobicContact CB-CZ2 3.61Å
151F89.4Confident86.5Confident151 Ų15170.8 Ų70.866%0.66236%0.358SS*.Hα-helixtrans-66-44.3176.5-176.5-95.9000111.9Q147 E148 E149 K154 S155Q147-F151 WeakPolarHBondContact O-CB 3.25Å; Q147-F151 PolarHBondContact O-N 3.29Å; E148-F151 PolarHBondContact O-N 3.05Å; E149-F151 PolarHBondContact O-N 2.84Å; F151-K154 PolarHBondContact O-N 2.97Å; F151-S155 PolarHBondContact O-N 3.14Å
152A90.9Very high86.6Confident41 Ų4168.2 Ų68.234%0.33935%0.347SS..Hα-helixtrans-60.3-46.2175.300000111.6E148 E149 K154 S155 I156E148-A152 PolarHBondContact O-N 2.79Å; E149-A152 PolarHBondContact O-N 3.28Å; E149-A152 VanDerWaalsContact O-N 3.15Å; A152-K154 PolarHBondContact O-N 3.24Å; A152-S155 WeakPolarHBondContact O-CA 3.26Å; A152-S155 WeakPolarHBondContact O-CB 3.32Å; A152-S155 PolarHBondContact O-N 2.84Å; A152-S155 VanDerWaalsContact O-N 3.08Å; A152-I156 VanDerWaalsContact O-CG1 3.26Å; A152-I156 WeakPolarHBondContact O-CG1 3.47Å; A152-I156 PolarHBondContact O-N 3.49Å
153L88.9Confident86.7Confident1 Ų171 Ų711%0.00536%0.36CS..Hα-helixtrans-62.8-40.4177.1-70.5170.4000112.1E149 A150 S155 I156 C157 F161 W170 V306 Y307 I310E149-L153 HydrophobicContact CG-CD1 4.05Å; E149-L153 HydrophobicContact CG-CG 4.22Å; E149-L153 WeakPolarHBondContact O-CB 3.34Å; E149-L153 VanDerWaalsContact O-CG 3.3Å; E149-L153 WeakPolarHBondContact O-CG 3.4Å; E149-L153 PolarHBondContact O-N 2.92Å; A150-L153 PolarHBondContact O-N 3.13Å; L153-S155 PolarHBondContact O-N 3.07Å; L153-I156 PolarHBondContact O-N 3.48Å; L153-C157 WeakPolarHBondContact O-CA 3.29Å; L153-C157 VanDerWaalsContact O-CB 3.3Å; L153-C157 WeakPolarHBondContact O-CB 3.49Å; L153-C157 PolarHBondContact O-N 3.17Å; L153-F161 HydrophobicContact CB-CD2 3.91Å; L153-F161 HydrophobicContact CB-CE2 4.17Å; L153-F161 HydrophobicContact CB-CG 4.22Å; L153-F161 HydrophobicContact CD1-CD2 4.13Å; L153-F161 HydrophobicContact CD1-CE2 3.81Å; L153-W170 HydrophobicContact CD1-CE3 4.13Å; L153-W170 HydrophobicContact CD1-CZ3 3.94Å; L153-V306 HydrophobicContact CD1-CB 3.76Å; L153-V306 HydrophobicContact CD1-CG1 3.47Å; L153-V306 VanDerWaalsContact CD1-CG1 3.47Å; L153-V306 HydrophobicContact CD1-CG2 4.38Å; L153-V306 HydrophobicContact CD2-CB 4.39Å; L153-V306 HydrophobicContact CD2-CG1 4.02Å; L153-V306 HydrophobicContact CG-CG1 4.4Å; L153-Y307 HydrophobicContact CD2-CD2 4.4Å; L153-I310 HydrophobicContact CD2-CD1 4.18Å
154K87.8Confident86.6Confident142 Ų14271.5 Ų71.562%0.61736%0.358SS*.Hα-helixtrans-61.3-35.8173.8-171.6173.6-175.81740111.6A150 F151 A152 G158 F161A150-K154 WeakPolarHBondContact O-CB 3.5Å; A150-K154 PolarHBondContact O-N 3.35Å; F151-K154 PolarHBondContact O-N 2.97Å; A152-K154 PolarHBondContact O-N 3.24Å; K154-G158 WeakPolarHBondContact O-CA 3.21Å; K154-G158 PolarHBondContact O-N 2.98Å; K154-G158 VanDerWaalsContact O-N 3.13Å; K154-F161 HydrophobicContact CB-CD1 4.33Å
155S90.6Very high86.3Confident98 Ų9869.3 Ų69.369%0.68535%0.35SS*.Hα-helixtrans-73-35.1175.2-171.10000113.2F151 A152 L153F151-S155 PolarHBondContact O-N 3.14Å; A152-S155 WeakPolarHBondContact O-CA 3.26Å; A152-S155 WeakPolarHBondContact O-CB 3.32Å; A152-S155 PolarHBondContact O-N 2.84Å; A152-S155 VanDerWaalsContact O-N 3.08Å; L153-S155 PolarHBondContact O-N 3.07Å
156I87.3Confident85.8Confident95 Ų9573.5 Ų73.549%0.48737%0.369SS..Hα-helixtrans-85.7-51.6-175.1-63.5161.9000111.3A152 L153 Y307A152-I156 VanDerWaalsContact O-CG1 3.26Å; A152-I156 WeakPolarHBondContact O-CG1 3.47Å; A152-I156 PolarHBondContact O-N 3.49Å; L153-I156 PolarHBondContact O-N 3.48Å; I156-Y307 HydrophobicContact CB-CE2 4.5Å; I156-Y307 HydrophobicContact CD1-CD2 4.19Å; I156-Y307 HydrophobicContact CD1-CE2 4.32Å; I156-Y307 HydrophobicContact CG2-CD2 4.04Å; I156-Y307 HydrophobicContact CG2-CE2 3.44Å; I156-Y307 VanDerWaalsContact CG2-CE2 3.44Å
157C79.1Confident85.4Confident22 Ų2275.3 Ų75.315%0.14938%0.379CS..Hα-helixtrans-86.3-13.9-176.4-60.10000112.5L153 E159 K160 F161L153-C157 WeakPolarHBondContact O-CA 3.29Å; L153-C157 VanDerWaalsContact O-CB 3.3Å; L153-C157 WeakPolarHBondContact O-CB 3.49Å; L153-C157 PolarHBondContact O-N 3.17Å; C157-E159 PolarHBondContact O-N 2.89Å; C157-K160 HydrophobicContact CB-CB 4.24Å; C157-K160 VanDerWaalsContact O-CB 3.29Å; C157-K160 WeakPolarHBondContact O-CB 3.49Å; C157-K160 WeakPolarHBondContact O-CG 3.3Å; C157-K160 PolarHBondContact O-N 3.33Å; C157-F161 HydrophobicContact CB-CB 4.03Å
158G83.8Confident85.1Confident35 Ų3576 Ų7636%0.36138%0.378SS..G310 helixtrans57.3-125.217800000111.7K154 K160 F161K154-G158 WeakPolarHBondContact O-CA 3.21Å; K154-G158 PolarHBondContact O-N 2.98Å; K154-G158 VanDerWaalsContact O-N 3.13Å; G158-K160 PolarHBondContact O-N 3.42Å; G158-F161 PolarHBondContact O-N 3.4Å
159E79.6Confident84.9Confident181 Ų18169.8 Ų69.885%0.84635%0.349SS*.G310 helixtrans-69.4-10.7-179.8-62.2174.1-176.300114C157 F161C157-E159 PolarHBondContact O-N 2.89Å; E159-F161 VanDerWaalsContact C-N 3.34Å
160K82.3Confident84.9Confident69 Ų6969 Ų6930%0.335%0.346SS..G310 helixtrans-76-24.1177.5-59.6-179.4176.5-172.20112.4C157 G158 I172 G173 E175 F249C157-K160 HydrophobicContact CB-CB 4.24Å; C157-K160 VanDerWaalsContact O-CB 3.29Å; C157-K160 WeakPolarHBondContact O-CB 3.49Å; C157-K160 WeakPolarHBondContact O-CG 3.3Å; C157-K160 PolarHBondContact O-N 3.33Å; G158-K160 PolarHBondContact O-N 3.42Å; K160-I172 CarbonylContact O-C 3.52Å; K160-I172 WeakPolarHBondContact O-CA 3.17Å; K160-G173 PolarHBondContact O-N 2.95Å; K160-E175 WeakPolarHBondContact CE-OE1 3.09Å; K160-E175 IonicContact NZ-OE1 3.72Å; K160-E175 PolarHBondContact NZ-OE1 3.14Å; K160-E175 IonicContact NZ-OE2 3.9Å; K160-F249 HydrophobicContact CB-CZ 4.42Å; K160-F249 HydrophobicContact CG-CE1 4.28Å; K160-F249 HydrophobicContact CG-CE2 4.38Å; K160-F249 HydrophobicContact CG-CZ 3.75Å
161F86.9Confident84.8Confident21 Ų2169 Ų699%0.09235%0.345CS..EExtended strand (participates in β ladder)trans-93.6123.6178.7175.9-91.7000110.5A150 L153 K154 C157 G158 E159 E163 W170 I172A150-F161 HydrophobicContact CB-CZ 4.25Å; L153-F161 HydrophobicContact CB-CD2 3.91Å; L153-F161 HydrophobicContact CB-CE2 4.17Å; L153-F161 HydrophobicContact CB-CG 4.22Å; L153-F161 HydrophobicContact CD1-CD2 4.13Å; L153-F161 HydrophobicContact CD1-CE2 3.81Å; K154-F161 HydrophobicContact CB-CD1 4.33Å; C157-F161 HydrophobicContact CB-CB 4.03Å; G158-F161 PolarHBondContact O-N 3.4Å; E159-F161 VanDerWaalsContact C-N 3.34Å; F161-E163 HydrophobicContact CE1-CB 4.26Å; F161-E163 HydrophobicContact CZ-CB 4.48Å; F161-W170 HydrophobicContact CE2-CB 3.87Å; F161-W170 AromaticContact CE2-CD2 3.88Å; F161-W170 HydrophobicContact CE2-CD2 3.88Å; F161-W170 AromaticContact CE2-CE3 4Å; F161-W170 HydrophobicContact CE2-CE3 4Å; F161-W170 AromaticContact CE2-CG 3.85Å; F161-W170 HydrophobicContact CE2-CG 3.85Å; F161-W170 HydrophobicContact CZ-CB 4.25Å; F161-W170 AromaticContact CZ-CD2 3.84Å; F161-W170 HydrophobicContact CZ-CD2 3.84Å; F161-W170 HydrophobicContact CZ-CE3 4.3Å; F161-W170 AromaticContact CZ-CG 3.81Å; F161-W170 HydrophobicContact CZ-CG 3.81Å; F161-I172 HydrophobicContact CD2-CD1 4.32Å; F161-I172 HydrophobicContact CD2-CG1 3.71Å; F161-I172 HydrophobicContact CE2-CG1 4.43Å
162I83.8Confident84.7Confident53 Ų5361.8 Ų61.827%0.27231%0.313SS..EExtended strand (participates in β ladder)trans-130.1119.5179-56.6173.4000108.6R164 T171I162-R164 HydrophobicContact CG2-CG 4.13Å; I162-R164 PolarHBondContact O-N 2.77Å; I162-T171 PolarHBondContact N-O 3.48Å; I162-T171 PolarHBondContact O-N 2.91Å
163E86.9Confident84.4Confident59 Ų5960 Ų6028%0.27630%0.299SS..EExtended strand (participates in β ladder)trans-8695.1168.8-179.8163.9-144.700109.2F161 Q166 N167 W170F161-E163 HydrophobicContact CE1-CB 4.26Å; F161-E163 HydrophobicContact CZ-CB 4.48Å; E163-Q166 WeakPolarHBondContact OE1-CA 3.34Å; E163-N167 PolarHBondContact OE1-N 3.37Å; E163-W170 PolarHBondContact OE1-NE1 2.81Å
164R81.1Confident84Confident82 Ų8260.3 Ų60.331%0.30930%0.3SS..EExtended strand (participates in β ladder)trans-69.4-39.9-178.1-74.7-172170.2124.8-4.4111.8I162 V169 T171 D246 E252I162-R164 HydrophobicContact CG2-CG 4.13Å; I162-R164 PolarHBondContact O-N 2.77Å; R164-V169 PolarHBondContact N-O 2.91Å; R164-T171 PolarHBondContact NH1-OG1 2.8Å; R164-D246 IonicContact CZ-OD2 2.8Å; R164-D246 IonicContact NE-OD2 2.76Å; R164-D246 IonicContact NH2-OD1 2.78Å; R164-D246 IonicContact NH2-OD2 3.92Å; R164-D246 PolarHBondContact NH2-OD2 2.8Å; R164-E252 IonicContact CZ-OE2 3.74Å; R164-E252 IonicContact NH1-OE2 3.98Å; R164-E252 PolarHBondContact NH1-OE2 2.94Å; R164-E252 IonicContact NH2-OE2 3.94Å; R164-E252 PolarHBondContact NH2-OE2 3.1Å
165I81.5Confident83.6Confident83 Ų8358.9 Ų58.943%0.42630%0.296SS..EExtended strand (participates in β ladder)trans-130.3118.4175.3-52.5179000107.5N167 R168 V169I165-N167 PolarHBondContact O-N 3.13Å; I165-R168 HydrophobicContact CB-CB 4.04Å; I165-R168 HydrophobicContact CG2-CB 3.76Å; I165-R168 HydrophobicContact CG2-CG 4.23Å; I165-R168 PolarHBondContact O-N 2.79Å; I165-V169 HydrophobicContact CB-CB 4.1Å; I165-V169 HydrophobicContact CB-CG2 4.21Å; I165-V169 HydrophobicContact CD1-CB 4.42Å; I165-V169 HydrophobicContact CD1-CG2 3.88Å; I165-V169 HydrophobicContact CG1-CB 4.22Å; I165-V169 HydrophobicContact CG1-CG2 4.21Å; I165-V169 PolarHBondContact N-O 3.17Å; I165-V169 PolarHBondContact O-N 3.08Å
166Q76.1Confident83Confident156 Ų15654.4 Ų54.473%0.72926%0.264SS*.THydrogen-bonded Turntrans-50.4126.7179.9-71.2178.6-5.800111E163 R168E163-Q166 WeakPolarHBondContact OE1-CA 3.34Å; Q166-R168 PolarHBondContact O-N 3.03Å
167N78.1Confident82Confident45 Ų4555.2 Ų55.224%0.24127%0.266CS..THydrogen-bonded Turntrans59.213.4179-60.1-54.1000115.4M143 R146 E163 I165M143-N167 HydrophobicContact CE-CB 3.67Å; M143-N167 WeakPolarHBondContact CE-ND2 3.39Å; M143-N167 HydrophobicContact SD-CB 4.43Å; R146-N167 PolarHBondContact NH1-O 3.46Å; E163-N167 PolarHBondContact OE1-N 3.37Å; I165-N167 PolarHBondContact O-N 3.13Å
168R82.2Confident81.6Confident108 Ų10855.7 Ų55.741%0.40827%0.265SS..THydrogen-bonded Turntrans-131.1-44-178.8-69.1-165.4-175164.111.3114.7I165 Q166 R256 F257 K259I165-R168 HydrophobicContact CB-CB 4.04Å; I165-R168 HydrophobicContact CG2-CB 3.76Å; I165-R168 HydrophobicContact CG2-CG 4.23Å; I165-R168 PolarHBondContact O-N 2.79Å; Q166-R168 PolarHBondContact O-N 3.03Å; R168-R256 CarbonylContact O-C 3.55Å; R168-R256 WeakPolarHBondContact O-CA 3.38Å; R168-F257 PolarHBondContact O-N 3.33Å; R168-K259 VanDerWaalsContact NH2-CE 3.33Å
169V86.5Confident80.8Confident4 Ų454 Ų542%0.02425%0.248CC..EExtended strand (participates in β ladder)trans-135.7114.7-174.1-175.80000110.1R164 I165 E254 I255 R256R164-V169 PolarHBondContact N-O 2.91Å; I165-V169 HydrophobicContact CB-CB 4.1Å; I165-V169 HydrophobicContact CB-CG2 4.21Å; I165-V169 HydrophobicContact CD1-CB 4.42Å; I165-V169 HydrophobicContact CD1-CG2 3.88Å; I165-V169 HydrophobicContact CG1-CB 4.22Å; I165-V169 HydrophobicContact CG1-CG2 4.21Å; I165-V169 PolarHBondContact N-O 3.17Å; I165-V169 PolarHBondContact O-N 3.08Å; V169-E254 HydrophobicContact CG1-CG 3.74Å; V169-I255 WeakPolarHBondContact CA-O 3.39Å; V169-R256 HydrophobicContact CG1-CG 4.5Å; V169-R256 HydrophobicContact CG2-CG 4.34Å
170W90.5Very high80.3Confident0 Ų046 Ų460%021%0.211CC..EExtended strand (participates in β ladder)trans-103.9141.5171.5-62.9-9.3000109.7R146 E149 A150 L153 F161 E163 E254 I255 F257 V306R146-W170 HydrophobicContact CG-CH2 3.63Å; R146-W170 HydrophobicContact CG-CZ2 3.37Å; R146-W170 VanDerWaalsContact O-CH2 3.28Å; R146-W170 WeakPolarHBondContact O-CH2 3.36Å; R146-W170 WeakPolarHBondContact O-CZ2 3.3Å; E149-W170 HydrophobicContact CB-CH2 4.49Å; A150-W170 HydrophobicContact CB-CH2 3.97Å; A150-W170 HydrophobicContact CB-CZ2 3.61Å; L153-W170 HydrophobicContact CD1-CE3 4.13Å; L153-W170 HydrophobicContact CD1-CZ3 3.94Å; F161-W170 HydrophobicContact CE2-CB 3.87Å; F161-W170 AromaticContact CE2-CD2 3.88Å; F161-W170 HydrophobicContact CE2-CD2 3.88Å; F161-W170 AromaticContact CE2-CE3 4Å; F161-W170 HydrophobicContact CE2-CE3 4Å; F161-W170 AromaticContact CE2-CG 3.85Å; F161-W170 HydrophobicContact CE2-CG 3.85Å; F161-W170 HydrophobicContact CZ-CB 4.25Å; F161-W170 AromaticContact CZ-CD2 3.84Å; F161-W170 HydrophobicContact CZ-CD2 3.84Å; F161-W170 HydrophobicContact CZ-CE3 4.3Å; F161-W170 AromaticContact CZ-CG 3.81Å; F161-W170 HydrophobicContact CZ-CG 3.81Å; E163-W170 PolarHBondContact OE1-NE1 2.81Å; W170-E254 WeakPolarHBondContact O-CA 3.45Å; W170-I255 HydrophobicContact CB-CB 4.39Å; W170-I255 PolarHBondContact N-O 3.44Å; W170-I255 PolarHBondContact O-N 2.89Å; W170-F257 AromaticContact CD2-CE2 3.66Å; W170-F257 HydrophobicContact CD2-CE2 3.66Å; W170-F257 HydrophobicContact CD2-CZ 4.17Å; W170-F257 AromaticContact CE2-CE2 3.8Å; W170-F257 AromaticContact CE3-CE2 3.9Å; W170-F257 HydrophobicContact CE3-CE2 3.9Å; W170-F257 AromaticContact CE3-CZ 3.92Å; W170-F257 HydrophobicContact CE3-CZ 3.92Å; W170-F257 HydrophobicContact CG-CE2 4.08Å; W170-F257 HydrophobicContact CH2-CE2 4.38Å; W170-F257 HydrophobicContact CH2-CZ 4.22Å; W170-F257 HydrophobicContact CZ2-CE2 4.17Å; W170-F257 HydrophobicContact CZ2-CZ 4.45Å; W170-F257 HydrophobicContact CZ3-CE2 4.26Å; W170-F257 AromaticContact CZ3-CZ 3.95Å; W170-F257 HydrophobicContact CZ3-CZ 3.95Å; W170-V306 HydrophobicContact CE3-CG2 4.02Å; W170-V306 HydrophobicContact CZ3-CG2 3.81Å
171T87.1Confident79.4Confident2 Ų246.3 Ų46.31%0.01222%0.222CC..EExtended strand (participates in β ladder)trans-127.4128.6176.1-59.10000108.5I162 R164 E252 L253I162-T171 PolarHBondContact N-O 3.48Å; I162-T171 PolarHBondContact O-N 2.91Å; R164-T171 PolarHBondContact NH1-OG1 2.8Å; T171-E252 HydrophobicContact CG2-CB 4.03Å; T171-E252 HydrophobicContact CG2-CG 4.24Å; T171-E252 VanDerWaalsContact CG2-OE2 3.32Å; T171-E252 WeakPolarHBondContact CG2-OE2 3.28Å; T171-L253 CarbonylContact C-O 3.46Å; T171-L253 WeakPolarHBondContact CA-O 3.46Å
172I87.5Confident78.1Confident1 Ų152.4 Ų52.41%0.00524%0.244CC..EExtended strand (participates in β ladder)trans-119.7119.8175.1-54.399.5000109.4K160 F161 L174 E252 L253 I255 V306 I310K160-I172 CarbonylContact O-C 3.52Å; K160-I172 WeakPolarHBondContact O-CA 3.17Å; F161-I172 HydrophobicContact CD2-CD1 4.32Å; F161-I172 HydrophobicContact CD2-CG1 3.71Å; F161-I172 HydrophobicContact CE2-CG1 4.43Å; I172-L174 HydrophobicContact CG2-CD2 4.14Å; I172-E252 CarbonylContact O-C 3.52Å; I172-E252 VanDerWaalsContact O-CA 3.31Å; I172-E252 WeakPolarHBondContact O-CA 3.31Å; I172-L253 HydrophobicContact CB-CB 4.4Å; I172-L253 HydrophobicContact CD1-CD2 4.46Å; I172-L253 PolarHBondContact N-O 3.31Å; I172-L253 PolarHBondContact O-N 2.87Å; I172-I255 HydrophobicContact CD1-CD1 4.1Å; I172-I255 HydrophobicContact CD1-CG1 4.45Å; I172-V306 HydrophobicContact CD1-CG1 3.88Å; I172-I310 HydrophobicContact CB-CD1 4.4Å; I172-I310 HydrophobicContact CG1-CD1 4.16Å; I172-I310 HydrophobicContact CG2-CD1 3.85Å; I172-I310 HydrophobicContact CG2-CG1 4.33Å
173G84.3Confident76.9Confident3 Ų351.9 Ų51.93%0.03124%0.24CC..EExtended strand (participates in β ladder)trans-71.9127.1172.300000112K160 F249K160-G173 PolarHBondContact O-N 2.95Å; G173-F249 VanDerWaalsContact CA-CD2 3.45Å
174L82.2Confident75.5Confident7 Ų757.2 Ų57.24%0.03726%0.258CS..EExtended strand (participates in β ladder)trans-117.6131.5-177.1-61.2176.6000111.8I172 L176 Y251 L253 I310 L313I172-L174 HydrophobicContact CG2-CD2 4.14Å; L174-L176 HydrophobicContact CB-CD1 4.31Å; L174-L176 HydrophobicContact CB-CD2 4.21Å; L174-L176 HydrophobicContact CB-CG 3.94Å; L174-L176 HydrophobicContact CD1-CD1 4.36Å; L174-L176 PolarHBondContact O-N 3.24Å; L174-Y251 PolarHBondContact N-O 2.81Å; L174-L253 HydrophobicContact CD1-CB 3.9Å; L174-L253 HydrophobicContact CG-CB 4.47Å; L174-I310 HydrophobicContact CD2-CG2 3.99Å; L174-L313 HydrophobicContact CD1-CB 4.24Å; L174-L313 HydrophobicContact CD1-CD1 3.45Å; L174-L313 VanDerWaalsContact CD1-CD1 3.45Å; L174-L313 HydrophobicContact CD1-CG 4.45Å
175E78.8Confident73.7Confident112 Ų11261.9 Ų61.952%0.52328%0.28SS..  trans-95.370.3176.2-73.8174.4-13500111K160 E177 F249K160-E175 WeakPolarHBondContact CE-OE1 3.09Å; K160-E175 IonicContact NZ-OE1 3.72Å; K160-E175 PolarHBondContact NZ-OE1 3.14Å; K160-E175 IonicContact NZ-OE2 3.9Å; E175-E177 VanDerWaalsContact C-N 3.32Å; E175-E177 PolarHBondContact O-N 2.79Å; E175-F249 HydrophobicContact CG-CD1 4.14Å; E175-F249 HydrophobicContact CG-CE1 4.19Å
176L76.8Confident71.7Confident5 Ų563.1 Ų63.13%0.02630%0.296CS..  trans-85.471.5-179.6-50.1177.3000111.1L174 Y178 L179 T180 Y251 F272 L313L174-L176 HydrophobicContact CB-CD1 4.31Å; L174-L176 HydrophobicContact CB-CD2 4.21Å; L174-L176 HydrophobicContact CB-CG 3.94Å; L174-L176 HydrophobicContact CD1-CD1 4.36Å; L174-L176 PolarHBondContact O-N 3.24Å; L176-Y178 HydrophobicContact CB-CD1 4.33Å; L176-Y178 HydrophobicContact CB-CE1 3.8Å; L176-Y178 HydrophobicContact CD2-CE1 3.66Å; L176-Y178 HydrophobicContact CG-CE1 4.22Å; L176-Y178 PolarHBondContact O-N 2.73Å; L176-L179 HydrophobicContact CB-CB 4.4Å; L176-L179 HydrophobicContact CB-CD1 3.91Å; L176-L179 HydrophobicContact CB-CG 4.08Å; L176-L179 HydrophobicContact CD1-CD1 3.61Å; L176-L179 HydrophobicContact CG-CD1 4.41Å; L176-L179 PolarHBondContact O-N 3.05Å; L176-T180 PolarHBondContact O-N 3.39Å; L176-Y251 HydrophobicContact CB-CD2 3.68Å; L176-Y251 HydrophobicContact CB-CE2 3.96Å; L176-Y251 HydrophobicContact CB-CG 4.28Å; L176-Y251 HydrophobicContact CD1-CD2 4.38Å; L176-Y251 HydrophobicContact CD1-CG 4.15Å; L176-Y251 HydrophobicContact CG-CD2 4.17Å; L176-Y251 HydrophobicContact CG-CG 4.4Å; L176-Y251 WeakPolarHBondContact O-CE2 3.47Å; L176-F272 HydrophobicContact CD1-CE2 3.79Å; L176-F272 HydrophobicContact CD1-CZ 3.9Å; L176-L313 WeakPolarHBondContact CD2-O 3.32Å
177E67.9Low69.7Low112 Ų11264.7 Ų64.752%0.52330%0.301SS..Hα-helixtrans-57-30179.7-71.8-174.9-172.300112.5E175 T180 S181 K398E175-E177 VanDerWaalsContact C-N 3.32Å; E175-E177 PolarHBondContact O-N 2.79Å; E177-T180 PolarHBondContact O-N 2.88Å; E177-S181 WeakPolarHBondContact O-CB 3.31Å; E177-S181 PolarHBondContact O-N 3.38Å; E177-S181 PolarHBondContact O-OG 2.76Å; E177-K398 IonicContact OE1-NZ 3.05Å; E177-K398 PolarHBondContact OE1-NZ 3.22Å; E177-K398 IonicContact OE2-NZ 3.62Å
178Y70.7Confident67.7Low31 Ų3167.9 Ų67.912%0.12232%0.324CS..Hα-helixtrans-66.9-40.6179.566.8-93.5000112.8L176 S181 R182 L313 E316 I319L176-Y178 HydrophobicContact CB-CD1 4.33Å; L176-Y178 HydrophobicContact CB-CE1 3.8Å; L176-Y178 HydrophobicContact CD2-CE1 3.66Å; L176-Y178 HydrophobicContact CG-CE1 4.22Å; L176-Y178 PolarHBondContact O-N 2.73Å; Y178-S181 PolarHBondContact O-N 3.26Å; Y178-R182 WeakPolarHBondContact O-CB 3.4Å; Y178-R182 WeakPolarHBondContact O-CG 3.34Å; Y178-R182 PolarHBondContact O-N 3.25Å; Y178-L313 PolarHBondContact OH-O 2.76Å; Y178-E316 HydrophobicContact CD2-CB 4.44Å; Y178-E316 HydrophobicContact CD2-CG 3.95Å; Y178-E316 HydrophobicContact CG-CB 4.41Å; Y178-E316 HydrophobicContact CG-CG 4.16Å; Y178-I319 HydrophobicContact CE2-CB 4.48Å; Y178-I319 HydrophobicContact CE2-CG2 4.12Å; Y178-I319 WeakPolarHBondContact OH-CD1 3.41Å
179L66.7Low65.6Low0 Ų072.7 Ų72.70%035%0.348CS..Hα-helixtrans-62.9-45.5176.1-68.4-178.2000110.6L176 S181 R182 F183 Y251 F272 I319 L323L176-L179 HydrophobicContact CB-CB 4.4Å; L176-L179 HydrophobicContact CB-CD1 3.91Å; L176-L179 HydrophobicContact CB-CG 4.08Å; L176-L179 HydrophobicContact CD1-CD1 3.61Å; L176-L179 HydrophobicContact CG-CD1 4.41Å; L176-L179 PolarHBondContact O-N 3.05Å; L179-S181 VanDerWaalsContact C-N 3.3Å; L179-S181 PolarHBondContact O-N 3.09Å; L179-R182 PolarHBondContact O-N 3.08Å; L179-F183 VanDerWaalsContact O-CD2 3.3Å; L179-F183 WeakPolarHBondContact O-CD2 3.39Å; L179-F183 PolarHBondContact O-N 2.97Å; L179-F183 VanDerWaalsContact O-N 3.09Å; L179-Y251 HydrophobicContact CB-CE1 4.16Å; L179-Y251 HydrophobicContact CB-CE2 4.18Å; L179-Y251 WeakPolarHBondContact CB-OH 3.46Å; L179-Y251 HydrophobicContact CD1-CD1 4.08Å; L179-Y251 HydrophobicContact CD1-CE1 3.82Å; L179-F272 HydrophobicContact CD1-CZ 3.99Å; L179-I319 HydrophobicContact CD2-CG2 4.23Å; L179-L323 HydrophobicContact CD2-CD1 3.56Å; L179-L323 HydrophobicContact CD2-CD2 4.13Å; L179-L323 HydrophobicContact CD2-CG 4.37Å
180T67.6Low63Low13 Ų1381 Ų818%0.0839%0.387CS..Hα-helixtrans-65-37.6179.5-49.20000111.2L176 E177 R184 L250 Y251L176-T180 PolarHBondContact O-N 3.39Å; E177-T180 PolarHBondContact O-N 2.88Å; T180-R184 HydrophobicContact CG2-CG 4.48Å; T180-R184 VanDerWaalsContact O-CB 3.3Å; T180-R184 WeakPolarHBondContact O-CB 3.35Å; T180-R184 WeakPolarHBondContact O-CG 3.13Å; T180-R184 PolarHBondContact O-N 3.04Å; T180-L250 HydrophobicContact CG2-CD1 4.18Å; T180-Y251 PolarHBondContact N-OH 3.38Å; T180-Y251 WeakPolarHBondContact OG1-CE2 3.36Å; T180-Y251 PolarHBondContact OG1-OH 3.08Å
181S63.5Low60.2Low76 Ų7685.4 Ų85.453%0.53142%0.418SS..Hα-helixtrans-71-33.2178.8-600000113.2E177 Y178 L179E177-S181 WeakPolarHBondContact O-CB 3.31Å; E177-S181 PolarHBondContact O-N 3.38Å; E177-S181 PolarHBondContact O-OG 2.76Å; Y178-S181 PolarHBondContact O-N 3.26Å; L179-S181 VanDerWaalsContact C-N 3.3Å; L179-S181 PolarHBondContact O-N 3.09Å
182R60.5Low57.7Low148 Ų14892.8 Ų92.856%0.55846%0.463SS*.Hα-helixtrans-74.9-39178.2-70.3-101.5-176.2-178.40.4113.2Y178 L179 E316Y178-R182 WeakPolarHBondContact O-CB 3.4Å; Y178-R182 WeakPolarHBondContact O-CG 3.34Å; Y178-R182 PolarHBondContact O-N 3.25Å; L179-R182 PolarHBondContact O-N 3.08Å; R182-E316 IonicContact CZ-OE1 3.94Å; R182-E316 IonicContact NE-OE1 2.88Å; R182-E316 PolarHBondContact NE-OE1 2.82Å; R182-E316 IonicContact NH2-OE1 3.21Å; R182-E316 PolarHBondContact NH2-OE1 3.03Å
183F58.8Low55.2Low43 Ų43101.3 Ų101.319%0.18950%0.5CS..Hα-helixtrans-96.8-6.4-176.9-69-74.9000114.3L179 K185 N278 L279 P280 L323L179-F183 VanDerWaalsContact O-CD2 3.3Å; L179-F183 WeakPolarHBondContact O-CD2 3.39Å; L179-F183 PolarHBondContact O-N 2.97Å; L179-F183 VanDerWaalsContact O-N 3.09Å; F183-K185 PolarHBondContact O-N 3.29Å; F183-N278 HydrophobicContact CB-CB 3.79Å; F183-N278 WeakPolarHBondContact CD1-O 3.3Å; F183-N278 WeakPolarHBondContact O-CB 3.48Å; F183-L279 HydrophobicContact CD2-CD1 3.83Å; F183-L279 HydrophobicContact CE2-CD1 3.34Å; F183-L279 HydrophobicContact CZ-CD1 3.81Å; F183-P280 HydrophobicContact CE1-CG 4.24Å; F183-L323 HydrophobicContact CE2-CD1 3.9Å; F183-L323 HydrophobicContact CE2-CD2 3.92Å; F183-L323 HydrophobicContact CE2-CG 4.4Å; F183-L323 HydrophobicContact CZ-CB 4.43Å; F183-L323 HydrophobicContact CZ-CD1 4.3Å; F183-L323 HydrophobicContact CZ-CD2 4.03Å; F183-L323 HydrophobicContact CZ-CG 4.47Å
184R57.2Low52.9Low170 Ų170109.1 Ų109.164%0.64254%0.541SS*.SBendtrans-63.284.7156.4-83.5172.9-175172.66.7107.3T180 S186T180-R184 HydrophobicContact CG2-CG 4.48Å; T180-R184 VanDerWaalsContact O-CB 3.3Å; T180-R184 WeakPolarHBondContact O-CB 3.35Å; T180-R184 WeakPolarHBondContact O-CG 3.13Å; T180-R184 PolarHBondContact O-N 3.04Å; R184-S186 PolarHBondContact O-N 3.04Å
185K42.9Very low50.7Low180 Ų180115.5 Ų115.578%0.78358%0.58SS**  trans-43.9120.6163.9-67.7177.1-178.7172.60105.7F183 K187F183-K185 PolarHBondContact O-N 3.29Å; K185-K187 PolarHBondContact O-N 2.94Å; K185-K187 VanDerWaalsContact O-N 3.13Å
186S39Very low48.7Very low109 Ų109118.2 Ų118.276%0.76259%0.592SS**  trans-44.5128.4159.545.60000106R184R184-S186 PolarHBondContact O-N 3.04Å
187K34.2Very low47Very low189 Ų189127 Ų12782%0.82263%0.634SS**  trans-43.6139166-76.4-170.3174-175.10107.1K185 K189K185-K187 PolarHBondContact O-N 2.94Å; K185-K187 VanDerWaalsContact O-N 3.13Å; K187-K189 PolarHBondContact O-N 2.98Å; K187-K189 VanDerWaalsContact O-N 3.1Å
188P36.5Very low45.5Very low113 Ų113128 Ų12873%0.73464%0.643SS**  trans-51130.2175.516.4-21.5000107E190P188-E190 PolarHBondContact O-N 3.32Å
189K38.8Very low44.3Very low209 Ų209131.7 Ų131.791%0.90967%0.672SS**  trans-58.589.5161.3-78.8-179.2173.9178.60105.8K187 S191K187-K189 PolarHBondContact O-N 2.98Å; K187-K189 VanDerWaalsContact O-N 3.1Å; K189-S191 PolarHBondContact O-N 3.31Å; K189-S191 VanDerWaalsContact O-N 3.11Å
190E30.7Very low43.9Very low178 Ų178136.2 Ų136.283%0.83270%0.696SS**  trans-56.6114.4152.8-94-178.2155.100105.6P188 T192P188-E190 PolarHBondContact O-N 3.32Å; E190-T192 PolarHBondContact O-N 3.04Å
191S32.7Very low43.7Very low93 Ų93140.7 Ų140.765%0.6572%0.716SS**  trans-11.6113.6163.749.90000114.5K189 K193K189-S191 PolarHBondContact O-N 3.31Å; K189-S191 VanDerWaalsContact O-N 3.11Å; S191-K193 PolarHBondContact O-N 2.98Å
192T34.3Very low44.3Very low156 Ų156140.5 Ų140.596%0.95771%0.709SS**  trans-66.278.7152.640000108.2E190E190-T192 PolarHBondContact O-N 3.04Å
193K34.5Very low45Very low180 Ų180133.6 Ų133.678%0.78368%0.683SS**  trans-101.7117.1148.4-77.1-173177.4179.70106.2S191 V195S191-K193 PolarHBondContact O-N 2.98Å; K193-V195 PolarHBondContact O-N 3.3Å
194N37.4Very low45.8Very low168 Ų168137.7 Ų137.790%0.89870%0.7SS**  trans-31.8116.3172.6-76.1-45.9000113.3
195V35.7Very low46.5Very low140 Ų140136.3 Ų136.385%0.84870%0.699SS**  trans-132.6118.1148.8-177.70000107.3K193K193-V195 PolarHBondContact O-N 3.3Å
196Q36.3Very low48.1Very low169 Ų169131.9 Ų131.979%0.7968%0.678SS**  trans-44.2131.3179.2-158.3153.5-10.100113N198Q196-N198 PolarHBondContact O-N 3.43Å
197E40.5Very low49.7Very low191 Ų191131.3 Ų131.389%0.89367%0.666SS**  trans-49.5110.4161.3-83.9174.3141.700109.5
198N37Very low51.5Low133 Ų133130.5 Ų130.571%0.71166%0.663SS**  trans-114.4100152.1-84.8-26.3000105.9Q196 L200Q196-N198 PolarHBondContact O-N 3.43Å; N198-L200 PolarHBondContact O-N 2.97Å
199S44.9Very low53.1Low107 Ų107128.1 Ų128.175%0.74866%0.659SS**  trans-51.1101.7165.342.50000109.2E201S199-E201 VanDerWaalsContact C-N 3.33Å; S199-E201 PolarHBondContact O-N 3.48Å
200L58.5Low54.8Low95 Ų95124.6 Ų124.650%0.49765%0.65SS.*  trans-7194.8171.3-70.5173.8000107.8N198N198-L200 PolarHBondContact O-N 2.97Å
201E64.3Low57.2Low108 Ų108117.5 Ų117.551%0.50562%0.619SS.*  trans-50.6144.2174.3-69.4-172.2175.100111.2S199 K204 F219S199-E201 VanDerWaalsContact C-N 3.33Å; S199-E201 PolarHBondContact O-N 3.48Å; E201-K204 WeakPolarHBondContact OE2-CE 3.3Å; E201-K204 IonicContact OE2-NZ 2.79Å; E201-K204 PolarHBondContact OE2-NZ 2.96Å; E201-F219 WeakPolarHBondContact O-CB 3.31Å; E201-F219 WeakPolarHBondContact O-CD1 3.41Å
202I75.4Confident59.2Low72 Ų72122.6 Ų122.637%0.36963%0.63SS.*BIsolated β-bridgetrans-60.8138173-61.2170.1000108.7K204 L207I202-K204 PolarHBondContact O-N 3.07Å; I202-L207 HydrophobicContact CG2-CD1 3.89Å; I202-L207 HydrophobicContact CG2-CD2 4.33Å; I202-L207 HydrophobicContact CG2-CG 4.03Å
203C76.4Confident60.8Low2 Ų2122.3 Ų122.31%0.01462%0.616CS.*  trans-63.7106.5-176.4-173.40000111.3F205 Y206 L207 F219 K220 H221C203-F205 PolarHBondContact O-N 3.5Å; C203-F205 VanDerWaalsContact O-N 3.13Å; C203-Y206 WeakPolarHBondContact O-CB 3.23Å; C203-Y206 PolarHBondContact O-N 2.82Å; C203-L207 PolarHBondContact O-N 2.8Å; C203-L207 VanDerWaalsContact O-N 3.11Å; C203-F219 HydrophobicContact CB-CB 3.54Å; C203-K220 PolarHBondContact N-O 2.88Å; C203-H221 WeakPolarHBondContact CB-CD2 3.35Å
204K74.7Confident62.5Low129 Ų129115.6 Ų115.656%0.56160%0.597SS**Hα-helixtrans-58.9-26.6178.3-64.2171.7-172.3159.30112.8E201 I202 K208E201-K204 WeakPolarHBondContact OE2-CE 3.3Å; E201-K204 IonicContact OE2-NZ 2.79Å; E201-K204 PolarHBondContact OE2-NZ 2.96Å; I202-K204 PolarHBondContact O-N 3.07Å; K204-K208 WeakPolarHBondContact O-CG 3.4Å; K204-K208 PolarHBondContact O-N 3.5Å
205F72.5Confident63.9Low141 Ų141113.6 Ų113.662%0.61860%0.597SS**Hα-helixtrans-80.6-27.6176.5-63.8-76000113.4C203 K208 G209 N210 C211C203-F205 PolarHBondContact O-N 3.5Å; C203-F205 VanDerWaalsContact O-N 3.13Å; F205-K208 PolarHBondContact O-N 2.82Å; F205-G209 PolarHBondContact O-N 3.15Å; F205-N210 PolarHBondContact O-N 2.98Å; F205-C211 HydrophobicContact CB-CB 4.25Å; F205-C211 PolarHBondContact O-N 2.82Å
206Y75.8Confident65.3Low88 Ų88116.1 Ų116.135%0.34560%0.596SS.*Hα-helixtrans-73-42.4173.4-178.1-106.8000111.1C203 K208 G209 H221 V223C203-Y206 WeakPolarHBondContact O-CB 3.23Å; C203-Y206 PolarHBondContact O-N 2.82Å; Y206-K208 PolarHBondContact O-N 3.06Å; Y206-G209 PolarHBondContact O-N 2.93Å; Y206-H221 VanDerWaalsContact CB-CD2 3.41Å; Y206-H221 WeakPolarHBondContact CB-CD2 3.44Å; Y206-H221 HydrophobicContact CD1-CB 3.68Å; Y206-H221 AromaticContact CD1-CG 3.86Å; Y206-H221 HydrophobicContact CD2-CB 3.93Å; Y206-H221 AromaticContact CD2-CD2 3.86Å; Y206-H221 AromaticContact CD2-CE1 3.64Å; Y206-H221 AromaticContact CD2-CG 3.44Å; Y206-H221 VanDerWaalsContact CD2-CG 3.44Å; Y206-H221 AromaticContact CD2-ND1 3.31Å; Y206-H221 VanDerWaalsContact CD2-ND1 3.31Å; Y206-H221 WeakPolarHBondContact CD2-ND1 3.49Å; Y206-H221 AromaticContact CD2-NE2 3.97Å; Y206-H221 HydrophobicContact CE1-CB 3.67Å; Y206-H221 HydrophobicContact CE2-CB 3.92Å; Y206-H221 AromaticContact CE2-CG 3.87Å; Y206-H221 AromaticContact CE2-ND1 3.68Å; Y206-H221 HydrophobicContact CG-CB 3.81Å; Y206-H221 AromaticContact CG-CD2 3.53Å; Y206-H221 AromaticContact CG-CG 3.44Å; Y206-H221 VanDerWaalsContact CG-CG 3.44Å; Y206-H221 AromaticContact CG-ND1 3.8Å; Y206-H221 AromaticContact CG-NE2 3.92Å; Y206-V223 HydrophobicContact CE1-CG2 3.66Å
207L73.8Confident67.1Low97 Ų97109.3 Ų109.351%0.50857%0.567SS.*Hα-helixtrans-59.7-26.7172.8-69174.3000112.9I202 C203I202-L207 HydrophobicContact CG2-CD1 3.89Å; I202-L207 HydrophobicContact CG2-CD2 4.33Å; I202-L207 HydrophobicContact CG2-CG 4.03Å; C203-L207 PolarHBondContact O-N 2.8Å; C203-L207 VanDerWaalsContact O-N 3.11Å
208K71.3Confident68.2Low172 Ų172110 Ų11075%0.74856%0.562SS**THydrogen-bonded Turntrans-934.1174.4-68.8-178.6178.4-175.90114.1K204 F205 Y206 N210K204-K208 WeakPolarHBondContact O-CG 3.4Å; K204-K208 PolarHBondContact O-N 3.5Å; F205-K208 PolarHBondContact O-N 2.82Å; Y206-K208 PolarHBondContact O-N 3.06Å; K208-N210 VanDerWaalsContact C-N 3.33Å; K208-N210 PolarHBondContact O-N 2.79Å
209G70.6Confident70.1Confident63 Ų63108 Ų10865%0.64955%0.547SS*.THydrogen-bonded Turntrans75.84.917600000117F205 Y206F205-G209 PolarHBondContact O-N 3.15Å; Y206-G209 PolarHBondContact O-N 2.93Å
210N72.8Confident71.5Confident134 Ų134108.6 Ų108.672%0.71754%0.536SS*.  trans-117.324.3-171.1-83.8-0.6000114F205 K208 K212F205-N210 PolarHBondContact O-N 2.98Å; K208-N210 VanDerWaalsContact C-N 3.33Å; K208-N210 PolarHBondContact O-N 2.79Å; N210-K212 PolarHBondContact O-N 2.85Å
211C81.8Confident72.3Confident29 Ų29106.4 Ų106.420%0.19652%0.523CS..  trans-76.5117.7178.4-171.10000111.8F205 F213 H221F205-C211 HydrophobicContact CB-CB 4.25Å; F205-C211 PolarHBondContact O-N 2.82Å; C211-F213 VanDerWaalsContact C-N 3.28Å; C211-F213 PolarHBondContact O-N 3.27Å; C211-H221 PolarHBondContact SG-CE1 3.07Å; C211-H221 PolarHBondContact SG-NE2 2.9Å; C211-H221 VanDerWaalsContact SG-NE2 3.35Å
212K73.9Confident72.3Confident200 Ų200107 Ų10787%0.8753%0.526SS*.THydrogen-bonded Turntrans-79.5-5.6179.5-60-175-179.7-1770114.3N210N210-K212 PolarHBondContact O-N 2.85Å
213F69.1Low71.4Confident150 Ų150107.7 Ų107.766%0.65853%0.533SS*.THydrogen-bonded Turntrans-102.7-4.4-169.7-60-75.4000114.6C211 K216 C217C211-F213 VanDerWaalsContact C-N 3.28Å; C211-F213 PolarHBondContact O-N 3.27Å; F213-K216 PolarHBondContact O-N 3.33Å; F213-K216 VanDerWaalsContact O-N 3.1Å; F213-C217 HydrophobicContact CB-CB 3.98Å; F213-C217 PolarHBondContact O-N 3.34Å
214G70.4Confident70.1Confident39 Ų39111.3 Ų111.340%0.40256%0.556SS.*G310 helixtrans50.7-140174.700000113.6K216 C217 H221G214-K216 PolarHBondContact O-N 3.34Å; G214-C217 PolarHBondContact O-N 3.43Å; G214-H221 PolarHBondContact O-CE1 3.16Å; G214-H221 PolarHBondContact O-ND1 3.45Å
215S65.7Low68.6Low127 Ų127111.2 Ų111.289%0.88857%0.569SS**G310 helixtrans-70.3-4.5178.349.40000114.9
216K65Low67.4Low192 Ų192111.7 Ų111.784%0.83558%0.578SS**G310 helixtrans-100.112.8176.7-61.3-177.1-179.1-179.50112.6F213 G214F213-K216 PolarHBondContact O-N 3.33Å; F213-K216 VanDerWaalsContact O-N 3.1Å; G214-K216 PolarHBondContact O-N 3.34Å
217C74.2Confident65.8Low26 Ų26115.8 Ų115.818%0.17660%0.6CS.*  trans-69142178.8-163.50000111.3F213 G214 F219 H221F213-C217 HydrophobicContact CB-CB 3.98Å; F213-C217 PolarHBondContact O-N 3.34Å; G214-C217 PolarHBondContact O-N 3.43Å; C217-F219 PolarHBondContact O-N 3.03Å; C217-H221 WeakPolarHBondContact CB-NE2 3.28Å
218R65.1Low64.5Low206 Ų206119.4 Ų119.478%0.77762%0.618SS**SBendtrans-66.1-18.1175.9-175.3176.4174.4-173.8-1.6113
219F76Confident62.8Low92 Ų92118 Ų11840%0.40462%0.624SS.*SBendtrans-110.1148.4-178.1-60.7-71.8000110.6E201 C203 C217 H221E201-F219 WeakPolarHBondContact O-CB 3.31Å; E201-F219 WeakPolarHBondContact O-CD1 3.41Å; C203-F219 HydrophobicContact CB-CB 3.54Å; C217-F219 PolarHBondContact O-N 3.03Å; F219-H221 PolarHBondContact O-CD2 3.3Å; F219-H221 PolarHBondContact O-N 3Å
220K75.1Confident61.4Low119 Ų119118.4 Ų118.452%0.51763%0.628SS.*BIsolated β-bridgetrans-66.8133.1-176.3-72.4-171.3173.6-170.90111.7C203C203-K220 PolarHBondContact N-O 2.88Å
221H73.5Confident59.5Low49 Ų49124 Ų12423%0.22764%0.639CS.*  trans-102.973.5175-75.1-171.8000109.2C203 Y206 C211 G214 C217 F219C203-H221 WeakPolarHBondContact CB-CD2 3.35Å; Y206-H221 VanDerWaalsContact CB-CD2 3.41Å; Y206-H221 WeakPolarHBondContact CB-CD2 3.44Å; Y206-H221 HydrophobicContact CD1-CB 3.68Å; Y206-H221 AromaticContact CD1-CG 3.86Å; Y206-H221 HydrophobicContact CD2-CB 3.93Å; Y206-H221 AromaticContact CD2-CD2 3.86Å; Y206-H221 AromaticContact CD2-CE1 3.64Å; Y206-H221 AromaticContact CD2-CG 3.44Å; Y206-H221 VanDerWaalsContact CD2-CG 3.44Å; Y206-H221 AromaticContact CD2-ND1 3.31Å; Y206-H221 VanDerWaalsContact CD2-ND1 3.31Å; Y206-H221 WeakPolarHBondContact CD2-ND1 3.49Å; Y206-H221 AromaticContact CD2-NE2 3.97Å; Y206-H221 HydrophobicContact CE1-CB 3.67Å; Y206-H221 HydrophobicContact CE2-CB 3.92Å; Y206-H221 AromaticContact CE2-CG 3.87Å; Y206-H221 AromaticContact CE2-ND1 3.68Å; Y206-H221 HydrophobicContact CG-CB 3.81Å; Y206-H221 AromaticContact CG-CD2 3.53Å; Y206-H221 AromaticContact CG-CG 3.44Å; Y206-H221 VanDerWaalsContact CG-CG 3.44Å; Y206-H221 AromaticContact CG-ND1 3.8Å; Y206-H221 AromaticContact CG-NE2 3.92Å; C211-H221 PolarHBondContact SG-CE1 3.07Å; C211-H221 PolarHBondContact SG-NE2 2.9Å; C211-H221 VanDerWaalsContact SG-NE2 3.35Å; G214-H221 PolarHBondContact O-CE1 3.16Å; G214-H221 PolarHBondContact O-ND1 3.45Å; C217-H221 WeakPolarHBondContact CB-NE2 3.28Å; F219-H221 PolarHBondContact O-CD2 3.3Å; F219-H221 PolarHBondContact O-N 3Å
222E66.3Low57.8Low121 Ų121129.5 Ų129.557%0.56567%0.665SS**  trans-119.7127.4-179.2-156.6167-168.900107.8
223V56.1Low55.9Low86 Ų86129.1 Ų129.152%0.52167%0.666SS.*  trans-96.5124.2179.9-173.40000107.8Y206Y206-V223 HydrophobicContact CE1-CG2 3.66Å
224P48.5Very low54.6Low77 Ų77133.1 Ų133.150%0.568%0.677SS.*  trans-62.3151.8174.5-19.630.9000111.9N226P224-N226 PolarHBondContact O-N 3.5Å
225P43.9Very low53.1Low128 Ų128136.3 Ų136.383%0.83169%0.693SS**THydrogen-bonded Turntrans-68.112.3-159.9-2032.6000118.9
226N46.5Very low51.8Low150 Ų150136 Ų13680%0.80269%0.685SS**THydrogen-bonded Turntrans-124.226-166.3-70.9-18.4000116.5P224P224-N226 PolarHBondContact O-N 3.5Å
227Q42.4Very low50.7Low175 Ų175131.3 Ų131.382%0.81867%0.67SS**  trans-136.7115.1165.9-74.8-175.55.200111.8
228I46.2Very low49.2Very low172 Ų172135.8 Ų135.888%0.88269%0.692SS**  trans-78.6114.6174.4-59.8167.5000108.7
229V36.3Very low48.5Very low143 Ų143130.2 Ų130.287%0.86768%0.684SS**  trans-139.6117150.5-179.40000107.6
230G41.3Very low47.5Very low71 Ų71133.2 Ų133.273%0.73270%0.7SS**  trans-73.4146.1-167.600000115.2
231R32.6Very low46.1Very low251 Ų251134.8 Ų134.895%0.94771%0.713SS**  trans-150.7129.1143.4-141.9177.8-166.2-176.73.1110.3
232I45Very low44.6Very low146 Ų146139 Ų13975%0.74974%0.737SS**  trans-65.5121.9-179-65.4154.5000110R234I232-R234 HydrophobicContact CG2-CG 4Å
233E35.6Very low43.3Very low191 Ų191137.9 Ų137.989%0.89375%0.748SS**  trans-121119151.3-78.7-174.4174.400107.8S235E233-S235 PolarHBondContact O-N 3.19Å
234R41.2Very low42.6Very low234 Ų234140.2 Ų140.288%0.88376%0.756SS**  trans-75.4102-179.6-58.7175.1-139.2175.24.1107.7I232I232-R234 HydrophobicContact CG2-CG 4Å
235S37.8Very low42.7Very low107 Ų107146 Ų14675%0.74878%0.777SS**  trans-82.7119.8152.855.60000106.8E233 D237E233-S235 PolarHBondContact O-N 3.19Å; S235-D237 PolarHBondContact O-N 2.79Å
236V39Very low42.9Very low119 Ų119142.5 Ų142.572%0.72175%0.751SS**  trans-57.3122.8173.4178.60000107.8D238V236-D238 PolarHBondContact O-N 3.31Å
237D42.9Very low43Very low95 Ų95137.6 Ų137.651%0.50873%0.731SS.*  trans-84.589179.2-175.521.9000108.4S235 S239 H240S235-D237 PolarHBondContact O-N 2.79Å; D237-S239 PolarHBondContact O-N 3Å; D237-S239 WeakPolarHBondContact OD1-CB 3.46Å; D237-S239 PolarHBondContact OD1-N 2.95Å; D237-S239 PolarHBondContact OD1-OG 3.24Å; D237-H240 IonicContact OD2-NE2 2.68Å
238D41.8Very low43.7Very low119 Ų119135.1 Ų135.164%0.63673%0.733SS**  trans-8426.4170.3-75.7-27.6000111.5V236 H240V236-D238 PolarHBondContact O-N 3.31Å; D238-H240 PolarHBondContact O-N 3.13Å
239S49.9Very low44.7Very low89 Ų89128.8 Ų128.862%0.62270%0.7SS**THydrogen-bonded Turntrans-73.30.3177.6-52.80000114D237D237-S239 PolarHBondContact O-N 3Å; D237-S239 WeakPolarHBondContact OD1-CB 3.46Å; D237-S239 PolarHBondContact OD1-N 2.95Å; D237-S239 PolarHBondContact OD1-OG 3.24Å
240H55.2Low46.6Very low156 Ų156125.8 Ų125.872%0.72268%0.678SS**THydrogen-bonded Turntrans-101.81.4-174.5-70.1-69.6000115.6D237 D238D237-H240 IonicContact OD2-NE2 2.68Å; D238-H240 PolarHBondContact O-N 3.13Å
241L46.4Very low48.6Very low151 Ų151122.5 Ų122.579%0.79164%0.644SS**SBendtrans-1121.5179.3-66.2-178.6000115.6
242N41.7Very low51.2Low139 Ų139111.4 Ų111.474%0.74360%0.603SS**  trans-108.461.6177.3-65.7-46.1000111.4I244N242-I244 PolarHBondContact O-N 2.74Å
243A38.8Very low53.3Low97 Ų97104.4 Ų104.480%0.80257%0.567SS**  trans-8162169.300000110.6
244I42.3Very low55.9Low134 Ų13495.7 Ų95.769%0.68753%0.526SS*.  trans-143.496.5153.7-53.7179.7000105.5N242 D246N242-I244 PolarHBondContact O-N 2.74Å; I244-D246 PolarHBondContact O-N 3.1Å
245E50.5Low58.2Low198 Ų19884.6 Ų84.693%0.92548%0.484SS*.  trans-66.973.6167.3-71174.9149.800109.2
246D47.6Very low60.5Low55 Ų5580.5 Ų80.529%0.29445%0.452SS..  trans-81.4113.9161.9-87.1-14.6000106.6R164 I244 S248R164-D246 IonicContact CZ-OD2 2.8Å; R164-D246 IonicContact NE-OD2 2.76Å; R164-D246 IonicContact NH2-OD1 2.78Å; R164-D246 IonicContact NH2-OD2 3.92Å; R164-D246 PolarHBondContact NH2-OD2 2.8Å; I244-D246 PolarHBondContact O-N 3.1Å; D246-S248 PolarHBondContact O-N 3.11Å; D246-S248 PolarHBondContact O-OG 3.29Å
247A47.8Very low62.7Low47 Ų4774.9 Ų74.939%0.38842%0.418SS..  trans-45.1108.8167.100000108.4F249A247-F249 HydrophobicContact CB-CD2 3.82Å; A247-F249 HydrophobicContact CB-CE2 3.33Å; A247-F249 HydrophobicContact CB-CZ 4.04Å; A247-F249 WeakPolarHBondContact O-CD2 3.4Å; A247-F249 PolarHBondContact O-N 3.35Å
248S58.2Low64.5Low123 Ų12372.8 Ų72.886%0.8641%0.411SS*.  trans-75.970.8-167.4-67.80000111.1D246D246-S248 PolarHBondContact O-N 3.11Å; D246-S248 PolarHBondContact O-OG 3.29Å
249F67.2Low65.9Low40 Ų4074.4 Ų74.418%0.17541%0.412CS..  trans-70.8143.7170.2-62.8-74.7000109.3K160 G173 E175 A247 Y251 E252K160-F249 HydrophobicContact CB-CZ 4.42Å; K160-F249 HydrophobicContact CG-CE1 4.28Å; K160-F249 HydrophobicContact CG-CE2 4.38Å; K160-F249 HydrophobicContact CG-CZ 3.75Å; G173-F249 VanDerWaalsContact CA-CD2 3.45Å; E175-F249 HydrophobicContact CG-CD1 4.14Å; E175-F249 HydrophobicContact CG-CE1 4.19Å; A247-F249 HydrophobicContact CB-CD2 3.82Å; A247-F249 HydrophobicContact CB-CE2 3.33Å; A247-F249 HydrophobicContact CB-CZ 4.04Å; A247-F249 WeakPolarHBondContact O-CD2 3.4Å; A247-F249 PolarHBondContact O-N 3.35Å; F249-Y251 PolarHBondContact O-N 3.1Å; F249-E252 HydrophobicContact CB-CG 4.5Å
250L75.4Confident67Low79 Ų7976.1 Ų76.141%0.41442%0.415SS..SBendtrans-72.3-21.7178.1-71.4175.7000112.7T180 S274 T275T180-L250 HydrophobicContact CG2-CD1 4.18Å; L250-S274 WeakPolarHBondContact O-CA 3Å; L250-S274 PolarHBondContact O-OG 2.98Å; L250-T275 WeakPolarHBondContact CA-OG1 3.33Å; L250-T275 PolarHBondContact O-N 2.67Å; L250-T275 VanDerWaalsContact O-N 3.07Å; L250-T275 PolarHBondContact O-OG1 3.03Å
251Y83.6Confident68.2Low2 Ų269.3 Ų69.31%0.00838%0.383CS..EExtended strand (participates in β ladder)trans-136.3134-179-49.7-78.2000108.4L174 L176 L179 T180 F249 F272 Y273 S274 N276 L279L174-Y251 PolarHBondContact N-O 2.81Å; L176-Y251 HydrophobicContact CB-CD2 3.68Å; L176-Y251 HydrophobicContact CB-CE2 3.96Å; L176-Y251 HydrophobicContact CB-CG 4.28Å; L176-Y251 HydrophobicContact CD1-CD2 4.38Å; L176-Y251 HydrophobicContact CD1-CG 4.15Å; L176-Y251 HydrophobicContact CG-CD2 4.17Å; L176-Y251 HydrophobicContact CG-CG 4.4Å; L176-Y251 WeakPolarHBondContact O-CE2 3.47Å; L179-Y251 HydrophobicContact CB-CE1 4.16Å; L179-Y251 HydrophobicContact CB-CE2 4.18Å; L179-Y251 WeakPolarHBondContact CB-OH 3.46Å; L179-Y251 HydrophobicContact CD1-CD1 4.08Å; L179-Y251 HydrophobicContact CD1-CE1 3.82Å; T180-Y251 PolarHBondContact N-OH 3.38Å; T180-Y251 WeakPolarHBondContact OG1-CE2 3.36Å; T180-Y251 PolarHBondContact OG1-OH 3.08Å; F249-Y251 PolarHBondContact O-N 3.1Å; Y251-F272 AromaticContact CD1-CE1 3.92Å; Y251-F272 HydrophobicContact CD1-CE1 3.92Å; Y251-F272 AromaticContact CD1-CZ 3.5Å; Y251-F272 HydrophobicContact CD1-CZ 3.5Å; Y251-F272 VanDerWaalsContact CD1-CZ 3.5Å; Y251-F272 HydrophobicContact CE1-CZ 4.41Å; Y251-F272 AromaticContact CG-CZ 3.98Å; Y251-F272 HydrophobicContact CG-CZ 3.98Å; Y251-Y273 WeakPolarHBondContact CA-O 3.37Å; Y251-S274 VanDerWaalsContact CD1-OG 3.27Å; Y251-S274 WeakPolarHBondContact CD1-OG 3.42Å; Y251-S274 VanDerWaalsContact CE1-OG 3.22Å; Y251-S274 WeakPolarHBondContact CE1-OG 3.03Å; Y251-N276 HydrophobicContact CE1-CB 4.18Å; Y251-N276 PolarHBondContact OH-ND2 2.81Å; Y251-L279 HydrophobicContact CE1-CD2 4.27Å
252E87.8Confident69.9Low18 Ų1863.1 Ų63.18%0.08435%0.35CS..EExtended strand (participates in β ladder)trans-129.1141.1174.3-62.3169.1-148.600108.4R164 T171 I172 F249 Y273R164-E252 IonicContact CZ-OE2 3.74Å; R164-E252 IonicContact NH1-OE2 3.98Å; R164-E252 PolarHBondContact NH1-OE2 2.94Å; R164-E252 IonicContact NH2-OE2 3.94Å; R164-E252 PolarHBondContact NH2-OE2 3.1Å; T171-E252 HydrophobicContact CG2-CB 4.03Å; T171-E252 HydrophobicContact CG2-CG 4.24Å; T171-E252 VanDerWaalsContact CG2-OE2 3.32Å; T171-E252 WeakPolarHBondContact CG2-OE2 3.28Å; I172-E252 CarbonylContact O-C 3.52Å; I172-E252 VanDerWaalsContact O-CA 3.31Å; I172-E252 WeakPolarHBondContact O-CA 3.31Å; F249-E252 HydrophobicContact CB-CG 4.5Å; E252-Y273 HydrophobicContact CB-CD1 3.93Å; E252-Y273 HydrophobicContact CG-CD1 4.1Å; E252-Y273 PolarHBondContact N-O 3.04Å; E252-Y273 WeakPolarHBondContact O-CA 3.48Å; E252-Y273 WeakPolarHBondContact O-CB 3.22Å; E252-Y273 PolarHBondContact O-N 3.23Å
253L88.3Confident71.9Confident0 Ų056.6 Ų56.60%032%0.315CS..EExtended strand (participates in β ladder)trans-99.3119.3168.5-179.564.6000108.2T171 I172 L174 I255 V270 L291 I310 L313T171-L253 CarbonylContact C-O 3.46Å; T171-L253 WeakPolarHBondContact CA-O 3.46Å; I172-L253 HydrophobicContact CB-CB 4.4Å; I172-L253 HydrophobicContact CD1-CD2 4.46Å; I172-L253 PolarHBondContact N-O 3.31Å; I172-L253 PolarHBondContact O-N 2.87Å; L174-L253 HydrophobicContact CD1-CB 3.9Å; L174-L253 HydrophobicContact CG-CB 4.47Å; L253-I255 HydrophobicContact CD2-CD1 4.31Å; L253-I255 HydrophobicContact CG-CG1 4.29Å; L253-V270 HydrophobicContact CD1-CG1 3.47Å; L253-V270 VanDerWaalsContact CD1-CG1 3.47Å; L253-V270 HydrophobicContact CG-CG1 4.48Å; L253-L291 HydrophobicContact CD1-CD1 3.67Å; L253-I310 HydrophobicContact CD2-CG1 4.21Å; L253-L313 HydrophobicContact CB-CD1 4.5Å; L253-L313 HydrophobicContact CD1-CD1 4.05Å; L253-L313 HydrophobicContact CD2-CD1 3.96Å; L253-L313 HydrophobicContact CG-CD1 4.41Å
254E89.6Confident74Confident8 Ų852.2 Ų52.24%0.03728%0.278CS..EExtended strand (participates in β ladder)trans-105.4128.7175.5-171178145.100109.9Y90 V169 W170 R256 A271Y90-E254 HydrophobicContact CE1-CB 4.47Å; Y90-E254 PolarHBondContact OH-OE2 3.33Å; V169-E254 HydrophobicContact CG1-CG 3.74Å; W170-E254 WeakPolarHBondContact O-CA 3.45Å; E254-R256 HydrophobicContact CG-CG 4.12Å; E254-R256 WeakPolarHBondContact OE1-CD 3.28Å; E254-R256 IonicContact OE1-CZ 3.71Å; E254-R256 IonicContact OE1-NE 2.98Å; E254-R256 IonicContact OE1-NH1 3.68Å; E254-R256 PolarHBondContact OE1-NH1 3.48Å; E254-A271 HydrophobicContact CB-CB 4.43Å; E254-A271 PolarHBondContact N-O 3.06Å; E254-A271 PolarHBondContact O-N 3.45Å
255I89.4Confident75.8Confident0 Ų049.1 Ų49.10%026%0.258CS..EExtended strand (participates in β ladder)trans-118124.8177.7-56.3-178000107.6V169 W170 I172 L253 F257 P268 L269 V306V169-I255 WeakPolarHBondContact CA-O 3.39Å; W170-I255 HydrophobicContact CB-CB 4.39Å; W170-I255 PolarHBondContact N-O 3.44Å; W170-I255 PolarHBondContact O-N 2.89Å; I172-I255 HydrophobicContact CD1-CD1 4.1Å; I172-I255 HydrophobicContact CD1-CG1 4.45Å; L253-I255 HydrophobicContact CD2-CD1 4.31Å; L253-I255 HydrophobicContact CG-CG1 4.29Å; I255-F257 HydrophobicContact CG2-CE1 4.16Å; I255-F257 HydrophobicContact CG2-CE2 4.05Å; I255-F257 HydrophobicContact CG2-CZ 3.71Å; I255-P268 HydrophobicContact CG2-CB 3.68Å; I255-P268 HydrophobicContact CG2-CG 3.8Å; I255-L269 WeakPolarHBondContact CA-O 3.45Å; I255-V306 HydrophobicContact CD1-CB 3.92Å; I255-V306 HydrophobicContact CD1-CG1 3.43Å; I255-V306 VanDerWaalsContact CD1-CG1 3.43Å; I255-V306 HydrophobicContact CD1-CG2 3.47Å; I255-V306 VanDerWaalsContact CD1-CG2 3.47Å
256R86.6Confident77.4Confident22 Ų2241.7 Ų41.78%0.08322%0.223CC..EExtended strand (participates in β ladder)trans-117.4132.3-175.8-55.9-174.569.195.91.3110.9E113 R168 V169 E254 L269E113-R256 IonicContact OE1-CZ 3.51Å; E113-R256 VanDerWaalsContact OE1-CZ 3.28Å; E113-R256 IonicContact OE1-NE 3.83Å; E113-R256 PolarHBondContact OE1-NE 3.4Å; E113-R256 IonicContact OE1-NH2 3.06Å; E113-R256 PolarHBondContact OE1-NH2 3.04Å; R168-R256 CarbonylContact O-C 3.55Å; R168-R256 WeakPolarHBondContact O-CA 3.38Å; V169-R256 HydrophobicContact CG1-CG 4.5Å; V169-R256 HydrophobicContact CG2-CG 4.34Å; E254-R256 HydrophobicContact CG-CG 4.12Å; E254-R256 WeakPolarHBondContact OE1-CD 3.28Å; E254-R256 IonicContact OE1-CZ 3.71Å; E254-R256 IonicContact OE1-NE 2.98Å; E254-R256 IonicContact OE1-NH1 3.68Å; E254-R256 PolarHBondContact OE1-NH1 3.48Å; R256-L269 HydrophobicContact CB-CB 4.23Å; R256-L269 PolarHBondContact N-O 3.45Å; R256-L269 PolarHBondContact O-N 2.93Å; R256-L269 VanDerWaalsContact O-N 3.08Å
257F86.3Confident79.2Confident1 Ų139.4 Ų39.40%0.00421%0.212CC..  trans-115.3121.9174.2-49.8-81.6000108.9R168 W170 I255 H261 Y263 P268R168-F257 PolarHBondContact O-N 3.33Å; W170-F257 AromaticContact CD2-CE2 3.66Å; W170-F257 HydrophobicContact CD2-CE2 3.66Å; W170-F257 HydrophobicContact CD2-CZ 4.17Å; W170-F257 AromaticContact CE2-CE2 3.8Å; W170-F257 AromaticContact CE3-CE2 3.9Å; W170-F257 HydrophobicContact CE3-CE2 3.9Å; W170-F257 AromaticContact CE3-CZ 3.92Å; W170-F257 HydrophobicContact CE3-CZ 3.92Å; W170-F257 HydrophobicContact CG-CE2 4.08Å; W170-F257 HydrophobicContact CH2-CE2 4.38Å; W170-F257 HydrophobicContact CH2-CZ 4.22Å; W170-F257 HydrophobicContact CZ2-CE2 4.17Å; W170-F257 HydrophobicContact CZ2-CZ 4.45Å; W170-F257 HydrophobicContact CZ3-CE2 4.26Å; W170-F257 AromaticContact CZ3-CZ 3.95Å; W170-F257 HydrophobicContact CZ3-CZ 3.95Å; I255-F257 HydrophobicContact CG2-CE1 4.16Å; I255-F257 HydrophobicContact CG2-CE2 4.05Å; I255-F257 HydrophobicContact CG2-CZ 3.71Å; F257-H261 HydrophobicContact CB-CB 4.21Å; F257-H261 AromaticContact CD1-CD2 3.8Å; F257-Y263 HydrophobicContact CD1-CG 4.36Å; F257-Y263 HydrophobicContact CE1-CD1 4.25Å; F257-Y263 AromaticContact CE1-CD2 3.76Å; F257-Y263 HydrophobicContact CE1-CD2 3.76Å; F257-Y263 HydrophobicContact CE1-CE2 4.32Å; F257-Y263 AromaticContact CE1-CG 3.71Å; F257-Y263 HydrophobicContact CE1-CG 3.71Å; F257-P268 HydrophobicContact CD1-CB 3.76Å; F257-P268 HydrophobicContact CE1-CB 3.54Å; F257-P268 HydrophobicContact CE1-CG 4.12Å; F257-P268 HydrophobicContact CZ-CB 4.38Å
258S80.1Confident81.1Confident50 Ų5037.1 Ų37.135%0.3519%0.194SC..  trans-64.5162168.9-57.10000110.7D260 H261S258-D260 PolarHBondContact O-N 2.8Å; S258-D260 VanDerWaalsContact O-N 3.13Å; S258-H261 WeakPolarHBondContact O-CB 3.26Å; S258-H261 PolarHBondContact O-N 3.06Å
259K70.9Confident82.5Confident154 Ų15431.7 Ų31.767%0.6716%0.155SC*.THydrogen-bonded Turntrans-55.3-34.9-173.8-64.8-175.4-172.5175.90114R168R168-K259 VanDerWaalsContact NH2-CE 3.33Å
260D73.5Confident83.5Confident125 Ų12529.8 Ų29.867%0.66815%0.147SC*.THydrogen-bonded Turntrans-110.222.9-178.2-51.6-48.7000112.5S258 K262S258-D260 PolarHBondContact O-N 2.8Å; S258-D260 VanDerWaalsContact O-N 3.13Å; D260-K262 PolarHBondContact O-N 2.54Å
261H80.6Confident84Confident12 Ų1226.1 Ų26.16%0.05613%0.127CC..  trans-74.4126.2-173.9-169.988.5000112.1R146 F257 S258 Y263 Q266 A267R146-H261 PolarHBondContact NH2-O 3.19Å; F257-H261 HydrophobicContact CB-CB 4.21Å; F257-H261 AromaticContact CD1-CD2 3.8Å; S258-H261 WeakPolarHBondContact O-CB 3.26Å; S258-H261 PolarHBondContact O-N 3.06Å; H261-Y263 PolarHBondContact O-N 3.3Å; H261-Q266 WeakPolarHBondContact CE1-CG 3.49Å; H261-Q266 VanDerWaalsContact ND1-CD 3.32Å; H261-Q266 PolarHBondContact ND1-NE2 2.98Å; H261-Q266 PolarHBondContact ND1-OE1 2.92Å; H261-Q266 PolarHBondContact NE2-O 3.35Å; H261-A267 PolarHBondContact CE1-O 2.71Å
262K81.8Confident84.2Confident21 Ų2126 Ų269%0.09113%0.127CC..  trans-95.762.3-172.7-63.4-170.5172-141.30112.7V134 N135 I137 L139 D260 Y265 Q266V134-K262 HydrophobicContact CG1-CB 3.7Å; V134-K262 HydrophobicContact CG1-CD 3.68Å; V134-K262 HydrophobicContact CG1-CG 4.33Å; V134-K262 WeakPolarHBondContact O-CD 3.35Å; V134-K262 WeakPolarHBondContact O-CE 3.46Å; V134-K262 PolarHBondContact O-NZ 2.92Å; N135-K262 VanDerWaalsContact CA-NZ 3.34Å; N135-K262 PolarHBondContact O-NZ 2.88Å; I137-K262 PolarHBondContact O-NZ 2.49Å; L139-K262 HydrophobicContact CD2-CG 4.23Å; D260-K262 PolarHBondContact O-N 2.54Å; K262-Y265 CarbonylContact O-C 3.56Å; K262-Y265 WeakPolarHBondContact O-CA 3.5Å; K262-Y265 WeakPolarHBondContact O-CB 3.34Å; K262-Y265 PolarHBondContact O-N 3.43Å; K262-Q266 HydrophobicContact CB-CB 4.37Å; K262-Q266 VanDerWaalsContact N-OE1 3.11Å; K262-Q266 WeakPolarHBondContact O-CB 3.5Å; K262-Q266 PolarHBondContact O-N 3.17Å
263Y83.3Confident84Confident2 Ų226.1 Ų26.11%0.00813%0.127CC..THydrogen-bonded Turntrans-73.1139.4173.5-174.7-99.4000110.9C142 R146 E149 F257 H261 P268 P304 V305C142-Y263 VanDerWaalsContact CB-O 3.31Å; C142-Y263 WeakPolarHBondContact CB-O 3.43Å; R146-Y263 HydrophobicContact CB-CD1 4.32Å; E149-Y263 PolarHBondContact OE1-OH 3.36Å; E149-Y263 WeakPolarHBondContact OE2-CE1 3.46Å; E149-Y263 PolarHBondContact OE2-OH 3.46Å; F257-Y263 HydrophobicContact CD1-CG 4.36Å; F257-Y263 HydrophobicContact CE1-CD1 4.25Å; F257-Y263 AromaticContact CE1-CD2 3.76Å; F257-Y263 HydrophobicContact CE1-CD2 3.76Å; F257-Y263 HydrophobicContact CE1-CE2 4.32Å; F257-Y263 AromaticContact CE1-CG 3.71Å; F257-Y263 HydrophobicContact CE1-CG 3.71Å; H261-Y263 PolarHBondContact O-N 3.3Å; Y263-P268 HydrophobicContact CD2-CG 4.12Å; Y263-P268 HydrophobicContact CE2-CG 4.04Å; Y263-P304 WeakPolarHBondContact OH-CA 3.39Å; Y263-V305 HydrophobicContact CE2-CG1 4.15Å; Y263-V305 HydrophobicContact CE2-CG2 3.76Å; Y263-V305 PolarHBondContact OH-N 3.49Å
264P82.3Confident83.7Confident5 Ų526.1 Ų26.13%0.03213%0.127CC..THydrogen-bonded Turncis-87.7-3.86.533.8-35000115.6Q266P264-Q266 PolarHBondContact O-N 2.98Å
265Y81.2Confident83Confident69 Ų6928.4 Ų28.427%0.27114%0.141SC..THydrogen-bonded Turntrans-69.1-16.1-179.1-52.9-78.1000114.4I137 K262 S302I137-Y265 HydrophobicContact CD1-CD1 3.8Å; I137-Y265 HydrophobicContact CD1-CD2 3.62Å; I137-Y265 HydrophobicContact CD1-CE1 3.98Å; I137-Y265 HydrophobicContact CD1-CE2 3.81Å; I137-Y265 HydrophobicContact CD1-CG 3.62Å; I137-Y265 HydrophobicContact CG2-CD2 4.39Å; I137-Y265 HydrophobicContact CG2-CE2 4.02Å; K262-Y265 CarbonylContact O-C 3.56Å; K262-Y265 WeakPolarHBondContact O-CA 3.5Å; K262-Y265 WeakPolarHBondContact O-CB 3.34Å; K262-Y265 PolarHBondContact O-N 3.43Å; Y265-S302 VanDerWaalsContact CE1-CB 3.49Å
266Q83.9Confident82.2Confident42 Ų4229 Ų2920%0.19615%0.145CC..SBendtrans-124127.6178.3-170.3-171.9-5.300109.4I130 H261 K262 P264I130-Q266 VanDerWaalsContact CD1-CD 3.5Å; I130-Q266 HydrophobicContact CD1-CG 4.38Å; I130-Q266 VanDerWaalsContact CD1-NE2 3.34Å; I130-Q266 HydrophobicContact CG1-CG 4.1Å; H261-Q266 WeakPolarHBondContact CE1-CG 3.49Å; H261-Q266 VanDerWaalsContact ND1-CD 3.32Å; H261-Q266 PolarHBondContact ND1-NE2 2.98Å; H261-Q266 PolarHBondContact ND1-OE1 2.92Å; H261-Q266 PolarHBondContact NE2-O 3.35Å; K262-Q266 HydrophobicContact CB-CB 4.37Å; K262-Q266 VanDerWaalsContact N-OE1 3.11Å; K262-Q266 WeakPolarHBondContact O-CB 3.5Å; K262-Q266 PolarHBondContact O-N 3.17Å; P264-Q266 PolarHBondContact O-N 2.98Å
267A85.3Confident81.4Confident7 Ų736.8 Ų36.86%0.05818%0.182CC..PPolyproline II helixtrans-62.4123.8178.700000111.1H261 Y292 A295 L296 A299H261-A267 PolarHBondContact CE1-O 2.71Å; A267-Y292 HydrophobicContact CB-CE2 4.27Å; A267-A295 HydrophobicContact CB-CB 4.05Å; A267-L296 HydrophobicContact CB-CD2 3.71Å; A267-L296 HydrophobicContact CB-CG 4.11Å; A267-A299 HydrophobicContact CB-CB 4.12Å
268P87.5Confident80.5Confident0 Ų040.8 Ų40.80%020%0.203CC..PPolyproline II helixtrans-72.3160.717931.5-34.8000111.6I255 F257 Y263 V270 Y292 V305I255-P268 HydrophobicContact CG2-CB 3.68Å; I255-P268 HydrophobicContact CG2-CG 3.8Å; F257-P268 HydrophobicContact CD1-CB 3.76Å; F257-P268 HydrophobicContact CE1-CB 3.54Å; F257-P268 HydrophobicContact CE1-CG 4.12Å; F257-P268 HydrophobicContact CZ-CB 4.38Å; Y263-P268 HydrophobicContact CD2-CG 4.12Å; Y263-P268 HydrophobicContact CE2-CG 4.04Å; P268-V270 PolarHBondContact O-N 3.12Å; P268-Y292 WeakPolarHBondContact O-CD2 3.43Å; P268-Y292 WeakPolarHBondContact O-CE2 3.29Å; P268-V305 HydrophobicContact CG-CG2 4.01Å
269L87.6Confident80.3Confident9 Ų938.5 Ų38.55%0.04719%0.187CC..EExtended strand (participates in β ladder)trans-73.9123.4173.5-67.3176000108.9E113 L116 F120 M128 I255 R256 Y292E113-L269 HydrophobicContact CB-CD1 4.13Å; E113-L269 HydrophobicContact CG-CD1 4.04Å; L116-L269 HydrophobicContact CB-CD2 4.44Å; F120-L269 HydrophobicContact CD2-CD2 3.79Å; F120-L269 HydrophobicContact CE2-CD2 4.02Å; M128-L269 HydrophobicContact CE-CD2 4.26Å; I255-L269 WeakPolarHBondContact CA-O 3.45Å; R256-L269 HydrophobicContact CB-CB 4.23Å; R256-L269 PolarHBondContact N-O 3.45Å; R256-L269 PolarHBondContact O-N 2.93Å; R256-L269 VanDerWaalsContact O-N 3.08Å; L269-Y292 HydrophobicContact CD2-CE2 4.33Å
270V88.4Confident80.5Confident0 Ų033.6 Ų33.60%017%0.171CC..EExtended strand (participates in β ladder)trans-112.2132.5-177.9-175.50000109.6F120 L253 P268 L291 L309F120-V270 WeakPolarHBondContact CZ-O 3.43Å; L253-V270 HydrophobicContact CD1-CG1 3.47Å; L253-V270 VanDerWaalsContact CD1-CG1 3.47Å; L253-V270 HydrophobicContact CG-CG1 4.48Å; P268-V270 PolarHBondContact O-N 3.12Å; V270-L291 HydrophobicContact CB-CB 4.37Å; V270-L291 HydrophobicContact CG1-CB 3.79Å; V270-L291 HydrophobicContact CG1-CD1 3.8Å; V270-L291 HydrophobicContact CG1-CG 4.46Å; V270-L309 HydrophobicContact CG2-CD1 3.97Å
271A86.6Confident80.6Confident1 Ų130.7 Ų30.71%0.00816%0.155CC..EExtended strand (participates in β ladder)trans-133.5128.4178.900000110.9Y90 L116 E254Y90-A271 HydrophobicContact CD1-CB 3.76Å; Y90-A271 HydrophobicContact CE1-CB 3.99Å; L116-A271 HydrophobicContact CD1-CB 3.82Å; L116-A271 HydrophobicContact CD2-CB 4.32Å; E254-A271 HydrophobicContact CB-CB 4.43Å; E254-A271 PolarHBondContact N-O 3.06Å; E254-A271 PolarHBondContact O-N 3.45Å
272F86.3Confident80.4Confident0 Ų030.3 Ų30.30%015%0.154CC..EExtended strand (participates in β ladder)trans-89.8115.7173.5-173.3-101.4000110.4L176 L179 Y251 L279 R284 I287 S288L176-F272 HydrophobicContact CD1-CE2 3.79Å; L176-F272 HydrophobicContact CD1-CZ 3.9Å; L179-F272 HydrophobicContact CD1-CZ 3.99Å; Y251-F272 AromaticContact CD1-CE1 3.92Å; Y251-F272 HydrophobicContact CD1-CE1 3.92Å; Y251-F272 AromaticContact CD1-CZ 3.5Å; Y251-F272 HydrophobicContact CD1-CZ 3.5Å; Y251-F272 VanDerWaalsContact CD1-CZ 3.5Å; Y251-F272 HydrophobicContact CE1-CZ 4.41Å; Y251-F272 AromaticContact CG-CZ 3.98Å; Y251-F272 HydrophobicContact CG-CZ 3.98Å; F272-L279 HydrophobicContact CE1-CD2 3.85Å; F272-R284 HydrophobicContact CD1-CB 4.28Å; F272-R284 HydrophobicContact CD1-CG 4.32Å; F272-I287 HydrophobicContact CB-CB 4.42Å; F272-I287 HydrophobicContact CB-CG2 3.96Å; F272-I287 HydrophobicContact CD1-CD1 4.23Å; F272-I287 HydrophobicContact CD1-CG2 4.37Å; F272-I287 HydrophobicContact CD2-CG2 3.89Å; F272-I287 HydrophobicContact CE1-CD1 4.11Å; F272-I287 HydrophobicContact CE2-CG2 4.47Å; F272-I287 HydrophobicContact CG-CB 4.39Å; F272-I287 HydrophobicContact CG-CG2 3.81Å; F272-I287 HydrophobicContact CZ-CD1 4.47Å; F272-S288 WeakPolarHBondContact CB-OG 3.46Å; F272-S288 PolarHBondContact N-OG 3.37Å
273Y84.9Confident80.1Confident20 Ų2029.3 Ų29.38%0.07815%0.15CC..EExtended strand (participates in β ladder)trans-100.2135.7176.5177.6-97.9000110.5R89 Y90 Y251 E252 T275R89-Y273 HydrophobicContact CB-CD2 3.91Å; R89-Y273 HydrophobicContact CB-CE2 3.5Å; R89-Y273 VanDerWaalsContact CB-CE2 3.5Å; R89-Y273 VanDerWaalsContact CD-OH 3.31Å; R89-Y273 WeakPolarHBondContact CD-OH 3.27Å; R89-Y273 HydrophobicContact CG-CE2 4.2Å; R89-Y273 PolarHBondContact NH1-OH 3.06Å; Y90-Y273 HydrophobicContact CD1-CD2 4.3Å; Y90-Y273 HydrophobicContact CD2-CD2 4.3Å; Y90-Y273 AromaticContact CE1-CD2 3.94Å; Y90-Y273 HydrophobicContact CE1-CD2 3.94Å; Y90-Y273 HydrophobicContact CE1-CG 4.29Å; Y90-Y273 AromaticContact CE2-CD2 3.9Å; Y90-Y273 HydrophobicContact CE2-CD2 3.9Å; Y90-Y273 HydrophobicContact CE2-CE2 4.44Å; Y90-Y273 HydrophobicContact CG-CD2 4.49Å; Y90-Y273 AromaticContact CZ-CD2 3.72Å; Y251-Y273 WeakPolarHBondContact CA-O 3.37Å; E252-Y273 HydrophobicContact CB-CD1 3.93Å; E252-Y273 HydrophobicContact CG-CD1 4.1Å; E252-Y273 PolarHBondContact N-O 3.04Å; E252-Y273 WeakPolarHBondContact O-CA 3.48Å; E252-Y273 WeakPolarHBondContact O-CB 3.22Å; E252-Y273 PolarHBondContact O-N 3.23Å; Y273-T275 HydrophobicContact CE1-CG2 3.59Å
274S81.7Confident80Confident1 Ų129.9 Ų29.91%0.00715%0.152CC..EExtended strand (participates in β ladder)trans-139.1134.6174.6-173.80000111.8L250 Y251 N276L250-S274 WeakPolarHBondContact O-CA 3Å; L250-S274 PolarHBondContact O-OG 2.98Å; Y251-S274 VanDerWaalsContact CD1-OG 3.27Å; Y251-S274 WeakPolarHBondContact CD1-OG 3.42Å; Y251-S274 VanDerWaalsContact CE1-OG 3.22Å; Y251-S274 WeakPolarHBondContact CE1-OG 3.03Å; S274-N276 PolarHBondContact OG-N 3.29Å; S274-N276 VanDerWaalsContact OG-N 3.16Å
275T74.9Confident80Confident55 Ų5529.8 Ų29.834%0.33715%0.151SC..  trans-89.2-5.4170.155.60000112.3L250 Y273 E277L250-T275 WeakPolarHBondContact CA-OG1 3.33Å; L250-T275 PolarHBondContact O-N 2.67Å; L250-T275 VanDerWaalsContact O-N 3.07Å; L250-T275 PolarHBondContact O-OG1 3.03Å; Y273-T275 HydrophobicContact CE1-CG2 3.59Å; T275-E277 PolarHBondContact O-N 2.88Å
276N72.8Confident79.9Confident14 Ų1427.8 Ų27.88%0.07514%0.144CC..  trans-79.9110.3-179.2-171.5-8.3000111.6Y251 S274 N278 L279 R284Y251-N276 HydrophobicContact CE1-CB 4.18Å; Y251-N276 PolarHBondContact OH-ND2 2.81Å; S274-N276 PolarHBondContact OG-N 3.29Å; S274-N276 VanDerWaalsContact OG-N 3.16Å; N276-N278 PolarHBondContact O-N 3.46Å; N276-N278 WeakPolarHBondContact OD1-CB 3.41Å; N276-N278 PolarHBondContact OD1-N 3.05Å; N276-N278 PolarHBondContact OD1-ND2 3.03Å; N276-L279 PolarHBondContact O-N 3.33Å; N276-R284 PolarHBondContact O-NH2 2.85Å
277E69.1Low79.9Confident184 Ų18425.8 Ų25.886%0.8614%0.135SC*.THydrogen-bonded Turntrans-63.1-20.1177.1-61.1-173.9166.300114T275 L279T275-E277 PolarHBondContact O-N 2.88Å; E277-L279 VanDerWaalsContact C-N 3.33Å
278N67.9Low80Confident85 Ų8525.5 Ų25.546%0.45513%0.133SC..THydrogen-bonded Turntrans-81.2-14.1-178.6-56.6-70.6000113.5F183 N276F183-N278 HydrophobicContact CB-CB 3.79Å; F183-N278 WeakPolarHBondContact CD1-O 3.3Å; F183-N278 WeakPolarHBondContact O-CB 3.48Å; N276-N278 PolarHBondContact O-N 3.46Å; N276-N278 WeakPolarHBondContact OD1-CB 3.41Å; N276-N278 PolarHBondContact OD1-N 3.05Å; N276-N278 PolarHBondContact OD1-ND2 3.03Å
279L75.5Confident79.9Confident3 Ų327 Ų272%0.01614%0.139CC..SBendtrans-84.8120.5178-176.667.3000109.6F183 Y251 F272 N276 E277 C283 R284 L323F183-L279 HydrophobicContact CD2-CD1 3.83Å; F183-L279 HydrophobicContact CE2-CD1 3.34Å; F183-L279 HydrophobicContact CZ-CD1 3.81Å; Y251-L279 HydrophobicContact CE1-CD2 4.27Å; F272-L279 HydrophobicContact CE1-CD2 3.85Å; N276-L279 PolarHBondContact O-N 3.33Å; E277-L279 VanDerWaalsContact C-N 3.33Å; L279-C283 HydrophobicContact CD1-CB 3.99Å; L279-C283 HydrophobicContact CG-CB 4.44Å; L279-R284 HydrophobicContact CD2-CG 3.64Å; L279-R284 HydrophobicContact CG-CG 4.09Å; L279-R284 PolarHBondContact O-NH2 3.09Å; L279-R284 VanDerWaalsContact O-NH2 3.09Å; L279-L323 HydrophobicContact CD1-CD2 3.95Å
280P76.1Confident79.8Confident50 Ų5028 Ų2833%0.32514%0.144SC..  trans-58.7144.4178.4-23.433.6000112.4F183 A282 C283F183-P280 HydrophobicContact CE1-CG 4.24Å; P280-A282 VanDerWaalsContact C-N 3.27Å; P280-A282 PolarHBondContact O-N 3.39Å; P280-C283 WeakPolarHBondContact O-CB 3.46Å; P280-C283 PolarHBondContact O-N 3.49Å; P280-C283 VanDerWaalsContact O-N 3.12Å
281L76Confident79.8Confident64 Ų6428 Ų2834%0.33514%0.144SC..Hα-helixtrans-56.8-41.3178.9-61.2-176.9000112.1S88 G91 C283 R284 L285S88-L281 WeakPolarHBondContact O-CD2 3.42Å; G91-L281 WeakPolarHBondContact CA-O 3.36Å; L281-C283 VanDerWaalsContact C-N 3.3Å; L281-C283 PolarHBondContact O-N 3.01Å; L281-R284 WeakPolarHBondContact O-CB 3.43Å; L281-R284 PolarHBondContact O-N 2.95Å; L281-R284 VanDerWaalsContact O-N 3.16Å; L281-L285 PolarHBondContact O-N 3.28Å
282A75.5Confident79.8Confident5 Ų528.2 Ų28.24%0.04114%0.144CC..Hα-helixtrans-60.2-38.1178.300000112.8P280 R284 L285 H286 T326 H328 S331P280-A282 VanDerWaalsContact C-N 3.27Å; P280-A282 PolarHBondContact O-N 3.39Å; A282-R284 VanDerWaalsContact C-N 3.29Å; A282-R284 PolarHBondContact O-N 2.92Å; A282-L285 PolarHBondContact O-N 3.2Å; A282-H286 PolarHBondContact O-CD2 3.28Å; A282-H286 PolarHBondContact O-N 3.2Å; A282-T326 WeakPolarHBondContact CB-O 3.16Å; A282-H328 HydrophobicContact CB-CB 3.7Å; A282-S331 VanDerWaalsContact CA-OG 3.25Å; A282-S331 WeakPolarHBondContact CA-OG 3.42Å; A282-S331 PolarHBondContact N-OG 2.99Å
283C74.7Confident79.8Confident0 Ų030.2 Ų30.20%016%0.155CC..Hα-helixtrans-65.7-33.1179.3-62.60000112L279 P280 L281 H286 I287 L323L279-C283 HydrophobicContact CD1-CB 3.99Å; L279-C283 HydrophobicContact CG-CB 4.44Å; P280-C283 WeakPolarHBondContact O-CB 3.46Å; P280-C283 PolarHBondContact O-N 3.49Å; P280-C283 VanDerWaalsContact O-N 3.12Å; L281-C283 VanDerWaalsContact C-N 3.3Å; L281-C283 PolarHBondContact O-N 3.01Å; C283-H286 PolarHBondContact O-N 3.42Å; C283-I287 WeakPolarHBondContact O-CD1 3.35Å; C283-I287 WeakPolarHBondContact O-CG1 3.39Å; C283-I287 PolarHBondContact O-N 3.39Å; C283-L323 HydrophobicContact CB-CD2 3.85Å
284R82.6Confident80Confident13 Ų1332 Ų325%0.04916%0.163CC..Hα-helixtrans-68.1-39.4178.7-57.7178.9-168.3160.11.2111.6R89 Y90 F272 N276 L279 L281 A282 S288R89-R284 WeakPolarHBondContact O-CD 3.31Å; R89-R284 PolarHBondContact O-NH1 3.29Å; Y90-R284 WeakPolarHBondContact O-CB 3.4Å; F272-R284 HydrophobicContact CD1-CB 4.28Å; F272-R284 HydrophobicContact CD1-CG 4.32Å; N276-R284 PolarHBondContact O-NH2 2.85Å; L279-R284 HydrophobicContact CD2-CG 3.64Å; L279-R284 HydrophobicContact CG-CG 4.09Å; L279-R284 PolarHBondContact O-NH2 3.09Å; L279-R284 VanDerWaalsContact O-NH2 3.09Å; L281-R284 WeakPolarHBondContact O-CB 3.43Å; L281-R284 PolarHBondContact O-N 2.95Å; L281-R284 VanDerWaalsContact O-N 3.16Å; A282-R284 VanDerWaalsContact C-N 3.29Å; A282-R284 PolarHBondContact O-N 2.92Å; R284-S288 PolarHBondContact O-N 2.96Å; R284-S288 PolarHBondContact O-OG 2.95Å
285L81.4Confident80.3Confident3 Ų332 Ų322%0.01616%0.163CC..Hα-helixtrans-70.3-43.1175.3-65.4-177.9000111.6Y90 G91 F92 L281 A282 I287 S288 E289 H328 S331Y90-L285 WeakPolarHBondContact O-CD2 3.34Å; G91-L285 VanDerWaalsContact O-CD1 3.3Å; G91-L285 WeakPolarHBondContact O-CD1 3.18Å; F92-L285 HydrophobicContact CD1-CD1 4.15Å; F92-L285 HydrophobicContact CD1-CD2 4.09Å; F92-L285 HydrophobicContact CD2-CD2 4.25Å; F92-L285 HydrophobicContact CE1-CD1 4.3Å; F92-L285 HydrophobicContact CE1-CD2 3.73Å; F92-L285 HydrophobicContact CE2-CD2 3.9Å; F92-L285 HydrophobicContact CG-CD2 4.34Å; F92-L285 HydrophobicContact CZ-CD2 3.62Å; L281-L285 PolarHBondContact O-N 3.28Å; A282-L285 PolarHBondContact O-N 3.2Å; L285-I287 VanDerWaalsContact C-N 3.28Å; L285-I287 PolarHBondContact O-N 2.73Å; L285-S288 CarbonylContact O-C 3.56Å; L285-S288 WeakPolarHBondContact O-CA 3.15Å; L285-S288 WeakPolarHBondContact O-CB 3.24Å; L285-S288 PolarHBondContact O-N 3.34Å; L285-E289 WeakPolarHBondContact O-CG 3.38Å; L285-E289 PolarHBondContact O-N 3.21Å; L285-H328 VanDerWaalsContact CD1-CE1 3.48Å; L285-H328 WeakPolarHBondContact CD1-CE1 3.43Å; L285-H328 WeakPolarHBondContact CD1-ND1 3.31Å; L285-S331 WeakPolarHBondContact CD1-OG 3.5Å
286H80.2Confident80.8Confident27 Ų2730 Ų3013%0.12515%0.15CC..Hα-helixtrans-58.2-39.7174.1-76.8-55.8000112.8A282 C283 E289 F290 N325 H327 H328A282-H286 PolarHBondContact O-CD2 3.28Å; A282-H286 PolarHBondContact O-N 3.2Å; C283-H286 PolarHBondContact O-N 3.42Å; H286-E289 IonicContact ND1-OE2 2.71Å; H286-F290 VanDerWaalsContact O-CB 3.31Å; H286-F290 WeakPolarHBondContact O-CB 3.42Å; H286-F290 PolarHBondContact O-N 3.33Å; H286-N325 PolarHBondContact CD2-O 2.95Å; H286-H327 PolarHBondContact NE2-O 2.76Å; H286-H328 AromaticContact CE1-CD2 3.71Å; H286-H328 AromaticContact ND1-CD2 3.98Å
287I83.9Confident81.4Confident1 Ų131.9 Ų31.91%0.00516%0.162CC..Hα-helixtrans-63.8-45.6173.4-68.2163.9000109.9F272 C283 L285 E289 F290 L291 L313 I319 L323F272-I287 HydrophobicContact CB-CB 4.42Å; F272-I287 HydrophobicContact CB-CG2 3.96Å; F272-I287 HydrophobicContact CD1-CD1 4.23Å; F272-I287 HydrophobicContact CD1-CG2 4.37Å; F272-I287 HydrophobicContact CD2-CG2 3.89Å; F272-I287 HydrophobicContact CE1-CD1 4.11Å; F272-I287 HydrophobicContact CE2-CG2 4.47Å; F272-I287 HydrophobicContact CG-CB 4.39Å; F272-I287 HydrophobicContact CG-CG2 3.81Å; F272-I287 HydrophobicContact CZ-CD1 4.47Å; C283-I287 WeakPolarHBondContact O-CD1 3.35Å; C283-I287 WeakPolarHBondContact O-CG1 3.39Å; C283-I287 PolarHBondContact O-N 3.39Å; L285-I287 VanDerWaalsContact C-N 3.28Å; L285-I287 PolarHBondContact O-N 2.73Å; I287-E289 PolarHBondContact O-N 3.09Å; I287-F290 PolarHBondContact O-N 3.41Å; I287-L291 HydrophobicContact CG2-CD1 3.95Å; I287-L291 HydrophobicContact CG2-CG 4.36Å; I287-L291 VanDerWaalsContact O-CG 3.22Å; I287-L291 WeakPolarHBondContact O-CG 3.24Å; I287-L291 PolarHBondContact O-N 3.17Å; I287-L313 HydrophobicContact CG2-CD2 3.78Å; I287-I319 HydrophobicContact CD1-CG2 4.22Å; I287-I319 HydrophobicContact CG1-CG2 4.31Å; I287-L323 HydrophobicContact CD1-CD2 4.41Å
288S86.9Confident82.2Confident1 Ų125.3 Ų25.31%0.00713%0.131CC..Hα-helixtrans-63.4-41.4179.5-54.10000112.4F272 R284 L285 L291 Y292F272-S288 WeakPolarHBondContact CB-OG 3.46Å; F272-S288 PolarHBondContact N-OG 3.37Å; R284-S288 PolarHBondContact O-N 2.96Å; R284-S288 PolarHBondContact O-OG 2.95Å; L285-S288 CarbonylContact O-C 3.56Å; L285-S288 WeakPolarHBondContact O-CA 3.15Å; L285-S288 WeakPolarHBondContact O-CB 3.24Å; L285-S288 PolarHBondContact O-N 3.34Å; S288-L291 PolarHBondContact O-N 2.76Å; S288-Y292 WeakPolarHBondContact O-CB 3.46Å; S288-Y292 PolarHBondContact O-N 3.49Å
289E85.4Confident83Confident30 Ų3021.9 Ų21.914%0.1411%0.114CC..Hα-helixtrans-63.4-43.5174.9-72.2-171.8152.700112.2C119 F120 T123 F124 L285 H286 I287 Y292 D293 H328C119-E289 PolarHBondContact SG-OE1 3.25Å; F120-E289 HydrophobicContact CD1-CG 4.37Å; F120-E289 HydrophobicContact CE1-CG 4.13Å; T123-E289 WeakPolarHBondContact CG2-OE1 2.97Å; F124-E289 HydrophobicContact CE2-CB 4.47Å; L285-E289 WeakPolarHBondContact O-CG 3.38Å; L285-E289 PolarHBondContact O-N 3.21Å; H286-E289 IonicContact ND1-OE2 2.71Å; I287-E289 PolarHBondContact O-N 3.09Å; E289-Y292 PolarHBondContact O-N 2.91Å; E289-D293 PolarHBondContact O-N 3.45Å; E289-H328 VanDerWaalsContact CD-NE2 3.33Å; E289-H328 IonicContact OE1-CE1 3.49Å; E289-H328 IonicContact OE1-NE2 2.91Å; E289-H328 PolarHBondContact OE1-NE2 3.46Å; E289-H328 IonicContact OE2-CD2 3.28Å; E289-H328 IonicContact OE2-NE2 3.65Å
290F85.1Confident83.5Confident32 Ų3228.9 Ų28.914%0.1415%0.147CC..Hα-helixtrans-62.5-44.2176.9170.1-98.1000111.9H286 I287 Y292 D293 K294 E318 L322H286-F290 VanDerWaalsContact O-CB 3.31Å; H286-F290 WeakPolarHBondContact O-CB 3.42Å; H286-F290 PolarHBondContact O-N 3.33Å; I287-F290 PolarHBondContact O-N 3.41Å; F290-Y292 VanDerWaalsContact C-N 3.31Å; F290-Y292 PolarHBondContact O-N 3.02Å; F290-D293 PolarHBondContact O-N 3.29Å; F290-K294 HydrophobicContact CE1-CG 4.26Å; F290-K294 VanDerWaalsContact CE2-CE 3.47Å; F290-K294 HydrophobicContact CE2-CG 4.24Å; F290-K294 HydrophobicContact CZ-CD 4.37Å; F290-K294 VanDerWaalsContact CZ-CE 3.45Å; F290-K294 HydrophobicContact CZ-CG 3.96Å; F290-K294 WeakPolarHBondContact O-CG 3.49Å; F290-K294 PolarHBondContact O-N 3.4Å; F290-K294 VanDerWaalsContact O-N 3.14Å; F290-E318 HydrophobicContact CZ-CB 4.28Å; F290-E318 WeakPolarHBondContact CZ-OE2 3.3Å; F290-L322 HydrophobicContact CB-CD1 3.46Å; F290-L322 VanDerWaalsContact CB-CD1 3.46Å; F290-L322 HydrophobicContact CD1-CD1 3.98Å; F290-L322 HydrophobicContact CD2-CD1 3.93Å; F290-L322 HydrophobicContact CG-CD1 3.5Å; F290-L322 VanDerWaalsContact CG-CD1 3.5Å
291L87.3Confident83.9Confident0 Ų029.9 Ų29.90%015%0.152CC..Hα-helixtrans-64.6-39177-65.9169.8000111.7L253 V270 I287 S288 K294 A295 L309 L313L253-L291 HydrophobicContact CD1-CD1 3.67Å; V270-L291 HydrophobicContact CB-CB 4.37Å; V270-L291 HydrophobicContact CG1-CB 3.79Å; V270-L291 HydrophobicContact CG1-CD1 3.8Å; V270-L291 HydrophobicContact CG1-CG 4.46Å; I287-L291 HydrophobicContact CG2-CD1 3.95Å; I287-L291 HydrophobicContact CG2-CG 4.36Å; I287-L291 VanDerWaalsContact O-CG 3.22Å; I287-L291 WeakPolarHBondContact O-CG 3.24Å; I287-L291 PolarHBondContact O-N 3.17Å; S288-L291 PolarHBondContact O-N 2.76Å; L291-K294 PolarHBondContact O-N 2.99Å; L291-A295 WeakPolarHBondContact O-CB 3.43Å; L291-A295 PolarHBondContact O-N 3.03Å; L291-L309 HydrophobicContact CB-CD2 4.23Å; L291-L309 HydrophobicContact CD2-CB 4.36Å; L291-L309 HydrophobicContact CD2-CD2 4Å; L291-L309 WeakPolarHBondContact O-CD2 3.48Å; L291-L313 HydrophobicContact CD1-CD1 3.84Å; L291-L313 HydrophobicContact CD1-CD2 4.02Å; L291-L313 HydrophobicContact CD1-CG 4.23Å; L291-L313 HydrophobicContact CD2-CD1 4.01Å; L291-L313 HydrophobicContact CD2-CD2 3.82Å; L291-L313 HydrophobicContact CD2-CG 3.67Å; L291-L313 HydrophobicContact CG-CD2 4.27Å; L291-L313 HydrophobicContact CG-CG 4.49Å
292Y88.3Confident84.2Confident5 Ų529.6 Ų29.62%0.0216%0.156CC..Hα-helixtrans-66.8-39.9177.1-171.4-103.5000112.2F120 F124 M128 A267 P268 L269 S288 E289 F290 K294 A295 L296F120-Y292 HydrophobicContact CB-CD1 3.89Å; F120-Y292 HydrophobicContact CB-CE1 3.68Å; F120-Y292 AromaticContact CD1-CD1 3.94Å; F120-Y292 HydrophobicContact CD1-CD1 3.94Å; F120-Y292 HydrophobicContact CD1-CG 4.09Å; F120-Y292 AromaticContact CD2-CD1 3.93Å; F120-Y292 HydrophobicContact CD2-CD1 3.93Å; F120-Y292 AromaticContact CD2-CD2 3.82Å; F120-Y292 HydrophobicContact CD2-CD2 3.82Å; F120-Y292 HydrophobicContact CD2-CE1 4.06Å; F120-Y292 AromaticContact CD2-CE2 3.97Å; F120-Y292 HydrophobicContact CD2-CE2 3.97Å; F120-Y292 AromaticContact CD2-CG 3.8Å; F120-Y292 HydrophobicContact CD2-CG 3.8Å; F120-Y292 HydrophobicContact CE1-CD1 4.46Å; F120-Y292 HydrophobicContact CE1-CG 4.18Å; F120-Y292 HydrophobicContact CE2-CD1 4.45Å; F120-Y292 AromaticContact CE2-CD2 3.81Å; F120-Y292 HydrophobicContact CE2-CD2 3.81Å; F120-Y292 HydrophobicContact CE2-CE2 4.32Å; F120-Y292 AromaticContact CE2-CG 3.88Å; F120-Y292 HydrophobicContact CE2-CG 3.88Å; F120-Y292 AromaticContact CG-CD1 3.65Å; F120-Y292 HydrophobicContact CG-CD1 3.65Å; F120-Y292 HydrophobicContact CG-CD2 4.39Å; F120-Y292 AromaticContact CG-CE1 3.88Å; F120-Y292 HydrophobicContact CG-CE1 3.88Å; F120-Y292 AromaticContact CG-CG 3.91Å; F120-Y292 HydrophobicContact CG-CG 3.91Å; F120-Y292 HydrophobicContact CZ-CD2 4.37Å; F120-Y292 HydrophobicContact CZ-CG 4.07Å; F124-Y292 AromaticContact CD2-CD1 3.75Å; F124-Y292 HydrophobicContact CD2-CD1 3.75Å; F124-Y292 HydrophobicContact CD2-CE1 4.16Å; F124-Y292 HydrophobicContact CE2-CD1 4.14Å; M128-Y292 WeakPolarHBondContact CG-OH 3.42Å; A267-Y292 HydrophobicContact CB-CE2 4.27Å; P268-Y292 WeakPolarHBondContact O-CD2 3.43Å; P268-Y292 WeakPolarHBondContact O-CE2 3.29Å; L269-Y292 HydrophobicContact CD2-CE2 4.33Å; S288-Y292 WeakPolarHBondContact O-CB 3.46Å; S288-Y292 PolarHBondContact O-N 3.49Å; E289-Y292 PolarHBondContact O-N 2.91Å; F290-Y292 VanDerWaalsContact C-N 3.31Å; F290-Y292 PolarHBondContact O-N 3.02Å; Y292-K294 VanDerWaalsContact C-N 3.31Å; Y292-K294 PolarHBondContact O-N 3.38Å; Y292-A295 WeakPolarHBondContact O-CB 3.47Å; Y292-A295 PolarHBondContact O-N 3.01Å; Y292-L296 HydrophobicContact CD1-CD1 4.03Å; Y292-L296 HydrophobicContact CD1-CG 4.34Å; Y292-L296 HydrophobicContact CE1-CD1 3.76Å; Y292-L296 HydrophobicContact CE1-CD2 4.27Å; Y292-L296 HydrophobicContact CE1-CG 4.02Å; Y292-L296 WeakPolarHBondContact O-CG 3.37Å; Y292-L296 PolarHBondContact O-N 3.13Å
293D86.1Confident84.6Confident42 Ų4234.3 Ų34.323%0.22518%0.177CC..Hα-helixtrans-58.1-43.4173.4-177.260.8000111.8F124 R127 E289 F290 L296 T297F124-D293 HydrophobicContact CE1-CB 4.14Å; F124-D293 HydrophobicContact CZ-CB 3.86Å; R127-D293 IonicContact CZ-OD1 3.68Å; R127-D293 IonicContact NH1-OD1 2.71Å; R127-D293 PolarHBondContact NH1-OD1 3.49Å; R127-D293 IonicContact NH2-OD1 2.74Å; R127-D293 PolarHBondContact NH2-OD1 3.12Å; E289-D293 PolarHBondContact O-N 3.45Å; F290-D293 PolarHBondContact O-N 3.29Å; D293-L296 WeakPolarHBondContact O-CB 3.34Å; D293-L296 PolarHBondContact O-N 3.06Å; D293-T297 PolarHBondContact O-N 3.04Å
294K87.8Confident85.2Confident57 Ų5737.9 Ų37.925%0.24820%0.2CC..Hα-helixtrans-66.3-42.2175.1-64.3-66.5-173.6178.50111.8F290 L291 Y292 L296 T297 F298 L309 L312F290-K294 HydrophobicContact CE1-CG 4.26Å; F290-K294 VanDerWaalsContact CE2-CE 3.47Å; F290-K294 HydrophobicContact CE2-CG 4.24Å; F290-K294 HydrophobicContact CZ-CD 4.37Å; F290-K294 VanDerWaalsContact CZ-CE 3.45Å; F290-K294 HydrophobicContact CZ-CG 3.96Å; F290-K294 WeakPolarHBondContact O-CG 3.49Å; F290-K294 PolarHBondContact O-N 3.4Å; F290-K294 VanDerWaalsContact O-N 3.14Å; L291-K294 PolarHBondContact O-N 2.99Å; Y292-K294 VanDerWaalsContact C-N 3.31Å; Y292-K294 PolarHBondContact O-N 3.38Å; K294-L296 VanDerWaalsContact C-N 3.26Å; K294-L296 PolarHBondContact O-N 2.86Å; K294-T297 PolarHBondContact O-N 2.75Å; K294-T297 VanDerWaalsContact O-N 3.07Å; K294-T297 PolarHBondContact O-OG1 3Å; K294-F298 HydrophobicContact CB-CD2 4.49Å; K294-F298 HydrophobicContact CB-CE2 4.16Å; K294-F298 WeakPolarHBondContact O-CD2 3.26Å; K294-F298 PolarHBondContact O-N 2.82Å; K294-L309 HydrophobicContact CB-CD2 3.91Å; K294-L312 HydrophobicContact CB-CD1 4.05Å; K294-L312 HydrophobicContact CD-CD1 4.27Å; K294-L312 HydrophobicContact CG-CD1 3.91Å
295A88.2Confident85.3Confident0 Ų037.3 Ų37.30%020%0.198CC..Hα-helixtrans-58.9-37.2175.700000112.2A267 L291 Y292 F298 A299 L309A267-A295 HydrophobicContact CB-CB 4.05Å; L291-A295 WeakPolarHBondContact O-CB 3.43Å; L291-A295 PolarHBondContact O-N 3.03Å; Y292-A295 WeakPolarHBondContact O-CB 3.47Å; Y292-A295 PolarHBondContact O-N 3.01Å; A295-F298 PolarHBondContact O-N 3.23Å; A295-A299 WeakPolarHBondContact O-CB 3.36Å; A295-A299 PolarHBondContact O-N 3.35Å; A295-L309 HydrophobicContact CB-CD1 4.32Å
296L86.1Confident85.6Confident13 Ų1337.1 Ų37.17%0.06820%0.197CC..Hα-helixtrans-61.9-44.7172.9-71.6169.7000111.7F124 R127 A267 Y292 D293 K294 F298 A299 E300F124-L296 HydrophobicContact CB-CD1 4.06Å; F124-L296 HydrophobicContact CG-CD1 4.17Å; R127-L296 HydrophobicContact CB-CD1 4.08Å; A267-L296 HydrophobicContact CB-CD2 3.71Å; A267-L296 HydrophobicContact CB-CG 4.11Å; Y292-L296 HydrophobicContact CD1-CD1 4.03Å; Y292-L296 HydrophobicContact CD1-CG 4.34Å; Y292-L296 HydrophobicContact CE1-CD1 3.76Å; Y292-L296 HydrophobicContact CE1-CD2 4.27Å; Y292-L296 HydrophobicContact CE1-CG 4.02Å; Y292-L296 WeakPolarHBondContact O-CG 3.37Å; Y292-L296 PolarHBondContact O-N 3.13Å; D293-L296 WeakPolarHBondContact O-CB 3.34Å; D293-L296 PolarHBondContact O-N 3.06Å; K294-L296 VanDerWaalsContact C-N 3.26Å; K294-L296 PolarHBondContact O-N 2.86Å; L296-F298 VanDerWaalsContact C-N 3.31Å; L296-F298 PolarHBondContact O-N 3.21Å; L296-A299 PolarHBondContact O-N 3.1Å; L296-E300 PolarHBondContact O-N 3Å
297T86.2Confident86Confident55 Ų5541 Ų4134%0.33721%0.211SC..Hα-helixtrans-64.3-34.6178.460.20000113.1D293 K294D293-T297 PolarHBondContact O-N 3.04Å; K294-T297 PolarHBondContact O-N 2.75Å; K294-T297 VanDerWaalsContact O-N 3.07Å; K294-T297 PolarHBondContact O-OG1 3Å
298F85.1Confident86.2Confident45 Ų4543 Ų4320%0.19723%0.225CC..Hα-helixtrans-77.4-27.5175.7-65.1-62.8000112.9K294 A295 L296 E300 T301 S302 E303 V305 L312K294-F298 HydrophobicContact CB-CD2 4.49Å; K294-F298 HydrophobicContact CB-CE2 4.16Å; K294-F298 WeakPolarHBondContact O-CD2 3.26Å; K294-F298 PolarHBondContact O-N 2.82Å; A295-F298 PolarHBondContact O-N 3.23Å; L296-F298 VanDerWaalsContact C-N 3.31Å; L296-F298 PolarHBondContact O-N 3.21Å; F298-E300 VanDerWaalsContact C-N 3.27Å; F298-E300 PolarHBondContact O-N 3Å; F298-T301 PolarHBondContact O-N 3.22Å; F298-T301 PolarHBondContact O-OG1 2.66Å; F298-S302 PolarHBondContact O-N 2.82Å; F298-S302 VanDerWaalsContact O-N 3.16Å; F298-E303 PolarHBondContact O-N 2.74Å; F298-V305 HydrophobicContact CB-CB 4.12Å; F298-V305 HydrophobicContact CB-CG1 3.44Å; F298-V305 VanDerWaalsContact CB-CG1 3.44Å; F298-V305 HydrophobicContact CD2-CB 4.38Å; F298-V305 HydrophobicContact CG-CG1 4.35Å; F298-L312 HydrophobicContact CE2-CD1 4.21Å
299A85.4Confident86.2Confident13 Ų1342.9 Ų42.911%0.10723%0.225CC..Hα-helixtrans-65.5-32.4173.200000111.9A267 A295 L296 T301 S302A267-A299 HydrophobicContact CB-CB 4.12Å; A295-A299 WeakPolarHBondContact O-CB 3.36Å; A295-A299 PolarHBondContact O-N 3.35Å; L296-A299 PolarHBondContact O-N 3.1Å; A299-T301 VanDerWaalsContact C-N 3.27Å; A299-T301 PolarHBondContact O-N 3.42Å; A299-S302 PolarHBondContact O-N 3.36Å; A299-S302 VanDerWaalsContact O-N 3.16Å
300E85.6Confident86.3Confident151 Ų15141.8 Ų41.871%0.70622%0.219SC*.Hα-helixtrans-63.7-31.7173.1-67.6176-172.800112.5L296 F298 S302L296-E300 PolarHBondContact O-N 3Å; F298-E300 VanDerWaalsContact C-N 3.27Å; F298-E300 PolarHBondContact O-N 3Å; E300-S302 VanDerWaalsContact C-N 3.35Å
301T84Confident86.4Confident70 Ų7043.2 Ų43.243%0.42923%0.231SC..Hα-helixtrans-87.4-4.5176.361.30000113.1F298 A299 E303F298-T301 PolarHBondContact O-N 3.22Å; F298-T301 PolarHBondContact O-OG1 2.66Å; A299-T301 VanDerWaalsContact C-N 3.27Å; A299-T301 PolarHBondContact O-N 3.42Å; T301-E303 PolarHBondContact O-N 2.93Å; T301-E303 PolarHBondContact OG1-OE2 3.08Å
302S82.5Confident86.3Confident58 Ų5844.5 Ų44.541%0.40624%0.238SC..THydrogen-bonded Turntrans54.930.9-174.460.60000114Y265 F298 A299 E300Y265-S302 VanDerWaalsContact CE1-CB 3.49Å; F298-S302 PolarHBondContact O-N 2.82Å; F298-S302 VanDerWaalsContact O-N 3.16Å; A299-S302 PolarHBondContact O-N 3.36Å; A299-S302 VanDerWaalsContact O-N 3.16Å; E300-S302 VanDerWaalsContact C-N 3.35Å
303E84.8Confident85.9Confident105 Ų10544.3 Ų44.349%0.49124%0.237SC..  trans-97.6152.6-179.2-71.3177.2156.500112F298 T301 V305F298-E303 PolarHBondContact O-N 2.74Å; T301-E303 PolarHBondContact O-N 2.93Å; T301-E303 PolarHBondContact OG1-OE2 3.08Å; E303-V305 VanDerWaalsContact O-CG1 3.29Å; E303-V305 WeakPolarHBondContact O-CG1 3.42Å; E303-V305 PolarHBondContact O-N 2.99Å
304P85.9Confident85.7Confident74 Ų7448.3 Ų48.348%0.48125%0.254SS..  trans-61.4126.7171.324.4-32.5000111E149 Y263E149-P304 HydrophobicContact CB-CB 4.44Å; E149-P304 HydrophobicContact CG-CB 3.93Å; E149-P304 VanDerWaalsContact OE1-CB 3.28Å; E149-P304 WeakPolarHBondContact OE1-CB 3.35Å; Y263-P304 WeakPolarHBondContact OH-CA 3.39Å
305V86.1Confident85.4Confident1 Ų150.2 Ų50.21%0.00626%0.264CS..  trans-98.3-24.2-167.4-44.70000113E149 Y263 P268 F298 E303 S308 L309E149-V305 PolarHBondContact OE1-N 2.88Å; Y263-V305 HydrophobicContact CE2-CG1 4.15Å; Y263-V305 HydrophobicContact CE2-CG2 3.76Å; Y263-V305 PolarHBondContact OH-N 3.49Å; P268-V305 HydrophobicContact CG-CG2 4.01Å; F298-V305 HydrophobicContact CB-CB 4.12Å; F298-V305 HydrophobicContact CB-CG1 3.44Å; F298-V305 VanDerWaalsContact CB-CG1 3.44Å; F298-V305 HydrophobicContact CD2-CB 4.38Å; F298-V305 HydrophobicContact CG-CG1 4.35Å; E303-V305 VanDerWaalsContact O-CG1 3.29Å; E303-V305 WeakPolarHBondContact O-CG1 3.42Å; E303-V305 PolarHBondContact O-N 2.99Å; V305-S308 PolarHBondContact O-N 3.35Å; V305-L309 HydrophobicContact CB-CD1 4.48Å; V305-L309 HydrophobicContact CG2-CD1 3.96Å; V305-L309 VanDerWaalsContact O-CG 3.26Å; V305-L309 WeakPolarHBondContact O-CG 3.43Å; V305-L309 PolarHBondContact O-N 3.3Å
306V87.6Confident84.7Confident0 Ų054 Ų540%028%0.282CS..Hα-helixtrans-69.3-46.4-161.21780000112.2E149 L153 W170 I172 I255 S308 L309 I310E149-V306 VanDerWaalsContact OE1-CB 3.28Å; E149-V306 WeakPolarHBondContact OE1-CB 3.46Å; E149-V306 WeakPolarHBondContact OE1-CG2 3.12Å; E149-V306 PolarHBondContact OE1-N 3.29Å; L153-V306 HydrophobicContact CD1-CB 3.76Å; L153-V306 HydrophobicContact CD1-CG1 3.47Å; L153-V306 VanDerWaalsContact CD1-CG1 3.47Å; L153-V306 HydrophobicContact CD1-CG2 4.38Å; L153-V306 HydrophobicContact CD2-CB 4.39Å; L153-V306 HydrophobicContact CD2-CG1 4.02Å; L153-V306 HydrophobicContact CG-CG1 4.4Å; W170-V306 HydrophobicContact CE3-CG2 4.02Å; W170-V306 HydrophobicContact CZ3-CG2 3.81Å; I172-V306 HydrophobicContact CD1-CG1 3.88Å; I255-V306 HydrophobicContact CD1-CB 3.92Å; I255-V306 HydrophobicContact CD1-CG1 3.43Å; I255-V306 VanDerWaalsContact CD1-CG1 3.43Å; I255-V306 HydrophobicContact CD1-CG2 3.47Å; I255-V306 VanDerWaalsContact CD1-CG2 3.47Å; V306-S308 VanDerWaalsContact C-N 3.32Å; V306-S308 PolarHBondContact O-N 3.03Å; V306-L309 PolarHBondContact O-N 3.39Å; V306-I310 HydrophobicContact CG1-CD1 4.13Å; V306-I310 WeakPolarHBondContact O-CG1 3.48Å; V306-I310 PolarHBondContact O-N 2.84Å
307Y87.8Confident84Confident109 Ų10956.2 Ų56.243%0.42730%0.299SS..Hα-helixtrans-65.7-37.1178.5-175.8-103.9000112.4L153 I156 I310 T311L153-Y307 HydrophobicContact CD2-CD2 4.4Å; I156-Y307 HydrophobicContact CB-CE2 4.5Å; I156-Y307 HydrophobicContact CD1-CD2 4.19Å; I156-Y307 HydrophobicContact CD1-CE2 4.32Å; I156-Y307 HydrophobicContact CG2-CD2 4.04Å; I156-Y307 HydrophobicContact CG2-CE2 3.44Å; I156-Y307 VanDerWaalsContact CG2-CE2 3.44Å; Y307-I310 PolarHBondContact O-N 3.32Å; Y307-T311 PolarHBondContact O-N 2.98Å; Y307-T311 PolarHBondContact O-OG1 2.95Å
308S87.6Confident83.5Confident41 Ų4156.3 Ų56.329%0.28730%0.295SS..Hα-helixtrans-62.9-43175-58.70000111.2V305 V306 I310 T311 L312V305-S308 PolarHBondContact O-N 3.35Å; V306-S308 VanDerWaalsContact C-N 3.32Å; V306-S308 PolarHBondContact O-N 3.03Å; S308-I310 PolarHBondContact O-N 2.91Å; S308-T311 PolarHBondContact O-N 2.84Å; S308-L312 VanDerWaalsContact O-CG 3.31Å; S308-L312 WeakPolarHBondContact O-CG 3.31Å; S308-L312 PolarHBondContact O-N 3.18Å
309L87.6Confident83.1Confident0 Ų054.2 Ų54.20%029%0.286CS..Hα-helixtrans-62.9-39.3174.6-67.8175.5000112.4V270 L291 K294 A295 V305 V306 L312 L313V270-L309 HydrophobicContact CG2-CD1 3.97Å; L291-L309 HydrophobicContact CB-CD2 4.23Å; L291-L309 HydrophobicContact CD2-CB 4.36Å; L291-L309 HydrophobicContact CD2-CD2 4Å; L291-L309 WeakPolarHBondContact O-CD2 3.48Å; K294-L309 HydrophobicContact CB-CD2 3.91Å; A295-L309 HydrophobicContact CB-CD1 4.32Å; V305-L309 HydrophobicContact CB-CD1 4.48Å; V305-L309 HydrophobicContact CG2-CD1 3.96Å; V305-L309 VanDerWaalsContact O-CG 3.26Å; V305-L309 WeakPolarHBondContact O-CG 3.43Å; V305-L309 PolarHBondContact O-N 3.3Å; V306-L309 PolarHBondContact O-N 3.39Å; L309-L312 HydrophobicContact CD2-CD1 4.44Å; L309-L312 PolarHBondContact O-N 2.84Å; L309-L313 WeakPolarHBondContact O-CG 3.2Å; L309-L313 PolarHBondContact O-N 3.31Å
310I87.5Confident82.3Confident6 Ų655.2 Ų55.23%0.03129%0.291CS..Hα-helixtrans-61.6-47174.7-66.9162.7000110.2L153 I172 L174 L253 V306 Y307 S308 L312 L313 E314L153-I310 HydrophobicContact CD2-CD1 4.18Å; I172-I310 HydrophobicContact CB-CD1 4.4Å; I172-I310 HydrophobicContact CG1-CD1 4.16Å; I172-I310 HydrophobicContact CG2-CD1 3.85Å; I172-I310 HydrophobicContact CG2-CG1 4.33Å; L174-I310 HydrophobicContact CD2-CG2 3.99Å; L253-I310 HydrophobicContact CD2-CG1 4.21Å; V306-I310 HydrophobicContact CG1-CD1 4.13Å; V306-I310 WeakPolarHBondContact O-CG1 3.48Å; V306-I310 PolarHBondContact O-N 2.84Å; Y307-I310 PolarHBondContact O-N 3.32Å; S308-I310 PolarHBondContact O-N 2.91Å; I310-L312 VanDerWaalsContact C-N 3.31Å; I310-L312 PolarHBondContact O-N 3.22Å; I310-L313 WeakPolarHBondContact O-CA 3.22Å; I310-L313 WeakPolarHBondContact O-CB 3.46Å; I310-L313 PolarHBondContact O-N 3.09Å; I310-E314 PolarHBondContact O-N 3.35Å
311T86.4Confident81.7Confident63 Ų6354.6 Ų54.639%0.38729%0.286SS..Hα-helixtrans-61.5-40.6179.2-530000111.4Y307 S308 L313 E314 E315Y307-T311 PolarHBondContact O-N 2.98Å; Y307-T311 PolarHBondContact O-OG1 2.95Å; S308-T311 PolarHBondContact O-N 2.84Å; T311-L313 VanDerWaalsContact C-N 3.29Å; T311-L313 PolarHBondContact O-N 3.04Å; T311-E314 PolarHBondContact O-N 3.34Å; T311-E315 PolarHBondContact O-N 2.88Å
312L85.2Confident80.7Confident27 Ų2752.9 Ų52.914%0.14127%0.274CS..Hα-helixtrans-63.7-33.7174.3-71.4169.6000112.3K294 F298 S308 L309 I310 E314 E315K294-L312 HydrophobicContact CB-CD1 4.05Å; K294-L312 HydrophobicContact CD-CD1 4.27Å; K294-L312 HydrophobicContact CG-CD1 3.91Å; F298-L312 HydrophobicContact CE2-CD1 4.21Å; S308-L312 VanDerWaalsContact O-CG 3.31Å; S308-L312 WeakPolarHBondContact O-CG 3.31Å; S308-L312 PolarHBondContact O-N 3.18Å; L309-L312 HydrophobicContact CD2-CD1 4.44Å; L309-L312 PolarHBondContact O-N 2.84Å; I310-L312 VanDerWaalsContact C-N 3.31Å; I310-L312 PolarHBondContact O-N 3.22Å; L312-E314 VanDerWaalsContact C-N 3.34Å; L312-E315 PolarHBondContact O-N 3.42Å
313L81.5Confident79.9Confident1 Ų151.1 Ų51.11%0.00526%0.259CS..Hα-helixtrans-72.2-26.5175.2-75.8173000113.7L174 L176 Y178 L253 I287 L291 L309 I310 T311 E315 I319L174-L313 HydrophobicContact CD1-CB 4.24Å; L174-L313 HydrophobicContact CD1-CD1 3.45Å; L174-L313 VanDerWaalsContact CD1-CD1 3.45Å; L174-L313 HydrophobicContact CD1-CG 4.45Å; L176-L313 WeakPolarHBondContact CD2-O 3.32Å; Y178-L313 PolarHBondContact OH-O 2.76Å; L253-L313 HydrophobicContact CB-CD1 4.5Å; L253-L313 HydrophobicContact CD1-CD1 4.05Å; L253-L313 HydrophobicContact CD2-CD1 3.96Å; L253-L313 HydrophobicContact CG-CD1 4.41Å; I287-L313 HydrophobicContact CG2-CD2 3.78Å; L291-L313 HydrophobicContact CD1-CD1 3.84Å; L291-L313 HydrophobicContact CD1-CD2 4.02Å; L291-L313 HydrophobicContact CD1-CG 4.23Å; L291-L313 HydrophobicContact CD2-CD1 4.01Å; L291-L313 HydrophobicContact CD2-CD2 3.82Å; L291-L313 HydrophobicContact CD2-CG 3.67Å; L291-L313 HydrophobicContact CG-CD2 4.27Å; L291-L313 HydrophobicContact CG-CG 4.49Å; L309-L313 WeakPolarHBondContact O-CG 3.2Å; L309-L313 PolarHBondContact O-N 3.31Å; I310-L313 WeakPolarHBondContact O-CA 3.22Å; I310-L313 WeakPolarHBondContact O-CB 3.46Å; I310-L313 PolarHBondContact O-N 3.09Å; T311-L313 VanDerWaalsContact C-N 3.29Å; T311-L313 PolarHBondContact O-N 3.04Å; L313-E315 VanDerWaalsContact C-N 3.33Å; L313-I319 HydrophobicContact CB-CD1 4.49Å; L313-I319 HydrophobicContact CD2-CD1 4.05Å; L313-I319 WeakPolarHBondContact O-CD1 3.41Å
314E81.1Confident78.7Confident126 Ų12651 Ų5159%0.58927%0.266SS*.Hα-helixtrans-76.5-23.5173.2-67.8-177.7168.500112I310 T311 L312 E316I310-E314 PolarHBondContact O-N 3.35Å; T311-E314 PolarHBondContact O-N 3.34Å; L312-E314 VanDerWaalsContact C-N 3.34Å; E314-E316 PolarHBondContact O-N 2.84Å; E314-E316 VanDerWaalsContact O-N 3.17Å
315E80.8Confident77.5Confident97 Ų9751.4 Ų51.445%0.45326%0.264SS..  trans-76.299.8176.7-169.8168.7-159.500112.4T311 L312 L313 S317 I319T311-E315 PolarHBondContact O-N 2.88Å; L312-E315 PolarHBondContact O-N 3.42Å; L313-E315 VanDerWaalsContact C-N 3.33Å; E315-S317 PolarHBondContact O-N 3.12Å; E315-I319 WeakPolarHBondContact O-CD1 3.18Å
316E74.3Confident76.2Confident78 Ų7855.2 Ų55.236%0.36429%0.288SS..Hα-helixtrans-56.6-29.2-176.7-178.2179.217200113.5Y178 R182 E314 E318 V320Y178-E316 HydrophobicContact CD2-CB 4.44Å; Y178-E316 HydrophobicContact CD2-CG 3.95Å; Y178-E316 HydrophobicContact CG-CB 4.41Å; Y178-E316 HydrophobicContact CG-CG 4.16Å; R182-E316 IonicContact CZ-OE1 3.94Å; R182-E316 IonicContact NE-OE1 2.88Å; R182-E316 PolarHBondContact NE-OE1 2.82Å; R182-E316 IonicContact NH2-OE1 3.21Å; R182-E316 PolarHBondContact NH2-OE1 3.03Å; E314-E316 PolarHBondContact O-N 2.84Å; E314-E316 VanDerWaalsContact O-N 3.17Å; E316-E318 PolarHBondContact O-N 3.31Å; E316-V320 HydrophobicContact CG-CG2 3.44Å; E316-V320 VanDerWaalsContact CG-CG2 3.44Å; E316-V320 VanDerWaalsContact O-CB 3.29Å; E316-V320 WeakPolarHBondContact O-CB 3.49Å; E316-V320 WeakPolarHBondContact O-CG2 3.38Å; E316-V320 PolarHBondContact O-N 3Å
317S71.6Confident74.7Confident61 Ų6161.7 Ų61.743%0.42732%0.318SS..Hα-helixtrans-70.2-34.4-164.884.10000114.5E315 K321E315-S317 PolarHBondContact O-N 3.12Å; S317-K321 WeakPolarHBondContact O-CE 3.36Å; S317-K321 WeakPolarHBondContact O-CG 3.43Å
318E75.3Confident73.3Confident57 Ų5757.1 Ų57.127%0.26630%0.3SS..Hα-helixtrans-83.8-40.5-179.6-57.2-155.6145.900110.7F290 E316 K321 L322F290-E318 HydrophobicContact CZ-CB 4.28Å; F290-E318 WeakPolarHBondContact CZ-OE2 3.3Å; E316-E318 PolarHBondContact O-N 3.31Å; E318-K321 WeakPolarHBondContact O-CB 3.29Å; E318-K321 PolarHBondContact O-N 2.99Å; E318-L322 PolarHBondContact O-N 3.43Å
319I77.8Confident71.9Confident1 Ų162.9 Ų62.91%0.00532%0.32CS..Hα-helixtrans-68.3-41-178.3-60.3158.4000110.6Y178 L179 I287 L313 E315 K321 L322 L323Y178-I319 HydrophobicContact CE2-CB 4.48Å; Y178-I319 HydrophobicContact CE2-CG2 4.12Å; Y178-I319 WeakPolarHBondContact OH-CD1 3.41Å; L179-I319 HydrophobicContact CD2-CG2 4.23Å; I287-I319 HydrophobicContact CD1-CG2 4.22Å; I287-I319 HydrophobicContact CG1-CG2 4.31Å; L313-I319 HydrophobicContact CB-CD1 4.49Å; L313-I319 HydrophobicContact CD2-CD1 4.05Å; L313-I319 WeakPolarHBondContact O-CD1 3.41Å; E315-I319 WeakPolarHBondContact O-CD1 3.18Å; I319-K321 PolarHBondContact O-N 3.39Å; I319-L322 WeakPolarHBondContact O-CA 3.49Å; I319-L322 WeakPolarHBondContact O-CB 3.07Å; I319-L322 PolarHBondContact O-N 3.16Å; I319-L323 HydrophobicContact CG2-CG 4.42Å; I319-L323 WeakPolarHBondContact O-CG 3.46Å; I319-L323 PolarHBondContact O-N 2.99Å
320V68.4Low70.5Confident34 Ų3463.1 Ų63.121%0.20632%0.321CS..Hα-helixtrans-61.1-30.5178.3168.20000112.5E316 L323E316-V320 HydrophobicContact CG-CG2 3.44Å; E316-V320 VanDerWaalsContact CG-CG2 3.44Å; E316-V320 VanDerWaalsContact O-CB 3.29Å; E316-V320 WeakPolarHBondContact O-CB 3.49Å; E316-V320 WeakPolarHBondContact O-CG2 3.38Å; E316-V320 PolarHBondContact O-N 3Å; V320-L323 HydrophobicContact CG2-CD1 4.38Å; V320-L323 PolarHBondContact O-N 2.9Å
321K71.8Confident69Low138 Ų13863.5 Ų63.560%0.632%0.324SS*.Hα-helixtrans-66.9-41.9173.2-64.7169.1-171.91650110.8S317 E318 I319 L323 T324S317-K321 WeakPolarHBondContact O-CE 3.36Å; S317-K321 WeakPolarHBondContact O-CG 3.43Å; E318-K321 WeakPolarHBondContact O-CB 3.29Å; E318-K321 PolarHBondContact O-N 2.99Å; I319-K321 PolarHBondContact O-N 3.39Å; K321-L323 VanDerWaalsContact C-N 3.32Å; K321-L323 PolarHBondContact O-N 2.81Å; K321-T324 PolarHBondContact O-N 2.77Å; K321-T324 PolarHBondContact O-OG1 3.22Å
322L64.1Low67.4Low34 Ų3463.9 Ų63.918%0.17832%0.324CS..Hα-helixtrans-67.3-31.5178.5-60.8172000112.7F290 E318 I319 T324 N325F290-L322 HydrophobicContact CB-CD1 3.46Å; F290-L322 VanDerWaalsContact CB-CD1 3.46Å; F290-L322 HydrophobicContact CD1-CD1 3.98Å; F290-L322 HydrophobicContact CD2-CD1 3.93Å; F290-L322 HydrophobicContact CG-CD1 3.5Å; F290-L322 VanDerWaalsContact CG-CD1 3.5Å; E318-L322 PolarHBondContact O-N 3.43Å; I319-L322 WeakPolarHBondContact O-CA 3.49Å; I319-L322 WeakPolarHBondContact O-CB 3.07Å; I319-L322 PolarHBondContact O-N 3.16Å; L322-T324 PolarHBondContact O-N 3.23Å; L322-N325 PolarHBondContact O-N 3.07Å; L322-N325 VanDerWaalsContact O-N 3.1Å
323L64.5Low65.3Low20 Ų2066 Ų6611%0.10534%0.339CS..THydrogen-bonded Turntrans-65.2-17.8175.5-63.6176.2000113.8L179 F183 L279 C283 I287 I319 V320 K321 N325L179-L323 HydrophobicContact CD2-CD1 3.56Å; L179-L323 HydrophobicContact CD2-CD2 4.13Å; L179-L323 HydrophobicContact CD2-CG 4.37Å; F183-L323 HydrophobicContact CE2-CD1 3.9Å; F183-L323 HydrophobicContact CE2-CD2 3.92Å; F183-L323 HydrophobicContact CE2-CG 4.4Å; F183-L323 HydrophobicContact CZ-CB 4.43Å; F183-L323 HydrophobicContact CZ-CD1 4.3Å; F183-L323 HydrophobicContact CZ-CD2 4.03Å; F183-L323 HydrophobicContact CZ-CG 4.47Å; L279-L323 HydrophobicContact CD1-CD2 3.95Å; C283-L323 HydrophobicContact CB-CD2 3.85Å; I287-L323 HydrophobicContact CD1-CD2 4.41Å; I319-L323 HydrophobicContact CG2-CG 4.42Å; I319-L323 WeakPolarHBondContact O-CG 3.46Å; I319-L323 PolarHBondContact O-N 2.99Å; V320-L323 HydrophobicContact CG2-CD1 4.38Å; V320-L323 PolarHBondContact O-N 2.9Å; K321-L323 VanDerWaalsContact C-N 3.32Å; K321-L323 PolarHBondContact O-N 2.81Å; L323-N325 VanDerWaalsContact C-N 3.28Å
324T59.4Low63.4Low103 Ų10369 Ų6963%0.63236%0.358SS*.THydrogen-bonded Turntrans-76.1-18.5175.2670000112.7K321 L322 T326K321-T324 PolarHBondContact O-N 2.77Å; K321-T324 PolarHBondContact O-OG1 3.22Å; L322-T324 PolarHBondContact O-N 3.23Å; T324-T326 PolarHBondContact O-N 3.08Å
325N61.6Low61.4Low83 Ų8368.1 Ų68.144%0.44436%0.362SS..  trans-88102.5176.7-67.6-22.8000109.5H286 L322 L323H286-N325 PolarHBondContact CD2-O 2.95Å; L322-N325 PolarHBondContact O-N 3.07Å; L322-N325 VanDerWaalsContact O-N 3.1Å; L323-N325 VanDerWaalsContact C-N 3.28Å
326T57.7Low59.1Low80 Ų8070.7 Ų70.749%0.49138%0.379SS..  trans-94.60.8-17448.20000114.1A282 T324A282-T326 WeakPolarHBondContact CB-O 3.16Å; T324-T326 PolarHBondContact O-N 3.08Å
327H56.1Low57Low137 Ų13776.2 Ų76.263%0.63440%0.402SS*.  trans-118.5130.1-178.1-65.2-66.3000111H286H286-H327 PolarHBondContact NE2-O 2.76Å
328H59.2Low55.1Low13 Ų1380.7 Ų80.76%0.0642%0.42CS..  trans-143.3132.1173.6-171.2-86.2000109C119 A282 L285 H286 E289 Y330 S331 D332C119-H328 VanDerWaalsContact SG-CE1 3.57Å; A282-H328 HydrophobicContact CB-CB 3.7Å; L285-H328 VanDerWaalsContact CD1-CE1 3.48Å; L285-H328 WeakPolarHBondContact CD1-CE1 3.43Å; L285-H328 WeakPolarHBondContact CD1-ND1 3.31Å; H286-H328 AromaticContact CE1-CD2 3.71Å; H286-H328 AromaticContact ND1-CD2 3.98Å; E289-H328 VanDerWaalsContact CD-NE2 3.33Å; E289-H328 IonicContact OE1-CE1 3.49Å; E289-H328 IonicContact OE1-NE2 2.91Å; E289-H328 PolarHBondContact OE1-NE2 3.46Å; E289-H328 IonicContact OE2-CD2 3.28Å; E289-H328 IonicContact OE2-NE2 3.65Å; H328-Y330 AromaticContact CE1-CD2 3.46Å; H328-Y330 VanDerWaalsContact CE1-CD2 3.46Å; H328-Y330 WeakPolarHBondContact CE1-CD2 3.32Å; H328-Y330 AromaticContact ND1-CD2 3.88Å; H328-Y330 PolarHBondContact ND1-N 2.93Å; H328-Y330 PolarHBondContact O-N 3.32Å; H328-S331 PolarHBondContact O-N 3.26Å; H328-D332 PolarHBondContact O-N 3.43Å
329K59.3Low52.9Low162 Ų16283.7 Ų83.770%0.70445%0.445SS*.THydrogen-bonded Turntrans-58.3-21.9-170.8-65.7178.5-178.4173.70114.4R96R96-K329 PolarHBondContact NH2-O 3.49Å
330Y58.2Low50.6Low4 Ų489.5 Ų89.52%0.01648%0.48CS..THydrogen-bonded Turntrans-98.6-11-179.5-68.7-98000114.2N93 Q118 C119 E122 H328N93-Y330 WeakPolarHBondContact CB-O 3.25Å; N93-Y330 PolarHBondContact N-O 3.44Å; Q118-Y330 HydrophobicContact CG-CE1 4.37Å; C119-Y330 HydrophobicContact CB-CE2 4.38Å; E122-Y330 PolarHBondContact OE1-OH 3.3Å; E122-Y330 WeakPolarHBondContact OE2-CE2 3.5Å; E122-Y330 PolarHBondContact OE2-OH 3.16Å; H328-Y330 AromaticContact CE1-CD2 3.46Å; H328-Y330 VanDerWaalsContact CE1-CD2 3.46Å; H328-Y330 WeakPolarHBondContact CE1-CD2 3.32Å; H328-Y330 AromaticContact ND1-CD2 3.88Å; H328-Y330 PolarHBondContact ND1-N 2.93Å; H328-Y330 PolarHBondContact O-N 3.32Å
331S55.1Low48.7Very low14 Ų1493.8 Ų93.810%0.09851%0.508CS..THydrogen-bonded Turntrans-92.6-28.2175.9-590000111.7G91 A282 L285 H328G91-S331 PolarHBondContact O-OG 2.95Å; A282-S331 VanDerWaalsContact CA-OG 3.25Å; A282-S331 WeakPolarHBondContact CA-OG 3.42Å; A282-S331 PolarHBondContact N-OG 2.99Å; L285-S331 WeakPolarHBondContact CD1-OG 3.5Å; H328-S331 PolarHBondContact O-N 3.26Å
332D52.5Low46.5Very low72 Ų7291.9 Ų91.939%0.38551%0.512SS..SBendtrans-81.4144.1171-63.5-43.6000110.6H328H328-D332 PolarHBondContact O-N 3.43Å
333P42.4Very low44.7Very low71 Ų71101.6 Ų101.646%0.46155%0.547SS..  trans-57.6146.4173.125-32.3000109.8V335P333-V335 PolarHBondContact O-N 3.38Å
334P40.5Very low42.9Very low63 Ų63105.4 Ų105.441%0.40957%0.571SS.*  trans-57.2113.5-17723.7-31.5000110.2N336P334-N336 PolarHBondContact O-N 3.46Å
335V38.7Very low41.2Very low108 Ų108111.3 Ų111.366%0.65558%0.581SS**  trans-70.5105.2173.81800000107.3P333 F337P333-V335 PolarHBondContact O-N 3.38Å; V335-F337 WeakPolarHBondContact O-CD2 3.36Å; V335-F337 PolarHBondContact O-N 3.37Å
336N33.2Very low39.5Very low152 Ų152114.1 Ų114.181%0.81360%0.595SS**  trans-58.2105.3163.7-84.9-18.4000108.3P334 L338P334-N336 PolarHBondContact O-N 3.46Å; N336-L338 PolarHBondContact O-N 3.49Å; N336-L338 VanDerWaalsContact O-N 3.16Å
337F29.9Very low38.1Very low194 Ų194117.3 Ų117.385%0.85161%0.609SS**  trans-67.8108.7170.8-71.5-87.2000109V335V335-F337 WeakPolarHBondContact O-CD2 3.36Å; V335-F337 PolarHBondContact O-N 3.37Å
338L31.5Very low36.8Very low155 Ų155118.3 Ų118.381%0.81262%0.619SS**PPolyproline II helixtrans-89.1144.3154.6-72.5176000109.3N336N336-L338 PolarHBondContact O-N 3.49Å; N336-L338 VanDerWaalsContact O-N 3.16Å
339P28.5Very low35.7Very low120 Ų120123.3 Ų123.378%0.77965%0.653SS**PPolyproline II helixtrans-74135-167.9-7.724.7000111.5
340V30.5Very low34Very low123 Ų123120 Ų12075%0.74566%0.655SS**PPolyproline II helixtrans-69.3138.8168.7176.50000109.9
341P28.5Very low32.5Very low123 Ų123124.5 Ų124.580%0.79969%0.687SS**  trans-101.6115.7147.631.6-22.5000109.8
342S26.3Very low31.1Very low98 Ų98131.7 Ų131.769%0.68572%0.718SS**  trans-76130.8168.3-48.50000109.7
343R26.3Very low30Very low239 Ų239137.2 Ų137.290%0.90274%0.739SS**  trans-177.8114.8131.6-102.6168.7163.9-157.7-5.3109.9
344T24.7Very low29Very low99 Ų99140.1 Ų140.161%0.60776%0.756SS**  112.7106.353.4-65.80000109.2
345R25.5Very low28.2Very low227 Ų227142.6 Ų142.686%0.85777%0.769SS**  trans70.5138.6149.3-60.6170.9-169.4-171.41.3116.9
346I26.1Very low27.7Very low142 Ų142145.1 Ų145.173%0.72878%0.777SS**  -166.413265.3-79.7175.2000110.6
347N27.6Very low27.3Very low148 Ų148142.3 Ų142.379%0.79177%0.767SS**  trans80.8101146.8-58.9-4.5000124.9
348N27.7Very low27Very low157 Ų157139.9 Ų139.984%0.8476%0.763SS**  trans-9.4170.9130.8-72.50.4000120.4
349P35.9Very low26.7Very low118 Ų118139.6 Ų139.677%0.76676%0.763SS**  cis-136.4174.6-11.126.3-2.1000116.5
350A24.4Very low26.5Very low92 Ų92137.8 Ų137.876%0.7675%0.753SS**  trans59.9112.4142.600000122.8
351C27.6Very low26.2Very low100 Ų100141.8 Ų141.868%0.67676%0.76SS**  31.7116.6128.8-152.90000118.7
352H24.8Very low25.9Very low165 Ų165141.7 Ų141.776%0.76476%0.758SS**  -179.3140.3106.3-93.1-72.4000112.2
353K28.5Very low25.7Very low188 Ų188141.2 Ų141.282%0.81775%0.754SS**  trans-13.6155.6159.1-62.2171.9176.8176.80118.8
354T21.9Very low25.5Very low132 Ų132136.3 Ų136.381%0.8175%0.746SS**  trans-147.4109142-6.40000108
355V24.2Very low25.4Very low114 Ų114140.5 Ų140.569%0.69176%0.758SS**  83.7122.796.1171.30000109.3
356I27.9Very low25.6Very low161 Ų161137.1 Ų137.183%0.82676%0.756SS**  -148.8153.682.5-78.2170.2000112.1
357P26.2Very low25.7Very low94 Ų94135.3 Ų135.361%0.6175%0.753SS**  trans-107.7166.9-163.629.9-10.4000115.5
358N23.1Very low25.4Very low142 Ų142136.3 Ų136.376%0.75975%0.753SS**  trans31.6131.6142-63.3-4.8000121.2
359N24.5Very low25.2Very low150 Ų150134.7 Ų134.780%0.80275%0.749SS**  -166.7144.191.5-101.5-13.7000114.6
360S24.6Very low24.9Very low82 Ų82138 Ų13857%0.57375%0.754SS**  trans-72148.3175.9500000115
361F24Very low24.9Very low206 Ų206143.9 Ų143.990%0.90476%0.762SS**  trans-157.6114.7140.8-78.3-76.5000104.6
362V22.1Very low24.7Very low122 Ų122143 Ų14374%0.73976%0.762SS**  60.7107.854.3-172.40000114.4
363S22.7Very low24.7Very low87 Ų87140 Ų14061%0.60876%0.759SS**  trans89.9125.9142.4-107.50000123.2
364N22Very low24.5Very low136 Ų136139.5 Ų139.573%0.72776%0.76SS**  trans84.2133.3141.7-50.3-22000115.7
365Q22.9Very low24.9Very low188 Ų188138.3 Ų138.388%0.87976%0.757SS**  cis-154.5149.539.1-71.5170.39.100112.5
366I28.1Very low25.1Very low155 Ų155142.1 Ų142.180%0.79577%0.767SS**  trans-57.9152.4159.2-60.3161.2000107.9
367P29.7Very low25.3Very low104 Ų104143.2 Ų143.268%0.67577%0.769SS**  -148.8-177.355.145.8-23000113.7
368E21.5Very low25.3Very low169 Ų169144.7 Ų144.779%0.7978%0.781SS**  cis-179.1158.225.2-142.8166.2-177.600109.3
369V23.5Very low25.6Very low124 Ų124145.3 Ų145.375%0.75279%0.785SS**  trans76.5105.4153.6-166.70000120.6
370E28.3Very low26.1Very low186 Ų186147.3 Ų147.387%0.86979%0.789SS**  trans-60.9148.3154-59.5174.6145.900112.7
371K24.6Very low26.2Very low217 Ų217150.8 Ų150.894%0.94380%0.802SS**  trans-143.4132.6147-122.5-176.6-178-174.20111.8
372A22.7Very low26.4Very low81 Ų81148.4 Ų148.467%0.66980%0.798SS**  trans-83.6158.5-168.900000114.4
373S26Very low26.7Very low101 Ų101145.9 Ų145.971%0.70680%0.796SS**  trans70.3152.9131.873.40000117.3
374E24.9Very low27.2Very low179 Ų179147.7 Ų147.784%0.83681%0.806SS**  cis-154.1170.125.3-72.6175161.400110.6
375S29.3Very low27.5Very low106 Ų106145.8 Ų145.874%0.74181%0.81SS**  trans-62.3153.816543.30000115.1
376E28.8Very low27.9Very low195 Ų195141.9 Ų141.991%0.91180%0.8SS**  trans-145.2137.8145.6-72.6-159.6163.600112
377E30.8Very low28.5Very low184 Ų184141.1 Ų141.186%0.8680%0.803SS**  trans-90.8155.2164.7-62.5-162.2160.400110
378S27.5Very low28.7Very low124 Ų124142.4 Ų142.487%0.86780%0.802SS**  trans-160.5138.6148.641.90000112.1
379D29.1Very low29.9Very low155 Ų155140.1 Ų140.183%0.82980%0.8SS**  trans-89.4179.1176.2-85.7-40.5000112.5
380E34.9Very low30.6Very low193 Ų193141 Ų14190%0.90280%0.796SS**  trans99.1141.8169-61.1-172.2-179.200115.7
381D26.9Very low31.8Very low155 Ų155139.8 Ų139.883%0.82980%0.795SS**  cis-174.3169.5-10.717831.8000106.1
382D28.8Very low32.7Very low156 Ų156134.5 Ų134.583%0.83477%0.774SS**  trans-73.1142.7-155.6-118.3-29.9000120.4
383G27.6Very low34.3Very low68 Ų68134 Ų13470%0.70177%0.766SS**  trans88.6155.1142.100000121.6
384P32.5Very low35.3Very low125 Ų125138.5 Ų138.581%0.81277%0.768SS**  cis-112.3142.9-25.436.5-21.8000112.5
385A29.6Very low36.4Very low97 Ų97134.8 Ų134.880%0.80276%0.758SS**  trans-74.3129.7-178.500000112.7
386P29.8Very low37.2Very low105 Ų105134.1 Ų134.168%0.68275%0.746SS**  trans-73.6137.5162.830.6-29.1000109.1I388P386-I388 PolarHBondContact O-N 3.43Å
387V41Very low38.2Very low140 Ų140128.7 Ų128.785%0.84872%0.723SS**  trans-61.5104.71761780000109V389V387-V389 HydrophobicContact CG1-CG2 4.49Å
388I35.3Very low39.2Very low130 Ų130125.5 Ų125.567%0.66771%0.706SS**  trans-103.6113167.1-60.8173.6000106.5P386 E390P386-I388 PolarHBondContact O-N 3.43Å; I388-E390 HydrophobicContact CG2-CG 3.99Å; I388-E390 PolarHBondContact O-N 2.83Å
389V45.1Very low40.5Very low122 Ų122126.5 Ų126.574%0.73970%0.695SS**  trans-73.7101.8168.7177.80000106.8V387V387-V389 HydrophobicContact CG1-CG2 4.49Å
390E38.3Very low41.4Very low141 Ų141124.5 Ų124.566%0.65968%0.679SS**  trans-85.2120.1172.5-70.6-171.8163.700110.1I388 E392I388-E390 HydrophobicContact CG2-CG 3.99Å; I388-E390 PolarHBondContact O-N 2.83Å; E390-E392 VanDerWaalsContact C-N 3.35Å; E390-E392 PolarHBondContact O-N 3.25Å
391N53.3Low42.4Very low162 Ų162118.8 Ų118.887%0.86665%0.654SS**  trans-71.488.9165.1-79.6-2.5000108.9S393N391-S393 PolarHBondContact O-N 3.15Å
392E45.3Very low43.5Very low105 Ų105115.3 Ų115.349%0.49164%0.642SS.*  trans-75122.3173.8-71.8-168.1176.900111E390 K400E390-E392 VanDerWaalsContact C-N 3.35Å; E390-E392 PolarHBondContact O-N 3.25Å; E392-K400 IonicContact OE1-NZ 2.93Å; E392-K400 IonicContact OE2-NZ 3.92Å
393S54.9Low44.6Very low71 Ų71116.1 Ų116.150%0.49764%0.638SS.*  trans-70.5144.1175.180.70000112.8N391 V395 N396N391-S393 PolarHBondContact O-N 3.15Å; S393-V395 PolarHBondContact O-N 2.83Å; S393-N396 PolarHBondContact O-N 3.07Å
394Y47.3Very low45.7Very low195 Ų195121 Ų12177%0.76564%0.635SS**Hα-helixtrans-51.5-23.7-174.8-136.6-101000115.3L397 K398Y394-L397 WeakPolarHBondContact O-CB 3.47Å; Y394-L397 PolarHBondContact O-N 3.32Å; Y394-K398 PolarHBondContact O-N 2.97Å
395V47.2Very low46.4Very low102 Ų102124.5 Ų124.562%0.61863%0.633SS**Hα-helixtrans-70.9-33.6-179.8-177.50000112S393 L397 K399S393-V395 PolarHBondContact O-N 2.83Å; V395-L397 VanDerWaalsContact C-N 3.34Å; V395-K399 PolarHBondContact O-N 2.95Å
396N47.6Very low47.3Very low92 Ų92126.3 Ų126.349%0.49263%0.629SS.*Hα-helixtrans-73.9-30.4175.1-77.4-25.9000111.3S393 K400S393-N396 PolarHBondContact O-N 3.07Å; N396-K400 VanDerWaalsContact O-CB 3.26Å; N396-K400 WeakPolarHBondContact O-CB 3.35Å; N396-K400 PolarHBondContact O-N 3.31Å
397L49.8Very low48.3Very low81 Ų81128.8 Ų128.842%0.42463%0.625SS.*Hα-helixtrans-63-48.2175-144.782.5000111.3Y394 V395 K399 K400 I401Y394-L397 WeakPolarHBondContact O-CB 3.47Å; Y394-L397 PolarHBondContact O-N 3.32Å; V395-L397 VanDerWaalsContact C-N 3.34Å; L397-K399 PolarHBondContact O-N 2.96Å; L397-K400 WeakPolarHBondContact O-CB 3.48Å; L397-K400 PolarHBondContact O-N 3.43Å; L397-K400 VanDerWaalsContact O-N 3.14Å; L397-I401 HydrophobicContact CD2-CD1 4.32Å; L397-I401 HydrophobicContact CG-CD1 4.2Å; L397-I401 WeakPolarHBondContact O-CD1 3.49Å; L397-I401 WeakPolarHBondContact O-CG1 3.32Å; L397-I401 PolarHBondContact O-N 2.88Å
398K50.5Low49Very low117 Ų117128.9 Ų128.951%0.50962%0.616SS.*Hα-helixtrans-62.1-42.4179.2-128.8-177.5-177.8-175.10111.9E177 Y394 K400 I401 S402E177-K398 IonicContact OE1-NZ 3.05Å; E177-K398 PolarHBondContact OE1-NZ 3.22Å; E177-K398 IonicContact OE2-NZ 3.62Å; Y394-K398 PolarHBondContact O-N 2.97Å; K398-K400 PolarHBondContact O-N 3.06Å; K398-I401 PolarHBondContact O-N 3.16Å; K398-S402 PolarHBondContact O-N 3.3Å; K398-S402 PolarHBondContact O-OG 3.02Å
399K55Low50.1Low145 Ų145126 Ų12663%0.6361%0.612SS**Hα-helixtrans-65.5-35173.5-88.9-178.6176.6175.10113.4V395 L397 K403V395-K399 PolarHBondContact O-N 2.95Å; L397-K399 PolarHBondContact O-N 2.96Å; K399-K403 WeakPolarHBondContact O-CG 3.29Å; K399-K403 PolarHBondContact O-N 2.92Å; K399-K403 VanDerWaalsContact O-N 3.14Å
400K49Very low50.7Low113 Ų113129 Ų12949%0.49162%0.616SS.*Hα-helixtrans-70.9-34.2176.7-149170.6-167.6171.90110.8E392 N396 L397 K398 R404E392-K400 IonicContact OE1-NZ 2.93Å; E392-K400 IonicContact OE2-NZ 3.92Å; N396-K400 VanDerWaalsContact O-CB 3.26Å; N396-K400 WeakPolarHBondContact O-CB 3.35Å; N396-K400 PolarHBondContact O-N 3.31Å; L397-K400 WeakPolarHBondContact O-CB 3.48Å; L397-K400 PolarHBondContact O-N 3.43Å; L397-K400 VanDerWaalsContact O-N 3.14Å; K398-K400 PolarHBondContact O-N 3.06Å; K400-R404 WeakPolarHBondContact O-CG 3.41Å; K400-R404 PolarHBondContact O-N 2.9Å
401I55.4Low52.2Low73 Ų73125.3 Ų125.337%0.37461%0.605SS.*Hα-helixtrans-72.8-46.6175-64.5159000110.9L397 K398 K403 R404 Y405L397-I401 HydrophobicContact CD2-CD1 4.32Å; L397-I401 HydrophobicContact CG-CD1 4.2Å; L397-I401 WeakPolarHBondContact O-CD1 3.49Å; L397-I401 WeakPolarHBondContact O-CG1 3.32Å; L397-I401 PolarHBondContact O-N 2.88Å; K398-I401 PolarHBondContact O-N 3.16Å; I401-K403 VanDerWaalsContact C-N 3.3Å; I401-K403 PolarHBondContact O-N 3.41Å; I401-R404 WeakPolarHBondContact O-CB 3.38Å; I401-R404 PolarHBondContact O-N 3.23Å; I401-Y405 HydrophobicContact CG2-CD2 4.23Å; I401-Y405 HydrophobicContact CG2-CE2 3.96Å; I401-Y405 WeakPolarHBondContact O-CD2 3.48Å; I401-Y405 PolarHBondContact O-N 2.93Å
402S50.1Low53.2Low82 Ų82118.8 Ų118.857%0.57357%0.571SS**Hα-helixtrans-62.4-34.6176.8-60.50000113K398 R404 Y405K398-S402 PolarHBondContact O-N 3.3Å; K398-S402 PolarHBondContact O-OG 3.02Å; S402-R404 VanDerWaalsContact C-N 3.31Å; S402-R404 PolarHBondContact O-N 3.16Å; S402-Y405 PolarHBondContact O-N 3.17Å
403K51.3Low54.6Low172 Ų172120.5 Ų120.575%0.74858%0.579SS**Hα-helixtrans-71-20.3171.6-76.6-176177.1-175.60114.1K399 I401K399-K403 WeakPolarHBondContact O-CG 3.29Å; K399-K403 PolarHBondContact O-N 2.92Å; K399-K403 VanDerWaalsContact O-N 3.14Å; I401-K403 VanDerWaalsContact C-N 3.3Å; I401-K403 PolarHBondContact O-N 3.41Å
404R51.8Low56Low171 Ų171119.9 Ų119.965%0.64558%0.578SS**Hα-helixtrans-74.3-26.2173.8-79.2-179.1-167.2-178.14.1112.6K400 I401 S402K400-R404 WeakPolarHBondContact O-CG 3.41Å; K400-R404 PolarHBondContact O-N 2.9Å; I401-R404 WeakPolarHBondContact O-CB 3.38Å; I401-R404 PolarHBondContact O-N 3.23Å; S402-R404 VanDerWaalsContact C-N 3.31Å; S402-R404 PolarHBondContact O-N 3.16Å
405Y46.1Very low57.8Low198 Ų198114.4 Ų114.478%0.77656%0.559SS**Hα-helixtrans-87.8-14.2179.9-76.4-81.7000113.9I401 S402 W407I401-Y405 HydrophobicContact CG2-CD2 4.23Å; I401-Y405 HydrophobicContact CG2-CE2 3.96Å; I401-Y405 WeakPolarHBondContact O-CD2 3.48Å; I401-Y405 PolarHBondContact O-N 2.93Å; S402-Y405 PolarHBondContact O-N 3.17Å; Y405-W407 PolarHBondContact O-N 3.44Å
406D49.8Very low59.8Low135 Ų135113.3 Ų113.372%0.72255%0.55SS*.SBendtrans-80.268.4159.2-102.9-20.8000109.2Q408D406-Q408 PolarHBondContact O-N 2.87Å
407W50.6Low61.9Low157 Ų157110.4 Ų110.460%0.59554%0.542SS*.  trans-70.980.9179.6-164.5-100.2000109.3Y405 A409 V412Y405-W407 PolarHBondContact O-N 3.44Å; W407-A409 PolarHBondContact O-N 3.11Å; W407-A409 VanDerWaalsContact O-N 3.08Å; W407-V412 HydrophobicContact CD2-CG2 4.37Å; W407-V412 HydrophobicContact CG-CG2 4.08Å; W407-V412 HydrophobicContact CZ2-CG1 3.96Å; W407-V412 HydrophobicContact CZ2-CG2 4.36Å
408Q56Low63.9Low142 Ų142113.3 Ų113.366%0.66455%0.551SS**  trans-56.2118.1176-72-177.4-1.900108.9D406 K410 S411 V412D406-Q408 PolarHBondContact O-N 2.87Å; Q408-K410 PolarHBondContact O-N 3.29Å; Q408-S411 WeakPolarHBondContact O-CA 3.22Å; Q408-S411 VanDerWaalsContact O-CB 3.25Å; Q408-S411 WeakPolarHBondContact O-CB 3.4Å; Q408-S411 PolarHBondContact O-N 3.26Å; Q408-V412 WeakPolarHBondContact O-CG2 3.43Å
409A56.9Low65.9Low70 Ų70112 Ų11258%0.57955%0.549SS*.Hα-helixtrans-51-28.8-178.400000113.6W407 H413W407-A409 PolarHBondContact O-N 3.11Å; W407-A409 VanDerWaalsContact O-N 3.08Å; A409-H413 PolarHBondContact O-CD2 2.99Å
410K59.4Low67.5Low186 Ų186108.2 Ų108.281%0.80954%0.539SS*.Hα-helixtrans-70.5-30.6175.1-64.2-179-179.31780113.5Q408Q408-K410 PolarHBondContact O-N 3.29Å
411S68.4Low69.5Low62 Ų62109.7 Ų109.743%0.43455%0.546SS..Hα-helixtrans-69.2-39.1176.4-171.70000111.8Q408 H413 A414 E415Q408-S411 WeakPolarHBondContact O-CA 3.22Å; Q408-S411 VanDerWaalsContact O-CB 3.25Å; Q408-S411 WeakPolarHBondContact O-CB 3.4Å; Q408-S411 PolarHBondContact O-N 3.26Å; S411-H413 PolarHBondContact O-N 3.32Å; S411-A414 PolarHBondContact O-N 2.97Å; S411-E415 WeakPolarHBondContact O-CB 3.43Å; S411-E415 PolarHBondContact O-N 2.94Å
412V73.9Confident71.3Confident25 Ų25111.6 Ų111.615%0.15255%0.553CS.*Hα-helixtrans-61.8-45.2-177.8-159.70000112.2W407 Q408 A414 E415 N416W407-V412 HydrophobicContact CD2-CG2 4.37Å; W407-V412 HydrophobicContact CG-CG2 4.08Å; W407-V412 HydrophobicContact CZ2-CG1 3.96Å; W407-V412 HydrophobicContact CZ2-CG2 4.36Å; Q408-V412 WeakPolarHBondContact O-CG2 3.43Å; V412-A414 VanDerWaalsContact C-N 3.35Å; V412-E415 PolarHBondContact O-N 3.34Å; V412-N416 VanDerWaalsContact O-CB 3.25Å; V412-N416 WeakPolarHBondContact O-CB 3.47Å; V412-N416 PolarHBondContact O-N 3.36Å; V412-N416 PolarHBondContact O-ND2 3.4Å; V412-N416 PolarHBondContact O-OD1 3.37Å
413H76Confident73.3Confident142 Ų142112.8 Ų112.866%0.65755%0.548SS*.Hα-helixtrans-67.8-38-179.6-68.5-61.1000111.6A409 S411 G417A409-H413 PolarHBondContact O-CD2 2.99Å; S411-H413 PolarHBondContact O-N 3.32Å; H413-G417 PolarHBondContact O-N 3.39Å
414A83.5Confident75.1Confident58 Ų58112.9 Ų112.948%0.47954%0.544SS..Hα-helixtrans-66.4-41174.900000111.6S411 V412 G417 K418S411-A414 PolarHBondContact O-N 2.97Å; V412-A414 VanDerWaalsContact C-N 3.35Å; A414-G417 PolarHBondContact O-N 3.47Å; A414-K418 WeakPolarHBondContact O-CG 3.43Å; A414-K418 PolarHBondContact O-N 3.04Å
415E85.3Confident76.9Confident80 Ų80111.8 Ų111.837%0.37455%0.548SS..Hα-helixtrans-68.1-45.2176.6-170.7170.5-170.200112.2S411 V412 G417 K418 I419S411-E415 WeakPolarHBondContact O-CB 3.43Å; S411-E415 PolarHBondContact O-N 2.94Å; V412-E415 PolarHBondContact O-N 3.34Å; E415-G417 PolarHBondContact O-N 3.32Å; E415-K418 CarbonylContact O-C 3.58Å; E415-K418 WeakPolarHBondContact O-CA 3.44Å; E415-K418 WeakPolarHBondContact O-CB 3.4Å; E415-K418 PolarHBondContact O-N 3.18Å; E415-I419 HydrophobicContact CG-CD1 4.13Å; E415-I419 WeakPolarHBondContact O-CG1 3.47Å; E415-I419 PolarHBondContact O-N 2.88Å
416N90.4Very high78.9Confident79 Ų79108.3 Ų108.342%0.42254%0.537SS..Hα-helixtrans-57.5-36.7172.4-72.7-10.4000111.6V412 C420V412-N416 VanDerWaalsContact O-CB 3.25Å; V412-N416 WeakPolarHBondContact O-CB 3.47Å; V412-N416 PolarHBondContact O-N 3.36Å; V412-N416 PolarHBondContact O-ND2 3.4Å; V412-N416 PolarHBondContact O-OD1 3.37Å; N416-C420 WeakPolarHBondContact O-CB 3.02Å; N416-C420 PolarHBondContact O-N 2.83Å; N416-C420 PolarHBondContact O-SG 2.92Å
417G91Very high80.6Confident31 Ų31106.4 Ų106.432%0.3252%0.523SS..Hα-helixtrans-62.9-42.7172.200000112.8H413 A414 E415 K421H413-G417 PolarHBondContact O-N 3.39Å; A414-G417 PolarHBondContact O-N 3.47Å; E415-G417 PolarHBondContact O-N 3.32Å; G417-K421 WeakPolarHBondContact O-CG 3.35Å; G417-K421 PolarHBondContact O-N 3.22Å; G417-K421 VanDerWaalsContact O-N 3.08Å
418K91.8Very high82.3Confident141 Ų141102.7 Ų102.761%0.61353%0.527SS*.Hα-helixtrans-65.3-45.4175.3-68.9174.1-177.7179.50111.5A414 E415 C420 K421 Q422A414-K418 WeakPolarHBondContact O-CG 3.43Å; A414-K418 PolarHBondContact O-N 3.04Å; E415-K418 CarbonylContact O-C 3.58Å; E415-K418 WeakPolarHBondContact O-CA 3.44Å; E415-K418 WeakPolarHBondContact O-CB 3.4Å; E415-K418 PolarHBondContact O-N 3.18Å; K418-C420 VanDerWaalsContact C-N 3.35Å; K418-C420 PolarHBondContact O-N 2.67Å; K418-K421 PolarHBondContact O-N 3.07Å; K418-Q422 WeakPolarHBondContact O-CG 3.39Å; K418-Q422 PolarHBondContact O-N 2.8Å
419I92.1Very high84Confident90 Ų9098.2 Ų98.246%0.46251%0.511SS..Hα-helixtrans-60.7-45.1177.7-65.2167.6000110.3E415 K421 Q422 F423E415-I419 HydrophobicContact CG-CD1 4.13Å; E415-I419 WeakPolarHBondContact O-CG1 3.47Å; E415-I419 PolarHBondContact O-N 2.88Å; I419-K421 VanDerWaalsContact C-N 3.35Å; I419-K421 PolarHBondContact O-N 2.94Å; I419-Q422 PolarHBondContact O-N 3.01Å; I419-F423 WeakPolarHBondContact O-CB 3.25Å; I419-F423 PolarHBondContact O-N 3.34Å
420C89.3Confident85.6Confident65 Ų65105.4 Ų105.444%0.43952%0.523SS..Hα-helixtrans-58.3-44.2174.8-76.20000112.5N416 K418 F423 R424N416-C420 WeakPolarHBondContact O-CB 3.02Å; N416-C420 PolarHBondContact O-N 2.83Å; N416-C420 PolarHBondContact O-SG 2.92Å; K418-C420 VanDerWaalsContact C-N 3.35Å; K418-C420 PolarHBondContact O-N 2.67Å; C420-F423 PolarHBondContact O-N 3.42Å; C420-R424 WeakPolarHBondContact O-CG 3.3Å; C420-R424 PolarHBondContact O-N 2.96Å
421K90.8Very high87Confident145 Ų145104 Ų10463%0.6352%0.519SS*.Hα-helixtrans-64.8-47.3178.2-73.8176.4-179-176.40111.4G417 K418 I419 F423 R424 M425G417-K421 WeakPolarHBondContact O-CG 3.35Å; G417-K421 PolarHBondContact O-N 3.22Å; G417-K421 VanDerWaalsContact O-N 3.08Å; K418-K421 PolarHBondContact O-N 3.07Å; I419-K421 VanDerWaalsContact C-N 3.35Å; I419-K421 PolarHBondContact O-N 2.94Å; K421-F423 VanDerWaalsContact C-N 3.31Å; K421-F423 PolarHBondContact O-N 3.43Å; K421-R424 PolarHBondContact O-N 3.32Å; K421-M425 WeakPolarHBondContact O-CG 3.48Å; K421-M425 PolarHBondContact O-N 3.33Å
422Q92.1Very high88.1Confident113 Ų113103.7 Ų103.753%0.52851%0.51SS..Hα-helixtrans-61.3-39.9177.1-72.5179.9-3.700112K418 I419 M425 K426K418-Q422 WeakPolarHBondContact O-CG 3.39Å; K418-Q422 PolarHBondContact O-N 2.8Å; I419-Q422 PolarHBondContact O-N 3.01Å; Q422-M425 PolarHBondContact O-N 3Å; Q422-K426 WeakPolarHBondContact O-CB 3.19Å; Q422-K426 WeakPolarHBondContact O-CG 3.47Å; Q422-K426 PolarHBondContact O-N 3.14Å
423F92.1Very high88.8Confident106 Ų106106.9 Ų106.947%0.46552%0.523SS..Hα-helixtrans-63.9-43.8176.4-177.1-113.4000112I419 C420 K421 M425 K426 Q427 F432I419-F423 WeakPolarHBondContact O-CB 3.25Å; I419-F423 PolarHBondContact O-N 3.34Å; C420-F423 PolarHBondContact O-N 3.42Å; K421-F423 VanDerWaalsContact C-N 3.31Å; K421-F423 PolarHBondContact O-N 3.43Å; F423-M425 VanDerWaalsContact C-N 3.32Å; F423-M425 PolarHBondContact O-N 3.48Å; F423-K426 PolarHBondContact O-N 3.35Å; F423-Q427 HydrophobicContact CE1-CG 4.24Å; F423-Q427 HydrophobicContact CZ-CG 4.24Å; F423-Q427 WeakPolarHBondContact O-CG 3.46Å; F423-Q427 PolarHBondContact O-N 2.99Å; F423-F432 AromaticContact CE2-CZ 3.95Å; F423-F432 HydrophobicContact CE2-CZ 3.95Å
424R89.9Confident89.6Confident175 Ų175103.7 Ų103.766%0.6652%0.517SS*.Hα-helixtrans-60.4-40.5174.1-70.8178.9-151.5-178.54.5112.3C420 K421 Q427C420-R424 WeakPolarHBondContact O-CG 3.3Å; C420-R424 PolarHBondContact O-N 2.96Å; K421-R424 PolarHBondContact O-N 3.32Å; R424-Q427 PolarHBondContact O-N 3.01Å
425M89Confident89.9Confident147 Ų147105 Ų10572%0.72452%0.516SS*.Hα-helixtrans-65.8-40.1175.5-67.5177.973.600111.8K421 Q422 F423 Q427 A428K421-M425 WeakPolarHBondContact O-CG 3.48Å; K421-M425 PolarHBondContact O-N 3.33Å; Q422-M425 PolarHBondContact O-N 3Å; F423-M425 VanDerWaalsContact C-N 3.32Å; F423-M425 PolarHBondContact O-N 3.48Å; M425-Q427 VanDerWaalsContact C-N 3.35Å; M425-Q427 PolarHBondContact O-N 3.06Å; M425-A428 PolarHBondContact O-N 3.21Å
426K89Confident90Very high126 Ų126103.5 Ų103.555%0.54851%0.51SS..Hα-helixtrans-64.9-36.2175.8-75.9-179.1178.3-177.50112.3Q422 F423 A428 S429 F432Q422-K426 WeakPolarHBondContact O-CB 3.19Å; Q422-K426 WeakPolarHBondContact O-CG 3.47Å; Q422-K426 PolarHBondContact O-N 3.14Å; F423-K426 PolarHBondContact O-N 3.35Å; K426-A428 PolarHBondContact O-N 3.5Å; K426-S429 WeakPolarHBondContact O-CB 3.47Å; K426-S429 PolarHBondContact O-N 3.23Å; K426-F432 HydrophobicContact CB-CD2 4.43Å; K426-F432 WeakPolarHBondContact O-CB 3.4Å; K426-F432 WeakPolarHBondContact O-CD1 3.1Å; K426-F432 WeakPolarHBondContact O-CG 3.42Å
427Q85.7Confident89.9Confident94 Ų94106.1 Ų106.144%0.43952%0.519SS..Hα-helixtrans-60.1-28.7175-75.1-177.5-21.700113.6F423 R424 M425 S429 F432 Q433F423-Q427 HydrophobicContact CE1-CG 4.24Å; F423-Q427 HydrophobicContact CZ-CG 4.24Å; F423-Q427 WeakPolarHBondContact O-CG 3.46Å; F423-Q427 PolarHBondContact O-N 2.99Å; R424-Q427 PolarHBondContact O-N 3.01Å; M425-Q427 VanDerWaalsContact C-N 3.35Å; M425-Q427 PolarHBondContact O-N 3.06Å; Q427-S429 VanDerWaalsContact C-N 3.32Å; Q427-F432 HydrophobicContact CB-CE1 4.49Å; Q427-F432 HydrophobicContact CG-CD1 4.5Å; Q427-F432 HydrophobicContact CG-CE1 3.89Å; Q427-Q433 PolarHBondContact O-NE2 3.27Å; Q427-Q433 VanDerWaalsContact O-NE2 3.09Å
428A86.3Confident89.8Confident80 Ų80111.2 Ų111.266%0.66154%0.535SS*.THydrogen-bonded Turntrans-79.8-11.2176.200000113.6M425 K426M425-A428 PolarHBondContact O-N 3.21Å; K426-A428 PolarHBondContact O-N 3.5Å
429S92.1Very high89.6Confident48 Ų48111.5 Ų111.534%0.33653%0.532SS..  trans-78134.5179.1179.20000111.9K426 Q427 Q431 F432 Q433K426-S429 WeakPolarHBondContact O-CB 3.47Å; K426-S429 PolarHBondContact O-N 3.23Å; Q427-S429 VanDerWaalsContact C-N 3.32Å; S429-Q431 VanDerWaalsContact C-N 3.31Å; S429-Q431 PolarHBondContact O-N 3.45Å; S429-Q431 PolarHBondContact OG-N 3.49Å; S429-F432 PolarHBondContact O-N 3.43Å; S429-Q433 WeakPolarHBondContact O-CG 3.31Å; S429-Q433 PolarHBondContact O-N 2.66Å; S429-Q433 VanDerWaalsContact O-N 3.11Å
430R89.8Confident89.4Confident221 Ų221111.7 Ų111.783%0.83453%0.531SS*.Hα-helixtrans-62.4-36.6176.7-67.1-173.2178.8-155.80112.8F432 Q433 S434R430-F432 VanDerWaalsContact C-N 3.34Å; R430-Q433 PolarHBondContact O-N 3.1Å; R430-S434 PolarHBondContact O-N 3.22Å
431Q89.1Confident89.2Confident155 Ų155113 Ų11372%0.72454%0.541SS*.Hα-helixtrans-64.5-41.1177.9-69.3175-1300111.3S429 S434 I435S429-Q431 VanDerWaalsContact C-N 3.31Å; S429-Q431 PolarHBondContact O-N 3.45Å; S429-Q431 PolarHBondContact OG-N 3.49Å; Q431-S434 PolarHBondContact O-N 3.48Å; Q431-I435 WeakPolarHBondContact O-CG1 3.46Å; Q431-I435 PolarHBondContact O-N 2.9Å
432F90.8Very high89.1Confident57 Ų57108.4 Ų108.425%0.2552%0.523CS..Hα-helixtrans-67-39.3177.2-178.6-96.6000111.8F423 K426 Q427 S429 R430 S434 I435 L436F423-F432 AromaticContact CE2-CZ 3.95Å; F423-F432 HydrophobicContact CE2-CZ 3.95Å; K426-F432 HydrophobicContact CB-CD2 4.43Å; K426-F432 WeakPolarHBondContact O-CB 3.4Å; K426-F432 WeakPolarHBondContact O-CD1 3.1Å; K426-F432 WeakPolarHBondContact O-CG 3.42Å; Q427-F432 HydrophobicContact CB-CE1 4.49Å; Q427-F432 HydrophobicContact CG-CD1 4.5Å; Q427-F432 HydrophobicContact CG-CE1 3.89Å; S429-F432 PolarHBondContact O-N 3.43Å; R430-F432 VanDerWaalsContact C-N 3.34Å; F432-S434 PolarHBondContact O-N 2.92Å; F432-I435 PolarHBondContact O-N 2.71Å; F432-L436 HydrophobicContact CE1-CD2 4.31Å; F432-L436 VanDerWaalsContact O-CB 3.26Å; F432-L436 WeakPolarHBondContact O-CB 3.4Å; F432-L436 PolarHBondContact O-N 3.45Å
433Q89.4Confident88.7Confident91 Ų91106 Ų10643%0.42552%0.517SS..Hα-helixtrans-63.6-39176.2-70.2173.44.800112.4Q427 S429 R430 L436 Q437Q427-Q433 PolarHBondContact O-NE2 3.27Å; Q427-Q433 VanDerWaalsContact O-NE2 3.09Å; S429-Q433 WeakPolarHBondContact O-CG 3.31Å; S429-Q433 PolarHBondContact O-N 2.66Å; S429-Q433 VanDerWaalsContact O-N 3.11Å; R430-Q433 PolarHBondContact O-N 3.1Å; Q433-L436 PolarHBondContact O-N 2.88Å; Q433-Q437 WeakPolarHBondContact O-CG 3.48Å; Q433-Q437 PolarHBondContact O-N 3.4Å
434S91.9Very high88.3Confident76 Ų76101.6 Ų101.653%0.53150%0.5SS..Hα-helixtrans-61.3-47.6175.2-169.80000111.9R430 Q431 F432 L436 Q437 E438R430-S434 PolarHBondContact O-N 3.22Å; Q431-S434 PolarHBondContact O-N 3.48Å; F432-S434 PolarHBondContact O-N 2.92Å; S434-L436 VanDerWaalsContact C-N 3.31Å; S434-L436 PolarHBondContact O-N 3.11Å; S434-Q437 PolarHBondContact O-N 3.22Å; S434-E438 PolarHBondContact O-N 3.37Å
435I89.2Confident88.1Confident86 Ų8697.2 Ų97.244%0.44148%0.484SS..Hα-helixtrans-67.1-35.2178.3-64.5168.1000110.8Q431 F432 E438 R439Q431-I435 WeakPolarHBondContact O-CG1 3.46Å; Q431-I435 PolarHBondContact O-N 2.9Å; F432-I435 PolarHBondContact O-N 2.71Å; I435-E438 PolarHBondContact O-N 3.27Å; I435-R439 WeakPolarHBondContact O-CG 3.48Å; I435-R439 PolarHBondContact O-N 2.94Å
436L88.8Confident88Confident48 Ų4897.7 Ų97.725%0.25148%0.484SS..Hα-helixtrans-64.8-39.1177.1-175.764.9000111.9F432 Q433 S434 R439 Q440 W445F432-L436 HydrophobicContact CE1-CD2 4.31Å; F432-L436 VanDerWaalsContact O-CB 3.26Å; F432-L436 WeakPolarHBondContact O-CB 3.4Å; F432-L436 PolarHBondContact O-N 3.45Å; Q433-L436 PolarHBondContact O-N 2.88Å; S434-L436 VanDerWaalsContact C-N 3.31Å; S434-L436 PolarHBondContact O-N 3.11Å; L436-R439 PolarHBondContact O-N 3.2Å; L436-Q440 VanDerWaalsContact O-CG 3.27Å; L436-Q440 WeakPolarHBondContact O-CG 3.48Å; L436-Q440 PolarHBondContact O-N 3.42Å; L436-W445 HydrophobicContact CD1-CH2 3.38Å; L436-W445 HydrophobicContact CD1-CZ2 3.86Å; L436-W445 HydrophobicContact CD1-CZ3 4.14Å
437Q88.4Confident87.9Confident134 Ų13496.4 Ų96.463%0.62648%0.48SS*.Hα-helixtrans-64.4-40.7176.1-75.2175.4-10.500112Q433 S434 Q440 S441Q433-Q437 WeakPolarHBondContact O-CG 3.48Å; Q433-Q437 PolarHBondContact O-N 3.4Å; S434-Q437 PolarHBondContact O-N 3.22Å; Q437-Q440 PolarHBondContact O-N 3.01Å; Q437-S441 PolarHBondContact O-N 3.26Å
438E88.1Confident88.1Confident137 Ų13795.9 Ų95.964%0.6447%0.474SS*.Hα-helixtrans-62.8-44.9174.3-171.8178.1-174.800111.1S434 I435 Q440 S441S434-E438 PolarHBondContact O-N 3.37Å; I435-E438 PolarHBondContact O-N 3.27Å; E438-Q440 VanDerWaalsContact C-N 3.3Å; E438-Q440 PolarHBondContact O-N 2.82Å; E438-S441 WeakPolarHBondContact O-CB 3.44Å; E438-S441 PolarHBondContact O-N 2.83Å; E438-S441 VanDerWaalsContact O-N 3.11Å; E438-S441 PolarHBondContact O-OG 3.47Å
439R88.1Confident88.3Confident147 Ų14796.2 Ų96.256%0.55546%0.462SS*.Hα-helixtrans-64.4-32177.3-72.1179176.9-156.2-4.9113.6I435 L436 S441 L442 W445I435-R439 WeakPolarHBondContact O-CG 3.48Å; I435-R439 PolarHBondContact O-N 2.94Å; L436-R439 PolarHBondContact O-N 3.2Å; R439-S441 PolarHBondContact O-N 3.4Å; R439-L442 WeakPolarHBondContact O-CB 3.36Å; R439-L442 PolarHBondContact O-N 3.5Å; R439-W445 HydrophobicContact CB-CE3 4.22Å; R439-W445 HydrophobicContact CB-CZ3 4.37Å; R439-W445 WeakPolarHBondContact O-CB 3.35Å
440Q86.9Confident88.2Confident95 Ų9597.2 Ų97.244%0.44447%0.466SS..Hα-helixtrans-65.9-23.5175.6-78.5173.14.100113.2L436 Q437 E438 L442 W445L436-Q440 VanDerWaalsContact O-CG 3.27Å; L436-Q440 WeakPolarHBondContact O-CG 3.48Å; L436-Q440 PolarHBondContact O-N 3.42Å; Q437-Q440 PolarHBondContact O-N 3.01Å; E438-Q440 VanDerWaalsContact C-N 3.3Å; E438-Q440 PolarHBondContact O-N 2.82Å; Q440-L442 PolarHBondContact O-N 3.5Å; Q440-W445 HydrophobicContact CG-CD2 4.3Å; Q440-W445 HydrophobicContact CG-CG 4.49Å; Q440-W445 HydrophobicContact CG-CZ2 4.02Å
441S86.3Confident88.2Confident92 Ų9287.5 Ų87.564%0.64343%0.431SS*.THydrogen-bonded Turntrans-77.3-10.1176.974.90000113.7Q437 E438 R439Q437-S441 PolarHBondContact O-N 3.26Å; E438-S441 WeakPolarHBondContact O-CB 3.44Å; E438-S441 PolarHBondContact O-N 2.83Å; E438-S441 VanDerWaalsContact O-N 3.11Å; E438-S441 PolarHBondContact O-OG 3.47Å; R439-S441 PolarHBondContact O-N 3.4Å
442L87.8Confident88.3Confident48 Ų4883.3 Ų83.325%0.25141%0.413SS..SBendtrans-83.7139.1-176.9-59.2177.6000111.1R439 Q440 A444 W445 Y470R439-L442 WeakPolarHBondContact O-CB 3.36Å; R439-L442 PolarHBondContact O-N 3.5Å; Q440-L442 PolarHBondContact O-N 3.5Å; L442-A444 PolarHBondContact O-N 3.3Å; L442-W445 VanDerWaalsContact O-CB 3.24Å; L442-W445 WeakPolarHBondContact O-CB 3.1Å; L442-W445 PolarHBondContact O-N 2.78Å; L442-Y470 HydrophobicContact CD1-CD2 4.46Å; L442-Y470 HydrophobicContact CD2-CD2 3.72Å; L442-Y470 HydrophobicContact CD2-CE2 4.25Å
443P83.9Confident88.4Confident64 Ų6483.8 Ų83.842%0.41642%0.418SS..Hα-helixtrans-62.8-30.3-179.424.4-33.4000112.7W445 E446 T469P443-W445 PolarHBondContact O-N 2.94Å; P443-E446 PolarHBondContact O-N 3Å; P443-T469 HydrophobicContact CG-CG2 4.22Å
444A83.5Confident88.5Confident13 Ų1382.8 Ų82.811%0.10742%0.415CS..Hα-helixtrans-65-21.1174.800000113.7L442 R448 T469L442-A444 PolarHBondContact O-N 3.3Å; A444-R448 PolarHBondContact O-N 3.23Å; A444-T469 VanDerWaalsContact CB-O 3.3Å; A444-T469 WeakPolarHBondContact CB-O 3.4Å
445W86.5Confident88.6Confident83 Ų8383.9 Ų83.931%0.31441%0.414SS..Hα-helixtrans-70.2-34.8177.7-174.5-92.6000112.3L436 R439 Q440 L442 P443 E447 R448L436-W445 HydrophobicContact CD1-CH2 3.38Å; L436-W445 HydrophobicContact CD1-CZ2 3.86Å; L436-W445 HydrophobicContact CD1-CZ3 4.14Å; R439-W445 HydrophobicContact CB-CE3 4.22Å; R439-W445 HydrophobicContact CB-CZ3 4.37Å; R439-W445 WeakPolarHBondContact O-CB 3.35Å; Q440-W445 HydrophobicContact CG-CD2 4.3Å; Q440-W445 HydrophobicContact CG-CG 4.49Å; Q440-W445 HydrophobicContact CG-CZ2 4.02Å; L442-W445 VanDerWaalsContact O-CB 3.24Å; L442-W445 WeakPolarHBondContact O-CB 3.1Å; L442-W445 PolarHBondContact O-N 2.78Å; P443-W445 PolarHBondContact O-N 2.94Å; W445-E447 VanDerWaalsContact C-N 3.34Å; W445-R448 VanDerWaalsContact CH2-NH1 3.32Å; W445-R448 VanDerWaalsContact O-CB 3.23Å; W445-R448 WeakPolarHBondContact O-CB 3.48Å; W445-R448 PolarHBondContact O-N 2.94Å
446E86.4Confident88.8Confident157 Ų15788 Ų8873%0.73443%0.425SS*.Hα-helixtrans-65.5-40.3177.5-60.7-176.7166.300110.9P443 R448P443-E446 PolarHBondContact O-N 3Å; E446-R448 VanDerWaalsContact C-N 3.29Å; E446-R448 PolarHBondContact O-N 3.29Å
447E87.8Confident89Confident99 Ų9993.7 Ų93.746%0.46345%0.447SS..THydrogen-bonded Turntrans-84.94.9179.9-67.5-58.9155.300114.5W445 E449 T450 I451W445-E447 VanDerWaalsContact C-N 3.34Å; E447-E449 PolarHBondContact O-N 3.39Å; E447-T450 WeakPolarHBondContact O-CB 3.19Å; E447-T450 PolarHBondContact O-N 3.31Å; E447-T450 WeakPolarHBondContact OE2-CB 3.16Å; E447-T450 PolarHBondContact OE2-OG1 3.05Å; E447-I451 HydrophobicContact CB-CD1 4.21Å; E447-I451 VanDerWaalsContact O-CG1 3.31Å; E447-I451 WeakPolarHBondContact O-CG1 3.4Å; E447-I451 PolarHBondContact O-N 2.98Å
448R89.1Confident89.2Confident83 Ų8392.1 Ų92.131%0.31344%0.44SS..Hα-helixtrans-51.4-51.4-178.5176.8-175.282.9-160.12.7112.5A444 W445 E446 T450 I451 L452A444-R448 PolarHBondContact O-N 3.23Å; W445-R448 VanDerWaalsContact CH2-NH1 3.32Å; W445-R448 VanDerWaalsContact O-CB 3.23Å; W445-R448 WeakPolarHBondContact O-CB 3.48Å; W445-R448 PolarHBondContact O-N 2.94Å; E446-R448 VanDerWaalsContact C-N 3.29Å; E446-R448 PolarHBondContact O-N 3.29Å; R448-T450 VanDerWaalsContact C-N 3.34Å; R448-I451 PolarHBondContact O-N 2.84Å; R448-L452 HydrophobicContact CG-CD1 4.06Å; R448-L452 WeakPolarHBondContact O-CB 3.49Å; R448-L452 VanDerWaalsContact O-CG 3.29Å; R448-L452 WeakPolarHBondContact O-CG 3.34Å; R448-L452 PolarHBondContact O-N 3.33Å
449E91.2Very high89.4Confident87 Ų8795.2 Ų95.241%0.40745%0.454SS..Hα-helixtrans-69.3-35.6-175.5-62.1-57150.500111.5E447 L452 N453E447-E449 PolarHBondContact O-N 3.39Å; E449-L452 PolarHBondContact O-N 3.42Å; E449-N453 WeakPolarHBondContact O-CB 3.46Å; E449-N453 PolarHBondContact O-N 3.26Å; E449-N453 PolarHBondContact O-ND2 2.8Å; E449-N453 VanDerWaalsContact O-ND2 3.07Å
450T90.3Very high89.6Confident68 Ų6893.9 Ų93.942%0.41746%0.462SS..Hα-helixtrans-60.8-49.5174.3-46.40000110.5E447 R448 N453 L454E447-T450 WeakPolarHBondContact O-CB 3.19Å; E447-T450 PolarHBondContact O-N 3.31Å; E447-T450 WeakPolarHBondContact OE2-CB 3.16Å; E447-T450 PolarHBondContact OE2-OG1 3.05Å; R448-T450 VanDerWaalsContact C-N 3.34Å; T450-N453 PolarHBondContact O-N 3.21Å; T450-L454 HydrophobicContact CG2-CD1 4.45Å; T450-L454 WeakPolarHBondContact O-CG 3.38Å; T450-L454 PolarHBondContact O-N 3Å
451I89.5Confident89.8Confident17 Ų1791.3 Ų91.39%0.08745%0.453CS..Hα-helixtrans-61.7-46.8179-67165.5000110.9E447 R448 N453 L454 L455 I463 F472E447-I451 HydrophobicContact CB-CD1 4.21Å; E447-I451 VanDerWaalsContact O-CG1 3.31Å; E447-I451 WeakPolarHBondContact O-CG1 3.4Å; E447-I451 PolarHBondContact O-N 2.98Å; R448-I451 PolarHBondContact O-N 2.84Å; I451-N453 VanDerWaalsContact C-N 3.28Å; I451-N453 PolarHBondContact O-N 3.36Å; I451-L454 PolarHBondContact O-N 2.89Å; I451-L454 VanDerWaalsContact O-N 3.13Å; I451-L455 HydrophobicContact CG2-CD1 3.95Å; I451-L455 HydrophobicContact CG2-CG 4.36Å; I451-L455 WeakPolarHBondContact O-CG 3.46Å; I451-L455 PolarHBondContact O-N 3.02Å; I451-I463 HydrophobicContact CB-CD1 4.44Å; I451-I463 HydrophobicContact CD1-CD1 4.21Å; I451-I463 HydrophobicContact CG1-CD1 4.07Å; I451-I463 HydrophobicContact CG2-CD1 3.55Å; I451-F472 HydrophobicContact CD1-CE2 4.3Å
452L90.7Very high90Very high67 Ų6793.3 Ų93.335%0.35146%0.461SS..Hα-helixtrans-60.7-38.7177.8-72.6175.4000112.1R448 E449 R456R448-L452 HydrophobicContact CG-CD1 4.06Å; R448-L452 WeakPolarHBondContact O-CB 3.49Å; R448-L452 VanDerWaalsContact O-CG 3.29Å; R448-L452 WeakPolarHBondContact O-CG 3.34Å; R448-L452 PolarHBondContact O-N 3.33Å; E449-L452 PolarHBondContact O-N 3.42Å; L452-R456 WeakPolarHBondContact O-CG 3.42Å; L452-R456 PolarHBondContact O-N 2.85Å; L452-R456 VanDerWaalsContact O-N 3.14Å
453N92.9Very high90Very high67 Ų6794.5 Ų94.536%0.35847%0.467SS..Hα-helixtrans-68.9-35.2176.2-73.5-32.5000112.4E449 T450 I451 R456 K457E449-N453 WeakPolarHBondContact O-CB 3.46Å; E449-N453 PolarHBondContact O-N 3.26Å; E449-N453 PolarHBondContact O-ND2 2.8Å; E449-N453 VanDerWaalsContact O-ND2 3.07Å; T450-N453 PolarHBondContact O-N 3.21Å; I451-N453 VanDerWaalsContact C-N 3.28Å; I451-N453 PolarHBondContact O-N 3.36Å; N453-R456 PolarHBondContact OD1-NH1 2.65Å; N453-K457 WeakPolarHBondContact O-CG 3.37Å; N453-K457 PolarHBondContact O-N 2.71Å
454L92.3Very high90.1Very high71 Ų7196.9 Ų96.937%0.37249%0.485SS..Hα-helixtrans-68.8-44175.9-71.9173.4000112T450 I451 R456 K457 H458 V461T450-L454 HydrophobicContact CG2-CD1 4.45Å; T450-L454 WeakPolarHBondContact O-CG 3.38Å; T450-L454 PolarHBondContact O-N 3Å; I451-L454 PolarHBondContact O-N 2.89Å; I451-L454 VanDerWaalsContact O-N 3.13Å; L454-R456 VanDerWaalsContact C-N 3.29Å; L454-R456 PolarHBondContact O-N 2.95Å; L454-K457 PolarHBondContact O-N 3.39Å; L454-K457 VanDerWaalsContact O-N 3.08Å; L454-H458 PolarHBondContact O-N 3.22Å; L454-H458 PolarHBondContact O-ND1 2.78Å; L454-H458 VanDerWaalsContact O-ND1 3.09Å; L454-V461 HydrophobicContact CB-CG1 4.28Å; L454-V461 HydrophobicContact CB-CG2 4.2Å
455L92.5Very high90.2Very high98 Ų9898.5 Ų98.551%0.51350%0.503SS..Hα-helixtrans-62.6-33176.4-72172.1000112.8I451 K457 V461I451-L455 HydrophobicContact CG2-CD1 3.95Å; I451-L455 HydrophobicContact CG2-CG 4.36Å; I451-L455 WeakPolarHBondContact O-CG 3.46Å; I451-L455 PolarHBondContact O-N 3.02Å; L455-K457 VanDerWaalsContact C-N 3.32Å; L455-V461 HydrophobicContact CD2-CB 4.12Å; L455-V461 HydrophobicContact CD2-CG2 4.05Å
456R92.9Very high90Very high174 Ų174102.3 Ų102.366%0.65753%0.526SS*.Hα-helixtrans-70.6-27.3174.1-73.8-174.7-139130.56.9113.2L452 N453 L454L452-R456 WeakPolarHBondContact O-CG 3.42Å; L452-R456 PolarHBondContact O-N 2.85Å; L452-R456 VanDerWaalsContact O-N 3.14Å; N453-R456 PolarHBondContact OD1-NH1 2.65Å; L454-R456 VanDerWaalsContact C-N 3.29Å; L454-R456 PolarHBondContact O-N 2.95Å
457K93.9Very high89.3Confident166 Ų166102.4 Ų102.472%0.72254%0.537SS*.Hα-helixtrans-96-27.8-173-72.7177.8-178.5-178.40113.6N453 L454 L455N453-K457 WeakPolarHBondContact O-CG 3.37Å; N453-K457 PolarHBondContact O-N 2.71Å; L454-K457 PolarHBondContact O-N 3.39Å; L454-K457 VanDerWaalsContact O-N 3.08Å; L455-K457 VanDerWaalsContact C-N 3.32Å
458H93.4Very high88.2Confident102 Ų10299.8 Ų99.847%0.47254%0.537SS..  trans-125.5139.9-173.1-51.886.4000110.5L454 V460 V461L454-H458 PolarHBondContact O-N 3.22Å; L454-H458 PolarHBondContact O-ND1 2.78Å; L454-H458 VanDerWaalsContact O-ND1 3.09Å; H458-V460 VanDerWaalsContact C-N 3.29Å; H458-V461 HydrophobicContact CB-CG2 3.93Å
459Q91.3Very high87.2Confident202 Ų20297.5 Ų97.594%0.94453%0.533SS*.SBendtrans-69.2-29.3175.8-173.8176.85.400112.3
460V91.8Very high85.8Confident118 Ų118101.4 Ų101.472%0.71555%0.545SS*.  trans-131127.9178.9-175.70000108.9H458H458-V460 VanDerWaalsContact C-N 3.29Å
461V91.8Very high84.4Confident42 Ų42101.6 Ų101.626%0.25554%0.543SS..  trans-130.9125.3176.3-179.20000108L454 L455 H458 I463L454-V461 HydrophobicContact CB-CG1 4.28Å; L454-V461 HydrophobicContact CB-CG2 4.2Å; L455-V461 HydrophobicContact CD2-CB 4.12Å; L455-V461 HydrophobicContact CD2-CG2 4.05Å; H458-V461 HydrophobicContact CB-CG2 3.93Å; V461-I463 HydrophobicContact CG1-CD1 4.5Å; V461-I463 HydrophobicContact CG1-CG1 3.91Å
462V89.7Confident82.6Confident134 Ų134110.8 Ų110.881%0.81258%0.583SS**  trans-99.1121.2172.5-178.70000107.9
463I87.6Confident82.2Confident72 Ų72113 Ų11337%0.36959%0.594SS.*  trans-112.8117.3177.1-51.2172.1000107.2I451 V461 L471I451-I463 HydrophobicContact CB-CD1 4.44Å; I451-I463 HydrophobicContact CD1-CD1 4.21Å; I451-I463 HydrophobicContact CG1-CD1 4.07Å; I451-I463 HydrophobicContact CG2-CD1 3.55Å; V461-I463 HydrophobicContact CG1-CD1 4.5Å; V461-I463 HydrophobicContact CG1-CG1 3.91Å; I463-L471 HydrophobicContact CG2-CD1 4.06Å; I463-L471 HydrophobicContact CG2-CD2 3.54Å; I463-L471 HydrophobicContact CG2-CG 4.46Å
464S87.4Confident81.6Confident114 Ų114115.4 Ų115.480%0.79761%0.607SS**  trans-105.4145.3174.7570000110.4
465G85.1Confident81Confident47 Ų47117.9 Ų117.949%0.48562%0.62SS.*  trans-153.2154.2179.500000111.1
466M81.4Confident80.3Confident163 Ų163119.1 Ų119.180%0.80363%0.626SS**  trans-74.9155.1174.8-62.917369.900110.1G468 T469M466-G468 PolarHBondContact O-N 3.05Å; M466-G468 VanDerWaalsContact O-N 3.14Å; M466-T469 HydrophobicContact CB-CG2 4.44Å; M466-T469 WeakPolarHBondContact O-CB 3.09Å; M466-T469 WeakPolarHBondContact O-CG2 3.36Å; M466-T469 PolarHBondContact O-N 2.98Å; M466-T469 PolarHBondContact O-OG1 3.07Å
467T71.7Confident79.5Confident159 Ų159115.6 Ų115.698%0.97562%0.624SS**THydrogen-bonded Turntrans-53.8123177.5-47.90000110.7
468G66.4Low78.6Confident44 Ų44112.3 Ų112.345%0.45462%0.618SS.*THydrogen-bonded Turntrans99.4-0.8-175.200000115.2M466 Y470M466-G468 PolarHBondContact O-N 3.05Å; M466-G468 VanDerWaalsContact O-N 3.14Å; G468-Y470 WeakPolarHBondContact O-CD2 3.42Å; G468-Y470 PolarHBondContact O-N 3Å
469T66.8Low77.5Confident36 Ų36113 Ų11322%0.22163%0.628CS.*SBendtrans-72.7-7170.153.80000113.5P443 A444 M466 L471P443-T469 HydrophobicContact CG-CG2 4.22Å; A444-T469 VanDerWaalsContact CB-O 3.3Å; A444-T469 WeakPolarHBondContact CB-O 3.4Å; M466-T469 HydrophobicContact CB-CG2 4.44Å; M466-T469 WeakPolarHBondContact O-CB 3.09Å; M466-T469 WeakPolarHBondContact O-CG2 3.36Å; M466-T469 PolarHBondContact O-N 2.98Å; M466-T469 PolarHBondContact O-OG1 3.07Å; T469-L471 PolarHBondContact O-N 3.16Å
470Y62.1Low76.5Confident168 Ų168106.2 Ų106.266%0.65960%0.604SS**  trans37.470-177.6-62.1-81.7000111.8L442 G468 F472L442-Y470 HydrophobicContact CD1-CD2 4.46Å; L442-Y470 HydrophobicContact CD2-CD2 3.72Å; L442-Y470 HydrophobicContact CD2-CE2 4.25Å; G468-Y470 WeakPolarHBondContact O-CD2 3.42Å; G468-Y470 PolarHBondContact O-N 3Å; Y470-F472 PolarHBondContact O-N 3.41Å; Y470-F472 VanDerWaalsContact O-N 3.16Å
471L60.8Low75.2Confident72 Ų72105.2 Ų105.238%0.37759%0.594SS.*  trans-72.2104.9170.5-71169.5000107.9I463 T469I463-L471 HydrophobicContact CG2-CD1 4.06Å; I463-L471 HydrophobicContact CG2-CD2 3.54Å; I463-L471 HydrophobicContact CG2-CG 4.46Å; T469-L471 PolarHBondContact O-N 3.16Å
472F51.5Low73.7Confident211 Ų211110.9 Ų110.993%0.92563%0.625SS**  trans32.30173.5-74.2-76.8000119.5I451 Y470I451-F472 HydrophobicContact CD1-CE2 4.3Å; Y470-F472 PolarHBondContact O-N 3.41Å; Y470-F472 VanDerWaalsContact O-N 3.16Å

Retrieved 472 of 472 residues in 73.8 ms (Link to these results)