A0A077ZIX1_TRITR Loading...

Pkinase Tyr domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZIX1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 287 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
1M28Very low24.4Very low219 Ų219121.7 Ų121.7100%1.07969%0.689SS**  051.50-64.5-168.4-178.200107.4
2D26.4Very low25.4Very low141 Ų141118.8 Ų118.875%0.75466%0.663SS**  8892.375.6-57.8-20.2000107.4
3Q21Very low27.2Very low167 Ų167115.8 Ų115.878%0.7864%0.641SS**  63.6123.899.9-75.1-150.20.600113.4
4I24.8Very low28.9Very low162 Ų162109.2 Ų109.283%0.83161%0.606SS**  trans163.981.1145-78.6151000103.9
5E22.1Very low30.2Very low170 Ų170103.3 Ų103.379%0.79457%0.571SS**  64.2134.185.6-82.2-169.314100115.1A7E5-A7 PolarHBondContact O-N 3.47Å
6A22.9Very low31Very low98 Ų9896.8 Ų96.881%0.8154%0.536SS*.  trans-60122.7-168.400000113.1G8A6-G8 PolarHBondContact O-N 2.81Å
7A22.6Very low31.9Very low102 Ų10291.1 Ų91.184%0.84350%0.504SS*.  trans-72.275.6156.900000108.9E5 V9E5-A7 PolarHBondContact O-N 3.47Å; A7-V9 PolarHBondContact O-N 2.7Å
8G21.8Very low32.3Very low52 Ų5286.2 Ų86.254%0.53648%0.477SS..  trans-64.4109.1167.800000109.3A6 E10A6-G8 PolarHBondContact O-N 2.81Å; G8-E10 PolarHBondContact O-N 3.04Å
9V25Very low32.4Very low48 Ų4882.9 Ų82.929%0.29146%0.46SS..  trans-66102.7167.2-174.60000107.4A7 L11 R271A7-V9 PolarHBondContact O-N 2.7Å; V9-L11 HydrophobicContact CG1-CG 4.38Å; V9-L11 PolarHBondContact O-N 3.36Å; V9-R271 PolarHBondContact O-NH1 3.06Å
10E25.1Very low32.4Very low147 Ų14780 Ų8069%0.68745%0.446SS*.  trans-66.2105.8165.5-70.3-173.9153.800108G8 F12G8-E10 PolarHBondContact O-N 3.04Å; E10-F12 HydrophobicContact CB-CD2 3.91Å; E10-F12 HydrophobicContact CB-CE2 3.57Å; E10-F12 HydrophobicContact CB-CZ 4.36Å; E10-F12 HydrophobicContact CG-CE2 4.41Å; E10-F12 PolarHBondContact O-N 3.28Å; E10-F12 WeakPolarHBondContact OE2-CE2 3.16Å; E10-F12 VanDerWaalsContact OE2-CZ 3.23Å; E10-F12 WeakPolarHBondContact OE2-CZ 2.86Å
11L28.6Very low32.4Very low33 Ų3378.9 Ų78.917%0.17344%0.441CS..  trans-87.897.3169.4-79169.1000106.8V9 E13 F15 L198V9-L11 HydrophobicContact CG1-CG 4.38Å; V9-L11 PolarHBondContact O-N 3.36Å; L11-E13 PolarHBondContact O-N 2.76Å; L11-F15 HydrophobicContact CB-CE2 3.98Å; L11-F15 HydrophobicContact CD2-CE2 4.3Å; L11-F15 HydrophobicContact CD2-CZ 4.25Å; L11-L198 HydrophobicContact CD1-CD1 4.27Å; L11-L198 HydrophobicContact CD2-CD1 3.52Å
12F36.5Very low32.4Very low87 Ų8772.6 Ų72.638%0.38242%0.419SS..  trans-74.5116.1-176.4-84.7-89.6000112.5E10 F163E10-F12 HydrophobicContact CB-CD2 3.91Å; E10-F12 HydrophobicContact CB-CE2 3.57Å; E10-F12 HydrophobicContact CB-CZ 4.36Å; E10-F12 HydrophobicContact CG-CE2 4.41Å; E10-F12 PolarHBondContact O-N 3.28Å; E10-F12 WeakPolarHBondContact OE2-CE2 3.16Å; E10-F12 VanDerWaalsContact OE2-CZ 3.23Å; E10-F12 WeakPolarHBondContact OE2-CZ 2.86Å; F12-F163 HydrophobicContact CE1-CD2 4.43Å; F12-F163 HydrophobicContact CE1-CE2 4.29Å; F12-F163 HydrophobicContact CE2-CE2 4.49Å; F12-F163 HydrophobicContact CZ-CD2 4.35Å; F12-F163 AromaticContact CZ-CE2 3.93Å; F12-F163 HydrophobicContact CZ-CE2 3.93Å
13E49.3Very low32.5Very low80 Ų8073.4 Ų73.437%0.37442%0.423SS..SBendtrans46.4137.7149.8-65.3-160.7-162.700121L11 D272 R276L11-E13 PolarHBondContact O-N 2.76Å; E13-D272 VanDerWaalsContact CG-OD2 3.31Å; E13-D272 WeakPolarHBondContact CG-OD2 3.39Å; E13-R276 VanDerWaalsContact CD-NH1 3.26Å; E13-R276 IonicContact OE1-NH1 3.08Å; E13-R276 PolarHBondContact OE1-NH1 3.04Å; E13-R276 IonicContact OE2-CZ 3.55Å; E13-R276 IonicContact OE2-NH1 3.62Å; E13-R276 PolarHBondContact OE2-NH1 3.23Å
14P50.1Low32.8Very low23 Ų2370 Ų7015%0.14941%0.414CS..  -89.6130.3-86.232.4-22.6000111.6V16 R276 V277P14-V16 PolarHBondContact O-N 3.19Å; P14-R276 HydrophobicContact CG-CB 4.32Å; P14-R276 WeakPolarHBondContact CG-O 3.44Å; P14-V277 HydrophobicContact CB-CG2 4.02Å
15F49.5Very low32.7Very low20 Ų2068.1 Ų68.19%0.08842%0.415CS..  trans-76.8-9.3177.7-61.1-80.9000113.3L11 E195 M199 V207 L208 H270L11-F15 HydrophobicContact CB-CE2 3.98Å; L11-F15 HydrophobicContact CD2-CE2 4.3Å; L11-F15 HydrophobicContact CD2-CZ 4.25Å; F15-E195 HydrophobicContact CE1-CG 3.99Å; F15-E195 HydrophobicContact CZ-CG 3.89Å; F15-M199 HydrophobicContact CD1-CG 3.72Å; F15-M199 HydrophobicContact CD1-SD 4.31Å; F15-M199 HydrophobicContact CE1-CG 3.49Å; F15-M199 VanDerWaalsContact CE1-CG 3.49Å; F15-M199 HydrophobicContact CE1-SD 3.93Å; F15-V207 VanDerWaalsContact O-CG1 3.3Å; F15-V207 WeakPolarHBondContact O-CG1 3.25Å; F15-L208 PolarHBondContact O-N 3.24Å; F15-H270 AromaticContact CD2-NE2 3.79Å; F15-H270 PolarHBondContact N-NE2 3.2Å
16V43.1Very low32.9Very low0 Ų069.2 Ų69.20%042%0.417CS..BIsolated β-bridgetrans-92.3138.3-176.7-178.70000109.9P14 V256 M260 I263 L273 V277P14-V16 PolarHBondContact O-N 3.19Å; V16-V256 HydrophobicContact CG1-CG1 4.36Å; V16-M260 HydrophobicContact CG2-CG 4.43Å; V16-M260 HydrophobicContact CG2-SD 3.67Å; V16-I263 HydrophobicContact CG2-CD1 3.57Å; V16-L273 HydrophobicContact CB-CD1 3.95Å; V16-L273 HydrophobicContact CG1-CD1 4.34Å; V16-L273 HydrophobicContact CG2-CD1 3.82Å; V16-V277 HydrophobicContact CB-CG1 4.44Å; V16-V277 HydrophobicContact CB-CG2 3.95Å; V16-V277 HydrophobicContact CG1-CG1 4.2Å; V16-V277 HydrophobicContact CG1-CG2 4.37Å; V16-V277 WeakPolarHBondContact O-CG1 3.4Å
17C44.8Very low32.9Very low0 Ų067.8 Ų67.80%041%0.406CS..EExtended strand (participates in β ladder)trans-131140.5176-163.40000109.5C19 N206 L208 C227 S278 V280C17-C19 PolarHBondContact O-N 3.38Å; C17-N206 PolarHBondContact N-O 2.87Å; C17-N206 CarbonylContact O-C 3.57Å; C17-N206 WeakPolarHBondContact O-CA 3.42Å; C17-L208 HydrophobicContact CB-CB 4.06Å; C17-L208 HydrophobicContact CB-CD1 4.39Å; C17-C227 PolarHBondContact SG-SG 2.71Å; C17-S278 CarbonylContact C-O 3.54Å; C17-S278 VanDerWaalsContact CA-O 3.25Å; C17-S278 WeakPolarHBondContact CA-O 3.3Å; C17-S278 PolarHBondContact SG-O 2.84Å; C17-V280 HydrophobicContact CB-CG2 4.41Å; C17-V280 WeakPolarHBondContact SG-CG2 3.3Å
18V39.3Very low32.9Very low3 Ų369.8 Ų69.82%0.01841%0.408CS..EExtended strand (participates in β ladder)trans-88.7101.8178.9-156.20000108.8L252 D255 V256 V277 S278 I279 V280V18-L252 HydrophobicContact CB-CD2 4.18Å; V18-L252 HydrophobicContact CG1-CB 4.4Å; V18-L252 HydrophobicContact CG1-CD2 3.55Å; V18-D255 HydrophobicContact CG1-CB 3.28Å; V18-V256 HydrophobicContact CG1-CG2 4.41Å; V18-V256 HydrophobicContact CG2-CG2 3.63Å; V18-V277 HydrophobicContact CG2-CG1 3.56Å; V18-S278 PolarHBondContact N-O 3.4Å; V18-I279 HydrophobicContact CG2-CG1 4.39Å; V18-V280 PolarHBondContact O-N 2.83Å
19C34.2Very low33.1Very low23 Ų2374 Ų7416%0.15542%0.417CS..  trans-105.3122.9170.6-92.40000111.7C17 T21 P205 N206 D255 V280C17-C19 PolarHBondContact O-N 3.38Å; C19-T21 PolarHBondContact O-N 3.28Å; C19-P205 VanDerWaalsContact CB-C 3.44Å; C19-P205 HydrophobicContact CB-CB 4.08Å; C19-P205 WeakPolarHBondContact CB-O 3.2Å; C19-P205 PolarHBondContact SG-O 3.45Å; C19-N206 PolarHBondContact N-ND2 3.21Å; C19-N206 PolarHBondContact O-ND2 3.05Å; C19-D255 VanDerWaalsContact O-CG 3.29Å; C19-V280 VanDerWaalsContact SG-CB 3.58Å; C19-V280 WeakPolarHBondContact SG-CG2 3.37Å
20S33.9Very low33Very low24 Ų2474.3 Ų74.317%0.16843%0.429CS..  trans-70.3112.9165.1160.50000110S22 D255 R286S20-S22 PolarHBondContact O-N 2.95Å; S20-D255 WeakPolarHBondContact CA-OD2 3.41Å; S20-R286 PolarHBondContact OG-NH2 3.45Å
21T32.2Very low33Very low58 Ų5871.8 Ų71.836%0.35643%0.434SS..  trans-77.7103.4157.656.10000108.4C19 D23 P205C19-T21 PolarHBondContact O-N 3.28Å; T21-D23 VanDerWaalsContact C-N 3.27Å; T21-D23 PolarHBondContact O-N 3.08Å; T21-P205 HydrophobicContact CG2-CB 3.87Å; T21-P205 HydrophobicContact CG2-CG 3.82Å
22S27.9Very low32.9Very low87 Ų8776.8 Ų76.861%0.60847%0.466SS*.  trans-75.881.2165.7510000108.9S20S20-S22 PolarHBondContact O-N 2.95Å
23D27.6Very low32.5Very low157 Ų15777.6 Ų77.684%0.8448%0.482SS*.  trans-160.950.5167.4-98.8-21000111.2T21T21-D23 VanDerWaalsContact C-N 3.27Å; T21-D23 PolarHBondContact O-N 3.08Å
24T28.3Very low31.4Very low97 Ų9777.7 Ų77.760%0.59549%0.492SS*.  trans-128.798.5155.451.20000107.7F26T24-F26 PolarHBondContact O-N 2.7Å
25S22.1Very low30.4Very low121 Ų12186 Ų8685%0.84653%0.526SS*.  trans-55.486.7157.341.70000108.7A27S25-A27 PolarHBondContact O-N 3.18Å
26F27.1Very low29.4Very low193 Ų19390.8 Ų90.885%0.84655%0.552SS**  trans-74.886158.6-109.6-88.7000106.4T24 T28T24-F26 PolarHBondContact O-N 2.7Å; F26-T28 PolarHBondContact O-N 3.16Å
27A22.6Very low28.7Very low69 Ų6998 Ų9857%0.5759%0.591SS**  trans-51.2125.2159.100000107.6S25 I29S25-A27 PolarHBondContact O-N 3.18Å; A27-I29 VanDerWaalsContact C-N 3.3Å; A27-I29 PolarHBondContact O-N 3.24Å
28T22.4Very low27.8Very low143 Ų143105.3 Ų105.388%0.87763%0.629SS**  trans-51.593.8166-54.90000109F26F26-T28 PolarHBondContact O-N 3.16Å
29I24.9Very low27.1Very low141 Ų141116.4 Ų116.472%0.72367%0.671SS**  trans-106107.4160.6-61.1-179.5000104.7A27A27-I29 VanDerWaalsContact C-N 3.3Å; A27-I29 PolarHBondContact O-N 3.24Å
30G24.6Very low26.7Very low54 Ų54121.4 Ų121.456%0.55770%0.704SS**  trans-53.6159.5177.100000111.8
31A25.3Very low26.2Very low95 Ų95125.4 Ų125.479%0.78573%0.733SS**SBendtrans-34.5144168.300000112.4
32T25.7Very low26Very low137 Ų137128.1 Ų128.184%0.8475%0.751SS**  trans94.373.6177.175.90000116.2
33S27.4Very low26.1Very low105 Ų105132.2 Ų132.273%0.73477%0.765SS**  trans-167.7145.1140.639.80000110.3
34S26.6Very low26Very low82 Ų82133.7 Ų133.757%0.57377%0.767SS**  trans-68.1142.6-164.968.50000113.9D36S34-D36 WeakPolarHBondContact CB-OD2 3.04Å; S34-D36 PolarHBondContact O-N 2.95Å; S34-D36 PolarHBondContact OG-OD2 3.22Å
35F28.9Very low26Very low196 Ų196135.4 Ų135.486%0.8678%0.777SS**SBendtrans-7948.8169.2-96.5-87.9000111L38F35-L38 HydrophobicContact CD1-CD1 4.41Å; F35-L38 HydrophobicContact CE1-CD1 4.5Å
36D29.3Very low26.2Very low121 Ų121134.7 Ų134.765%0.64777%0.772SS**  trans-95.93-179.3-72.6-42.1000114.2S34S34-D36 WeakPolarHBondContact CB-OD2 3.04Å; S34-D36 PolarHBondContact O-N 2.95Å; S34-D36 PolarHBondContact OG-OD2 3.22Å
37N28.4Very low26.4Very low152 Ų152133 Ų13381%0.81377%0.772SS**  trans-115.616.7-169.9-79.2-38.6000116.7R39N37-R39 PolarHBondContact O-N 2.83Å
38L25.9Very low26.5Very low153 Ų153134.8 Ų134.880%0.80178%0.78SS**  trans-95.567.3166.5-78.5159.9000110.5F35 C40F35-L38 HydrophobicContact CD1-CD1 4.41Å; F35-L38 HydrophobicContact CE1-CD1 4.5Å; L38-C40 PolarHBondContact O-N 3.07Å
39R23.3Very low26.8Very low237 Ų237139.2 Ų139.289%0.89478%0.783SS**  trans-74.5100.8164.2-85.5-173.6174.2-149.7-1.3109.1N37N37-R39 PolarHBondContact O-N 2.83Å
40C26.7Very low26.8Very low127 Ų127141.3 Ų141.386%0.85879%0.789SS**  trans-77.4114.4153.1-99.90000108L38L38-C40 PolarHBondContact O-N 3.07Å
41S23.4Very low27.1Very low109 Ų109145.3 Ų145.376%0.76280%0.803SS**PPolyproline II helixtrans-61126.2176.3-57.40000110.8L43S41-L43 PolarHBondContact O-N 3.36Å
42P27.3Very low27.4Very low114 Ų114147.7 Ų147.774%0.7480%0.802SS**PPolyproline II helixtrans-74.4122.2171.828-28.5000109.2H44P42-H44 PolarHBondContact O-N 3.17Å
43L30.1Very low27.7Very low173 Ų173149.2 Ų149.291%0.90680%0.8SS**PPolyproline II helixtrans-60.7116.6161.9-84.4157.5000107.8S41 T45S41-L43 PolarHBondContact O-N 3.36Å; L43-T45 PolarHBondContact O-N 3.43Å
44H26.4Very low27.8Very low188 Ų188151.2 Ų151.287%0.8780%0.801SS**  trans-41.7119-179-91.9-100.3000113.2P42P42-H44 PolarHBondContact O-N 3.17Å
45T29Very low28Very low134 Ų134153 Ų15382%0.82281%0.811SS**  trans-129.5121.3144.752.90000107.5L43 N47L43-T45 PolarHBondContact O-N 3.43Å; T45-N47 PolarHBondContact O-N 2.74Å
46S26.3Very low28Very low105 Ų105148.4 Ų148.473%0.73480%0.803SS**  trans-69.1116.1-179.549.70000110.1
47N29.3Very low28.2Very low159 Ų159149.8 Ų149.885%0.8581%0.81SS**  trans-169.9109.1140.1-89.6-19.2000108.5T45T45-N47 PolarHBondContact O-N 2.74Å
48S25.7Very low28.4Very low105 Ų105149.7 Ų149.773%0.73481%0.809SS**  trans-79128.6-178.746.70000112.2
49Y28.9Very low28.7Very low237 Ų237145.5 Ų145.593%0.92980%0.803SS**  trans-148.2114.1148.3-76.9-75.7000108.8
50E25.3Very low29.2Very low185 Ų185140.6 Ų140.686%0.86480%0.799SS**  trans-73.8142.4170.1-75.6167124.200110.8
51V30.8Very low29.3Very low138 Ų138142.4 Ų142.484%0.83680%0.8SS**  trans-157.1107.2137.9-169.60000110.8
52D31.3Very low29.6Very low145 Ų145146.6 Ų146.678%0.77580%0.8SS**  trans40.5121.1133.5-51.8-31.5000125.5
53E31.2Very low29.8Very low169 Ų169146.2 Ų146.279%0.7980%0.795SS**  trans12.2125.8144.3-66.5-170.2150.100125.8
54L30.2Very low29.8Very low147 Ų147144.4 Ų144.477%0.7779%0.794SS**  63.6165.2129.1-72.9157.7000119.8
55P29.8Very low30.1Very low120 Ų120143.7 Ų143.778%0.77979%0.791SS**  cis-139.6177.116.935.3-11.7000117.6
56S29.3Very low30.1Very low98 Ų98142.6 Ų142.669%0.68578%0.777SS**  trans-71.2152.5175.353.60000115.5
57L33.1Very low30.2Very low151 Ų151150 Ų15079%0.79179%0.788SS**  trans166.9130.5130.8-89.8155.5000113.2
58D33.5Very low30Very low150 Ų150154.8 Ų154.880%0.80280%0.795SS**  trans25.4128.7139.5-58.5-14.8000122
59G30.9Very low30.1Very low64 Ų64153 Ų15366%0.6679%0.792SS**  87.6118.9128.800000118.4
60T33.7Very low30Very low135 Ų135146.2 Ų146.283%0.82879%0.785SS**  trans86.7123.9152.873.60000118.8
61N30.5Very low30.1Very low164 Ų164147.8 Ų147.888%0.87779%0.785SS**  trans45.393.1154.6-74.9-13.3000117.5
62R28.4Very low29.8Very low198 Ų198145.1 Ų145.175%0.74779%0.785SS**  trans-127.9139149.3-64.7-158.8-164.4-175.64111.6E66R62-E66 WeakPolarHBondContact CD-OE2 3.44Å; R62-E66 IonicContact CZ-OE2 3.89Å; R62-E66 IonicContact NE-OE2 2.82Å; R62-E66 IonicContact NH1-OE1 3.93Å; R62-E66 PolarHBondContact NH1-OE1 2.9Å; R62-E66 IonicContact NH1-OE2 3.47Å; R62-E66 PolarHBondContact NH1-OE2 3.47Å
63T31.5Very low29.5Very low105 Ų105146 Ų14664%0.64478%0.784SS**  trans-62.4165.3178.246.20000111.4E65T63-E65 PolarHBondContact O-N 3.34Å
64P31.1Very low29.3Very low136 Ų136145.2 Ų145.288%0.88378%0.78SS**THydrogen-bonded Turntrans-65.518.6-170.1-21.133.4000117.7
65E32Very low29Very low173 Ų173145.7 Ų145.781%0.80878%0.783SS**THydrogen-bonded Turntrans-110.97.5-169.3-73.6-178148.100115.6T63T63-E65 PolarHBondContact O-N 3.34Å
66E29.1Very low28.7Very low111 Ų111147.2 Ų147.252%0.51978%0.777SS.*  trans-131.887.6-178-72.4-177.5149.400113.3R62R62-E66 WeakPolarHBondContact CD-OE2 3.44Å; R62-E66 IonicContact CZ-OE2 3.89Å; R62-E66 IonicContact NE-OE2 2.82Å; R62-E66 IonicContact NH1-OE1 3.93Å; R62-E66 PolarHBondContact NH1-OE1 2.9Å; R62-E66 IonicContact NH1-OE2 3.47Å; R62-E66 PolarHBondContact NH1-OE2 3.47Å
67W27.6Very low28.5Very low260 Ų260147.2 Ų147.299%0.98577%0.773SS**  trans-133.496155-73.993.5000108.8
68R25.9Very low28Very low260 Ų260150.7 Ų150.798%0.98178%0.776SS**  trans-121.5103.4166.2-114.2-172.3-92.4-120.1-0107.2
69G26.8Very low27.6Very low66 Ų66152.3 Ų152.368%0.6878%0.776SS**  trans-118.9144.9174.800000110.1
70A28Very low27.3Very low95 Ų95152.9 Ų152.979%0.78577%0.77SS**SBendtrans-49.2148.1-167.700000115
71Y27.1Very low26.7Very low219 Ų219154.3 Ų154.386%0.85977%0.773SS**SBendtrans74.793.9-158.9-53.1-76.5000112.3H73Y71-H73 VanDerWaalsContact C-N 3.26Å; Y71-H73 PolarHBondContact O-N 3.16Å
72G25.3Very low26.4Very low81 Ų81151.7 Ų151.784%0.83577%0.767SS**SBendtrans-62.866.1-172.100000117
73H25.2Very low26.2Very low165 Ų165147.1 Ų147.176%0.76476%0.757SS**  trans-129120165-76.6-81.5000110.3Y71 L75Y71-H73 VanDerWaalsContact C-N 3.26Å; Y71-H73 PolarHBondContact O-N 3.16Å; H73-L75 PolarHBondContact O-N 2.96Å
74E25.2Very low25.8Very low151 Ų151146.5 Ų146.571%0.70676%0.755SS**  trans-73102.4177.4-163.5-179.8-157.100109.3K76E74-K76 HydrophobicContact CG-CD 4.21Å; E74-K76 HydrophobicContact CG-CG 4.08Å; E74-K76 PolarHBondContact O-N 2.91Å; E74-K76 WeakPolarHBondContact OE1-CE 3.41Å; E74-K76 IonicContact OE1-NZ 3.39Å; E74-K76 PolarHBondContact OE1-NZ 3.46Å; E74-K76 IonicContact OE2-NZ 2.91Å; E74-K76 PolarHBondContact OE2-NZ 3.28Å; E74-K76 VanDerWaalsContact OE2-NZ 3.08Å
75L24.2Very low25.4Very low157 Ų157149.1 Ų149.182%0.82275%0.749SS**  trans-73.577.8167.3-95.2157000109.2H73 T77H73-L75 PolarHBondContact O-N 2.96Å; L75-T77 HydrophobicContact CD2-CG2 4.42Å; L75-T77 PolarHBondContact O-N 3.46Å
76K23.6Very low25Very low153 Ų153150.3 Ų150.367%0.66575%0.746SS**  trans-82.882.1166.6-96.1172.1176.9148.40109.4E74 R78E74-K76 HydrophobicContact CG-CD 4.21Å; E74-K76 HydrophobicContact CG-CG 4.08Å; E74-K76 PolarHBondContact O-N 2.91Å; E74-K76 WeakPolarHBondContact OE1-CE 3.41Å; E74-K76 IonicContact OE1-NZ 3.39Å; E74-K76 PolarHBondContact OE1-NZ 3.46Å; E74-K76 IonicContact OE2-NZ 2.91Å; E74-K76 PolarHBondContact OE2-NZ 3.28Å; E74-K76 VanDerWaalsContact OE2-NZ 3.08Å; K76-R78 VanDerWaalsContact C-N 3.34Å; K76-R78 PolarHBondContact O-N 3.09Å
77T26.6Very low24.7Very low97 Ų97154.1 Ų154.160%0.59576%0.764SS**  trans-81.784.8162.1550000108.7L75 F79L75-T77 HydrophobicContact CD2-CG2 4.42Å; L75-T77 PolarHBondContact O-N 3.46Å; T77-F79 PolarHBondContact O-N 3.34Å
78R22.4Very low24.6Very low224 Ų224147.7 Ų147.785%0.84575%0.754SS**  trans-78.8106153.2-91-170.9179.1-170.20.6106.5K76 S80K76-R78 VanDerWaalsContact C-N 3.34Å; K76-R78 PolarHBondContact O-N 3.09Å; R78-S80 PolarHBondContact O-N 3.17Å
79F24.4Very low24.6Very low184 Ų184140.2 Ų140.281%0.80774%0.739SS**  trans-68.284.9162.9-90.7-93.1000107.9T77T77-F79 PolarHBondContact O-N 3.34Å
80S23.9Very low24.7Very low76 Ų76142.8 Ų142.853%0.53175%0.746SS.*SBendtrans-146.7104.7162.764.30000107.2R78 S82R78-S80 PolarHBondContact O-N 3.17Å; S80-S82 PolarHBondContact O-N 3.32Å; S80-S82 VanDerWaalsContact O-N 3.11Å
81D22.8Very low24.8Very low166 Ų166145.8 Ų145.889%0.88875%0.748SS**SBendtrans36.258.5160.7-56.1-19.2000117.2
82S23.3Very low24.9Very low108 Ų108143.4 Ų143.476%0.75575%0.75SS**  trans-173.4120.3167.3-81.40000113.4S80S80-S82 PolarHBondContact O-N 3.32Å; S80-S82 VanDerWaalsContact O-N 3.11Å
83I23.7Very low25.1Very low103 Ų103149 Ų14953%0.52875%0.751SS.*  trans13.3117.8148.8-55.4166.3000117Y85I83-Y85 HydrophobicContact CB-CE2 4.17Å; I83-Y85 HydrophobicContact CG2-CD2 3.69Å; I83-Y85 HydrophobicContact CG2-CE2 3.41Å; I83-Y85 VanDerWaalsContact CG2-CE2 3.41Å; I83-Y85 HydrophobicContact CG2-CG 4.38Å
84C23.1Very low25.2Very low92 Ų92144.2 Ų144.262%0.62275%0.747SS**  trans-83.5114.6164.6-70.70000110.3
85Y22.5Very low25.3Very low190 Ų190142.3 Ų142.375%0.74575%0.75SS**  trans-90.1129.3169-77.7-87000110.7I83I83-Y85 HydrophobicContact CB-CE2 4.17Å; I83-Y85 HydrophobicContact CG2-CD2 3.69Å; I83-Y85 HydrophobicContact CG2-CE2 3.41Å; I83-Y85 VanDerWaalsContact CG2-CE2 3.41Å; I83-Y85 HydrophobicContact CG2-CG 4.38Å
86W24.5Very low25.3Very low199 Ų199140.9 Ų140.975%0.75475%0.748SS**  trans-96.8109.7164.4-67.591.6000108.6
87Q23Very low25.3Very low190 Ų190139.4 Ų139.489%0.88875%0.751SS**  trans-98.1115.2164.9-94.8178.7-44.200108.6
88T24.9Very low25.2Very low126 Ų126143.3 Ų143.377%0.77377%0.765SS**  trans-84135161.638.70000109.2S90T88-S90 PolarHBondContact O-N 3.13Å
89P26.8Very low25.1Very low103 Ų103144.1 Ų144.167%0.66977%0.768SS**  trans-64129.3176.8-16.728.9000110.6L91P89-L91 PolarHBondContact O-N 3.31Å
90S28Very low25Very low119 Ų119141.3 Ų141.383%0.83277%0.771SS**  trans-64.5101.8165.816.30000109.2T88 L92T88-S90 PolarHBondContact O-N 3.13Å; S90-L92 PolarHBondContact O-N 2.9Å; S90-L92 VanDerWaalsContact O-N 3.16Å
91L30Very low25.1Very low158 Ų158142.1 Ų142.183%0.82778%0.783SS**  trans-70109.3166.5-75.6172.4000109P89 F93P89-L91 PolarHBondContact O-N 3.31Å; L91-F93 PolarHBondContact O-N 3.42Å
92L28.6Very low25.2Very low170 Ų170142.1 Ų142.189%0.8978%0.783SS**  trans-55.3108161.3-80148.7000109.2S90S90-L92 PolarHBondContact O-N 2.9Å; S90-L92 VanDerWaalsContact O-N 3.16Å
93F29.8Very low25.3Very low197 Ų197149.4 Ų149.486%0.86479%0.794SS**  trans-132.6117.2155.4-100.8-84.6000109.4L91L91-F93 PolarHBondContact O-N 3.42Å
94G28.6Very low25.3Very low65 Ų65147.7 Ų147.767%0.6780%0.802SS**  trans-74.9159.1177.600000113.2
95S26.3Very low25.5Very low112 Ų112148.8 Ų148.878%0.78381%0.81SS**  trans62.2106.2154.2590000119.9
96T23.9Very low25.7Very low126 Ų126147.2 Ų147.277%0.77381%0.814SS**  82.5130127.1-36.50000119
97V24.7Very low25.7Very low122 Ų122144.7 Ų144.774%0.73982%0.815SS**  trans78.8114.8166.8-159.40000112.1
98M23.5Very low25.9Very low179 Ų179139.3 Ų139.388%0.88279%0.791SS**  -165.2144.460.6-155.6175.8-92.100111
99R21.8Very low25.9Very low242 Ų242137.7 Ų137.791%0.91379%0.785SS**  trans-62.5154.6171.2-72.5171.8168.4176.9-4.4111.7
100S22.4Very low25.9Very low124 Ų124133.9 Ų133.987%0.86776%0.759SS**  trans99.9102.1156.3-155.40000116.6
101A25.4Very low25.8Very low94 Ų94138.1 Ų138.178%0.77776%0.758SS**SBendtrans-169.9113.2133.100000110.2
102N24.9Very low25.8Very low165 Ų165134.5 Ų134.588%0.88274%0.742SS**  trans51.479.1158.8-72.9-11.8000119.4G104N102-G104 VanDerWaalsContact C-N 3.34Å; N102-G104 PolarHBondContact O-N 3.05Å
103R24.2Very low25.6Very low261 Ų261131.9 Ų131.999%0.98573%0.729SS**  trans-82.281.7148.4-76.5-173.1180-176.7-0.2109.5
104G24.4Very low25.7Very low68 Ų68130.8 Ų130.870%0.70173%0.726SS**  trans-98.669.8165.200000110.1N102 L106N102-G104 VanDerWaalsContact C-N 3.34Å; N102-G104 PolarHBondContact O-N 3.05Å; G104-L106 PolarHBondContact O-N 3.11Å; G104-L106 VanDerWaalsContact O-N 3.14Å
105S26.6Very low25.9Very low115 Ų115133.7 Ų133.780%0.80472%0.723SS**  trans-75.793.8171.9-175.20000108.2D107S105-D107 PolarHBondContact O-N 3.25Å
106L27.7Very low26.2Very low156 Ų156132.7 Ų132.782%0.81772%0.721SS**  trans-79.398171.7-78.5163.6000108.6G104 M108G104-L106 PolarHBondContact O-N 3.11Å; G104-L106 VanDerWaalsContact O-N 3.14Å; L106-M108 PolarHBondContact O-N 2.89Å; L106-M108 VanDerWaalsContact O-N 3.17Å
107D24.4Very low26.5Very low146 Ų146130.1 Ų130.178%0.78172%0.72SS**  trans-71.198.7169.8-163.63.4000108.7S105 S109S105-D107 PolarHBondContact O-N 3.25Å; D107-S109 PolarHBondContact O-N 2.91Å
108M26.7Very low26.8Very low77 Ų77133.5 Ų133.538%0.37973%0.725SS.*  trans-100.574.7-176.4-149.385.9-112.500110L106 I110 A139L106-M108 PolarHBondContact O-N 2.89Å; L106-M108 VanDerWaalsContact O-N 3.17Å; M108-I110 HydrophobicContact CG-CD1 3.9Å; M108-I110 HydrophobicContact CG-CG1 3.92Å; M108-I110 PolarHBondContact O-N 3.36Å; M108-A139 HydrophobicContact CE-CB 3.27Å; M108-A139 HydrophobicContact CG-CB 3.99Å; M108-A139 HydrophobicContact SD-CB 3.17Å; M108-A139 WeakPolarHBondContact SD-CB 3.43Å
109S25Very low27.1Very low93 Ų93134.7 Ų134.765%0.6572%0.72SS**  trans-69.699.3169.159.10000109.2D107D107-S109 PolarHBondContact O-N 2.91Å
110I28.1Very low27.7Very low22 Ų22132.7 Ų132.711%0.11372%0.717CS.*  trans-95.1102.2178.3-64.9166.7000108.2M108 V112 L140 L193M108-I110 HydrophobicContact CG-CD1 3.9Å; M108-I110 HydrophobicContact CG-CG1 3.92Å; M108-I110 PolarHBondContact O-N 3.36Å; I110-V112 HydrophobicContact CG2-CG2 3.85Å; I110-L140 HydrophobicContact CD1-CD2 4.15Å; I110-L140 HydrophobicContact CD1-CG 4.27Å; I110-L193 HydrophobicContact CD1-CD1 4.22Å; I110-L193 HydrophobicContact CD1-CD2 4.38Å
111Y25.1Very low28.1Very low209 Ų209136.3 Ų136.382%0.8272%0.717SS**  trans-83.3119.7156.3-86.6-98.3000107.6
112V30Very low28.4Very low81 Ų81137.9 Ų137.949%0.49171%0.713SS.*  trans-96.7111161.4-176.70000104.9I110 E114I110-V112 HydrophobicContact CG2-CG2 3.85Å; V112-E114 PolarHBondContact O-N 3.1Å; V112-E114 VanDerWaalsContact O-N 3.14Å
113D25Very low28.8Very low116 Ų116137.6 Ų137.662%0.6271%0.706SS**  trans-70.9105.3179.4-162.5-21.1000109E115 A116D113-E115 PolarHBondContact O-N 2.67Å; D113-E115 PolarHBondContact OD1-N 3.34Å; D113-A116 PolarHBondContact O-N 3.45Å
114E31.5Very low29Very low173 Ų173132.3 Ų132.381%0.80870%0.698SS**G310 helixtrans-64.8-15.2178.5-74.2-174.7154.400112.4V112V112-E114 PolarHBondContact O-N 3.1Å; V112-E114 VanDerWaalsContact O-N 3.14Å
115E32.5Very low29.3Very low126 Ų126134.1 Ų134.159%0.58970%0.7SS**G310 helixtrans-82.6-11.5-178.9-66.9-149.716400114.6D113 G117 K118 R119D113-E115 PolarHBondContact O-N 2.67Å; D113-E115 PolarHBondContact OD1-N 3.34Å; E115-G117 PolarHBondContact O-N 3.21Å; E115-K118 PolarHBondContact O-N 3.45Å; E115-R119 IonicContact OE2-NH2 3.51Å
116A32.2Very low29.4Very low91 Ų91136.9 Ų136.975%0.75270%0.697SS**G310 helixtrans-68.7-15179.600000113.7D113D113-A116 PolarHBondContact O-N 3.45Å
117G30.5Very low29.5Very low73 Ų73135 Ų13575%0.75370%0.696SS**G310 helixtrans-90.4-1.4-178.100000116.3E115E115-G117 PolarHBondContact O-N 3.21Å
118K30.4Very low29.8Very low192 Ų192138.7 Ų138.784%0.83570%0.699SS**SBendtrans-125.48.1-167.7-78.3-179.2-179.6167.90117.1E115E115-K118 PolarHBondContact O-N 3.45Å
119R30.4Very low30.1Very low205 Ų205140.7 Ų140.777%0.77471%0.711SS**  trans-111.3110.5-179-71-174.3-175.2-178.77.9114.5E115E115-R119 IonicContact OE2-NH2 3.51Å
120K33.9Very low30.6Very low200 Ų200143.5 Ų143.587%0.8772%0.718SS**  trans77.197.4149.9-74.4-178.5172.4179.60119.8N122K120-N122 PolarHBondContact O-N 3.06Å
121K30.2Very low31.1Very low199 Ų199148.3 Ų148.387%0.86575%0.753SS**  trans-50.1118.1130.5-69176.6175.9178.30109.2
122N32Very low31.8Very low128 Ų128143.9 Ų143.968%0.68475%0.747SS**  trans157.6137136.6-92.515.5000110.1K120K120-N122 PolarHBondContact O-N 3.06Å
123E33.3Very low32.5Very low158 Ų158142.9 Ų142.974%0.73874%0.742SS**  trans77.496.9151.9-66.1153-146.100116.5
124D28.2Very low33.6Very low151 Ų151139.9 Ų139.981%0.80773%0.73SS**  43.8137.2123-59.6-19.9000120
125S30.7Very low34.8Very low106 Ų106136.8 Ų136.874%0.74173%0.725SS**  trans90.3108.6163.379.20000117.2C127S125-C127 PolarHBondContact O-N 3.22Å
126F29.7Very low35.8Very low173 Ų173131.7 Ų131.776%0.75970%0.703SS**  trans41.278.1135.8-156.7-97.3000116.7
127C29.2Very low36.7Very low117 Ų117129.2 Ų129.279%0.79168%0.68SS**  trans-122.689.7160-80.10000109.2S125S125-C127 PolarHBondContact O-N 3.22Å
128R31.4Very low38Very low223 Ų223128.6 Ų128.684%0.84266%0.662SS**  trans-86.413.5158-80.7-170.7-165.8162.15.9111.9
129D33.1Very low39.4Very low119 Ų119120.1 Ų120.164%0.63663%0.627SS**  trans-98.6112.6-173.5-68.9-37.5000112.7
130L35.7Very low40.7Very low151 Ų151111.4 Ų111.479%0.79160%0.596SS**  trans52.369.9130.9-66.1147.5000117V132L130-V132 PolarHBondContact O-N 2.68Å
131C37.2Very low42Very low124 Ų124108.1 Ų108.184%0.83858%0.581SS**  trans-82.6102.5144.3-164.70000107.2P133C131-P133 VanDerWaalsContact O-CD 3.3Å; C131-P133 WeakPolarHBondContact O-CD 3.38Å; C131-P133 VanDerWaalsContact O-N 3.12Å
132V40.5Very low43.5Very low116 Ų116104.3 Ų104.370%0.70357%0.571SS**PPolyproline II helixtrans-57.2116.3168.9-178.90000106.4L130 S134L130-V132 PolarHBondContact O-N 2.68Å; V132-S134 PolarHBondContact O-N 3.19Å
133P45Very low44.8Very low59 Ų5999.6 Ų99.638%0.38355%0.55SS..PPolyproline II helixtrans-59.8131.6-178.817.6-23000108.2C131 C137 V138C131-P133 VanDerWaalsContact O-CD 3.3Å; C131-P133 WeakPolarHBondContact O-CD 3.38Å; C131-P133 VanDerWaalsContact O-N 3.12Å; P133-C137 HydrophobicContact CB-CB 4.05Å; P133-V138 HydrophobicContact CB-CG2 3.99Å; P133-V138 HydrophobicContact CG-CG2 3.89Å
134S47.9Very low46.3Very low53 Ų5392.4 Ų92.437%0.37152%0.516SS..PPolyproline II helixtrans-52.9151.5179.462.80000110.3V132 S136 C137 V138V132-S134 PolarHBondContact O-N 3.19Å; S134-S136 WeakPolarHBondContact CB-OG 3.49Å; S134-S136 PolarHBondContact O-N 2.83Å; S134-S136 PolarHBondContact OG-OG 3.39Å; S134-C137 WeakPolarHBondContact O-CA 3.42Å; S134-C137 WeakPolarHBondContact O-CB 3.42Å; S134-C137 PolarHBondContact O-N 3.36Å; S134-C137 WeakPolarHBondContact OG-CB 3.49Å; S134-C137 PolarHBondContact OG-N 2.89Å; S134-V138 PolarHBondContact O-N 3.3Å
135P56.1Low48.4Very low108 Ų10889.8 Ų89.870%0.70150%0.502SS*.Hα-helixtrans-50.9-33.4173-28.235.3000112.5A139P135-A139 WeakPolarHBondContact O-CB 3.4Å; P135-A139 PolarHBondContact O-N 3.42Å
136S54.2Low50.9Low19 Ų1991.7 Ų91.713%0.13349%0.493CS..Hα-helixtrans-65.5-40.9172.652.20000113.4S134 L140S134-S136 WeakPolarHBondContact CB-OG 3.49Å; S134-S136 PolarHBondContact O-N 2.83Å; S134-S136 PolarHBondContact OG-OG 3.39Å; S136-L140 WeakPolarHBondContact O-CB 3.16Å; S136-L140 VanDerWaalsContact O-CG 3.25Å; S136-L140 WeakPolarHBondContact O-CG 3.41Å; S136-L140 PolarHBondContact O-N 3.25Å
137C50.9Low53.6Low40 Ų4086.8 Ų86.827%0.2747%0.474SS..Hα-helixtrans-68.1-42.7176.2-175.30000111.9P133 S134 A139 L140 K141P133-C137 HydrophobicContact CB-CB 4.05Å; S134-C137 WeakPolarHBondContact O-CA 3.42Å; S134-C137 WeakPolarHBondContact O-CB 3.42Å; S134-C137 PolarHBondContact O-N 3.36Å; S134-C137 WeakPolarHBondContact OG-CB 3.49Å; S134-C137 PolarHBondContact OG-N 2.89Å; C137-A139 VanDerWaalsContact C-N 3.35Å; C137-L140 PolarHBondContact O-N 3.29Å; C137-K141 WeakPolarHBondContact O-CB 3.45Å; C137-K141 WeakPolarHBondContact O-CG 3.14Å; C137-K141 PolarHBondContact O-N 3.22Å
138V57.6Low56.3Low60 Ų6082.6 Ų82.636%0.36444%0.442SS..Hα-helixtrans-62.6-45.1175.6177.40000110.4P133 S134 K141 N142P133-V138 HydrophobicContact CB-CG2 3.99Å; P133-V138 HydrophobicContact CG-CG2 3.89Å; S134-V138 PolarHBondContact O-N 3.3Å; V138-K141 PolarHBondContact O-N 3.42Å; V138-N142 VanDerWaalsContact O-CG 3.27Å; V138-N142 PolarHBondContact O-N 3.04Å; V138-N142 PolarHBondContact O-ND2 3.09Å
139A59.9Low59Low13 Ų1379 Ų7911%0.10743%0.428CS..Hα-helixtrans-61-45175.800000113.1M108 P135 C137 N142 A143M108-A139 HydrophobicContact CE-CB 3.27Å; M108-A139 HydrophobicContact CG-CB 3.99Å; M108-A139 HydrophobicContact SD-CB 3.17Å; M108-A139 WeakPolarHBondContact SD-CB 3.43Å; P135-A139 WeakPolarHBondContact O-CB 3.4Å; P135-A139 PolarHBondContact O-N 3.42Å; C137-A139 VanDerWaalsContact C-N 3.35Å; A139-N142 PolarHBondContact O-N 2.83Å; A139-A143 WeakPolarHBondContact O-CB 3.36Å; A139-A143 PolarHBondContact O-N 3.47Å
140L58.5Low61.6Low23 Ų2374.4 Ų74.412%0.1240%0.404CS..Hα-helixtrans-62.7-44.8176.7-75.8169.3000111.2I110 S136 C137 N142 A143 V144 L147 L220I110-L140 HydrophobicContact CD1-CD2 4.15Å; I110-L140 HydrophobicContact CD1-CG 4.27Å; S136-L140 WeakPolarHBondContact O-CB 3.16Å; S136-L140 VanDerWaalsContact O-CG 3.25Å; S136-L140 WeakPolarHBondContact O-CG 3.41Å; S136-L140 PolarHBondContact O-N 3.25Å; C137-L140 PolarHBondContact O-N 3.29Å; L140-N142 PolarHBondContact O-N 2.97Å; L140-A143 PolarHBondContact O-N 3.4Å; L140-A143 VanDerWaalsContact O-N 3.15Å; L140-V144 WeakPolarHBondContact O-CG2 3.39Å; L140-V144 PolarHBondContact O-N 2.88Å; L140-L147 HydrophobicContact CB-CD1 4.15Å; L140-L220 HydrophobicContact CD2-CD1 4.29Å
141K59.9Low64.2Low130 Ų13073.2 Ų73.257%0.56539%0.394SS*.Hα-helixtrans-58.6-33.3175.7-77.5-179.6177.8-178.10112.8C137 V138 L147C137-K141 WeakPolarHBondContact O-CB 3.45Å; C137-K141 WeakPolarHBondContact O-CG 3.14Å; C137-K141 PolarHBondContact O-N 3.22Å; V138-K141 PolarHBondContact O-N 3.42Å; K141-L147 HydrophobicContact CG-CD1 4.27Å
142N62.5Low66.8Low119 Ų11969.7 Ų69.764%0.63637%0.367SS*.Hα-helixtrans-83.3-31.1177.1-67.9-23.1000112.9V138 A139 L140V138-N142 VanDerWaalsContact O-CG 3.27Å; V138-N142 PolarHBondContact O-N 3.04Å; V138-N142 PolarHBondContact O-ND2 3.09Å; A139-N142 PolarHBondContact O-N 2.83Å; L140-N142 PolarHBondContact O-N 2.97Å
143A58.7Low69.4Low30 Ų3064.2 Ų64.225%0.24833%0.334CS..Hα-helixtrans-86.6-13.6-174.800000113.7A139 L140 R200A139-A143 WeakPolarHBondContact O-CB 3.36Å; A139-A143 PolarHBondContact O-N 3.47Å; L140-A143 PolarHBondContact O-N 3.4Å; L140-A143 VanDerWaalsContact O-N 3.15Å; A143-R200 WeakPolarHBondContact O-CD 3.3Å
144V65.5Low71.8Confident6 Ų663.7 Ų63.74%0.03633%0.331CS..SBendtrans-126.8140.4175.1-61.50000111.5L140 R146 L147 V196 F210 A213 L220L140-V144 WeakPolarHBondContact O-CG2 3.39Å; L140-V144 PolarHBondContact O-N 2.88Å; V144-R146 PolarHBondContact O-N 3.46Å; V144-L147 HydrophobicContact CG2-CB 4.44Å; V144-L147 HydrophobicContact CG2-CD1 4.21Å; V144-L147 HydrophobicContact CG2-CD2 3.28Å; V144-L147 HydrophobicContact CG2-CG 3.32Å; V144-V196 HydrophobicContact CG1-CG1 3.68Å; V144-F210 HydrophobicContact CG1-CZ 4.47Å; V144-A213 HydrophobicContact CB-CB 4.28Å; V144-A213 HydrophobicContact CG1-CB 3.72Å; V144-L220 HydrophobicContact CG1-CD2 4.47Å
145L72.9Confident74Confident97 Ų9764.8 Ų64.851%0.50833%0.332SS..SBendtrans-57.9-38.9-179.6-66.4173.8000111.6R200 F210L145-R200 HydrophobicContact CD2-CG 4.32Å; L145-R200 HydrophobicContact CG-CG 4.29Å; L145-F210 HydrophobicContact CD1-CD1 4Å; L145-F210 WeakPolarHBondContact CD1-O 3.42Å; L145-F210 HydrophobicContact CG-CD1 4.24Å
146R83.2Confident75.8Confident145 Ų14564 Ų6455%0.54732%0.319SS..  trans-150.9142.5177.7-64.9-176.3-180150.5-3.6109.4V144 Y148 G212 A213V144-R146 PolarHBondContact O-N 3.46Å; R146-Y148 HydrophobicContact CB-CD2 4.25Å; R146-Y148 HydrophobicContact CB-CE2 3.48Å; R146-Y148 VanDerWaalsContact CB-CE2 3.48Å; R146-Y148 WeakPolarHBondContact CD-OH 3.38Å; R146-G212 CarbonylContact O-C 3.47Å; R146-G212 VanDerWaalsContact O-CA 3.23Å; R146-G212 WeakPolarHBondContact O-CA 3.49Å; R146-A213 PolarHBondContact O-N 2.91Å
147L84.8Confident77.4Confident71 Ų7168 Ų6837%0.37235%0.345SS..EExtended strand (participates in β ladder)trans-105.8135170.4-75.2170.2000109.2L140 K141 V144 A213 V215 L220L140-L147 HydrophobicContact CB-CD1 4.15Å; K141-L147 HydrophobicContact CG-CD1 4.27Å; V144-L147 HydrophobicContact CG2-CB 4.44Å; V144-L147 HydrophobicContact CG2-CD1 4.21Å; V144-L147 HydrophobicContact CG2-CD2 3.28Å; V144-L147 HydrophobicContact CG2-CG 3.32Å; L147-A213 WeakPolarHBondContact CA-O 3.49Å; L147-V215 HydrophobicContact CD2-CG2 3.76Å; L147-L220 HydrophobicContact CD2-CD1 4.48Å
148Y87.6Confident78.8Confident28 Ų2870 Ų7011%0.1135%0.352CS..EExtended strand (participates in β ladder)trans-126155.3176-61-88.3000110.3R146 F153 H171 A213 C214 V215 L223R146-Y148 HydrophobicContact CB-CD2 4.25Å; R146-Y148 HydrophobicContact CB-CE2 3.48Å; R146-Y148 VanDerWaalsContact CB-CE2 3.48Å; R146-Y148 WeakPolarHBondContact CD-OH 3.38Å; Y148-F153 VanDerWaalsContact CB-CE2 3.45Å; Y148-F153 HydrophobicContact CD1-CE2 4.36Å; Y148-F153 AromaticContact CD1-CZ 3.87Å; Y148-F153 HydrophobicContact CD1-CZ 3.87Å; Y148-F153 HydrophobicContact CD2-CZ 4.15Å; Y148-F153 HydrophobicContact CE1-CZ 4.49Å; Y148-F153 AromaticContact CG-CE2 3.94Å; Y148-F153 HydrophobicContact CG-CE2 3.94Å; Y148-F153 AromaticContact CG-CZ 3.66Å; Y148-F153 HydrophobicContact CG-CZ 3.66Å; Y148-H171 AromaticContact CD1-CD2 3.98Å; Y148-H171 AromaticContact CD1-NE2 3.75Å; Y148-H171 AromaticContact CE1-NE2 3.73Å; Y148-A213 PolarHBondContact N-O 3.39Å; Y148-C214 WeakPolarHBondContact O-CA 3.11Å; Y148-V215 PolarHBondContact O-N 3.39Å; Y148-V215 VanDerWaalsContact O-N 3.12Å; Y148-L223 HydrophobicContact CD2-CD1 3.46Å; Y148-L223 VanDerWaalsContact CD2-CD1 3.46Å; Y148-L223 HydrophobicContact CE2-CD1 4.08Å; Y148-L223 HydrophobicContact CG-CD1 4.11Å
149R87.5Confident79.8Confident147 Ų14769 Ų6956%0.55535%0.354SS*.EExtended strand (participates in β ladder)trans-89.8151.9166.2-63.7174.465.6108.62.4109.1E151 D152 F153 C214R149-E151 IonicContact CZ-OE2 3.27Å; R149-E151 VanDerWaalsContact CZ-OE2 3.27Å; R149-E151 IonicContact NE-OE2 2.89Å; R149-E151 PolarHBondContact NE-OE2 3.29Å; R149-E151 IonicContact NH2-OE1 3.2Å; R149-E151 PolarHBondContact NH2-OE1 3Å; R149-E151 IonicContact NH2-OE2 2.84Å; R149-E151 PolarHBondContact NH2-OE2 2.95Å; R149-E151 PolarHBondContact O-N 3.17Å; R149-D152 PolarHBondContact N-OD2 3.2Å; R149-D152 VanDerWaalsContact O-CB 3.3Å; R149-D152 WeakPolarHBondContact O-CB 3.42Å; R149-D152 PolarHBondContact O-N 2.91Å; R149-D152 VanDerWaalsContact O-N 3.07Å; R149-F153 WeakPolarHBondContact O-CD2 3.48Å; R149-C214 VanDerWaalsContact C-SG 3.59Å
150M88.3Confident80.6Confident24 Ų2475.3 Ų75.312%0.11838%0.381CS..G310 helixtrans-61.4-34.8178.4-163.361.3-96.800111.7D152 F153 L155 L180 C214 D216M150-D152 PolarHBondContact O-N 2.96Å; M150-F153 HydrophobicContact CE-CB 3.95Å; M150-F153 HydrophobicContact CE-CD2 3.98Å; M150-F153 HydrophobicContact CE-CG 4.36Å; M150-F153 PolarHBondContact O-N 3.28Å; M150-L155 HydrophobicContact CE-CD1 3.45Å; M150-L155 VanDerWaalsContact CE-CD1 3.45Å; M150-L155 HydrophobicContact CE-CD2 3.76Å; M150-L155 HydrophobicContact CE-CG 3.73Å; M150-L155 HydrophobicContact SD-CD2 4.37Å; M150-L180 HydrophobicContact CE-CD2 3.36Å; M150-L180 HydrophobicContact SD-CD2 3.44Å; M150-L180 WeakPolarHBondContact SD-CD2 3.3Å; M150-C214 WeakPolarHBondContact CA-SG 3.44Å; M150-C214 PolarHBondContact N-SG 2.96Å; M150-D216 HydrophobicContact CB-CB 4.11Å
151E89.8Confident81.2Confident125 Ų12575.8 Ų75.858%0.58439%0.392SS*.G310 helixtrans-60.4-24.5176.8-62.8153.7-174.600113.4R149 F153 R172R149-E151 IonicContact CZ-OE2 3.27Å; R149-E151 VanDerWaalsContact CZ-OE2 3.27Å; R149-E151 IonicContact NE-OE2 2.89Å; R149-E151 PolarHBondContact NE-OE2 3.29Å; R149-E151 IonicContact NH2-OE1 3.2Å; R149-E151 PolarHBondContact NH2-OE1 3Å; R149-E151 IonicContact NH2-OE2 2.84Å; R149-E151 PolarHBondContact NH2-OE2 2.95Å; R149-E151 PolarHBondContact O-N 3.17Å; E151-F153 PolarHBondContact O-N 2.93Å; E151-F153 VanDerWaalsContact O-N 3.14Å; E151-R172 WeakPolarHBondContact O-CD 3.44Å; E151-R172 PolarHBondContact O-NE 3.49Å
152D91.3Very high81.9Confident51 Ų5177.8 Ų77.827%0.27340%0.401SS..G310 helixtrans-70.4-7.9-179.7-59.3-29.3000112.4R149 M150 R172R149-D152 PolarHBondContact N-OD2 3.2Å; R149-D152 VanDerWaalsContact O-CB 3.3Å; R149-D152 WeakPolarHBondContact O-CB 3.42Å; R149-D152 PolarHBondContact O-N 2.91Å; R149-D152 VanDerWaalsContact O-N 3.07Å; M150-D152 PolarHBondContact O-N 2.96Å; D152-R172 WeakPolarHBondContact O-CB 3.2Å; D152-R172 VanDerWaalsContact O-CG 3.3Å; D152-R172 WeakPolarHBondContact O-CG 3.45Å; D152-R172 PolarHBondContact O-N 3.28Å
153F94.4Very high82.4Confident1 Ų176 Ų760%0.00439%0.388CS..EExtended strand (participates in β ladder)trans-117.6149-175-63-73.9000113.3Y148 R149 M150 E151 L155 V169 R170 H171 R172 L178 L223Y148-F153 VanDerWaalsContact CB-CE2 3.45Å; Y148-F153 HydrophobicContact CD1-CE2 4.36Å; Y148-F153 AromaticContact CD1-CZ 3.87Å; Y148-F153 HydrophobicContact CD1-CZ 3.87Å; Y148-F153 HydrophobicContact CD2-CZ 4.15Å; Y148-F153 HydrophobicContact CE1-CZ 4.49Å; Y148-F153 AromaticContact CG-CE2 3.94Å; Y148-F153 HydrophobicContact CG-CE2 3.94Å; Y148-F153 AromaticContact CG-CZ 3.66Å; Y148-F153 HydrophobicContact CG-CZ 3.66Å; R149-F153 WeakPolarHBondContact O-CD2 3.48Å; M150-F153 HydrophobicContact CE-CB 3.95Å; M150-F153 HydrophobicContact CE-CD2 3.98Å; M150-F153 HydrophobicContact CE-CG 4.36Å; M150-F153 PolarHBondContact O-N 3.28Å; E151-F153 PolarHBondContact O-N 2.93Å; E151-F153 VanDerWaalsContact O-N 3.14Å; F153-L155 HydrophobicContact CB-CD1 4.21Å; F153-V169 HydrophobicContact CB-CB 4.01Å; F153-V169 HydrophobicContact CB-CG1 4.38Å; F153-V169 HydrophobicContact CD1-CB 3.8Å; F153-V169 HydrophobicContact CD1-CG2 3.65Å; F153-V169 HydrophobicContact CE1-CG2 3.97Å; F153-V169 HydrophobicContact CG-CB 4.05Å; F153-V169 HydrophobicContact CG-CG2 4.19Å; F153-R170 WeakPolarHBondContact CA-O 3.45Å; F153-H171 HydrophobicContact CD1-CB 4.07Å; F153-H171 HydrophobicContact CE1-CB 3.74Å; F153-H171 AromaticContact CE1-CD2 3.86Å; F153-R172 PolarHBondContact O-NE 3.32Å; F153-R172 PolarHBondContact O-NH2 3.34Å; F153-L178 HydrophobicContact CE1-CD1 4.05Å; F153-L178 HydrophobicContact CZ-CD1 4.43Å; F153-L223 HydrophobicContact CE2-CD1 3.9Å; F153-L223 HydrophobicContact CE2-CD2 4.45Å; F153-L223 HydrophobicContact CZ-CD1 3.61Å; F153-L223 HydrophobicContact CZ-CD2 4.14Å
154S95.7Very high83.5Confident47 Ų4775.6 Ų75.633%0.32938%0.383SS..EExtended strand (participates in β ladder)trans-96.1127.1155.260.30000109.1V169 R170S154-V169 WeakPolarHBondContact O-CA 3.36Å; S154-R170 PolarHBondContact N-O 3.16Å; S154-R170 PolarHBondContact O-N 3.06Å; S154-R170 WeakPolarHBondContact OG-CB 3.21Å
155L95.2Very high84.3Confident76 Ų7677.8 Ų77.840%0.39839%0.393SS..EExtended strand (participates in β ladder)trans-99.9139.5-174.9-65.269.4000111.2M150 F153 Y167 V169M150-L155 HydrophobicContact CE-CD1 3.45Å; M150-L155 VanDerWaalsContact CE-CD1 3.45Å; M150-L155 HydrophobicContact CE-CD2 3.76Å; M150-L155 HydrophobicContact CE-CG 3.73Å; M150-L155 HydrophobicContact SD-CD2 4.37Å; F153-L155 HydrophobicContact CB-CD1 4.21Å; L155-Y167 HydrophobicContact CB-CD1 3.88Å; L155-Y167 HydrophobicContact CB-CG 4.32Å; L155-Y167 HydrophobicContact CD2-CD1 4.07Å; L155-Y167 HydrophobicContact CD2-CD2 4.34Å; L155-Y167 HydrophobicContact CD2-CE1 4.3Å; L155-Y167 HydrophobicContact CD2-CG 4.1Å; L155-Y167 HydrophobicContact CG-CD1 4.44Å; L155-Y167 HydrophobicContact CG-CG 4.48Å; L155-V169 HydrophobicContact CG-CG1 4.1Å
156E92.5Very high85Confident92 Ų9275.2 Ų75.243%0.4338%0.381SS..EExtended strand (participates in β ladder)trans-131.4121.3170.8178-173.8169.900107.8L158 Y167 R168E156-L158 PolarHBondContact O-N 3.26Å; E156-Y167 CarbonylContact O-C 3.58Å; E156-Y167 VanDerWaalsContact O-CA 3.28Å; E156-Y167 WeakPolarHBondContact O-CA 3.37Å; E156-R168 HydrophobicContact CB-CB 4.23Å; E156-R168 PolarHBondContact N-O 3.18Å; E156-R168 PolarHBondContact O-N 3.43Å; E156-R168 IonicContact OE1-NH1 3.83Å; E156-R168 WeakPolarHBondContact OE2-CD 3.19Å; E156-R168 IonicContact OE2-CZ 3.54Å; E156-R168 IonicContact OE2-NE 3.57Å; E156-R168 IonicContact OE2-NH1 2.65Å; E156-R168 PolarHBondContact OE2-NH1 3.11Å
157P89.1Confident85.3Confident103 Ų10370.4 Ų70.467%0.66936%0.363SS*.EExtended strand (participates in β ladder)trans-66.1132.3-176.627.1-33.6000111.1Y167P157-Y167 HydrophobicContact CB-CD1 4.2Å; P157-Y167 HydrophobicContact CB-CE1 4.08Å
158L80.9Confident85.5Confident81 Ų8170 Ų7042%0.42436%0.357SS..EExtended strand (participates in β ladder)trans-106.9-35.9174.6-73177.4000112.6E156 V166 R168 V179 Y226E156-L158 PolarHBondContact O-N 3.26Å; L158-V166 HydrophobicContact CB-CG1 4.28Å; L158-V166 WeakPolarHBondContact CB-O 3.42Å; L158-V166 HydrophobicContact CD1-CG1 4.32Å; L158-V166 PolarHBondContact N-O 3.16Å; L158-R168 HydrophobicContact CD1-CB 3.75Å; L158-R168 HydrophobicContact CD2-CB 3.9Å; L158-R168 HydrophobicContact CG-CB 3.7Å; L158-V179 HydrophobicContact CD1-CG1 4.5Å; L158-V179 HydrophobicContact CD1-CG2 4.15Å; L158-Y226 HydrophobicContact CD1-CE2 4.23Å
159G77Confident85.8Confident39 Ų3968.7 Ų68.740%0.40235%0.351SS..EExtended strand (participates in β ladder)trans-176.9162.8-177.200000112.6V166G159-V166 PolarHBondContact N-O 2.68Å; G159-V166 PolarHBondContact O-N 3.27Å
160E77.7Confident86.2Confident146 Ų14666.9 Ų66.968%0.68235%0.345SS*.EExtended strand (participates in β ladder)trans-132.9128.6-177.9-175.3178.3175.600109.2E165 K184E160-E165 HydrophobicContact CG-CG 4.33Å; E160-K184 IonicContact OE1-NZ 2.87Å; E160-K184 PolarHBondContact OE1-NZ 3.14Å
161G70.9Confident86.5Confident33 Ų3366.5 Ų66.534%0.3434%0.342SS..  trans-115.1179.8172.700000111.5S164 K184G161-S164 WeakPolarHBondContact CA-O 3.25Å; G161-S164 PolarHBondContact N-O 3.19Å; G161-K184 PolarHBondContact O-NZ 3.05Å
162F74.2Confident86.7Confident173 Ų17368.3 Ų68.376%0.75934%0.344SS*.SBendtrans-63.7-43.4179.7-172.5-96.1000112.3
163F73.9Confident86.8Confident82 Ų8271.8 Ų71.836%0.3637%0.367SS..SBendtrans-100.3-13.5-176.3-61.6-71000114.6F12 N183 K184F12-F163 HydrophobicContact CE1-CD2 4.43Å; F12-F163 HydrophobicContact CE1-CE2 4.29Å; F12-F163 HydrophobicContact CE2-CE2 4.49Å; F12-F163 HydrophobicContact CZ-CD2 4.35Å; F12-F163 AromaticContact CZ-CE2 3.93Å; F12-F163 HydrophobicContact CZ-CE2 3.93Å; F163-N183 PolarHBondContact O-OD1 2.89Å; F163-K184 PolarHBondContact O-N 3.33Å
164S80.5Confident86.7Confident20 Ų2075.5 Ų75.514%0.1439%0.39CS..EExtended strand (participates in β ladder)trans-149.9153.5-172.758.20000113.6G161 L182G161-S164 WeakPolarHBondContact CA-O 3.25Å; G161-S164 PolarHBondContact N-O 3.19Å; S164-L182 CarbonylContact C-O 2.93Å; S164-L182 WeakPolarHBondContact CA-O 3.39Å; S164-L182 WeakPolarHBondContact CB-O 3.15Å
165E83.9Confident86.7Confident53 Ų5374.8 Ų74.825%0.24839%0.39CS..EExtended strand (participates in β ladder)trans-105.8143.2165.7-57.9178.4127.400108.6E160 Y167 L182 K184E160-E165 HydrophobicContact CG-CG 4.33Å; E165-Y167 HydrophobicContact CB-CD2 4.32Å; E165-Y167 HydrophobicContact CB-CE2 3.53Å; E165-Y167 PolarHBondContact OE2-OH 3.27Å; E165-L182 HydrophobicContact CB-CB 4.37Å; E165-L182 PolarHBondContact N-O 3.35Å; E165-L182 PolarHBondContact O-N 3.01Å; E165-K184 HydrophobicContact CG-CD 4.33Å; E165-K184 HydrophobicContact CG-CG 4.17Å
166V87.2Confident86.5Confident42 Ų4274.7 Ų74.726%0.25539%0.39SS..EExtended strand (participates in β ladder)trans-118.2124.4-178.5-174.20000108.7L158 G159 V179 L180L158-V166 HydrophobicContact CB-CG1 4.28Å; L158-V166 WeakPolarHBondContact CB-O 3.42Å; L158-V166 HydrophobicContact CD1-CG1 4.32Å; L158-V166 PolarHBondContact N-O 3.16Å; G159-V166 PolarHBondContact N-O 2.68Å; G159-V166 PolarHBondContact O-N 3.27Å; V166-V179 HydrophobicContact CG1-CG1 3.4Å; V166-V179 VanDerWaalsContact CG1-CG1 3.4Å; V166-L180 WeakPolarHBondContact CA-O 3.31Å
167Y88.3Confident86.5Confident45 Ų4573 Ų7318%0.17638%0.383CS..EExtended strand (participates in β ladder)trans-120.6139.1179.3-62.7-91.8000110.7L155 E156 P157 E165 V179 L180 L182L155-Y167 HydrophobicContact CB-CD1 3.88Å; L155-Y167 HydrophobicContact CB-CG 4.32Å; L155-Y167 HydrophobicContact CD2-CD1 4.07Å; L155-Y167 HydrophobicContact CD2-CD2 4.34Å; L155-Y167 HydrophobicContact CD2-CE1 4.3Å; L155-Y167 HydrophobicContact CD2-CG 4.1Å; L155-Y167 HydrophobicContact CG-CD1 4.44Å; L155-Y167 HydrophobicContact CG-CG 4.48Å; E156-Y167 CarbonylContact O-C 3.58Å; E156-Y167 VanDerWaalsContact O-CA 3.28Å; E156-Y167 WeakPolarHBondContact O-CA 3.37Å; P157-Y167 HydrophobicContact CB-CD1 4.2Å; P157-Y167 HydrophobicContact CB-CE1 4.08Å; E165-Y167 HydrophobicContact CB-CD2 4.32Å; E165-Y167 HydrophobicContact CB-CE2 3.53Å; E165-Y167 PolarHBondContact OE2-OH 3.27Å; Y167-V179 CarbonylContact O-C 3.48Å; Y167-V179 WeakPolarHBondContact O-CA 3.01Å; Y167-L180 PolarHBondContact N-O 2.83Å; Y167-L180 PolarHBondContact O-N 3.38Å; Y167-L182 HydrophobicContact CD2-CB 4.44Å; Y167-L182 HydrophobicContact CE2-CB 4.26Å; Y167-L182 HydrophobicContact CE2-CD1 4.28Å
168R90.2Very high86.6Confident62 Ų6268.5 Ų68.523%0.23435%0.353CS..EExtended strand (participates in β ladder)trans-74.3127.4156.6177.2175.9170.6-136.4-1.5106.3E156 L158 I177 Y226E156-R168 HydrophobicContact CB-CB 4.23Å; E156-R168 PolarHBondContact N-O 3.18Å; E156-R168 PolarHBondContact O-N 3.43Å; E156-R168 IonicContact OE1-NH1 3.83Å; E156-R168 WeakPolarHBondContact OE2-CD 3.19Å; E156-R168 IonicContact OE2-CZ 3.54Å; E156-R168 IonicContact OE2-NE 3.57Å; E156-R168 IonicContact OE2-NH1 2.65Å; E156-R168 PolarHBondContact OE2-NH1 3.11Å; L158-R168 HydrophobicContact CD1-CB 3.75Å; L158-R168 HydrophobicContact CD2-CB 3.9Å; L158-R168 HydrophobicContact CG-CB 3.7Å; R168-I177 HydrophobicContact CG-CG2 3.95Å; R168-Y226 HydrophobicContact CB-CE2 4.38Å; R168-Y226 HydrophobicContact CG-CD2 4.17Å; R168-Y226 HydrophobicContact CG-CE2 4.04Å
169V93.7Very high87Confident0 Ų065.9 Ų65.90%034%0.34CS..EExtended strand (participates in β ladder)trans-124.5141.1-179.7-590000110.6F153 S154 L155 I177 L178 L180 L223F153-V169 HydrophobicContact CB-CB 4.01Å; F153-V169 HydrophobicContact CB-CG1 4.38Å; F153-V169 HydrophobicContact CD1-CB 3.8Å; F153-V169 HydrophobicContact CD1-CG2 3.65Å; F153-V169 HydrophobicContact CE1-CG2 3.97Å; F153-V169 HydrophobicContact CG-CB 4.05Å; F153-V169 HydrophobicContact CG-CG2 4.19Å; S154-V169 WeakPolarHBondContact O-CA 3.36Å; L155-V169 HydrophobicContact CG-CG1 4.1Å; V169-I177 WeakPolarHBondContact O-CA 3.06Å; V169-L178 HydrophobicContact CG2-CB 3.71Å; V169-L178 PolarHBondContact N-O 3.03Å; V169-L178 PolarHBondContact O-N 3.19Å; V169-L180 HydrophobicContact CG1-CB 3.63Å; V169-L180 HydrophobicContact CG1-CD2 4.12Å; V169-L180 HydrophobicContact CG2-CB 4.23Å; V169-L223 HydrophobicContact CG2-CD2 3.78Å
170R96.3Very high87.6Confident109 Ų10964 Ų6441%0.41132%0.321SS..EExtended strand (participates in β ladder)trans-110.1122.3168.8179.6-175.5-60.3-77.45108.9F153 S154 R172 G175 D176F153-R170 WeakPolarHBondContact CA-O 3.45Å; S154-R170 PolarHBondContact N-O 3.16Å; S154-R170 PolarHBondContact O-N 3.06Å; S154-R170 WeakPolarHBondContact OG-CB 3.21Å; R170-R172 PolarHBondContact O-N 3.31Å; R170-G175 PolarHBondContact NH1-O 3.02Å; R170-D176 CarbonylContact C-O 3.51Å; R170-D176 WeakPolarHBondContact CA-O 3.35Å
171H94.6Very high88.1Confident16 Ų1659.6 Ų59.67%0.07430%0.3CS..EExtended strand (participates in β ladder)trans-69.3122.4174.1-173.6-127.4000109.5Y148 F153 V173 T174 G175 D176Y148-H171 AromaticContact CD1-CD2 3.98Å; Y148-H171 AromaticContact CD1-NE2 3.75Å; Y148-H171 AromaticContact CE1-NE2 3.73Å; F153-H171 HydrophobicContact CD1-CB 4.07Å; F153-H171 HydrophobicContact CE1-CB 3.74Å; F153-H171 AromaticContact CE1-CD2 3.86Å; H171-V173 VanDerWaalsContact C-N 3.27Å; H171-V173 PolarHBondContact O-N 3.1Å; H171-T174 WeakPolarHBondContact ND1-CB 3.45Å; H171-T174 WeakPolarHBondContact ND1-CG2 3.49Å; H171-T174 PolarHBondContact ND1-N 3.26Å; H171-T174 PolarHBondContact ND1-OG1 2.97Å; H171-G175 VanDerWaalsContact O-CA 3.26Å; H171-G175 WeakPolarHBondContact O-CA 3.32Å; H171-G175 PolarHBondContact O-N 3.49Å; H171-D176 HydrophobicContact CB-CB 4.37Å; H171-D176 PolarHBondContact N-O 3.33Å
172R94.2Very high88.9Confident163 Ų16359.4 Ų59.462%0.61529%0.291SS*.THydrogen-bonded Turntrans-64.5-31.2-171.2-68.1174.1-170.1-77.5-3.5113.2E151 D152 F153 R170E151-R172 WeakPolarHBondContact O-CD 3.44Å; E151-R172 PolarHBondContact O-NE 3.49Å; D152-R172 WeakPolarHBondContact O-CB 3.2Å; D152-R172 VanDerWaalsContact O-CG 3.3Å; D152-R172 WeakPolarHBondContact O-CG 3.45Å; D152-R172 PolarHBondContact O-N 3.28Å; F153-R172 PolarHBondContact O-NE 3.32Å; F153-R172 PolarHBondContact O-NH2 3.34Å; R170-R172 PolarHBondContact O-N 3.31Å
173V92.4Very high89.4Confident125 Ų12551.9 Ų51.976%0.75826%0.258SS*.THydrogen-bonded Turntrans-86.9-48.7-176.5-178.80000112H171H171-V173 VanDerWaalsContact C-N 3.27Å; H171-V173 PolarHBondContact O-N 3.1Å
174T93.2Very high89.8Confident79 Ų7951.4 Ų51.449%0.48526%0.256SS..THydrogen-bonded Turntrans-90.4-17.5-175.463.10000113.3H171 D176H171-T174 WeakPolarHBondContact ND1-CB 3.45Å; H171-T174 WeakPolarHBondContact ND1-CG2 3.49Å; H171-T174 PolarHBondContact ND1-N 3.26Å; H171-T174 PolarHBondContact ND1-OG1 2.97Å; T174-D176 WeakPolarHBondContact CB-OD2 3.45Å; T174-D176 PolarHBondContact O-N 2.92Å; T174-D176 WeakPolarHBondContact OG1-CB 3.37Å; T174-D176 PolarHBondContact OG1-N 2.82Å; T174-D176 PolarHBondContact OG1-OD2 3.08Å
175G94Very high89.7Confident32 Ų3253 Ų5333%0.3327%0.265SS..  trans77.2-2.8-173.300000114.4R170 H171R170-G175 PolarHBondContact NH1-O 3.02Å; H171-G175 VanDerWaalsContact O-CA 3.26Å; H171-G175 WeakPolarHBondContact O-CA 3.32Å; H171-G175 PolarHBondContact O-N 3.49Å
176D92Very high89.2Confident73 Ų7354.4 Ų54.439%0.3928%0.281SS..  trans-58137.1-178.3-66.1-33.4000111.4R170 H171 T174R170-D176 CarbonylContact C-O 3.51Å; R170-D176 WeakPolarHBondContact CA-O 3.35Å; H171-D176 HydrophobicContact CB-CB 4.37Å; H171-D176 PolarHBondContact N-O 3.33Å; T174-D176 WeakPolarHBondContact CB-OD2 3.45Å; T174-D176 PolarHBondContact O-N 2.92Å; T174-D176 WeakPolarHBondContact OG1-CB 3.37Å; T174-D176 PolarHBondContact OG1-N 2.82Å; T174-D176 PolarHBondContact OG1-OD2 3.08Å
177I92Very high88.7Confident56 Ų5657.2 Ų57.229%0.28730%0.302SS..EExtended strand (participates in β ladder)trans-99.5126174-53.4-179.6000108.4R168 V169 Y226R168-I177 HydrophobicContact CG-CG2 3.95Å; V169-I177 WeakPolarHBondContact O-CA 3.06Å; I177-Y226 HydrophobicContact CG2-CD1 3.86Å; I177-Y226 HydrophobicContact CG2-CD2 4.28Å; I177-Y226 HydrophobicContact CG2-CG 3.72Å
178L90.7Very high88Confident10 Ų1057 Ų575%0.05230%0.304CS..EExtended strand (participates in β ladder)trans-133.9171.6-176.5-56.9173.6000110.2F153 V169 R211 L223 T224F153-L178 HydrophobicContact CE1-CD1 4.05Å; F153-L178 HydrophobicContact CZ-CD1 4.43Å; V169-L178 HydrophobicContact CG2-CB 3.71Å; V169-L178 PolarHBondContact N-O 3.03Å; V169-L178 PolarHBondContact O-N 3.19Å; L178-R211 HydrophobicContact CD2-CB 3.98Å; L178-R211 HydrophobicContact CD2-CG 3.76Å; L178-L223 HydrophobicContact CB-CD2 4.26Å; L178-L223 HydrophobicContact CD1-CD2 4.24Å; L178-T224 WeakPolarHBondContact CA-O 3.39Å; L178-T224 WeakPolarHBondContact CB-O 3.1Å
179V90.1Very high87.2Confident25 Ų2556.9 Ų56.915%0.15230%0.303CS..EExtended strand (participates in β ladder)trans-111.6125.3167.6176.90000109.3L158 V166 Y167 L223 T224 Y226L158-V179 HydrophobicContact CD1-CG1 4.5Å; L158-V179 HydrophobicContact CD1-CG2 4.15Å; V166-V179 HydrophobicContact CG1-CG1 3.4Å; V166-V179 VanDerWaalsContact CG1-CG1 3.4Å; Y167-V179 CarbonylContact O-C 3.48Å; Y167-V179 WeakPolarHBondContact O-CA 3.01Å; V179-L223 WeakPolarHBondContact O-CA 3.38Å; V179-T224 PolarHBondContact N-O 2.77Å; V179-T224 PolarHBondContact O-N 2.7Å; V179-Y226 HydrophobicContact CG2-CD2 3.65Å; V179-Y226 HydrophobicContact CG2-CG 4.42Å
180L89.9Confident86.2Confident0 Ų060.3 Ų60.30%033%0.327CS..EExtended strand (participates in β ladder)trans-100.1120.9173.417670.1000109.8M150 V166 Y167 V169 C214 H221 A222 L223M150-L180 HydrophobicContact CE-CD2 3.36Å; M150-L180 HydrophobicContact SD-CD2 3.44Å; M150-L180 WeakPolarHBondContact SD-CD2 3.3Å; V166-L180 WeakPolarHBondContact CA-O 3.31Å; Y167-L180 PolarHBondContact N-O 2.83Å; Y167-L180 PolarHBondContact O-N 3.38Å; V169-L180 HydrophobicContact CG1-CB 3.63Å; V169-L180 HydrophobicContact CG1-CD2 4.12Å; V169-L180 HydrophobicContact CG2-CB 4.23Å; L180-C214 HydrophobicContact CD1-CB 3.86Å; L180-H221 HydrophobicContact CD1-CB 3.62Å; L180-A222 WeakPolarHBondContact CA-O 3.34Å; L180-L223 HydrophobicContact CB-CD2 3.87Å; L180-L223 HydrophobicContact CD1-CD2 3.8Å; L180-L223 HydrophobicContact CD1-CG 4.06Å; L180-L223 HydrophobicContact CG-CD2 4.44Å
181K88.2Confident85.2Confident54 Ų5458.6 Ų58.624%0.23533%0.326CS..EExtended strand (participates in β ladder)trans-97.499.6168-173.4177.4179.1-177.20108.5E195 H221 A222K181-E195 IonicContact NZ-OE1 2.68Å; K181-E195 PolarHBondContact NZ-OE1 3.22Å; K181-E195 IonicContact NZ-OE2 3.48Å; K181-H221 WeakPolarHBondContact O-CA 3.45Å; K181-H221 WeakPolarHBondContact O-CB 3.23Å; K181-A222 HydrophobicContact CB-CB 4.47Å; K181-A222 PolarHBondContact N-O 3.44Å; K181-A222 PolarHBondContact O-N 2.91Å
182L87.7Confident84.2Confident29 Ų2958.5 Ų58.515%0.15233%0.327CS..EExtended strand (participates in β ladder)trans-84123.4177.7-171.7151.8000108.8S164 E165 Y167S164-L182 CarbonylContact C-O 2.93Å; S164-L182 WeakPolarHBondContact CA-O 3.39Å; S164-L182 WeakPolarHBondContact CB-O 3.15Å; E165-L182 HydrophobicContact CB-CB 4.37Å; E165-L182 PolarHBondContact N-O 3.35Å; E165-L182 PolarHBondContact O-N 3.01Å; Y167-L182 HydrophobicContact CD2-CB 4.44Å; Y167-L182 HydrophobicContact CE2-CB 4.26Å; Y167-L182 HydrophobicContact CE2-CD1 4.28Å
183N84.4Confident83.4Confident14 Ų1452.5 Ų52.58%0.07531%0.307CS..EExtended strand (participates in β ladder)trans-84.4129177.4178.112.2000109F163 V185 V192 Q219 H221F163-N183 PolarHBondContact O-OD1 2.89Å; N183-V185 PolarHBondContact ND2-O 3.29Å; N183-V185 PolarHBondContact OD1-N 3.32Å; N183-V185 PolarHBondContact OD1-O 3Å; N183-V192 HydrophobicContact CB-CG2 4.16Å; N183-V192 VanDerWaalsContact ND2-CG2 3.26Å; N183-V192 WeakPolarHBondContact ND2-CG2 3.09Å; N183-Q219 PolarHBondContact O-OE1 2.87Å; N183-Q219 VanDerWaalsContact O-OE1 3.1Å; N183-H221 PolarHBondContact N-ND1 3.34Å; N183-H221 VanDerWaalsContact N-ND1 3.15Å
184K82.6Confident82.6Confident73 Ų7352.2 Ų52.232%0.31729%0.292SS..SBendtrans-77.8-27.6179.5-67.3177.1173-179.50112.7E160 G161 F163 E165E160-K184 IonicContact OE1-NZ 2.87Å; E160-K184 PolarHBondContact OE1-NZ 3.14Å; G161-K184 PolarHBondContact O-NZ 3.05Å; F163-K184 PolarHBondContact O-N 3.33Å; E165-K184 HydrophobicContact CG-CD 4.33Å; E165-K184 HydrophobicContact CG-CG 4.17Å
185V77.9Confident81.7Confident54 Ų5449.9 Ų49.933%0.32728%0.276SS..  trans-116.4113.4-165.8-172.60000111.1N183 S187 N188N183-V185 PolarHBondContact ND2-O 3.29Å; N183-V185 PolarHBondContact OD1-N 3.32Å; N183-V185 PolarHBondContact OD1-O 3Å; V185-S187 VanDerWaalsContact C-N 3.28Å; V185-S187 WeakPolarHBondContact CG1-OG 3.46Å; V185-S187 PolarHBondContact O-N 3.18Å; V185-N188 HydrophobicContact CB-CB 4.47Å; V185-N188 WeakPolarHBondContact O-CB 3.39Å; V185-N188 PolarHBondContact O-N 2.96Å; V185-N188 VanDerWaalsContact O-N 3.13Å
186S74.7Confident80.9Confident81 Ų8148.5 Ų48.557%0.56626%0.261SS*.G310 helixtrans-61.8-31.9179.358.60000113.5N188 R189S186-N188 PolarHBondContact O-N 3.37Å; S186-R189 WeakPolarHBondContact O-CB 3.23Å; S186-R189 PolarHBondContact O-N 3.11Å
187S75.6Confident80.3Confident101 Ų10147.6 Ų47.671%0.70626%0.255SS*.G310 helixtrans-66.5-17.5178.363.60000113.2V185 R189V185-S187 VanDerWaalsContact C-N 3.28Å; V185-S187 WeakPolarHBondContact CG1-OG 3.46Å; V185-S187 PolarHBondContact O-N 3.18Å; S187-R189 PolarHBondContact O-N 3.3Å
188N73.5Confident79.6Confident40 Ų4046.2 Ų46.221%0.21425%0.248CC..G310 helixtrans-83.411.4178.8-154.921.3000113.5V185 S186 S190 N191 V192V185-N188 HydrophobicContact CB-CB 4.47Å; V185-N188 WeakPolarHBondContact O-CB 3.39Å; V185-N188 PolarHBondContact O-N 2.96Å; V185-N188 VanDerWaalsContact O-N 3.13Å; S186-N188 PolarHBondContact O-N 3.37Å; N188-S190 VanDerWaalsContact C-N 3.35Å; N188-S190 PolarHBondContact O-N 3.06Å; N188-N191 PolarHBondContact O-N 3.22Å; N188-N191 VanDerWaalsContact OD1-CB 3.25Å; N188-N191 WeakPolarHBondContact OD1-CB 3.3Å; N188-N191 PolarHBondContact OD1-ND2 2.91Å; N188-V192 PolarHBondContact O-N 2.99Å; N188-V192 VanDerWaalsContact O-N 3.07Å
189R72.6Confident79Confident60 Ų6046.4 Ų46.423%0.22625%0.249CC..Hα-helixtrans-53.9-43.7-173.6-176.8-176.9174.77419.2114.1S186 S187 N191 V192 L193 G218S186-R189 WeakPolarHBondContact O-CB 3.23Å; S186-R189 PolarHBondContact O-N 3.11Å; S187-R189 PolarHBondContact O-N 3.3Å; R189-N191 VanDerWaalsContact C-N 3.35Å; R189-V192 PolarHBondContact O-N 3.05Å; R189-L193 HydrophobicContact CG-CD1 4.15Å; R189-L193 WeakPolarHBondContact O-CG 3.09Å; R189-L193 PolarHBondContact O-N 3.29Å; R189-G218 PolarHBondContact NH1-O 3.47Å
190S74.6Confident78.6Confident72 Ų7249.4 Ų49.450%0.50326%0.257SS..Hα-helixtrans-65.3-38.4-178.253.80000112.3N188 R194N188-S190 VanDerWaalsContact C-N 3.35Å; N188-S190 PolarHBondContact O-N 3.06Å; S190-R194 PolarHBondContact O-N 2.92Å; S190-R194 VanDerWaalsContact O-N 3.09Å
191N74.3Confident78.3Confident73 Ų7354.1 Ų54.139%0.3928%0.278SS..Hα-helixtrans-69.9-42.4176.7-67.3-28.2000111.1N188 R189 L193 R194 E195N188-N191 PolarHBondContact O-N 3.22Å; N188-N191 VanDerWaalsContact OD1-CB 3.25Å; N188-N191 WeakPolarHBondContact OD1-CB 3.3Å; N188-N191 PolarHBondContact OD1-ND2 2.91Å; R189-N191 VanDerWaalsContact C-N 3.35Å; N191-L193 VanDerWaalsContact C-N 3.34Å; N191-L193 PolarHBondContact O-N 3.44Å; N191-R194 WeakPolarHBondContact O-CB 3.29Å; N191-R194 PolarHBondContact O-N 3.39Å; N191-E195 WeakPolarHBondContact O-CB 2.9Å; N191-E195 PolarHBondContact O-N 3.37Å
192V74.4Confident77.9Confident14 Ų1452.3 Ų52.39%0.08527%0.27CS..Hα-helixtrans-61.1-42.1175.2173.80000111.8N183 N188 R189 R194 E195 V196 L220N183-V192 HydrophobicContact CB-CG2 4.16Å; N183-V192 VanDerWaalsContact ND2-CG2 3.26Å; N183-V192 WeakPolarHBondContact ND2-CG2 3.09Å; N188-V192 PolarHBondContact O-N 2.99Å; N188-V192 VanDerWaalsContact O-N 3.07Å; R189-V192 PolarHBondContact O-N 3.05Å; V192-R194 VanDerWaalsContact C-N 3.32Å; V192-R194 PolarHBondContact O-N 3.11Å; V192-E195 WeakPolarHBondContact O-CB 3.23Å; V192-E195 PolarHBondContact O-N 3.29Å; V192-V196 HydrophobicContact CG1-CG2 4.37Å; V192-V196 WeakPolarHBondContact O-CB 3.25Å; V192-V196 WeakPolarHBondContact O-CG2 3.39Å; V192-V196 PolarHBondContact O-N 3.28Å; V192-L220 HydrophobicContact CG1-CB 4.36Å; V192-L220 WeakPolarHBondContact CG1-O 3.39Å
193L76.5Confident77.9Confident38 Ų3860 Ų6020%0.19930%0.297CS..Hα-helixtrans-62.4-40.9176.2-73.7169.8000111.8I110 R189 N191 E197 L220I110-L193 HydrophobicContact CD1-CD1 4.22Å; I110-L193 HydrophobicContact CD1-CD2 4.38Å; R189-L193 HydrophobicContact CG-CD1 4.15Å; R189-L193 WeakPolarHBondContact O-CG 3.09Å; R189-L193 PolarHBondContact O-N 3.29Å; N191-L193 VanDerWaalsContact C-N 3.34Å; N191-L193 PolarHBondContact O-N 3.44Å; L193-E197 WeakPolarHBondContact O-CB 2.93Å; L193-E197 PolarHBondContact O-N 3.28Å; L193-L220 HydrophobicContact CD2-CD2 3.72Å
194R75.3Confident77.8Confident118 Ų11861.7 Ų61.745%0.44531%0.305SS..Hα-helixtrans-64.1-42.9175.2-172.2-177.8-66155.20.2111.3S190 N191 V192 E197 L198S190-R194 PolarHBondContact O-N 2.92Å; S190-R194 VanDerWaalsContact O-N 3.09Å; N191-R194 WeakPolarHBondContact O-CB 3.29Å; N191-R194 PolarHBondContact O-N 3.39Å; V192-R194 VanDerWaalsContact C-N 3.32Å; V192-R194 PolarHBondContact O-N 3.11Å; R194-E197 PolarHBondContact O-N 3.38Å; R194-L198 HydrophobicContact CG-CD1 4.17Å; R194-L198 WeakPolarHBondContact O-CB 3.35Å; R194-L198 VanDerWaalsContact O-CG 3.23Å; R194-L198 WeakPolarHBondContact O-CG 3.36Å; R194-L198 PolarHBondContact O-N 2.79Å
195E74.4Confident77.9Confident30 Ų3061.2 Ų61.214%0.1431%0.309CS..Hα-helixtrans-60.4-49.2177-166.6-177.7156.900111F15 K181 N191 V192 E197 L198 M199F15-E195 HydrophobicContact CE1-CG 3.99Å; F15-E195 HydrophobicContact CZ-CG 3.89Å; K181-E195 IonicContact NZ-OE1 2.68Å; K181-E195 PolarHBondContact NZ-OE1 3.22Å; K181-E195 IonicContact NZ-OE2 3.48Å; N191-E195 WeakPolarHBondContact O-CB 2.9Å; N191-E195 PolarHBondContact O-N 3.37Å; V192-E195 WeakPolarHBondContact O-CB 3.23Å; V192-E195 PolarHBondContact O-N 3.29Å; E195-E197 PolarHBondContact O-N 3.36Å; E195-L198 PolarHBondContact O-N 3.05Å; E195-M199 HydrophobicContact CG-CE 3.92Å; E195-M199 HydrophobicContact CG-SD 4.46Å; E195-M199 WeakPolarHBondContact O-CB 3.15Å; E195-M199 VanDerWaalsContact O-CG 3.32Å; E195-M199 WeakPolarHBondContact O-CG 3.23Å; E195-M199 PolarHBondContact O-N 3.36Å
196V78.6Confident78.1Confident3 Ų358.7 Ų58.72%0.01829%0.294CS..Hα-helixtrans-59.8-44.5176.8164.80000111.8V144 V192 L198 M199 R200 F210 L220 A222V144-V196 HydrophobicContact CG1-CG1 3.68Å; V192-V196 HydrophobicContact CG1-CG2 4.37Å; V192-V196 WeakPolarHBondContact O-CB 3.25Å; V192-V196 WeakPolarHBondContact O-CG2 3.39Å; V192-V196 PolarHBondContact O-N 3.28Å; V196-L198 VanDerWaalsContact C-N 3.33Å; V196-L198 PolarHBondContact O-N 3.08Å; V196-M199 HydrophobicContact CG2-CE 4.06Å; V196-M199 PolarHBondContact O-N 3.37Å; V196-R200 VanDerWaalsContact O-CB 3.3Å; V196-R200 WeakPolarHBondContact O-CB 3.46Å; V196-R200 PolarHBondContact O-N 3.07Å; V196-F210 HydrophobicContact CB-CZ 4.39Å; V196-F210 HydrophobicContact CG1-CE1 4.08Å; V196-F210 HydrophobicContact CG1-CE2 4.36Å; V196-F210 HydrophobicContact CG1-CZ 3.61Å; V196-F210 HydrophobicContact CG2-CE2 4.32Å; V196-F210 HydrophobicContact CG2-CZ 4.28Å; V196-L220 HydrophobicContact CB-CD2 4.31Å; V196-L220 HydrophobicContact CG1-CD2 4.2Å; V196-L220 HydrophobicContact CG2-CD2 3.95Å; V196-A222 HydrophobicContact CG2-CB 4.28Å
197E77.4Confident78.4Confident55 Ų5555 Ų5526%0.25727%0.267SS..Hα-helixtrans-67-34.1179.2179.857.9-165.100112.4L193 R194 E195 R200 K201L193-E197 WeakPolarHBondContact O-CB 2.93Å; L193-E197 PolarHBondContact O-N 3.28Å; R194-E197 PolarHBondContact O-N 3.38Å; E195-E197 PolarHBondContact O-N 3.36Å; E197-R200 IonicContact OE1-CZ 3.71Å; E197-R200 IonicContact OE1-NE 3.79Å; E197-R200 IonicContact OE1-NH2 2.75Å; E197-R200 PolarHBondContact OE1-NH2 3.23Å; E197-R200 IonicContact OE2-CZ 3.65Å; E197-R200 IonicContact OE2-NE 3.7Å; E197-R200 PolarHBondContact OE2-NE 3.35Å; E197-R200 IonicContact OE2-NH2 2.76Å; E197-R200 PolarHBondContact OE2-NH2 2.99Å; E197-K201 WeakPolarHBondContact O-CG 3.4Å; E197-K201 WeakPolarHBondContact OE1-CE 3.32Å; E197-K201 IonicContact OE1-NZ 2.7Å; E197-K201 PolarHBondContact OE1-NZ 3.15Å
198L77.4Confident78.7Confident27 Ų2751.8 Ų51.814%0.14124%0.242CC..Hα-helixtrans-67.9-52.6173-73.1169.3000110.9L11 R194 E195 V196 R200 K201 L202 Y268L11-L198 HydrophobicContact CD1-CD1 4.27Å; L11-L198 HydrophobicContact CD2-CD1 3.52Å; R194-L198 HydrophobicContact CG-CD1 4.17Å; R194-L198 WeakPolarHBondContact O-CB 3.35Å; R194-L198 VanDerWaalsContact O-CG 3.23Å; R194-L198 WeakPolarHBondContact O-CG 3.36Å; R194-L198 PolarHBondContact O-N 2.79Å; E195-L198 PolarHBondContact O-N 3.05Å; V196-L198 VanDerWaalsContact C-N 3.33Å; V196-L198 PolarHBondContact O-N 3.08Å; L198-R200 PolarHBondContact O-N 2.8Å; L198-K201 PolarHBondContact O-N 2.75Å; L198-L202 PolarHBondContact O-N 3.36Å; L198-Y268 HydrophobicContact CD2-CD1 3.65Å; L198-Y268 HydrophobicContact CD2-CE1 3.1Å; L198-Y268 HydrophobicContact CD2-CE2 4.4Å; L198-Y268 HydrophobicContact CD2-CG 4.49Å
199M78.5Confident79.2Confident14 Ų1454.9 Ų54.97%0.06925%0.251CS..Hα-helixtrans-56.9-36.9178.7-73.6-171-65.800112.3F15 E195 V196 K201 L202 F210 A222 T224F15-M199 HydrophobicContact CD1-CG 3.72Å; F15-M199 HydrophobicContact CD1-SD 4.31Å; F15-M199 HydrophobicContact CE1-CG 3.49Å; F15-M199 VanDerWaalsContact CE1-CG 3.49Å; F15-M199 HydrophobicContact CE1-SD 3.93Å; E195-M199 HydrophobicContact CG-CE 3.92Å; E195-M199 HydrophobicContact CG-SD 4.46Å; E195-M199 WeakPolarHBondContact O-CB 3.15Å; E195-M199 VanDerWaalsContact O-CG 3.32Å; E195-M199 WeakPolarHBondContact O-CG 3.23Å; E195-M199 PolarHBondContact O-N 3.36Å; V196-M199 HydrophobicContact CG2-CE 4.06Å; V196-M199 PolarHBondContact O-N 3.37Å; M199-K201 VanDerWaalsContact C-N 3.28Å; M199-K201 PolarHBondContact O-N 2.84Å; M199-L202 PolarHBondContact O-N 3.44Å; M199-F210 HydrophobicContact CB-CB 3.94Å; M199-F210 HydrophobicContact CB-CD2 3.9Å; M199-F210 HydrophobicContact CB-CG 3.98Å; M199-F210 HydrophobicContact CE-CD2 3.93Å; M199-F210 HydrophobicContact CE-CE2 3.91Å; M199-F210 HydrophobicContact SD-CD2 4.22Å; M199-A222 HydrophobicContact CE-CB 3.61Å; M199-T224 HydrophobicContact SD-CG2 4.3Å
200R82.6Confident79.9Confident87 Ų8752.2 Ų52.233%0.32824%0.241SC..Hα-helixtrans-61.3-34.2176.3-174-174.874.179.10.9113.2A143 L145 V196 E197 L198 F210A143-R200 WeakPolarHBondContact O-CD 3.3Å; L145-R200 HydrophobicContact CD2-CG 4.32Å; L145-R200 HydrophobicContact CG-CG 4.29Å; V196-R200 VanDerWaalsContact O-CB 3.3Å; V196-R200 WeakPolarHBondContact O-CB 3.46Å; V196-R200 PolarHBondContact O-N 3.07Å; E197-R200 IonicContact OE1-CZ 3.71Å; E197-R200 IonicContact OE1-NE 3.79Å; E197-R200 IonicContact OE1-NH2 2.75Å; E197-R200 PolarHBondContact OE1-NH2 3.23Å; E197-R200 IonicContact OE2-CZ 3.65Å; E197-R200 IonicContact OE2-NE 3.7Å; E197-R200 PolarHBondContact OE2-NE 3.35Å; E197-R200 IonicContact OE2-NH2 2.76Å; E197-R200 PolarHBondContact OE2-NH2 2.99Å; L198-R200 PolarHBondContact O-N 2.8Å; R200-F210 HydrophobicContact CB-CD1 4.16Å; R200-F210 HydrophobicContact CB-CE1 4.48Å
201K82.3Confident80.6Confident100 Ų10052.5 Ų52.544%0.43523%0.231SC..Hα-helixtrans-80.4-24.6-177.5-69.8173.2-172.4172.80112.7E197 L198 M199 Y268E197-K201 WeakPolarHBondContact O-CG 3.4Å; E197-K201 WeakPolarHBondContact OE1-CE 3.32Å; E197-K201 IonicContact OE1-NZ 2.7Å; E197-K201 PolarHBondContact OE1-NZ 3.15Å; L198-K201 PolarHBondContact O-N 2.75Å; M199-K201 VanDerWaalsContact C-N 3.28Å; M199-K201 PolarHBondContact O-N 2.84Å; K201-Y268 WeakPolarHBondContact CD-OH 3.46Å
202L81.4Confident81.3Confident16 Ų1649 Ų498%0.08421%0.213CC..  trans-84.2121.6-177.1-61.1176.8000110.4L198 M199 V207 Y262 C266 Y268L198-L202 PolarHBondContact O-N 3.36Å; M199-L202 PolarHBondContact O-N 3.44Å; L202-V207 HydrophobicContact CB-CG1 3.97Å; L202-V207 HydrophobicContact CD1-CG1 4.23Å; L202-Y262 HydrophobicContact CB-CE1 4.25Å; L202-Y262 HydrophobicContact CD2-CE1 3.89Å; L202-C266 HydrophobicContact CD2-CB 4.34Å; L202-Y268 HydrophobicContact CD2-CD2 3.91Å; L202-Y268 HydrophobicContact CD2-CE2 4.14Å
203R86.4Confident82Confident190 Ų19048.4 Ų48.472%0.71721%0.209SC*.  trans-143.299.4176.6-175.4178.4176.2-179.1-3.6110Y262R203-Y262 PolarHBondContact N-OH 3.28Å; R203-Y262 PolarHBondContact O-OH 3.31Å
204H83.7Confident82.4Confident50 Ų5046.6 Ų46.623%0.23120%0.199CC..  trans-150.8146.3178.3-176.1-95.2000108.7N206 V207 Y262H204-N206 PolarHBondContact CE1-OD1 2.87Å; H204-N206 WeakPolarHBondContact ND1-CB 3.44Å; H204-N206 PolarHBondContact ND1-N 3.35Å; H204-N206 PolarHBondContact O-N 3.25Å; H204-V207 HydrophobicContact CB-CB 4.06Å; H204-V207 HydrophobicContact CB-CG2 3.86Å; H204-V207 PolarHBondContact O-N 2.85Å; H204-V207 VanDerWaalsContact O-N 3.14Å; H204-V207 VanDerWaalsContact O-O 3.11Å; H204-Y262 HydrophobicContact CB-CD1 3.38Å; H204-Y262 HydrophobicContact CB-CD2 4.01Å; H204-Y262 HydrophobicContact CB-CE1 3.63Å; H204-Y262 HydrophobicContact CB-CE2 4.24Å; H204-Y262 HydrophobicContact CB-CG 3.57Å; H204-Y262 AromaticContact CD2-CD2 3.76Å; H204-Y262 AromaticContact CD2-CG 3.63Å; H204-Y262 AromaticContact CG-CD1 3.91Å; H204-Y262 AromaticContact CG-CG 3.63Å
205P84Confident82.8Confident62 Ų6243.6 Ų43.640%0.40319%0.194SC..THydrogen-bonded Turntrans-51.8-46.1176.418.3-31.8000111.3C19 T21 V207C19-P205 VanDerWaalsContact CB-C 3.44Å; C19-P205 HydrophobicContact CB-CB 4.08Å; C19-P205 WeakPolarHBondContact CB-O 3.2Å; C19-P205 PolarHBondContact SG-O 3.45Å; T21-P205 HydrophobicContact CG2-CB 3.87Å; T21-P205 HydrophobicContact CG2-CG 3.82Å; P205-V207 PolarHBondContact O-N 3.46Å
206N81.6Confident83.2Confident1 Ų144.7 Ų44.71%0.00520%0.201CC..THydrogen-bonded Turntrans-84.926.4-179-51.692.6000115.4C17 C19 H204 D255 G259C17-N206 PolarHBondContact N-O 2.87Å; C17-N206 CarbonylContact O-C 3.57Å; C17-N206 WeakPolarHBondContact O-CA 3.42Å; C19-N206 PolarHBondContact N-ND2 3.21Å; C19-N206 PolarHBondContact O-ND2 3.05Å; H204-N206 PolarHBondContact CE1-OD1 2.87Å; H204-N206 WeakPolarHBondContact ND1-CB 3.44Å; H204-N206 PolarHBondContact ND1-N 3.35Å; H204-N206 PolarHBondContact O-N 3.25Å; N206-D255 WeakPolarHBondContact CB-O 3.36Å; N206-D255 WeakPolarHBondContact ND2-CA 3.35Å; N206-D255 WeakPolarHBondContact ND2-CB 3.33Å; N206-D255 PolarHBondContact ND2-O 2.92Å; N206-G259 WeakPolarHBondContact O-CA 3.34Å
207V80.6Confident83.3Confident3 Ų351.1 Ų51.12%0.01824%0.235CC..BIsolated β-bridgetrans-137.1133.4177.6177.20000108.3F15 L202 H204 P205 R209 Y262 I263F15-V207 VanDerWaalsContact O-CG1 3.3Å; F15-V207 WeakPolarHBondContact O-CG1 3.25Å; L202-V207 HydrophobicContact CB-CG1 3.97Å; L202-V207 HydrophobicContact CD1-CG1 4.23Å; H204-V207 HydrophobicContact CB-CB 4.06Å; H204-V207 HydrophobicContact CB-CG2 3.86Å; H204-V207 PolarHBondContact O-N 2.85Å; H204-V207 VanDerWaalsContact O-N 3.14Å; H204-V207 VanDerWaalsContact O-O 3.11Å; P205-V207 PolarHBondContact O-N 3.46Å; V207-R209 PolarHBondContact O-N 2.82Å; V207-R209 VanDerWaalsContact O-N 3.15Å; V207-Y262 HydrophobicContact CG2-CD1 3.9Å; V207-I263 HydrophobicContact CG2-CD1 4.1Å; V207-I263 HydrophobicContact CG2-CG1 4.05Å
208L82.4Confident83.2Confident34 Ų3449.8 Ų49.818%0.17824%0.236CC..PPolyproline II helixtrans-58.7119.6-173.9-174.668.3000110.4F15 C17 F210 T224 E225 C227F15-L208 PolarHBondContact O-N 3.24Å; C17-L208 HydrophobicContact CB-CB 4.06Å; C17-L208 HydrophobicContact CB-CD1 4.39Å; L208-F210 PolarHBondContact O-N 3.46Å; L208-T224 HydrophobicContact CD2-CG2 3.92Å; L208-T224 HydrophobicContact CG-CG2 4.28Å; L208-E225 HydrophobicContact CD1-CG 3.73Å; L208-C227 VanDerWaalsContact CD1-SG 3.57Å
209R84.4Confident83.3Confident106 Ų10650.6 Ų50.640%0.424%0.239SC..PPolyproline II helixtrans-76.6122.7-173.9-172.9170.2177175.31.1111.8V207 T224 E225V207-R209 PolarHBondContact O-N 2.82Å; V207-R209 VanDerWaalsContact O-N 3.15Å; R209-T224 WeakPolarHBondContact O-CA 3.47Å; R209-E225 VanDerWaalsContact CB-CD 3.43Å; R209-E225 HydrophobicContact CB-CG 4.19Å; R209-E225 WeakPolarHBondContact CB-OE1 3.35Å; R209-E225 PolarHBondContact N-OE1 3.23Å; R209-E225 PolarHBondContact O-N 3.19Å
210F87.3Confident83.5Confident4 Ų450.3 Ų50.32%0.01824%0.238CC..EExtended strand (participates in β ladder)trans-65.7131.5165.5-168.2-117.6000111.2V144 L145 V196 M199 R200 L208 G212 A213 A222 L223V144-F210 HydrophobicContact CG1-CZ 4.47Å; L145-F210 HydrophobicContact CD1-CD1 4Å; L145-F210 WeakPolarHBondContact CD1-O 3.42Å; L145-F210 HydrophobicContact CG-CD1 4.24Å; V196-F210 HydrophobicContact CB-CZ 4.39Å; V196-F210 HydrophobicContact CG1-CE1 4.08Å; V196-F210 HydrophobicContact CG1-CE2 4.36Å; V196-F210 HydrophobicContact CG1-CZ 3.61Å; V196-F210 HydrophobicContact CG2-CE2 4.32Å; V196-F210 HydrophobicContact CG2-CZ 4.28Å; M199-F210 HydrophobicContact CB-CB 3.94Å; M199-F210 HydrophobicContact CB-CD2 3.9Å; M199-F210 HydrophobicContact CB-CG 3.98Å; M199-F210 HydrophobicContact CE-CD2 3.93Å; M199-F210 HydrophobicContact CE-CE2 3.91Å; M199-F210 HydrophobicContact SD-CD2 4.22Å; R200-F210 HydrophobicContact CB-CD1 4.16Å; R200-F210 HydrophobicContact CB-CE1 4.48Å; L208-F210 PolarHBondContact O-N 3.46Å; F210-G212 WeakPolarHBondContact CE2-O 3.46Å; F210-G212 WeakPolarHBondContact CZ-O 3.36Å; F210-A213 HydrophobicContact CZ-CB 4.42Å; F210-A222 HydrophobicContact CE2-CB 4.11Å; F210-L223 WeakPolarHBondContact CD2-O 3.45Å
211R88.9Confident83.7Confident78 Ų7846.4 Ų46.429%0.29422%0.224SC..EExtended strand (participates in β ladder)trans-111.1-25.8-177.4-64.6-68.9-178.3154.22.2112.7L178 L223 E225L178-R211 HydrophobicContact CD2-CB 3.98Å; L178-R211 HydrophobicContact CD2-CG 3.76Å; R211-L223 PolarHBondContact N-O 3.15Å; R211-E225 HydrophobicContact CG-CB 4.33Å; R211-E225 IonicContact CZ-OE2 3.53Å; R211-E225 IonicContact NE-OE2 2.84Å; R211-E225 IonicContact NH2-OE2 3.36Å; R211-E225 PolarHBondContact NH2-OE2 3.14Å
212G89.4Confident83.9Confident0 Ų042 Ų420%021%0.206CC..EExtended strand (participates in β ladder)trans158.7-161.7177.300000111.2R146 F210 L223R146-G212 CarbonylContact O-C 3.47Å; R146-G212 VanDerWaalsContact O-CA 3.23Å; R146-G212 WeakPolarHBondContact O-CA 3.49Å; F210-G212 WeakPolarHBondContact CE2-O 3.46Å; F210-G212 WeakPolarHBondContact CZ-O 3.36Å; G212-L223 PolarHBondContact N-O 3.28Å; G212-L223 WeakPolarHBondContact O-CA 3.44Å; G212-L223 WeakPolarHBondContact O-CB 3.45Å; G212-L223 PolarHBondContact O-N 3.05Å
213A88.4Confident84.3Confident0 Ų041.2 Ų41.20%020%0.202CC..EExtended strand (participates in β ladder)trans-135.2151.3174.200000111.3V144 R146 L147 Y148 F210 L220 H221V144-A213 HydrophobicContact CB-CB 4.28Å; V144-A213 HydrophobicContact CG1-CB 3.72Å; R146-A213 PolarHBondContact O-N 2.91Å; L147-A213 WeakPolarHBondContact CA-O 3.49Å; Y148-A213 PolarHBondContact N-O 3.39Å; F210-A213 HydrophobicContact CZ-CB 4.42Å; A213-L220 HydrophobicContact CB-CD1 3.42Å; A213-L220 VanDerWaalsContact CB-CD1 3.42Å; A213-L220 HydrophobicContact CB-CD2 4.4Å; A213-L220 HydrophobicContact CB-CG 3.86Å; A213-H221 CarbonylContact C-O 3.41Å; A213-H221 WeakPolarHBondContact CA-O 3.37Å; A213-H221 WeakPolarHBondContact CB-O 3.44Å
214C86.3Confident84.4Confident0 Ų033 Ų330%017%0.173CC..EExtended strand (participates in β ladder)trans-99.3137.9168-177.20000108.9Y148 R149 M150 L180 H221 L223Y148-C214 WeakPolarHBondContact O-CA 3.11Å; R149-C214 VanDerWaalsContact C-SG 3.59Å; M150-C214 WeakPolarHBondContact CA-SG 3.44Å; M150-C214 PolarHBondContact N-SG 2.96Å; L180-C214 HydrophobicContact CD1-CB 3.86Å; C214-H221 HydrophobicContact CB-CB 4.25Å; C214-H221 PolarHBondContact N-O 3.25Å; C214-H221 PolarHBondContact O-N 3.46Å; C214-L223 HydrophobicContact CB-CD1 4.23Å
215V82.1Confident84.4Confident55 Ų5532 Ų3233%0.33317%0.168SC..EExtended strand (participates in β ladder)trans-109122171.6179.20000108.4L147 Y148 Q219 L220L147-V215 HydrophobicContact CD2-CG2 3.76Å; Y148-V215 PolarHBondContact O-N 3.39Å; Y148-V215 VanDerWaalsContact O-N 3.12Å; V215-Q219 WeakPolarHBondContact CA-O 3.36Å; V215-L220 HydrophobicContact CG2-CD1 3.72Å
216D83.1Confident84.4Confident53 Ų5332 Ų3228%0.28316%0.161SC..EExtended strand (participates in β ladder)trans-140.6136.2176.3-173.249.5000110M150 G218 Q219M150-D216 HydrophobicContact CB-CB 4.11Å; D216-G218 PolarHBondContact O-N 2.84Å; D216-Q219 PolarHBondContact N-O 3.42Å; D216-Q219 VanDerWaalsContact N-O 3.11Å; D216-Q219 WeakPolarHBondContact O-CA 2.92Å; D216-Q219 WeakPolarHBondContact O-CB 2.98Å; D216-Q219 PolarHBondContact O-N 2.76Å
217N80.3Confident84.3Confident138 Ų13832.5 Ų32.574%0.73816%0.164SC*.THydrogen-bonded Turntrans46.140.9179.7-64.5-54.2000114.4Q219N217-Q219 PolarHBondContact O-N 3.36Å
218G75.6Confident83.9Confident28 Ų2837.8 Ų37.829%0.28919%0.188SC..THydrogen-bonded Turntrans73.8-1.9-178.600000115.4R189 D216R189-G218 PolarHBondContact NH1-O 3.47Å; D216-G218 PolarHBondContact O-N 2.84Å
219Q79.2Confident83.1Confident43 Ų4337.8 Ų37.820%0.20119%0.193CC..EExtended strand (participates in β ladder)trans-96.7154.3178.1-56.5-165.722.900111.8N183 V215 D216 N217N183-Q219 PolarHBondContact O-OE1 2.87Å; N183-Q219 VanDerWaalsContact O-OE1 3.1Å; V215-Q219 WeakPolarHBondContact CA-O 3.36Å; D216-Q219 PolarHBondContact N-O 3.42Å; D216-Q219 VanDerWaalsContact N-O 3.11Å; D216-Q219 WeakPolarHBondContact O-CA 2.92Å; D216-Q219 WeakPolarHBondContact O-CB 2.98Å; D216-Q219 PolarHBondContact O-N 2.76Å; N217-Q219 PolarHBondContact O-N 3.36Å
220L82.4Confident82.4Confident9 Ų933.7 Ų33.75%0.04718%0.184CC..EExtended strand (participates in β ladder)trans-103.8134.9175.5-166.470.9000108.8L140 V144 L147 V192 L193 V196 A213 V215L140-L220 HydrophobicContact CD2-CD1 4.29Å; V144-L220 HydrophobicContact CG1-CD2 4.47Å; L147-L220 HydrophobicContact CD2-CD1 4.48Å; V192-L220 HydrophobicContact CG1-CB 4.36Å; V192-L220 WeakPolarHBondContact CG1-O 3.39Å; L193-L220 HydrophobicContact CD2-CD2 3.72Å; V196-L220 HydrophobicContact CB-CD2 4.31Å; V196-L220 HydrophobicContact CG1-CD2 4.2Å; V196-L220 HydrophobicContact CG2-CD2 3.95Å; A213-L220 HydrophobicContact CB-CD1 3.42Å; A213-L220 VanDerWaalsContact CB-CD1 3.42Å; A213-L220 HydrophobicContact CB-CD2 4.4Å; A213-L220 HydrophobicContact CB-CG 3.86Å; V215-L220 HydrophobicContact CG2-CD1 3.72Å
221H87.1Confident81.5Confident5 Ų533.9 Ų33.92%0.02319%0.187CC..EExtended strand (participates in β ladder)trans-126.9132.9179.4-55.1-46.9000109.2L180 K181 N183 A213 C214L180-H221 HydrophobicContact CD1-CB 3.62Å; K181-H221 WeakPolarHBondContact O-CA 3.45Å; K181-H221 WeakPolarHBondContact O-CB 3.23Å; N183-H221 PolarHBondContact N-ND1 3.34Å; N183-H221 VanDerWaalsContact N-ND1 3.15Å; A213-H221 CarbonylContact C-O 3.41Å; A213-H221 WeakPolarHBondContact CA-O 3.37Å; A213-H221 WeakPolarHBondContact CB-O 3.44Å; C214-H221 HydrophobicContact CB-CB 4.25Å; C214-H221 PolarHBondContact N-O 3.25Å; C214-H221 PolarHBondContact O-N 3.46Å
222A87.5Confident80.7Confident7 Ų731.3 Ų31.36%0.05818%0.179CC..EExtended strand (participates in β ladder)trans-81.5137.1-173.400000111.3L180 K181 V196 M199 F210L180-A222 WeakPolarHBondContact CA-O 3.34Å; K181-A222 HydrophobicContact CB-CB 4.47Å; K181-A222 PolarHBondContact N-O 3.44Å; K181-A222 PolarHBondContact O-N 2.91Å; V196-A222 HydrophobicContact CG2-CB 4.28Å; M199-A222 HydrophobicContact CE-CB 3.61Å; F210-A222 HydrophobicContact CE2-CB 4.11Å
223L89.7Confident79.7Confident0 Ų034 Ų340%019%0.193CC..EExtended strand (participates in β ladder)trans-111.6125.2170.6-71.4160.3000109.8Y148 F153 V169 L178 V179 L180 F210 R211 G212 C214Y148-L223 HydrophobicContact CD2-CD1 3.46Å; Y148-L223 VanDerWaalsContact CD2-CD1 3.46Å; Y148-L223 HydrophobicContact CE2-CD1 4.08Å; Y148-L223 HydrophobicContact CG-CD1 4.11Å; F153-L223 HydrophobicContact CE2-CD1 3.9Å; F153-L223 HydrophobicContact CE2-CD2 4.45Å; F153-L223 HydrophobicContact CZ-CD1 3.61Å; F153-L223 HydrophobicContact CZ-CD2 4.14Å; V169-L223 HydrophobicContact CG2-CD2 3.78Å; L178-L223 HydrophobicContact CB-CD2 4.26Å; L178-L223 HydrophobicContact CD1-CD2 4.24Å; V179-L223 WeakPolarHBondContact O-CA 3.38Å; L180-L223 HydrophobicContact CB-CD2 3.87Å; L180-L223 HydrophobicContact CD1-CD2 3.8Å; L180-L223 HydrophobicContact CD1-CG 4.06Å; L180-L223 HydrophobicContact CG-CD2 4.44Å; F210-L223 WeakPolarHBondContact CD2-O 3.45Å; R211-L223 PolarHBondContact N-O 3.15Å; G212-L223 PolarHBondContact N-O 3.28Å; G212-L223 WeakPolarHBondContact O-CA 3.44Å; G212-L223 WeakPolarHBondContact O-CB 3.45Å; G212-L223 PolarHBondContact O-N 3.05Å; C214-L223 HydrophobicContact CB-CD1 4.23Å
224T87.3Confident78.9Confident17 Ų1740.9 Ų40.910%0.10422%0.223CC..EExtended strand (participates in β ladder)trans-121.3169.617657.20000110.3L178 V179 M199 L208 R209L178-T224 WeakPolarHBondContact CA-O 3.39Å; L178-T224 WeakPolarHBondContact CB-O 3.1Å; V179-T224 PolarHBondContact N-O 2.77Å; V179-T224 PolarHBondContact O-N 2.7Å; M199-T224 HydrophobicContact SD-CG2 4.3Å; L208-T224 HydrophobicContact CD2-CG2 3.92Å; L208-T224 HydrophobicContact CG-CG2 4.28Å; R209-T224 WeakPolarHBondContact O-CA 3.47Å
225E84.8Confident78.2Confident30 Ų3041.5 Ų41.514%0.1423%0.227CC..EExtended strand (participates in β ladder)trans-65150.3170.668.3-165.315200112.1L208 R209 R211L208-E225 HydrophobicContact CD1-CG 3.73Å; R209-E225 VanDerWaalsContact CB-CD 3.43Å; R209-E225 HydrophobicContact CB-CG 4.19Å; R209-E225 WeakPolarHBondContact CB-OE1 3.35Å; R209-E225 PolarHBondContact N-OE1 3.23Å; R209-E225 PolarHBondContact O-N 3.19Å; R211-E225 HydrophobicContact CG-CB 4.33Å; R211-E225 IonicContact CZ-OE2 3.53Å; R211-E225 IonicContact NE-OE2 2.84Å; R211-E225 IonicContact NH2-OE2 3.36Å; R211-E225 PolarHBondContact NH2-OE2 3.14Å
226Y84.1Confident77.9Confident62 Ų6241.8 Ų41.824%0.24323%0.225CC..  trans-85.6133.4173.2-179.9-101.3000110.3L158 R168 I177 V179 Q228L158-Y226 HydrophobicContact CD1-CE2 4.23Å; R168-Y226 HydrophobicContact CB-CE2 4.38Å; R168-Y226 HydrophobicContact CG-CD2 4.17Å; R168-Y226 HydrophobicContact CG-CE2 4.04Å; I177-Y226 HydrophobicContact CG2-CD1 3.86Å; I177-Y226 HydrophobicContact CG2-CD2 4.28Å; I177-Y226 HydrophobicContact CG2-CG 3.72Å; V179-Y226 HydrophobicContact CG2-CD2 3.65Å; V179-Y226 HydrophobicContact CG2-CG 4.42Å; Y226-Q228 HydrophobicContact CE1-CB 4.05Å; Y226-Q228 HydrophobicContact CE1-CG 4.41Å
227C79.4Confident77.7Confident10 Ų1043.4 Ų43.47%0.06825%0.246CC..  trans-108.1104.1177.4-60.60000108.7C17 L208 A229 G230 I279C17-C227 PolarHBondContact SG-SG 2.71Å; L208-C227 VanDerWaalsContact CD1-SG 3.57Å; C227-A229 VanDerWaalsContact C-N 3.31Å; C227-A229 PolarHBondContact O-N 3.09Å; C227-G230 PolarHBondContact O-N 3.46Å; C227-G230 VanDerWaalsContact O-N 3.15Å; C227-I279 WeakPolarHBondContact CB-O 3.45Å
228Q71.7Confident77.6Confident115 Ų11538.5 Ų38.554%0.53722%0.223SC..THydrogen-bonded Turntrans-63.7-33.9-171.3-171.2177.8-10.500113.2Y226 G230 D281Y226-Q228 HydrophobicContact CE1-CB 4.05Å; Y226-Q228 HydrophobicContact CE1-CG 4.41Å; Q228-G230 PolarHBondContact O-N 3.18Å; Q228-D281 WeakPolarHBondContact CA-OD1 3.43Å; Q228-D281 HydrophobicContact CB-CB 4.34Å; Q228-D281 WeakPolarHBondContact CB-OD1 3.48Å; Q228-D281 PolarHBondContact N-OD1 3.17Å
229A66.9Low77.7Confident33 Ų3343.3 Ų43.327%0.27324%0.242SC..THydrogen-bonded Turntrans-75.9-3.3-179.900000113.4C227 I279C227-A229 VanDerWaalsContact C-N 3.31Å; C227-A229 PolarHBondContact O-N 3.09Å; A229-I279 HydrophobicContact CB-CB 3.83Å; A229-I279 HydrophobicContact CB-CG2 3.76Å
230G69Low77.6Confident20 Ų2046 Ų4621%0.20625%0.254CS..  trans71.3-154.8179.900000112.6C227 Q228 S278 I279C227-G230 PolarHBondContact O-N 3.46Å; C227-G230 VanDerWaalsContact O-N 3.15Å; Q228-G230 PolarHBondContact O-N 3.18Å; G230-S278 CarbonylContact O-C 3.44Å; G230-S278 WeakPolarHBondContact O-CA 3.5Å; G230-I279 PolarHBondContact O-N 3.03Å
231G69Low77.4Confident9 Ų948 Ų489%0.09326%0.261CS..BIsolated β-bridgetrans-84.5152.7178.300000113D233 K234 L235 V277G231-D233 WeakPolarHBondContact CA-OD1 3.46Å; G231-D233 PolarHBondContact O-N 2.84Å; G231-K234 WeakPolarHBondContact O-CB 3.33Å; G231-K234 PolarHBondContact O-N 3.43Å; G231-L235 PolarHBondContact O-N 2.89Å; G231-V277 CarbonylContact C-O 3.49Å; G231-V277 WeakPolarHBondContact CA-O 3.47Å
232L70.9Confident76.8Confident23 Ų2353.7 Ų53.712%0.1229%0.291CS..Hα-helixtrans-62.7-25.2175.5177.664.5000111.9K234 L235 I236 W241 L252 S275 V277 I279L232-K234 VanDerWaalsContact C-N 3.35Å; L232-L235 HydrophobicContact CD1-CB 4.43Å; L232-L235 HydrophobicContact CD1-CD2 4.03Å; L232-L235 PolarHBondContact O-N 3.27Å; L232-I236 HydrophobicContact CD1-CD1 4.13Å; L232-I236 HydrophobicContact CD1-CG1 4.07Å; L232-I236 HydrophobicContact CD2-CD1 4.2Å; L232-I236 HydrophobicContact CG-CD1 3.68Å; L232-I236 HydrophobicContact CG-CG1 4.12Å; L232-I236 WeakPolarHBondContact O-CB 3.26Å; L232-I236 WeakPolarHBondContact O-CG1 3.14Å; L232-I236 PolarHBondContact O-N 2.96Å; L232-W241 HydrophobicContact CD1-CZ3 4.31Å; L232-L252 HydrophobicContact CD1-CD1 3.94Å; L232-S275 CarbonylContact C-O 3.55Å; L232-S275 WeakPolarHBondContact CB-O 3.43Å; L232-S275 PolarHBondContact N-O 3.25Å; L232-V277 PolarHBondContact N-O 2.89Å; L232-I279 HydrophobicContact CB-CD1 3.97Å; L232-I279 HydrophobicContact CB-CG1 4.03Å; L232-I279 HydrophobicContact CD1-CD1 3.9Å; L232-I279 HydrophobicContact CD1-CG1 4.44Å
233D68.1Low76.4Confident56 Ų5661.1 Ų61.130%0.29932%0.324SS..Hα-helixtrans-58.4-43.6169.863.5-41000112.2G231 I236 A237 S275G231-D233 WeakPolarHBondContact CA-OD1 3.46Å; G231-D233 PolarHBondContact O-N 2.84Å; D233-I236 PolarHBondContact O-N 2.9Å; D233-A237 VanDerWaalsContact O-CB 3.23Å; D233-A237 WeakPolarHBondContact O-CB 3.05Å; D233-A237 PolarHBondContact O-N 3.01Å; D233-S275 PolarHBondContact N-O 3.19Å
234K71.5Confident76Confident145 Ų14561.5 Ų61.563%0.6333%0.326SS*.Hα-helixtrans-67.4-39.6177-63.8-174.3-180-178.90111.7G231 L232 S238G231-K234 WeakPolarHBondContact O-CB 3.33Å; G231-K234 PolarHBondContact O-N 3.43Å; L232-K234 VanDerWaalsContact C-N 3.35Å; K234-S238 PolarHBondContact O-N 2.98Å
235L72.2Confident75.9Confident14 Ų1463.3 Ų63.37%0.07334%0.343CS..Hα-helixtrans-65-51.1175.7-179.164.8000110.3G231 L232 A237 S238 W241 L244 L252 I279 F283G231-L235 PolarHBondContact O-N 2.89Å; L232-L235 HydrophobicContact CD1-CB 4.43Å; L232-L235 HydrophobicContact CD1-CD2 4.03Å; L232-L235 PolarHBondContact O-N 3.27Å; L235-A237 PolarHBondContact O-N 3.15Å; L235-S238 PolarHBondContact O-N 3.4Å; L235-S238 PolarHBondContact O-OG 2.75Å; L235-W241 HydrophobicContact CD2-CE3 4.26Å; L235-W241 HydrophobicContact CD2-CZ3 4.46Å; L235-W241 HydrophobicContact CG-CE3 4.16Å; L235-W241 WeakPolarHBondContact O-CB 3.49Å; L235-L244 HydrophobicContact CD1-CD1 4.13Å; L235-L244 HydrophobicContact CD2-CD1 3.92Å; L235-L244 HydrophobicContact CG-CD1 4.18Å; L235-L252 HydrophobicContact CD2-CD1 3.95Å; L235-I279 HydrophobicContact CB-CD1 3.77Å; L235-I279 HydrophobicContact CD2-CD1 3.6Å; L235-I279 HydrophobicContact CG-CD1 4.33Å; L235-F283 HydrophobicContact CD1-CE1 4.11Å; L235-F283 HydrophobicContact CD2-CD1 4.06Å; L235-F283 HydrophobicContact CD2-CE1 3.38Å; L235-F283 HydrophobicContact CD2-CZ 3.68Å; L235-F283 HydrophobicContact CG-CE1 4.4Å
236I76.9Confident76Confident60 Ų6070.4 Ų70.431%0.30837%0.368SS..Hα-helixtrans-59.4-35.7-179.6-70.5168.6000111.7L232 D233 S238 W241L232-I236 HydrophobicContact CD1-CD1 4.13Å; L232-I236 HydrophobicContact CD1-CG1 4.07Å; L232-I236 HydrophobicContact CD2-CD1 4.2Å; L232-I236 HydrophobicContact CG-CD1 3.68Å; L232-I236 HydrophobicContact CG-CG1 4.12Å; L232-I236 WeakPolarHBondContact O-CB 3.26Å; L232-I236 WeakPolarHBondContact O-CG1 3.14Å; L232-I236 PolarHBondContact O-N 2.96Å; D233-I236 PolarHBondContact O-N 2.9Å; I236-S238 VanDerWaalsContact C-N 3.31Å; I236-W241 HydrophobicContact CG1-CD2 4.06Å; I236-W241 HydrophobicContact CG1-CE3 3.98Å; I236-W241 HydrophobicContact CG1-CH2 4.25Å; I236-W241 HydrophobicContact CG1-CZ2 4.3Å; I236-W241 HydrophobicContact CG1-CZ3 4.09Å
237A78.4Confident76Confident87 Ų8771.3 Ų71.372%0.71938%0.384SS*.THydrogen-bonded Turntrans-78.3-11.1178.300000114.1D233 L235D233-A237 VanDerWaalsContact O-CB 3.23Å; D233-A237 WeakPolarHBondContact O-CB 3.05Å; D233-A237 PolarHBondContact O-N 3.01Å; L235-A237 PolarHBondContact O-N 3.15Å
238S77.3Confident76.2Confident36 Ų3672 Ų7225%0.25239%0.387SS..SBendtrans-88.2155.7-179.480.20000112K234 L235 I236 E240 W241K234-S238 PolarHBondContact O-N 2.98Å; L235-S238 PolarHBondContact O-N 3.4Å; L235-S238 PolarHBondContact O-OG 2.75Å; I236-S238 VanDerWaalsContact C-N 3.31Å; S238-E240 PolarHBondContact O-N 2.78Å; S238-E240 WeakPolarHBondContact OG-CB 3.17Å; S238-E240 PolarHBondContact OG-N 2.83Å; S238-W241 WeakPolarHBondContact O-CB 3.16Å; S238-W241 PolarHBondContact O-N 3.25Å; S238-W241 VanDerWaalsContact O-N 3.08Å
239D79.3Confident76.8Confident128 Ų12869 Ų6968%0.68437%0.371SS*.Hα-helixtrans-61.1-23.7172-68.7-35.2000112W241 I242 Q243D239-W241 PolarHBondContact O-N 2.84Å; D239-I242 PolarHBondContact O-N 3Å; D239-Q243 PolarHBondContact O-N 2.88Å
240E76.8Confident77.7Confident99 Ų9971 Ų7146%0.46338%0.379SS..Hα-helixtrans-61.4-34.3175.7-54.1178.9166.400111S238 I242 Q243 L244S238-E240 PolarHBondContact O-N 2.78Å; S238-E240 WeakPolarHBondContact OG-CB 3.17Å; S238-E240 PolarHBondContact OG-N 2.83Å; E240-I242 VanDerWaalsContact C-N 3.29Å; E240-I242 PolarHBondContact O-N 2.94Å; E240-Q243 CarbonylContact O-C 3.55Å; E240-Q243 PolarHBondContact O-N 3.28Å; E240-L244 WeakPolarHBondContact O-CG 3.47Å; E240-L244 PolarHBondContact O-N 2.65Å
241W76.9Confident78.4Confident52 Ų5271.3 Ų71.320%0.19738%0.378CS..Hα-helixtrans-59.2-42.1177176-104.7000112.4L232 L235 I236 S238 D239 Q243 L244 R249 L252L232-W241 HydrophobicContact CD1-CZ3 4.31Å; L235-W241 HydrophobicContact CD2-CE3 4.26Å; L235-W241 HydrophobicContact CD2-CZ3 4.46Å; L235-W241 HydrophobicContact CG-CE3 4.16Å; L235-W241 WeakPolarHBondContact O-CB 3.49Å; I236-W241 HydrophobicContact CG1-CD2 4.06Å; I236-W241 HydrophobicContact CG1-CE3 3.98Å; I236-W241 HydrophobicContact CG1-CH2 4.25Å; I236-W241 HydrophobicContact CG1-CZ2 4.3Å; I236-W241 HydrophobicContact CG1-CZ3 4.09Å; S238-W241 WeakPolarHBondContact O-CB 3.16Å; S238-W241 PolarHBondContact O-N 3.25Å; S238-W241 VanDerWaalsContact O-N 3.08Å; D239-W241 PolarHBondContact O-N 2.84Å; W241-Q243 PolarHBondContact O-N 3.27Å; W241-L244 HydrophobicContact CD2-CD1 4.46Å; W241-L244 HydrophobicContact CE3-CD1 3.62Å; W241-L244 HydrophobicContact CZ3-CD1 4.12Å; W241-L244 WeakPolarHBondContact O-CB 3.35Å; W241-L244 PolarHBondContact O-N 3.27Å; W241-R249 HydrophobicContact CE3-CG 4.42Å; W241-R249 HydrophobicContact CH2-CB 3.88Å; W241-R249 HydrophobicContact CH2-CG 3.6Å; W241-R249 HydrophobicContact CZ2-CB 4.35Å; W241-R249 HydrophobicContact CZ2-CG 3.88Å; W241-R249 HydrophobicContact CZ3-CB 4.46Å; W241-R249 HydrophobicContact CZ3-CG 3.89Å; W241-R249 PolarHBondContact O-NE 2.99Å; W241-R249 PolarHBondContact O-NH2 2.86Å; W241-L252 HydrophobicContact CZ3-CD1 3.8Å
242I75.7Confident78.9Confident125 Ų12571.2 Ų71.264%0.64138%0.375SS*.Hα-helixtrans-62.2-35.9178.7-62.2173.8000110.2D239 E240 R249D239-I242 PolarHBondContact O-N 3Å; E240-I242 VanDerWaalsContact C-N 3.29Å; E240-I242 PolarHBondContact O-N 2.94Å; I242-R249 PolarHBondContact O-NH2 2.81Å; I242-R249 VanDerWaalsContact O-NH2 3.1Å
243Q78.7Confident79.5Confident162 Ų16272.8 Ų72.876%0.75739%0.392SS*.Hα-helixtrans-80.4-18.8-179.7-60.7179.81000113.5D239 E240 W241 A245D239-Q243 PolarHBondContact O-N 2.88Å; E240-Q243 CarbonylContact O-C 3.55Å; E240-Q243 PolarHBondContact O-N 3.28Å; W241-Q243 PolarHBondContact O-N 3.27Å; Q243-A245 PolarHBondContact O-N 2.87Å
244L81Confident80.4Confident8 Ų873.9 Ų73.94%0.04240%0.397CS..SBendtrans-61.4126.7177.4-78174000112.1L235 E240 W241 I248 R249 F283 L287L235-L244 HydrophobicContact CD1-CD1 4.13Å; L235-L244 HydrophobicContact CD2-CD1 3.92Å; L235-L244 HydrophobicContact CG-CD1 4.18Å; E240-L244 WeakPolarHBondContact O-CG 3.47Å; E240-L244 PolarHBondContact O-N 2.65Å; W241-L244 HydrophobicContact CD2-CD1 4.46Å; W241-L244 HydrophobicContact CE3-CD1 3.62Å; W241-L244 HydrophobicContact CZ3-CD1 4.12Å; W241-L244 WeakPolarHBondContact O-CB 3.35Å; W241-L244 PolarHBondContact O-N 3.27Å; L244-I248 HydrophobicContact CD2-CB 4.27Å; L244-I248 HydrophobicContact CD2-CG2 3.89Å; L244-R249 HydrophobicContact CB-CG 4.26Å; L244-R249 PolarHBondContact O-NE 3.27Å; L244-R249 PolarHBondContact O-NH2 3.49Å; L244-F283 HydrophobicContact CD1-CE1 3.88Å; L244-F283 HydrophobicContact CD1-CZ 3.75Å; L244-F283 HydrophobicContact CD2-CE1 3.91Å; L244-F283 HydrophobicContact CD2-CZ 3.92Å; L244-L287 HydrophobicContact CD2-CD2 3.38Å; L244-L287 HydrophobicContact CD2-CG 4.25Å; L244-L287 HydrophobicContact CG-CD2 4.3Å
245A85Confident80.8Confident55 Ų5567.3 Ų67.346%0.45537%0.369SS..  trans-56141.9171.200000110.9Q243 S247 I248 R249Q243-A245 PolarHBondContact O-N 2.87Å; A245-S247 PolarHBondContact O-N 3.22Å; A245-S247 VanDerWaalsContact O-N 3.13Å; A245-I248 HydrophobicContact CB-CG1 4.33Å; A245-I248 WeakPolarHBondContact O-CB 3.49Å; A245-I248 PolarHBondContact O-N 3.29Å; A245-R249 PolarHBondContact O-N 3.13Å
246W86.7Confident81.3Confident179 Ų17967.7 Ų67.768%0.67837%0.372SS*.Hα-helixtrans-55.4-35.2-179.2-172.4-108.8000112.8I248 R249 V250W246-I248 VanDerWaalsContact C-N 3.26Å; W246-I248 PolarHBondContact O-N 3.07Å; W246-R249 PolarHBondContact O-N 3.35Å; W246-R249 VanDerWaalsContact O-N 3.17Å; W246-V250 HydrophobicContact CD2-CG2 4.48Å; W246-V250 HydrophobicContact CG-CG2 4.4Å; W246-V250 HydrophobicContact CZ2-CG2 4.5Å; W246-V250 WeakPolarHBondContact O-CG2 3.28Å; W246-V250 PolarHBondContact O-N 3.06Å
247S85.8Confident81.8Confident82 Ų8267.8 Ų67.857%0.57338%0.378SS*.Hα-helixtrans-56-38.7174.351.90000112.9A245 S251A245-S247 PolarHBondContact O-N 3.22Å; A245-S247 VanDerWaalsContact O-N 3.13Å; S247-S251 WeakPolarHBondContact O-CB 3.18Å; S247-S251 PolarHBondContact O-N 2.79Å
248I83Confident82.2Confident23 Ų2367.2 Ų67.212%0.11836%0.357CS..Hα-helixtrans-71.3-42.2177.7-56.4-59.9000110.8L244 A245 W246 V250 S251 L252 F283 R286L244-I248 HydrophobicContact CD2-CB 4.27Å; L244-I248 HydrophobicContact CD2-CG2 3.89Å; A245-I248 HydrophobicContact CB-CG1 4.33Å; A245-I248 WeakPolarHBondContact O-CB 3.49Å; A245-I248 PolarHBondContact O-N 3.29Å; W246-I248 VanDerWaalsContact C-N 3.26Å; W246-I248 PolarHBondContact O-N 3.07Å; I248-V250 VanDerWaalsContact C-N 3.34Å; I248-V250 PolarHBondContact O-N 3.15Å; I248-S251 WeakPolarHBondContact O-CB 3.44Å; I248-S251 PolarHBondContact O-N 3.19Å; I248-S251 VanDerWaalsContact O-N 3.16Å; I248-L252 PolarHBondContact O-N 2.81Å; I248-F283 HydrophobicContact CG2-CD2 4.49Å; I248-F283 HydrophobicContact CG2-CE1 4.36Å; I248-F283 HydrophobicContact CG2-CE2 3.32Å; I248-F283 HydrophobicContact CG2-CZ 3.26Å; I248-R286 HydrophobicContact CD1-CB 4Å
249R83Confident82.4Confident54 Ų5465.5 Ų65.520%0.20435%0.345CS..Hα-helixtrans-61.6-42.7176.5-58.5-176-175161.67.7111.8W241 I242 L244 A245 W246 L252 A253W241-R249 HydrophobicContact CE3-CG 4.42Å; W241-R249 HydrophobicContact CH2-CB 3.88Å; W241-R249 HydrophobicContact CH2-CG 3.6Å; W241-R249 HydrophobicContact CZ2-CB 4.35Å; W241-R249 HydrophobicContact CZ2-CG 3.88Å; W241-R249 HydrophobicContact CZ3-CB 4.46Å; W241-R249 HydrophobicContact CZ3-CG 3.89Å; W241-R249 PolarHBondContact O-NE 2.99Å; W241-R249 PolarHBondContact O-NH2 2.86Å; I242-R249 PolarHBondContact O-NH2 2.81Å; I242-R249 VanDerWaalsContact O-NH2 3.1Å; L244-R249 HydrophobicContact CB-CG 4.26Å; L244-R249 PolarHBondContact O-NE 3.27Å; L244-R249 PolarHBondContact O-NH2 3.49Å; A245-R249 PolarHBondContact O-N 3.13Å; W246-R249 PolarHBondContact O-N 3.35Å; W246-R249 VanDerWaalsContact O-N 3.17Å; R249-L252 WeakPolarHBondContact O-CB 3.36Å; R249-L252 PolarHBondContact O-N 2.98Å; R249-A253 PolarHBondContact O-N 3.16Å; R249-A253 VanDerWaalsContact O-N 3.09Å
250V85.9Confident82.6Confident75 Ų7560.2 Ų60.246%0.45532%0.316SS..Hα-helixtrans-64.4-40.5174173.90000111W246 I248 L252 A253 L254W246-V250 HydrophobicContact CD2-CG2 4.48Å; W246-V250 HydrophobicContact CG-CG2 4.4Å; W246-V250 HydrophobicContact CZ2-CG2 4.5Å; W246-V250 WeakPolarHBondContact O-CG2 3.28Å; W246-V250 PolarHBondContact O-N 3.06Å; I248-V250 VanDerWaalsContact C-N 3.34Å; I248-V250 PolarHBondContact O-N 3.15Å; V250-L252 VanDerWaalsContact C-N 3.35Å; V250-L252 PolarHBondContact O-N 2.85Å; V250-A253 PolarHBondContact O-N 2.81Å; V250-L254 WeakPolarHBondContact O-CB 3.25Å; V250-L254 PolarHBondContact O-N 2.81Å
251S84.3Confident83.1Confident26 Ų2662.2 Ų62.218%0.18233%0.326CS..Hα-helixtrans-60.1-43.1174.9-170.70000111.8S247 I248 L254 D255 R286S247-S251 WeakPolarHBondContact O-CB 3.18Å; S247-S251 PolarHBondContact O-N 2.79Å; I248-S251 WeakPolarHBondContact O-CB 3.44Å; I248-S251 PolarHBondContact O-N 3.19Å; I248-S251 VanDerWaalsContact O-N 3.16Å; S251-L254 PolarHBondContact O-N 2.88Å; S251-D255 WeakPolarHBondContact O-CB 3.4Å; S251-D255 VanDerWaalsContact O-CG 3.31Å; S251-D255 PolarHBondContact O-N 3.44Å; S251-R286 PolarHBondContact OG-NH1 3.22Å
252L80.1Confident83.5Confident6 Ų662.1 Ų62.13%0.03133%0.326CS..Hα-helixtrans-60.4-46.3175.4-74.5170.5000111.7V18 L232 L235 W241 I248 R249 V250 L254 D255 V256 F283V18-L252 HydrophobicContact CB-CD2 4.18Å; V18-L252 HydrophobicContact CG1-CB 4.4Å; V18-L252 HydrophobicContact CG1-CD2 3.55Å; L232-L252 HydrophobicContact CD1-CD1 3.94Å; L235-L252 HydrophobicContact CD2-CD1 3.95Å; W241-L252 HydrophobicContact CZ3-CD1 3.8Å; I248-L252 PolarHBondContact O-N 2.81Å; R249-L252 WeakPolarHBondContact O-CB 3.36Å; R249-L252 PolarHBondContact O-N 2.98Å; V250-L252 VanDerWaalsContact C-N 3.35Å; V250-L252 PolarHBondContact O-N 2.85Å; L252-L254 VanDerWaalsContact C-N 3.33Å; L252-L254 PolarHBondContact O-N 2.84Å; L252-D255 PolarHBondContact O-N 2.77Å; L252-V256 WeakPolarHBondContact O-CG2 3.33Å; L252-V256 PolarHBondContact O-N 3.25Å; L252-F283 HydrophobicContact CD1-CE2 3.55Å; L252-F283 HydrophobicContact CD1-CZ 3.55Å; L252-F283 HydrophobicContact CD2-CD2 3.62Å; L252-F283 HydrophobicContact CD2-CE2 3.29Å; L252-F283 HydrophobicContact CD2-CZ 4.1Å; L252-F283 HydrophobicContact CG-CD2 4.26Å; L252-F283 HydrophobicContact CG-CE2 3.42Å; L252-F283 VanDerWaalsContact CG-CE2 3.42Å; L252-F283 HydrophobicContact CG-CZ 3.99Å
253A82.5Confident83.8Confident56 Ų5656.3 Ų56.346%0.46330%0.296SS..Hα-helixtrans-63.5-39178.500000112.1R249 V250 V256 S257R249-A253 PolarHBondContact O-N 3.16Å; R249-A253 VanDerWaalsContact O-N 3.09Å; V250-A253 PolarHBondContact O-N 2.81Å; A253-V256 PolarHBondContact O-N 3.38Å; A253-S257 WeakPolarHBondContact O-CB 3.36Å; A253-S257 PolarHBondContact O-N 2.91Å; A253-S257 PolarHBondContact O-OG 2.89Å
254L86.5Confident84Confident80 Ų8053 Ų5342%0.41928%0.28SS..Hα-helixtrans-63.8-43.8175178.861000111.5V250 S251 L252 S257 R258V250-L254 WeakPolarHBondContact O-CB 3.25Å; V250-L254 PolarHBondContact O-N 2.81Å; S251-L254 PolarHBondContact O-N 2.88Å; L252-L254 VanDerWaalsContact C-N 3.33Å; L252-L254 PolarHBondContact O-N 2.84Å; L254-S257 WeakPolarHBondContact O-CB 3.44Å; L254-S257 PolarHBondContact O-N 3.21Å; L254-R258 HydrophobicContact CD1-CG 4.46Å; L254-R258 WeakPolarHBondContact O-CG 3.14Å; L254-R258 PolarHBondContact O-N 2.82Å
255D81.5Confident84.2Confident6 Ų657 Ų573%0.03231%0.309CS..Hα-helixtrans-62.7-43.4178-79.1-15.1000111.5V18 C19 S20 N206 S251 L252 S257 R258 G259V18-D255 HydrophobicContact CG1-CB 3.28Å; C19-D255 VanDerWaalsContact O-CG 3.29Å; S20-D255 WeakPolarHBondContact CA-OD2 3.41Å; N206-D255 WeakPolarHBondContact CB-O 3.36Å; N206-D255 WeakPolarHBondContact ND2-CA 3.35Å; N206-D255 WeakPolarHBondContact ND2-CB 3.33Å; N206-D255 PolarHBondContact ND2-O 2.92Å; S251-D255 WeakPolarHBondContact O-CB 3.4Å; S251-D255 VanDerWaalsContact O-CG 3.31Å; S251-D255 PolarHBondContact O-N 3.44Å; L252-D255 PolarHBondContact O-N 2.77Å; D255-S257 VanDerWaalsContact C-N 3.32Å; D255-S257 PolarHBondContact O-N 2.93Å; D255-R258 PolarHBondContact O-N 2.84Å; D255-R258 IonicContact OD1-NH1 2.7Å; D255-G259 PolarHBondContact O-N 3.02Å; D255-G259 VanDerWaalsContact O-N 3.09Å
256V81.8Confident84Confident23 Ų2356.6 Ų56.614%0.13930%0.302CS..Hα-helixtrans-59.6-44.2171.6172.90000111.1V16 V18 L252 A253 R258 G259 M260 L273 V277V16-V256 HydrophobicContact CG1-CG1 4.36Å; V18-V256 HydrophobicContact CG1-CG2 4.41Å; V18-V256 HydrophobicContact CG2-CG2 3.63Å; L252-V256 WeakPolarHBondContact O-CG2 3.33Å; L252-V256 PolarHBondContact O-N 3.25Å; A253-V256 PolarHBondContact O-N 3.38Å; V256-R258 PolarHBondContact O-N 2.68Å; V256-G259 PolarHBondContact O-N 3.35Å; V256-M260 PolarHBondContact O-N 2.91Å; V256-L273 HydrophobicContact CG1-CD1 4.33Å; V256-L273 HydrophobicContact CG1-CD2 4.03Å; V256-V277 HydrophobicContact CG2-CG1 4.38Å
257S86.7Confident83.6Confident61 Ų6151.2 Ų51.243%0.42730%0.302SS..Hα-helixtrans-63.2-41.1-179.2-57.70000112A253 L254 D255 M260 E261A253-S257 WeakPolarHBondContact O-CB 3.36Å; A253-S257 PolarHBondContact O-N 2.91Å; A253-S257 PolarHBondContact O-OG 2.89Å; L254-S257 WeakPolarHBondContact O-CB 3.44Å; L254-S257 PolarHBondContact O-N 3.21Å; D255-S257 VanDerWaalsContact C-N 3.32Å; D255-S257 PolarHBondContact O-N 2.93Å; S257-M260 PolarHBondContact O-N 2.88Å; S257-E261 WeakPolarHBondContact O-CB 3.48Å; S257-E261 PolarHBondContact O-N 3.39Å
258R87.4Confident83.2Confident76 Ų7650.3 Ų50.329%0.28729%0.287SS..Hα-helixtrans-62.4-41.3173.9-72.9169.2170.1170.8-6.1112.1L254 D255 V256 Y262L254-R258 HydrophobicContact CD1-CG 4.46Å; L254-R258 WeakPolarHBondContact O-CG 3.14Å; L254-R258 PolarHBondContact O-N 2.82Å; D255-R258 PolarHBondContact O-N 2.84Å; D255-R258 IonicContact OD1-NH1 2.7Å; V256-R258 PolarHBondContact O-N 2.68Å; R258-Y262 PolarHBondContact O-N 3.22Å
259G82.9Confident82.6Confident0 Ų055 Ų550%031%0.31CS..Hα-helixtrans-61-44.2174.300000112.4N206 D255 V256 Y262 I263N206-G259 WeakPolarHBondContact O-CA 3.34Å; D255-G259 PolarHBondContact O-N 3.02Å; D255-G259 VanDerWaalsContact O-N 3.09Å; V256-G259 PolarHBondContact O-N 3.35Å; G259-Y262 PolarHBondContact O-N 3.34Å; G259-I263 VanDerWaalsContact O-CG1 3.32Å; G259-I263 WeakPolarHBondContact O-CG1 3.49Å; G259-I263 PolarHBondContact O-N 2.94Å
260M83Confident81.8Confident17 Ų1752.7 Ų52.78%0.08430%0.301CS..Hα-helixtrans-68.6-41.5177.6-74.8-56.9-52.600113.2V16 V256 S257 Y262 I263 H264 H270 L273V16-M260 HydrophobicContact CG2-CG 4.43Å; V16-M260 HydrophobicContact CG2-SD 3.67Å; V256-M260 PolarHBondContact O-N 2.91Å; S257-M260 PolarHBondContact O-N 2.88Å; M260-Y262 VanDerWaalsContact C-N 3.29Å; M260-Y262 PolarHBondContact O-N 3.01Å; M260-I263 PolarHBondContact O-N 2.77Å; M260-I263 HydrophobicContact SD-CD1 4.3Å; M260-H264 WeakPolarHBondContact CE-NE2 3.12Å; M260-H264 WeakPolarHBondContact O-CB 3.4Å; M260-H264 VanDerWaalsContact O-CG 3.23Å; M260-H264 PolarHBondContact O-N 2.65Å; M260-H270 HydrophobicContact CE-CB 3.77Å; M260-H270 HydrophobicContact SD-CB 3.91Å; M260-L273 HydrophobicContact CG-CD1 4.37Å; M260-L273 HydrophobicContact CG-CD2 3.8Å; M260-L273 HydrophobicContact SD-CD1 3.97Å; M260-L273 HydrophobicContact SD-CD2 4.04Å; M260-L273 HydrophobicContact SD-CG 4.46Å
261E87.2Confident80.5Confident141 Ų14156.5 Ų56.566%0.65931%0.307SS*.Hα-helixtrans-55.4-47.1172.6179.1-178.4-132.800110.5S257 H264 S265S257-E261 WeakPolarHBondContact O-CB 3.48Å; S257-E261 PolarHBondContact O-N 3.39Å; E261-H264 PolarHBondContact O-N 2.85Å; E261-S265 WeakPolarHBondContact O-CB 3.38Å; E261-S265 PolarHBondContact O-N 2.97Å
262Y85Confident79.5Confident49 Ų4957.6 Ų57.619%0.19231%0.311CS..Hα-helixtrans-60.3-48.5176.2172.3-99.3000112.4L202 R203 H204 V207 R258 G259 M260 H264 S265 C266L202-Y262 HydrophobicContact CB-CE1 4.25Å; L202-Y262 HydrophobicContact CD2-CE1 3.89Å; R203-Y262 PolarHBondContact N-OH 3.28Å; R203-Y262 PolarHBondContact O-OH 3.31Å; H204-Y262 HydrophobicContact CB-CD1 3.38Å; H204-Y262 HydrophobicContact CB-CD2 4.01Å; H204-Y262 HydrophobicContact CB-CE1 3.63Å; H204-Y262 HydrophobicContact CB-CE2 4.24Å; H204-Y262 HydrophobicContact CB-CG 3.57Å; H204-Y262 AromaticContact CD2-CD2 3.76Å; H204-Y262 AromaticContact CD2-CG 3.63Å; H204-Y262 AromaticContact CG-CD1 3.91Å; H204-Y262 AromaticContact CG-CG 3.63Å; V207-Y262 HydrophobicContact CG2-CD1 3.9Å; R258-Y262 PolarHBondContact O-N 3.22Å; G259-Y262 PolarHBondContact O-N 3.34Å; M260-Y262 VanDerWaalsContact C-N 3.29Å; M260-Y262 PolarHBondContact O-N 3.01Å; Y262-H264 VanDerWaalsContact C-N 3.3Å; Y262-H264 PolarHBondContact O-N 3.1Å; Y262-S265 PolarHBondContact O-N 2.83Å; Y262-S265 PolarHBondContact O-OG 2.73Å; Y262-C266 VanDerWaalsContact CZ-SG 3.59Å; Y262-C266 PolarHBondContact O-N 3.05Å; Y262-C266 PolarHBondContact O-SG 2.88Å
263I81.5Confident78.6Confident4 Ų459 Ų592%0.02132%0.319CS..Hα-helixtrans-58.6-44.4178.6-71.5170.6000110.8V16 V207 G259 M260 C266 Y268V16-I263 HydrophobicContact CG2-CD1 3.57Å; V207-I263 HydrophobicContact CG2-CD1 4.1Å; V207-I263 HydrophobicContact CG2-CG1 4.05Å; G259-I263 VanDerWaalsContact O-CG1 3.32Å; G259-I263 WeakPolarHBondContact O-CG1 3.49Å; G259-I263 PolarHBondContact O-N 2.94Å; M260-I263 PolarHBondContact O-N 2.77Å; M260-I263 HydrophobicContact SD-CD1 4.3Å; I263-C266 WeakPolarHBondContact O-CB 3.45Å; I263-C266 PolarHBondContact O-N 3.12Å; I263-Y268 PolarHBondContact O-N 3.24Å; I263-Y268 VanDerWaalsContact O-N 3.16Å
264H83.1Confident77.5Confident92 Ų9257.9 Ų57.943%0.42631%0.306SS..Hα-helixtrans-65.5-40.7177.2-68.8174.1000111.9M260 E261 Y262 C266 G267 Y268M260-H264 WeakPolarHBondContact CE-NE2 3.12Å; M260-H264 WeakPolarHBondContact O-CB 3.4Å; M260-H264 VanDerWaalsContact O-CG 3.23Å; M260-H264 PolarHBondContact O-N 2.65Å; E261-H264 PolarHBondContact O-N 2.85Å; Y262-H264 VanDerWaalsContact C-N 3.3Å; Y262-H264 PolarHBondContact O-N 3.1Å; H264-C266 PolarHBondContact O-N 3.31Å; H264-G267 WeakPolarHBondContact O-CA 3.26Å; H264-G267 PolarHBondContact O-N 3.11Å; H264-Y268 PolarHBondContact CD2-O 2.81Å
265S85.8Confident76Confident91 Ų9157 Ų5764%0.63631%0.307SS*.Hα-helixtrans-62-27175.579.60000112.7E261 Y262 G267E261-S265 WeakPolarHBondContact O-CB 3.38Å; E261-S265 PolarHBondContact O-N 2.97Å; Y262-S265 PolarHBondContact O-N 2.83Å; Y262-S265 PolarHBondContact O-OG 2.73Å; S265-G267 PolarHBondContact O-N 3.06Å
266C81Confident74.8Confident48 Ų4863 Ų6332%0.32433%0.329SS..THydrogen-bonded Turntrans-81.30.2173.8-65.20000113.5L202 Y262 I263 H264 Y268L202-C266 HydrophobicContact CD2-CB 4.34Å; Y262-C266 VanDerWaalsContact CZ-SG 3.59Å; Y262-C266 PolarHBondContact O-N 3.05Å; Y262-C266 PolarHBondContact O-SG 2.88Å; I263-C266 WeakPolarHBondContact O-CB 3.45Å; I263-C266 PolarHBondContact O-N 3.12Å; H264-C266 PolarHBondContact O-N 3.31Å; C266-Y268 HydrophobicContact CB-CD2 3.56Å; C266-Y268 HydrophobicContact CB-CE2 3.79Å; C266-Y268 WeakPolarHBondContact O-CE2 3.33Å
267G78.4Confident73.6Confident66 Ų6662.1 Ų62.168%0.6832%0.323SS*.THydrogen-bonded Turntrans8015.1-179.900000114.6H264 S265H264-G267 WeakPolarHBondContact O-CA 3.26Å; H264-G267 PolarHBondContact O-N 3.11Å; S265-G267 PolarHBondContact O-N 3.06Å
268Y77.3Confident72.2Confident63 Ų6360.7 Ų60.725%0.24731%0.314CS..  trans-103.1150.4179-58.5-65.3000111.4L198 K201 L202 I263 H264 C266L198-Y268 HydrophobicContact CD2-CD1 3.65Å; L198-Y268 HydrophobicContact CD2-CE1 3.1Å; L198-Y268 HydrophobicContact CD2-CE2 4.4Å; L198-Y268 HydrophobicContact CD2-CG 4.49Å; K201-Y268 WeakPolarHBondContact CD-OH 3.46Å; L202-Y268 HydrophobicContact CD2-CD2 3.91Å; L202-Y268 HydrophobicContact CD2-CE2 4.14Å; I263-Y268 PolarHBondContact O-N 3.24Å; I263-Y268 VanDerWaalsContact O-N 3.16Å; H264-Y268 PolarHBondContact CD2-O 2.81Å; C266-Y268 HydrophobicContact CB-CD2 3.56Å; C266-Y268 HydrophobicContact CB-CE2 3.79Å; C266-Y268 WeakPolarHBondContact O-CE2 3.33Å
269M70.6Confident70.5Confident121 Ų12157.2 Ų57.260%0.59630%0.3SS*.  trans-114.4124.5170.6-71.9179.7-97.400108.2R271M269-R271 HydrophobicContact CB-CG 4.07Å
270H66.3Low69.1Low5 Ų558.5 Ų58.52%0.02331%0.308CS..  trans-66.5-39.9-179.2-171-77.8000112.4F15 M260 D272 L273F15-H270 AromaticContact CD2-NE2 3.79Å; F15-H270 PolarHBondContact N-NE2 3.2Å; M260-H270 HydrophobicContact CE-CB 3.77Å; M260-H270 HydrophobicContact SD-CB 3.91Å; H270-D272 VanDerWaalsContact CE1-C 3.45Å; H270-D272 PolarHBondContact CE1-O 2.86Å; H270-D272 PolarHBondContact ND1-N 2.86Å; H270-D272 PolarHBondContact ND1-O 3.14Å; H270-D272 PolarHBondContact O-N 3.19Å; H270-L273 PolarHBondContact ND1-N 3.07Å
271R57.2Low67.6Low156 Ų15660.5 Ų60.559%0.58932%0.32SS*.  trans65.4-22.4179.2-59.5175.8174.2177.8-4.9116.9V9 M269V9-R271 PolarHBondContact O-NH1 3.06Å; M269-R271 HydrophobicContact CB-CG 4.07Å
272D63.3Low65.7Low48 Ų4858.5 Ų58.526%0.25731%0.313SS..  trans-133.653.7-179-167.425.7000113.2E13 H270 T274E13-D272 VanDerWaalsContact CG-OD2 3.31Å; E13-D272 WeakPolarHBondContact CG-OD2 3.39Å; H270-D272 VanDerWaalsContact CE1-C 3.45Å; H270-D272 PolarHBondContact CE1-O 2.86Å; H270-D272 PolarHBondContact ND1-N 2.86Å; H270-D272 PolarHBondContact ND1-O 3.14Å; H270-D272 PolarHBondContact O-N 3.19Å; D272-T274 PolarHBondContact O-N 3.27Å; D272-T274 VanDerWaalsContact OD1-CG2 3.3Å; D272-T274 WeakPolarHBondContact OD1-CG2 3.42Å
273L61.5Low64Low36 Ų3657.2 Ų57.219%0.18831%0.309CS..  trans-77.5102.6178.7-172.671.2000109.5V16 V256 M260 H270 V277V16-L273 HydrophobicContact CB-CD1 3.95Å; V16-L273 HydrophobicContact CG1-CD1 4.34Å; V16-L273 HydrophobicContact CG2-CD1 3.82Å; V256-L273 HydrophobicContact CG1-CD1 4.33Å; V256-L273 HydrophobicContact CG1-CD2 4.03Å; M260-L273 HydrophobicContact CG-CD1 4.37Å; M260-L273 HydrophobicContact CG-CD2 3.8Å; M260-L273 HydrophobicContact SD-CD1 3.97Å; M260-L273 HydrophobicContact SD-CD2 4.04Å; M260-L273 HydrophobicContact SD-CG 4.46Å; H270-L273 PolarHBondContact ND1-N 3.07Å; L273-V277 HydrophobicContact CD1-CG2 3.75Å
274T59.7Low62.3Low33 Ų3361.6 Ų61.620%0.20233%0.332CS..  trans-117.5170.4179.867.10000111.6D272 R276 V277D272-T274 PolarHBondContact O-N 3.27Å; D272-T274 VanDerWaalsContact OD1-CG2 3.3Å; D272-T274 WeakPolarHBondContact OD1-CG2 3.42Å; T274-R276 PolarHBondContact O-N 3.03Å; T274-R276 VanDerWaalsContact O-N 3.1Å; T274-R276 PolarHBondContact OG1-N 2.83Å; T274-V277 VanDerWaalsContact O-CG2 3.25Å; T274-V277 WeakPolarHBondContact O-CG2 3.3Å; T274-V277 PolarHBondContact O-N 3.38Å
275S54.5Low60.3Low62 Ų6260.6 Ų60.643%0.43435%0.347SS..THydrogen-bonded Turntrans-64-9.3174.1520000113.6L232 D233 V277L232-S275 CarbonylContact C-O 3.55Å; L232-S275 WeakPolarHBondContact CB-O 3.43Å; L232-S275 PolarHBondContact N-O 3.25Å; D233-S275 PolarHBondContact N-O 3.19Å; S275-V277 PolarHBondContact O-N 3.43Å; S275-V277 VanDerWaalsContact O-N 3.11Å
276R55.8Low58.2Low132 Ų13261.1 Ų61.150%0.49833%0.334SS..THydrogen-bonded Turntrans-69.5-1.6174.3-60.5-177-179172.14.9113.9E13 P14 T274 S278E13-R276 VanDerWaalsContact CD-NH1 3.26Å; E13-R276 IonicContact OE1-NH1 3.08Å; E13-R276 PolarHBondContact OE1-NH1 3.04Å; E13-R276 IonicContact OE2-CZ 3.55Å; E13-R276 IonicContact OE2-NH1 3.62Å; E13-R276 PolarHBondContact OE2-NH1 3.23Å; P14-R276 HydrophobicContact CG-CB 4.32Å; P14-R276 WeakPolarHBondContact CG-O 3.44Å; T274-R276 PolarHBondContact O-N 3.03Å; T274-R276 VanDerWaalsContact O-N 3.1Å; T274-R276 PolarHBondContact OG1-N 2.83Å; R276-S278 PolarHBondContact O-N 3.14Å
277V58.4Low56.2Low3 Ų364.7 Ų64.72%0.01835%0.35CS..  trans-49.4129.3169.7159.30000110.6P14 V16 V18 G231 L232 V256 L273 T274 S275P14-V277 HydrophobicContact CB-CG2 4.02Å; V16-V277 HydrophobicContact CB-CG1 4.44Å; V16-V277 HydrophobicContact CB-CG2 3.95Å; V16-V277 HydrophobicContact CG1-CG1 4.2Å; V16-V277 HydrophobicContact CG1-CG2 4.37Å; V16-V277 WeakPolarHBondContact O-CG1 3.4Å; V18-V277 HydrophobicContact CG2-CG1 3.56Å; G231-V277 CarbonylContact C-O 3.49Å; G231-V277 WeakPolarHBondContact CA-O 3.47Å; L232-V277 PolarHBondContact N-O 2.89Å; V256-V277 HydrophobicContact CG2-CG1 4.38Å; L273-V277 HydrophobicContact CD1-CG2 3.75Å; T274-V277 VanDerWaalsContact O-CG2 3.25Å; T274-V277 WeakPolarHBondContact O-CG2 3.3Å; T274-V277 PolarHBondContact O-N 3.38Å; S275-V277 PolarHBondContact O-N 3.43Å; S275-V277 VanDerWaalsContact O-N 3.11Å
278S55.8Low55.1Low32 Ų3264.7 Ų64.722%0.22433%0.333CS..EExtended strand (participates in β ladder)trans-75.7145.9-178.1-63.80000112C17 V18 G230 R276C17-S278 CarbonylContact C-O 3.54Å; C17-S278 VanDerWaalsContact CA-O 3.25Å; C17-S278 WeakPolarHBondContact CA-O 3.3Å; C17-S278 PolarHBondContact SG-O 2.84Å; V18-S278 PolarHBondContact N-O 3.4Å; G230-S278 CarbonylContact O-C 3.44Å; G230-S278 WeakPolarHBondContact O-CA 3.5Å; R276-S278 PolarHBondContact O-N 3.14Å
279I53.2Low53.9Low2 Ų264.7 Ų64.71%0.0134%0.338CS..EExtended strand (participates in β ladder)trans-105.5129.3176.1-59.6163.8000109V18 C227 A229 G230 L232 L235 F283V18-I279 HydrophobicContact CG2-CG1 4.39Å; C227-I279 WeakPolarHBondContact CB-O 3.45Å; A229-I279 HydrophobicContact CB-CB 3.83Å; A229-I279 HydrophobicContact CB-CG2 3.76Å; G230-I279 PolarHBondContact O-N 3.03Å; L232-I279 HydrophobicContact CB-CD1 3.97Å; L232-I279 HydrophobicContact CB-CG1 4.03Å; L232-I279 HydrophobicContact CD1-CD1 3.9Å; L232-I279 HydrophobicContact CD1-CG1 4.44Å; L235-I279 HydrophobicContact CB-CD1 3.77Å; L235-I279 HydrophobicContact CD2-CD1 3.6Å; L235-I279 HydrophobicContact CG-CD1 4.33Å; I279-F283 HydrophobicContact CG2-CB 3.63Å; I279-F283 HydrophobicContact CG2-CD2 4.25Å; I279-F283 HydrophobicContact CG2-CG 3.93Å
280V53.4Low53Low28 Ų2861.6 Ų61.617%0.1732%0.324CS..  trans-85.1148.9176.8-171.30000112C17 V18 C19 N282 F283C17-V280 HydrophobicContact CB-CG2 4.41Å; C17-V280 WeakPolarHBondContact SG-CG2 3.3Å; V18-V280 PolarHBondContact O-N 2.83Å; C19-V280 VanDerWaalsContact SG-CB 3.58Å; C19-V280 WeakPolarHBondContact SG-CG2 3.37Å; V280-N282 PolarHBondContact O-N 3.17Å; V280-F283 PolarHBondContact O-N 3.24Å
281D50.9Low52.2Low59 Ų5964.9 Ų64.932%0.31634%0.341SS..G310 helixtrans-42.7-22.5-168.7-56.74.4000117.3Q228 F283 L284Q228-D281 WeakPolarHBondContact CA-OD1 3.43Å; Q228-D281 HydrophobicContact CB-CB 4.34Å; Q228-D281 WeakPolarHBondContact CB-OD1 3.48Å; Q228-D281 PolarHBondContact N-OD1 3.17Å; D281-F283 PolarHBondContact O-N 3.45Å; D281-F283 VanDerWaalsContact O-N 3.11Å; D281-L284 PolarHBondContact O-N 3.2Å
282N47.5Very low51.9Low99 Ų9959.3 Ų59.353%0.52933%0.326SS..G310 helixtrans-742.1179.1-83.2-9.7000114.5V280V280-N282 PolarHBondContact O-N 3.17Å
283F48.9Very low51.1Low21 Ų2160 Ų609%0.09233%0.33CS..G310 helixtrans-72.1-35.2173.1-155.8-101.3000112.9L235 L244 I248 L252 I279 V280 D281 G285 R286L235-F283 HydrophobicContact CD1-CE1 4.11Å; L235-F283 HydrophobicContact CD2-CD1 4.06Å; L235-F283 HydrophobicContact CD2-CE1 3.38Å; L235-F283 HydrophobicContact CD2-CZ 3.68Å; L235-F283 HydrophobicContact CG-CE1 4.4Å; L244-F283 HydrophobicContact CD1-CE1 3.88Å; L244-F283 HydrophobicContact CD1-CZ 3.75Å; L244-F283 HydrophobicContact CD2-CE1 3.91Å; L244-F283 HydrophobicContact CD2-CZ 3.92Å; I248-F283 HydrophobicContact CG2-CD2 4.49Å; I248-F283 HydrophobicContact CG2-CE1 4.36Å; I248-F283 HydrophobicContact CG2-CE2 3.32Å; I248-F283 HydrophobicContact CG2-CZ 3.26Å; L252-F283 HydrophobicContact CD1-CE2 3.55Å; L252-F283 HydrophobicContact CD1-CZ 3.55Å; L252-F283 HydrophobicContact CD2-CD2 3.62Å; L252-F283 HydrophobicContact CD2-CE2 3.29Å; L252-F283 HydrophobicContact CD2-CZ 4.1Å; L252-F283 HydrophobicContact CG-CD2 4.26Å; L252-F283 HydrophobicContact CG-CE2 3.42Å; L252-F283 VanDerWaalsContact CG-CE2 3.42Å; L252-F283 HydrophobicContact CG-CZ 3.99Å; I279-F283 HydrophobicContact CG2-CB 3.63Å; I279-F283 HydrophobicContact CG2-CD2 4.25Å; I279-F283 HydrophobicContact CG2-CG 3.93Å; V280-F283 PolarHBondContact O-N 3.24Å; D281-F283 PolarHBondContact O-N 3.45Å; D281-F283 VanDerWaalsContact O-N 3.11Å; F283-G285 PolarHBondContact O-N 3.5Å; F283-R286 PolarHBondContact O-N 3.19Å; F283-R286 VanDerWaalsContact O-N 3.16Å
284L44.8Very low50.4Low96 Ų9661.7 Ų61.750%0.50334%0.341SS..G310 helixtrans-67.2-24.4179.1-70.9170.4000112.9D281 R286 L287D281-L284 PolarHBondContact O-N 3.2Å; L284-R286 PolarHBondContact O-N 3.39Å; L284-L287 HydrophobicContact CD2-CD1 4.26Å
285G42Very low49.7Very low72 Ų7263.9 Ų63.974%0.74235%0.351SS*.G310 helixtrans-74.3-2.8175.900000114.5F283F283-G285 PolarHBondContact O-N 3.5Å
286R41.1Very low49.2Very low101 Ų10164.1 Ų64.138%0.38134%0.344SS..G310 helixtrans-117.7-0.5179.5-65.8-174.2175.7-173.4-0113.7S20 I248 S251 F283 L284S20-R286 PolarHBondContact OG-NH2 3.45Å; I248-R286 HydrophobicContact CD1-CB 4Å; S251-R286 PolarHBondContact OG-NH1 3.22Å; F283-R286 PolarHBondContact O-N 3.19Å; F283-R286 VanDerWaalsContact O-N 3.16Å; L284-R286 PolarHBondContact O-N 3.39Å
287L39.2Very low48.7Very low124 Ų12457.9 Ų57.965%0.64933%0.33SS*.  trans-89.70165.9-76170.2000109L244 L284L244-L287 HydrophobicContact CD2-CD2 3.38Å; L244-L287 HydrophobicContact CD2-CG 4.25Å; L244-L287 HydrophobicContact CG-CD2 4.3Å; L284-L287 HydrophobicContact CD2-CD1 4.26Å

Retrieved 287 of 287 residues in 60 ms (Link to these results)