A0A096N4L7_PAPAN Loading...

Nuclear envelope integral membrane protein 1

AlphaFold DB (A0A2K5Y980), UniProt , Accession A0A096N4L7, Species PAPAN (Papio anubis, Olive baboon), Gene NEMP1, Length 444 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
1M41.1Very low34.7Very low254 Ų254137.6 Ų137.6100%1.25188%0.875SS**  099.10-74.3173.1175.600107.1
2A35.2Very low34.4Very low106 Ų106134.6 Ų134.688%0.87687%0.871SS**  trans-94.3126.3-170.500000110.2
3G35.9Very low34.5Very low84 Ų84135.8 Ų135.887%0.86687%0.874SS**  trans-93.9107.2171.700000110.1
4G33.1Very low34.2Very low77 Ų77130.9 Ų130.979%0.79486%0.861SS**PPolyproline II helixtrans-84.7125.9177.700000112.4
5M33.3Very low34.9Very low188 Ų188131.3 Ų131.393%0.92686%0.863SS**PPolyproline II helixtrans-73.3133.6171.7-119.4148.490.500110.4
6K33.9Very low34.5Very low210 Ų210127.7 Ų127.791%0.91386%0.856SS**PPolyproline II helixtrans-78.8124.7175.5-70.9-178.8175.6-179.60110.3
7V33.4Very low35.4Very low127 Ų127127.1 Ų127.177%0.7785%0.851SS**  trans-110.5120.3166.31780000107.2
8A33.8Very low35.1Very low104 Ų104134.4 Ų134.486%0.8686%0.858SS**PPolyproline II helixtrans-86.4121.7173.900000109.4
9V33.1Very low34.6Very low126 Ų126131.2 Ų131.276%0.76485%0.853SS**PPolyproline II helixtrans-99.2123.91771710000108.2
10S32.2Very low34.4Very low112 Ų112138 Ų13878%0.78386%0.861SS**PPolyproline II helixtrans-78.3137165-61.90000109.8
11P36.9Very low34.1Very low126 Ų126134.6 Ų134.682%0.81885%0.852SS**PPolyproline II helixtrans-91.5145.9170.930.2-21.8000112
12A30.8Very low33.5Very low101 Ų101129.8 Ų129.884%0.83584%0.837SS**PPolyproline II helixtrans-79.8163.7-178.400000113.5
13V36.4Very low33.2Very low150 Ų150128.5 Ų128.591%0.90983%0.834SS**PPolyproline II helixtrans-50.9144.1173.1174.60000113.5
14G30Very low32.8Very low67 Ų67128.6 Ų128.669%0.69184%0.835SS**  trans-154.4144.1161.200000111.7
15P45Very low32.6Very low138 Ų138128.4 Ų128.490%0.89683%0.833SS**  trans-101.4160.2-157.238.6-31.4000113.8
16G28.8Very low32.4Very low73 Ų73130.9 Ų130.975%0.75383%0.832SS**  trans-175.112117300000114.8
17P48.8Very low32.3Very low118 Ų118126.3 Ų126.377%0.76682%0.822SS**  trans-95.6170.6177.937.9-31.3000112.4
18W29.5Very low32.3Very low258 Ų258126 Ų12698%0.97782%0.82SS**  trans133.1133.3166.3-77.621.9000108.5
19G27.1Very low32.2Very low73 Ų73132 Ų13275%0.75382%0.821SS**  cis131.2106.918.800000108.5
20W29.4Very low32.1Very low268 Ų268133.8 Ų133.8100%1.01583%0.825SS**  trans53.6147.3156.1-83.4-17.3000124.2
21G27.6Very low31.9Very low66 Ų66136 Ų13668%0.6883%0.827SS**  trans144.679.7162.600000112
22V30.2Very low31.8Very low154 Ų154136.9 Ų136.993%0.93382%0.824SS**  74126.285.5177.70000114.3
23G28.8Very low31.8Very low79 Ų79139.5 Ų139.581%0.81482%0.822SS**  trans127.4107.2162.300000111.2
24G27.5Very low31.7Very low86 Ų86140.4 Ų140.489%0.88782%0.821SS**  cis123.2111.920.500000108.4
25G27.9Very low31.8Very low73 Ų73142.5 Ų142.575%0.75383%0.825SS**  trans127.1116.4150.300000118
26R29.7Very low31.3Very low240 Ų240139.2 Ų139.291%0.90682%0.816SS**  trans76.6134.9144.8-70.7175.5147.9160.9-5.7117.4
27T32Very low31.2Very low114 Ų114141.9 Ų141.970%0.69982%0.822SS**  cis-176.1137.6-8.711.80000104.8
28V32.4Very low30.1Very low120 Ų120143.2 Ų143.273%0.72782%0.822SS**  trans64.5110.1139-173.50000118.1
29R31.2Very low30Very low231 Ų231137.4 Ų137.487%0.87282%0.815SS**  177.7117.5106.1-92.5-176-178.5167.4-0.1111.3
30L31Very low29.9Very low163 Ų163143.9 Ų143.985%0.85382%0.818SS**  trans-92.1122.7165.6-147.7138.8000106.4
31L30Very low29.9Very low158 Ų158133.5 Ų133.583%0.82779%0.794SS**  trans-154.9119.8160.9-119.8151.7000109.9
32L34.1Very low29.8Very low145 Ų145136.4 Ų136.476%0.75980%0.799SS**  trans-53.9130.8167.9-81.9148.2000111.1
33I30.4Very low29.6Very low156 Ų156133.2 Ų133.280%0.879%0.789SS**  trans-133.2108149.6-62.5-177.5000107.9
34L34.9Very low29.7Very low169 Ų169138 Ų13889%0.88579%0.79SS**  trans-61.5123153.9-91.5142.1000108.6
35S31.4Very low29.8Very low110 Ų110140.7 Ų140.777%0.76978%0.782SS**  trans-160.4125.2154.7179.40000108.5
36G34.1Very low30Very low69 Ų69144.3 Ų144.371%0.71179%0.785SS**  trans-64.6129.2-162.300000114.8L38G36-L38 PolarHBondContact O-N 2.99Å
37C27.1Very low31.1Very low129 Ų129136.2 Ų136.287%0.87276%0.761SS**  trans-7898.6146-76.80000106.6V39C37-V39 PolarHBondContact O-N 3.18Å; C37-V39 VanDerWaalsContact O-N 3.09Å
38L26Very low32.3Very low146 Ų146136.7 Ų136.776%0.76476%0.76SS**  trans-37.5116.5159.4-82.8141.5000108.8G36 Y40G36-L38 PolarHBondContact O-N 2.99Å; L38-Y40 PolarHBondContact O-N 3.44Å
39V27.9Very low34Very low136 Ų136133.5 Ų133.582%0.82474%0.74SS**  trans-52.896.9149.7174.40000104.7C37 G41C37-V39 PolarHBondContact O-N 3.18Å; C37-V39 VanDerWaalsContact O-N 3.09Å; V39-G41 PolarHBondContact O-N 3.05Å
40Y24.9Very low36.3Very low209 Ų209124 Ų12482%0.8271%0.708SS**  trans-68.681.8158.9-117.8-91.2000104.4L38 T42L38-Y40 PolarHBondContact O-N 3.44Å; Y40-T42 VanDerWaalsContact C-N 3.34Å; Y40-T42 PolarHBondContact O-N 2.78Å; Y40-T42 VanDerWaalsContact O-N 3.07Å
41G28.8Very low38.6Very low50 Ų50121.5 Ų121.552%0.51569%0.693SS.*  trans-53.7113.5149.800000104.1V39 A43V39-G41 PolarHBondContact O-N 3.05Å; G41-A43 PolarHBondContact O-N 3.22Å
42T26.4Very low40.9Very low128 Ų128114.5 Ų114.579%0.78566%0.657SS**  trans-55.4105.3163.741.20000104.8Y40 E44Y40-T42 VanDerWaalsContact C-N 3.34Å; Y40-T42 PolarHBondContact O-N 2.78Å; Y40-T42 VanDerWaalsContact O-N 3.07Å; T42-E44 VanDerWaalsContact C-N 3.31Å; T42-E44 PolarHBondContact O-N 3.19Å
43A24.5Very low43Very low87 Ų87113.9 Ų113.972%0.71965%0.65SS**  trans-52107.2165.700000104.9G41 I45G41-A43 PolarHBondContact O-N 3.22Å; A43-I45 PolarHBondContact O-N 3.29Å
44E31.5Very low45Very low179 Ų179109.6 Ų109.684%0.83663%0.627SS**  trans-50.7103.9158.4-97.9177.7146.700104.4T42 D46T42-E44 VanDerWaalsContact C-N 3.31Å; T42-E44 PolarHBondContact O-N 3.19Å; E44-D46 VanDerWaalsContact C-N 3.35Å; E44-D46 PolarHBondContact O-N 3.32Å
45I29.7Very low47Very low143 Ų143106.3 Ų106.373%0.73362%0.618SS**  trans-53.9114.7158.5-64.7172.4000102.9A43 V47A43-I45 PolarHBondContact O-N 3.29Å; I45-V47 HydrophobicContact CG2-CG2 4.01Å; I45-V47 PolarHBondContact O-N 2.65Å
46D32.2Very low49.2Very low149 Ų149105.9 Ų105.980%0.79760%0.603SS**  trans-66.769-179.2-155.7-3.1000108.7E44 N48E44-D46 VanDerWaalsContact C-N 3.35Å; E44-D46 PolarHBondContact O-N 3.32Å; D46-N48 PolarHBondContact O-N 3.34Å
47V52.2Low51.4Low69 Ų69106.2 Ų106.242%0.41859%0.591SS.*  trans-73.2110.3161.5-179.40000102.9I45 V49 Q65I45-V47 HydrophobicContact CG2-CG2 4.01Å; I45-V47 PolarHBondContact O-N 2.65Å; V47-V49 VanDerWaalsContact C-N 3.34Å; V47-V49 WeakPolarHBondContact O-CG2 3.35Å; V47-V49 PolarHBondContact O-N 3.44Å; V47-Q65 HydrophobicContact CG1-CB 4.25Å
48N57.1Low53.9Low124 Ų124101 Ų10166%0.66356%0.556SS**  trans-42.195.1175.8-91.8-71.3000111.2D46D46-N48 PolarHBondContact O-N 3.34Å
49V68.8Low56.5Low53 Ų53101 Ų10132%0.32155%0.552SS.*EExtended strand (participates in β ladder)trans-85.6117.5-179.3-179.80000107.4V47 M51 Q65 C67V47-V49 VanDerWaalsContact C-N 3.34Å; V47-V49 WeakPolarHBondContact O-CG2 3.35Å; V47-V49 PolarHBondContact O-N 3.44Å; V49-M51 HydrophobicContact CG1-CE 4.03Å; V49-Q65 WeakPolarHBondContact CA-O 3.37Å; V49-C67 HydrophobicContact CG1-CB 3.79Å; V49-C67 WeakPolarHBondContact CG1-SG 3.18Å
50V78.8Confident59Low32 Ų3298.2 Ų98.219%0.19453%0.529CS..EExtended strand (participates in β ladder)trans-90.1117.4176.6-179.30000108.8Q65 F66 C67V50-Q65 PolarHBondContact N-O 3.27Å; V50-F66 HydrophobicContact CB-CD1 3.8Å; V50-F66 HydrophobicContact CB-CE1 3.91Å; V50-F66 HydrophobicContact CG1-CD1 4.05Å; V50-F66 HydrophobicContact CG1-CE1 4.02Å; V50-F66 HydrophobicContact CG2-CE1 4.45Å; V50-F66 WeakPolarHBondContact O-CA 3.43Å; V50-C67 PolarHBondContact O-N 3.04Å
51M79.3Confident61.4Low111 Ų11196.1 Ų96.155%0.54752%0.52SS..EExtended strand (participates in β ladder)trans-75.3126.1173.5-67-65.7165.600109.9V49 C67 T69V49-M51 HydrophobicContact CG1-CE 4.03Å; M51-C67 WeakPolarHBondContact CA-O 3.21Å; M51-C67 HydrophobicContact CE-CB 4.13Å; M51-C67 HydrophobicContact SD-CB 3.88Å; M51-T69 HydrophobicContact SD-CG2 4.38Å
52L79.4Confident63.5Low11 Ų1196.2 Ų96.26%0.05852%0.516CS..EExtended strand (participates in β ladder)trans-88.1134.8178.2-69.1171000110.8C58 F66 C67 Y68 I85 V153 V155L52-C58 HydrophobicContact CD2-CB 4.18Å; L52-F66 HydrophobicContact CD1-CB 3.75Å; L52-F66 HydrophobicContact CD1-CD1 4.38Å; L52-F66 HydrophobicContact CD1-CG 4.31Å; L52-F66 HydrophobicContact CD2-CD1 3.7Å; L52-F66 HydrophobicContact CD2-CE1 4.34Å; L52-F66 HydrophobicContact CD2-CG 4.42Å; L52-F66 HydrophobicContact CG-CB 4.02Å; L52-F66 HydrophobicContact CG-CD1 4Å; L52-F66 HydrophobicContact CG-CG 4.39Å; L52-C67 PolarHBondContact N-O 2.92Å; L52-Y68 HydrophobicContact CB-CD2 4.48Å; L52-I85 HydrophobicContact CD1-CD1 4.47Å; L52-I85 HydrophobicContact CD1-CG2 4.27Å; L52-V153 HydrophobicContact CD1-CG1 3.64Å; L52-V153 HydrophobicContact CD2-CB 4.16Å; L52-V153 HydrophobicContact CD2-CG1 3.88Å; L52-V153 HydrophobicContact CG-CG1 4.44Å; L52-V155 HydrophobicContact CB-CG2 3.76Å; L52-V155 HydrophobicContact CD1-CG2 3.87Å; L52-V155 HydrophobicContact CG-CG2 4.36Å
53Q76.8Confident65.7Low132 Ų13293.1 Ų93.162%0.61750%0.499SS*.  trans-105.7149.4172.2-165.6167.12.200110.6Q56Q53-Q56 HydrophobicContact CB-CB 4.28Å; Q53-Q56 PolarHBondContact O-N 2.97Å
54E74.1Confident68.3Low66 Ų6690.9 Ų90.931%0.30847%0.474SS..BIsolated β-bridgetrans-61.9137.2-179.5-63.1-170.317000111.7Q56 Y68 R157E54-Q56 PolarHBondContact O-N 3.03Å; E54-Y68 HydrophobicContact CG-CE2 3.9Å; E54-Y68 PolarHBondContact OE1-OH 3.02Å; E54-R157 IonicContact OE1-CZ 4Å; E54-R157 IonicContact OE1-NE 2.78Å; E54-R157 IonicContact OE1-NH2 3.58Å; E54-R157 PolarHBondContact OE1-NH2 3.07Å; E54-R157 IonicContact OE2-NH2 3.98Å
55S76.1Confident70.6Confident100 Ų10084.5 Ų84.570%0.69944%0.444SS*.THydrogen-bonded Turntrans61.22-179.3-510000116.6V155S55-V155 PolarHBondContact N-O 3.4Å
56Q78.5Confident73Confident100 Ų10077.7 Ų77.747%0.46741%0.409SS..  trans-86.9135.6173.1-167.8173.4300110.6Q53 E54Q53-Q56 HydrophobicContact CB-CB 4.28Å; Q53-Q56 PolarHBondContact O-N 2.97Å; E54-Q56 PolarHBondContact O-N 3.03Å
57V80.4Confident75.3Confident76 Ų7670.9 Ų70.946%0.46137%0.373SS..EExtended strand (participates in β ladder)trans-93.9117.8177.7-171.70000109.3E59 I154V57-E59 HydrophobicContact CG1-CG 4.46Å; V57-I154 HydrophobicContact CB-CD1 4.36Å; V57-I154 HydrophobicContact CB-CG1 4.18Å; V57-I154 HydrophobicContact CG1-CD1 4.02Å; V57-I154 HydrophobicContact CG1-CG1 3.91Å; V57-I154 HydrophobicContact CG2-CD1 3.65Å; V57-I154 HydrophobicContact CG2-CG1 3.86Å
58C77.5Confident76.6Confident19 Ų1967.8 Ų67.813%0.12835%0.354CS..EExtended strand (participates in β ladder)trans-104109.6175.6-73.30000110L52 S152 V153L52-C58 HydrophobicContact CD2-CB 4.18Å; C58-S152 WeakPolarHBondContact O-CA 3.29Å; C58-V153 PolarHBondContact N-O 2.82Å; C58-V153 PolarHBondContact O-N 3.04Å
59E80.9Confident77.5Confident146 Ų14664.2 Ų64.268%0.68234%0.337SS*.EExtended strand (participates in β ladder)trans-94.4128.9173.7-68.2-169.4179.400111.4V57 Y151V57-E59 HydrophobicContact CG1-CG 4.46Å; E59-Y151 WeakPolarHBondContact CA-O 3.14Å
60K80.8Confident77.6Confident78 Ų7863.1 Ų63.134%0.33933%0.329SS..EExtended strand (participates in β ladder)trans-139.8157.4177.6-65-66.6-177.2-177.50110.9Q64 F66 Y151K60-Q64 VanDerWaalsContact CD-OE1 3.27Å; K60-Q64 VanDerWaalsContact CE-OE1 3.3Å; K60-F66 HydrophobicContact CB-CZ 4.49Å; K60-F66 HydrophobicContact CG-CE1 4.42Å; K60-F66 HydrophobicContact CG-CZ 4.02Å; K60-Y151 HydrophobicContact CB-CE1 4Å; K60-Y151 HydrophobicContact CB-CE2 4.06Å; K60-Y151 WeakPolarHBondContact CB-OH 3.14Å; K60-Y151 PolarHBondContact N-O 3.3Å; K60-Y151 WeakPolarHBondContact O-CD1 3.39Å; K60-Y151 PolarHBondContact O-N 2.98Å
61R74.6Confident77.1Confident165 Ų16567.5 Ų67.562%0.62336%0.356SS*.SBendtrans-119.21.3178.9-58.7-166.6-167.9-170.310113.7I144 K150R61-I144 VanDerWaalsContact O-CD1 3.28Å; R61-I144 WeakPolarHBondContact O-CD1 3.28Å; R61-K150 HydrophobicContact CG-CG 4.19Å; R61-K150 VanDerWaalsContact CZ-CE 3.41Å
62A74.9Confident76.5Confident52 Ų5266.8 Ų66.843%0.4335%0.353SS..SBendtrans-123.5155.2-178.300000110.6Q64 Y151A62-Q64 PolarHBondContact O-N 2.91Å; A62-Y151 WeakPolarHBondContact O-CE1 3.45Å; A62-Y151 PolarHBondContact O-OH 2.95Å
63S72.6Confident75.8Confident64 Ų6473.3 Ų73.345%0.44839%0.387SS..  trans-60.8120.7171.3-178.30000109.1V142S63-V142 WeakPolarHBondContact CA-O 3.36Å; S63-V142 PolarHBondContact OG-O 3.25Å; S63-V142 VanDerWaalsContact OG-O 3.12Å
64Q78.9Confident75.4Confident40 Ų4068.6 Ų68.619%0.18737%0.368CS..EExtended strand (participates in β ladder)trans-140.6154-178.6-70.1-166.1-27.500111K60 A62 F66 V142K60-Q64 VanDerWaalsContact CD-OE1 3.27Å; K60-Q64 VanDerWaalsContact CE-OE1 3.3Å; A62-Q64 PolarHBondContact O-N 2.91Å; Q64-F66 HydrophobicContact CB-CE2 4.09Å; Q64-F66 HydrophobicContact CB-CZ 4.17Å; Q64-V142 PolarHBondContact O-N 3.46Å; Q64-V142 VanDerWaalsContact O-N 3.12Å
65Q78.9Confident75.4Confident44 Ų4471.9 Ų71.921%0.20638%0.381CS..EExtended strand (participates in β ladder)trans-94.2123.8171.3-176.2169-18.800108.8V47 V49 V50 L140V47-Q65 HydrophobicContact CG1-CB 4.25Å; V49-Q65 WeakPolarHBondContact CA-O 3.37Å; V50-Q65 PolarHBondContact N-O 3.27Å; Q65-L140 CarbonylContact C-O 3.6Å; Q65-L140 WeakPolarHBondContact CA-O 3.3Å
66F80.5Confident75.1Confident1 Ų177 Ų770%0.00439%0.385CS..EExtended strand (participates in β ladder)trans-106.2133.6174.9-63.5-83.8000109.2V50 L52 K60 Q64 C139 L140 V142 Y151 V153V50-F66 HydrophobicContact CB-CD1 3.8Å; V50-F66 HydrophobicContact CB-CE1 3.91Å; V50-F66 HydrophobicContact CG1-CD1 4.05Å; V50-F66 HydrophobicContact CG1-CE1 4.02Å; V50-F66 HydrophobicContact CG2-CE1 4.45Å; V50-F66 WeakPolarHBondContact O-CA 3.43Å; L52-F66 HydrophobicContact CD1-CB 3.75Å; L52-F66 HydrophobicContact CD1-CD1 4.38Å; L52-F66 HydrophobicContact CD1-CG 4.31Å; L52-F66 HydrophobicContact CD2-CD1 3.7Å; L52-F66 HydrophobicContact CD2-CE1 4.34Å; L52-F66 HydrophobicContact CD2-CG 4.42Å; L52-F66 HydrophobicContact CG-CB 4.02Å; L52-F66 HydrophobicContact CG-CD1 4Å; L52-F66 HydrophobicContact CG-CG 4.39Å; K60-F66 HydrophobicContact CB-CZ 4.49Å; K60-F66 HydrophobicContact CG-CE1 4.42Å; K60-F66 HydrophobicContact CG-CZ 4.02Å; Q64-F66 HydrophobicContact CB-CE2 4.09Å; Q64-F66 HydrophobicContact CB-CZ 4.17Å; F66-C139 CarbonylContact O-C 3.47Å; F66-C139 VanDerWaalsContact O-CA 3.29Å; F66-C139 WeakPolarHBondContact O-CA 3.22Å; F66-L140 PolarHBondContact N-O 2.95Å; F66-L140 PolarHBondContact O-N 2.05Å; F66-V142 HydrophobicContact CD2-CG2 3.93Å; F66-V142 HydrophobicContact CE2-CB 4.36Å; F66-V142 HydrophobicContact CE2-CG2 4.04Å; F66-Y151 AromaticContact CE2-CE2 3.51Å; F66-Y151 HydrophobicContact CE2-CE2 3.51Å; F66-Y151 AromaticContact CE2-CZ 3.86Å; F66-Y151 WeakPolarHBondContact CE2-OH 3.47Å; F66-Y151 AromaticContact CZ-CE2 3.6Å; F66-Y151 HydrophobicContact CZ-CE2 3.6Å; F66-Y151 AromaticContact CZ-CZ 3.97Å; F66-Y151 WeakPolarHBondContact CZ-OH 3.43Å; F66-V153 HydrophobicContact CD2-CG2 4.26Å; F66-V153 HydrophobicContact CE1-CG2 4.37Å; F66-V153 HydrophobicContact CE2-CG2 3.97Å; F66-V153 HydrophobicContact CZ-CG2 4.02Å
67C80.6Confident74.8Confident6 Ų678.2 Ų78.24%0.04139%0.391CS..EExtended strand (participates in β ladder)trans-120.6137.3170.6-65.50000109.3V49 V50 M51 L52 T138 C139V49-C67 HydrophobicContact CG1-CB 3.79Å; V49-C67 WeakPolarHBondContact CG1-SG 3.18Å; V50-C67 PolarHBondContact O-N 3.04Å; M51-C67 WeakPolarHBondContact CA-O 3.21Å; M51-C67 HydrophobicContact CE-CB 4.13Å; M51-C67 HydrophobicContact SD-CB 3.88Å; L52-C67 PolarHBondContact N-O 2.92Å; C67-T138 WeakPolarHBondContact CA-O 3.44Å; C67-C139 HydrophobicContact CB-CB 4.25Å; C67-C139 WeakPolarHBondContact CB-SG 3.31Å; C67-C139 WeakPolarHBondContact SG-CB 2.91Å; C67-C139 CovalentContact SG-SG 2.05Å; C67-C139 PolarHBondContact SG-SG 2.89Å
68Y80.1Confident74.5Confident4 Ų475.4 Ų75.42%0.01637%0.373CS..EExtended strand (participates in β ladder)trans-113.7130.7172.2171.5-103.6000108.5L52 E54 N70 I83 V131 K137 T138 V155L52-Y68 HydrophobicContact CB-CD2 4.48Å; E54-Y68 HydrophobicContact CG-CE2 3.9Å; E54-Y68 PolarHBondContact OE1-OH 3.02Å; Y68-N70 HydrophobicContact CE1-CB 3.99Å; Y68-I83 HydrophobicContact CE1-CD1 4.31Å; Y68-I83 HydrophobicContact CE1-CG2 3.95Å; Y68-V131 HydrophobicContact CD1-CG1 4.25Å; Y68-V131 HydrophobicContact CE1-CG1 4.43Å; Y68-K137 WeakPolarHBondContact O-CA 3.35Å; Y68-T138 PolarHBondContact N-O 2.73Å; Y68-T138 PolarHBondContact O-N 2.7Å; Y68-V155 HydrophobicContact CD2-CB 4.48Å; Y68-V155 HydrophobicContact CD2-CG1 4.02Å; Y68-V155 HydrophobicContact CD2-CG2 4.05Å; Y68-V155 HydrophobicContact CE2-CG1 3.82Å; Y68-V155 HydrophobicContact CG-CG1 4.47Å; Y68-V155 HydrophobicContact CG-CG2 4.5Å
69T74.2Confident74.5Confident49 Ų4975 Ų7530%0.30137%0.369SS..EExtended strand (participates in β ladder)trans-110.8123.6174.557.40000108.7M51 V71 T136 K137M51-T69 HydrophobicContact SD-CG2 4.38Å; T69-V71 PolarHBondContact O-N 2.76Å; T69-T136 WeakPolarHBondContact CA-O 3.19Å; T69-K137 HydrophobicContact CG2-CD 4.23Å; T69-K137 HydrophobicContact CG2-CG 3.9Å
70N72.9Confident74.6Confident29 Ų2970.4 Ų70.416%0.15535%0.346CS..  trans-85.2106.6174.1-169.4-2.3000108.8Y68 L72 I83 L133 T136Y68-N70 HydrophobicContact CE1-CB 3.99Å; N70-L72 PolarHBondContact OD1-N 3.05Å; N70-L72 PolarHBondContact OD1-O 3.27Å; N70-I83 WeakPolarHBondContact ND2-CD1 3.47Å; N70-L133 PolarHBondContact ND2-O 3.3Å; N70-T136 PolarHBondContact N-O 3.04Å
71V66.3Low74.6Confident124 Ų12467.5 Ų67.575%0.75233%0.334SS*.  trans-96-9.3-178.3-165.80000111.6T69T69-V71 PolarHBondContact O-N 2.76Å
72L67.4Low74.8Confident96 Ų9662.7 Ų62.750%0.50332%0.316SS..SBendtrans-93.4125.9-174.9-70.6167.8000111.5N70N70-L72 PolarHBondContact OD1-N 3.05Å; N70-L72 PolarHBondContact OD1-O 3.27Å
73I66Low74.9Confident149 Ų14960.2 Ų60.276%0.76430%0.296SS*.PPolyproline II helixtrans-68.4122.1171.7-56.1169000107.9K75I73-K75 PolarHBondContact O-N 3.04Å
74P68Low75.1Confident32 Ų3259.3 Ų59.321%0.20829%0.285CS..PPolyproline II helixtrans-63.4133.2-178.324.8-32.3000110.7D78 L133 Y134 I298P74-D78 HydrophobicContact CB-CB 4.46Å; P74-L133 HydrophobicContact CB-CD2 4.45Å; P74-Y134 HydrophobicContact CG-CE2 3.8Å; P74-I298 HydrophobicContact CB-CD1 4.23Å; P74-I298 HydrophobicContact CG-CD1 4.39Å
75K72.8Confident75.1Confident135 Ų13557.4 Ų57.459%0.58728%0.276SS*.PPolyproline II helixtrans-94.1169.9174.7-66.4-178.7-179.7177.60110.7I73 H77 D78I73-K75 PolarHBondContact O-N 3.04Å; K75-H77 VanDerWaalsContact CB-CE1 3.47Å; K75-H77 WeakPolarHBondContact CB-CE1 3.33Å; K75-H77 VanDerWaalsContact CD-CE1 3.48Å; K75-H77 WeakPolarHBondContact CD-CE1 3.42Å; K75-H77 PolarHBondContact O-N 3.12Å; K75-D78 PolarHBondContact N-OD2 3.39Å; K75-D78 WeakPolarHBondContact O-CB 3.34Å; K75-D78 PolarHBondContact O-N 3.3Å
76W69.7Low75.1Confident207 Ų20758.3 Ų58.378%0.78428%0.277SS*.G310 helixtrans-59.1-27.7-179.6-69.393000114.6D78 I79W76-D78 VanDerWaalsContact C-N 3.28Å; W76-I79 HydrophobicContact CE3-CD1 4.33Å; W76-I79 WeakPolarHBondContact O-CD1 3.41Å; W76-I79 WeakPolarHBondContact O-CG1 3.42Å
77H72.2Confident75Confident127 Ų12758.3 Ų58.359%0.58828%0.277SS*.G310 helixtrans-79.4-10.4175.450.4-93.7000113.4K75 I79K75-H77 VanDerWaalsContact CB-CE1 3.47Å; K75-H77 WeakPolarHBondContact CB-CE1 3.33Å; K75-H77 VanDerWaalsContact CD-CE1 3.48Å; K75-H77 WeakPolarHBondContact CD-CE1 3.42Å; K75-H77 PolarHBondContact O-N 3.12Å; H77-I79 VanDerWaalsContact C-N 3.32Å; H77-I79 PolarHBondContact O-N 3.11Å
78D73.9Confident75Confident17 Ų1761.7 Ų61.79%0.09130%0.295CS..G310 helixtrans-87.20.5-177.4-64.3-39.5000113.3P74 K75 W76 W80 T81P74-D78 HydrophobicContact CB-CB 4.46Å; K75-D78 PolarHBondContact N-OD2 3.39Å; K75-D78 WeakPolarHBondContact O-CB 3.34Å; K75-D78 PolarHBondContact O-N 3.3Å; W76-D78 VanDerWaalsContact C-N 3.28Å; D78-W80 VanDerWaalsContact C-N 3.25Å; D78-W80 PolarHBondContact O-N 2.87Å; D78-T81 WeakPolarHBondContact CA-OG1 3.35Å; D78-T81 HydrophobicContact CB-CG2 4.27Å; D78-T81 WeakPolarHBondContact CB-OG1 3.32Å; D78-T81 WeakPolarHBondContact O-CB 3.43Å; D78-T81 PolarHBondContact O-N 3.47Å; D78-T81 PolarHBondContact O-OG1 3.32Å
79I79.1Confident74.7Confident10 Ų1062.6 Ų62.65%0.05130%0.302CS..THydrogen-bonded Turntrans-54.7-39.2-174.6-66.8169.4000112.5W76 H77 I296 I301W76-I79 HydrophobicContact CE3-CD1 4.33Å; W76-I79 WeakPolarHBondContact O-CD1 3.41Å; W76-I79 WeakPolarHBondContact O-CG1 3.42Å; H77-I79 VanDerWaalsContact C-N 3.32Å; H77-I79 PolarHBondContact O-N 3.11Å; I79-I296 HydrophobicContact CG2-CG1 4.02Å; I79-I296 HydrophobicContact CG2-CG2 4.02Å; I79-I301 HydrophobicContact CD1-CG2 4.15Å; I79-I301 HydrophobicContact CG1-CD1 4.39Å; I79-I301 HydrophobicContact CG1-CG2 4.41Å
80W83.3Confident74.6Confident50 Ų5064.4 Ų64.419%0.18932%0.317CS..THydrogen-bonded Turntrans-107.616.4178.5-56-74000113D78 F159 D160 F164 F167D78-W80 VanDerWaalsContact C-N 3.25Å; D78-W80 PolarHBondContact O-N 2.87Å; W80-F159 HydrophobicContact CB-CD2 4.03Å; W80-F159 HydrophobicContact CB-CE2 3.61Å; W80-F159 HydrophobicContact CB-CZ 4.39Å; W80-F159 HydrophobicContact CE3-CE2 4.4Å; W80-F159 HydrophobicContact CG-CE2 4.37Å; W80-D160 PolarHBondContact O-N 3.46Å; W80-F164 HydrophobicContact CD2-CB 4.5Å; W80-F164 AromaticContact CD2-CD2 3.85Å; W80-F164 HydrophobicContact CD2-CD2 3.85Å; W80-F164 AromaticContact CE2-CD2 3.78Å; W80-F164 HydrophobicContact CE3-CD2 4.12Å; W80-F164 HydrophobicContact CG-CB 4.12Å; W80-F164 HydrophobicContact CG-CD2 4.34Å; W80-F164 HydrophobicContact CH2-CD2 4.27Å; W80-F164 HydrophobicContact CH2-CE2 4.3Å; W80-F164 HydrophobicContact CZ2-CD2 4.01Å; W80-F164 HydrophobicContact CZ2-CE2 4.33Å; W80-F164 HydrophobicContact CZ3-CD2 4.32Å; W80-F164 HydrophobicContact CZ3-CE2 4.48Å; W80-F167 AromaticContact CZ2-CD1 3.71Å; W80-F167 HydrophobicContact CZ2-CD1 3.71Å; W80-F167 AromaticContact CZ2-CE1 3.94Å; W80-F167 HydrophobicContact CZ2-CE1 3.94Å; W80-F167 HydrophobicContact CZ2-CG 4.29Å
81T80.4Confident74.5Confident16 Ų1667.1 Ų67.110%0.09833%0.327CS..EExtended strand (participates in β ladder)trans-81.6147.417166.10000109.7D78 L133 R158 Q297D78-T81 WeakPolarHBondContact CA-OG1 3.35Å; D78-T81 HydrophobicContact CB-CG2 4.27Å; D78-T81 WeakPolarHBondContact CB-OG1 3.32Å; D78-T81 WeakPolarHBondContact O-CB 3.43Å; D78-T81 PolarHBondContact O-N 3.47Å; D78-T81 PolarHBondContact O-OG1 3.32Å; T81-L133 VanDerWaalsContact O-CD1 3.22Å; T81-L133 WeakPolarHBondContact O-CD1 3.28Å; T81-R158 CarbonylContact C-O 3.5Å; T81-R158 WeakPolarHBondContact CA-O 3.48Å; T81-Q297 PolarHBondContact O-NE2 2.81Å
82R77.5Confident74.4Confident64 Ų6467 Ų6724%0.24232%0.321CS..EExtended strand (participates in β ladder)trans-127.6132177.4-165.7170.5-166.5168.97.4108.8Q84 N130 R158 D160R82-Q84 HydrophobicContact CG-CG 4.13Å; R82-N130 PolarHBondContact NE-OD1 2.68Å; R82-N130 PolarHBondContact NH2-ND2 2.78Å; R82-R158 PolarHBondContact N-O 3.31Å; R82-R158 PolarHBondContact O-N 3.42Å; R82-R158 VanDerWaalsContact O-N 3.08Å; R82-D160 HydrophobicContact CB-CB 4.1Å; R82-D160 VanDerWaalsContact CD-OD2 3.22Å; R82-D160 WeakPolarHBondContact CD-OD2 3.31Å; R82-D160 IonicContact CZ-OD2 3.92Å; R82-D160 IonicContact NE-OD2 3.58Å; R82-D160 IonicContact NH1-OD2 3.7Å; R82-D160 PolarHBondContact NH1-OD2 3.19Å
83I77.7Confident74.4Confident1 Ų163.6 Ų63.61%0.00530%0.304CS..EExtended strand (participates in β ladder)trans-90.7118.7173.1-56.6173.5000107Y68 N70 V131 L133 V155 R157Y68-I83 HydrophobicContact CE1-CD1 4.31Å; Y68-I83 HydrophobicContact CE1-CG2 3.95Å; N70-I83 WeakPolarHBondContact ND2-CD1 3.47Å; I83-V131 HydrophobicContact CB-CB 4.19Å; I83-V131 HydrophobicContact CG2-CB 4.07Å; I83-V131 HydrophobicContact CG2-CG1 4.46Å; I83-V131 PolarHBondContact O-N 2.92Å; I83-L133 HydrophobicContact CD1-CG 4.38Å; I83-L133 HydrophobicContact CG1-CD1 4.41Å; I83-V155 HydrophobicContact CG2-CG1 3.8Å; I83-R157 HydrophobicContact CG1-CG 4.49Å
84Q76.9Confident74.1Confident44 Ų4463.3 Ų63.321%0.20629%0.293CS..EExtended strand (participates in β ladder)trans-120.1127.3179.2-67.1-175.5-21.300109.4R82 I156R82-Q84 HydrophobicContact CG-CG 4.13Å; Q84-I156 PolarHBondContact N-O 2.72Å; Q84-I156 PolarHBondContact O-N 3.49Å
85I78.4Confident73.9Confident0 Ų063.3 Ų63.30%029%0.292CS..EExtended strand (participates in β ladder)trans-92.1109.9167.9-54.3-178.5000106.4L52 V87 V129 V131 L140 V153 V155L52-I85 HydrophobicContact CD1-CD1 4.47Å; L52-I85 HydrophobicContact CD1-CG2 4.27Å; I85-V87 HydrophobicContact CG2-CG2 4.46Å; I85-V129 PolarHBondContact N-O 3.44Å; I85-V129 PolarHBondContact O-N 2.98Å; I85-V131 HydrophobicContact CD1-CG2 3.54Å; I85-V131 HydrophobicContact CG1-CG2 3.78Å; I85-L140 HydrophobicContact CB-CD1 3.9Å; I85-L140 HydrophobicContact CD1-CD1 3.4Å; I85-L140 VanDerWaalsContact CD1-CD1 3.4Å; I85-L140 HydrophobicContact CD1-CG 4.41Å; I85-L140 HydrophobicContact CG1-CD1 4.2Å; I85-L140 HydrophobicContact CG2-CD1 3.58Å; I85-V153 HydrophobicContact CG2-CG1 3.57Å; I85-V155 HydrophobicContact CG1-CG1 4.41Å; I85-V155 HydrophobicContact CG1-CG2 4.11Å
86R79.2Confident73.4Confident64 Ų6459.4 Ų59.424%0.24228%0.28CS..EExtended strand (participates in β ladder)trans-92.3120176.7179-177.9-80.8-172.3-8108.2D126 Y128 V153 I154R86-D126 HydrophobicContact CG-CB 4.34Å; R86-Y128 HydrophobicContact CB-CD1 4.4Å; R86-Y128 HydrophobicContact CB-CE1 4.24Å; R86-Y128 HydrophobicContact CG-CE1 4.07Å; R86-Y128 VanDerWaalsContact NE-CE1 3.27Å; R86-Y128 PolarHBondContact NE-OH 2.93Å; R86-Y128 PolarHBondContact NH2-OH 3.43Å; R86-V153 WeakPolarHBondContact O-CA 3.43Å; R86-I154 PolarHBondContact N-O 2.85Å; R86-I154 PolarHBondContact O-N 3.09Å
87V78.8Confident73Confident1 Ų153.9 Ų53.91%0.00626%0.263CS..EExtended strand (participates in β ladder)trans-107.7112.8170-170.30000108.2I85 I93 V95 T127 Y151 S152 V153I85-V87 HydrophobicContact CG2-CG2 4.46Å; V87-I93 HydrophobicContact CB-CD1 4.24Å; V87-I93 HydrophobicContact CG1-CD1 3.34Å; V87-V95 HydrophobicContact CB-CG2 4.42Å; V87-V95 HydrophobicContact CG1-CG2 4.42Å; V87-V95 HydrophobicContact CG2-CG2 4.32Å; V87-T127 PolarHBondContact N-O 3.46Å; V87-T127 PolarHBondContact O-N 2.87Å; V87-Y151 HydrophobicContact CG1-CD2 4.27Å; V87-S152 WeakPolarHBondContact CA-O 3.29Å; V87-V153 HydrophobicContact CG1-CG2 4.25Å; V87-V153 HydrophobicContact CG2-CG1 4.33Å; V87-V153 HydrophobicContact CG2-CG2 4.29Å
88N80.2Confident72.2Confident77 Ų7750.7 Ų50.741%0.41225%0.252SS..EExtended strand (participates in β ladder)trans-105.5124.1175.4178.71.4000108.6Y151 S152N88-Y151 CarbonylContact O-C 3.49Å; N88-Y151 WeakPolarHBondContact O-CA 3.29Å; N88-S152 PolarHBondContact N-O 2.85Å; N88-S152 PolarHBondContact O-N 3.1Å; N88-S152 PolarHBondContact O-OG 3.05Å
89S74.8Confident71.3Confident23 Ų2354.9 Ų54.916%0.16127%0.271CS..EExtended strand (participates in β ladder)trans-131.4141.8-178.5175.80000110.2K91 I93S89-K91 WeakPolarHBondContact CB-O 3.36Å; S89-K91 PolarHBondContact O-N 3.09Å; S89-K91 PolarHBondContact OG-N 2.94Å; S89-K91 PolarHBondContact OG-O 3.15Å; S89-I93 VanDerWaalsContact OG-CG2 3.31Å; S89-I93 WeakPolarHBondContact OG-CG2 3.37Å
90S70.3Confident69.8Low87 Ų8759.7 Ų59.761%0.60830%0.297SS*.SBendtrans-68.5-17.4176.262.30000113.7K150S90-K150 PolarHBondContact N-O 2.66Å
91K71.3Confident67.9Low85 Ų8565.3 Ų65.337%0.3733%0.325SS..SBendtrans-147.8172.4-170.5-80172.4176.9171.20110.4S89 I93 E146 K147 D148 T149S89-K91 WeakPolarHBondContact CB-O 3.36Å; S89-K91 PolarHBondContact O-N 3.09Å; S89-K91 PolarHBondContact OG-N 2.94Å; S89-K91 PolarHBondContact OG-O 3.15Å; K91-I93 PolarHBondContact O-N 3.42Å; K91-E146 WeakPolarHBondContact CB-OE2 3.35Å; K91-E146 HydrophobicContact CD-CB 4.35Å; K91-E146 WeakPolarHBondContact CD-OE2 3.34Å; K91-E146 WeakPolarHBondContact CG-OE2 3.43Å; K91-K147 PolarHBondContact NZ-O 2.74Å; K91-D148 PolarHBondContact NZ-O 3.04Å; K91-T149 HydrophobicContact CB-CG2 3.34Å; K91-T149 HydrophobicContact CD-CG2 3.68Å; K91-T149 HydrophobicContact CG-CG2 4.17Å
92L65.5Low66.3Low121 Ų12171.4 Ų71.463%0.63436%0.357SS*.  trans-61125.6-177.1-77.3160.9000112.6
93I66Low64.7Low26 Ų2672.1 Ų72.113%0.13336%0.362CS..EExtended strand (participates in β ladder)trans-128.7149.5176.352.1160.1000110.2V87 S89 K91 V95 V142V87-I93 HydrophobicContact CB-CD1 4.24Å; V87-I93 HydrophobicContact CG1-CD1 3.34Å; S89-I93 VanDerWaalsContact OG-CG2 3.31Å; S89-I93 WeakPolarHBondContact OG-CG2 3.37Å; K91-I93 PolarHBondContact O-N 3.42Å; I93-V95 HydrophobicContact CD1-CG2 3.93Å; I93-V142 HydrophobicContact CB-CG1 4.48Å; I93-V142 HydrophobicContact CD1-CG1 4.27Å
94R59.4Low62.9Low143 Ų14376.4 Ų76.454%0.5439%0.385SS..EExtended strand (participates in β ladder)trans-107113.6172.6-178.4-177.5-66.7-176.7-1.3108.4T96 E143 I145R94-T96 HydrophobicContact CG-CG2 4.15Å; R94-E143 HydrophobicContact CB-CB 4.25Å; R94-E143 PolarHBondContact N-O 2.93Å; R94-E143 PolarHBondContact O-N 3.12Å; R94-I145 HydrophobicContact CB-CD1 4.11Å; R94-I145 HydrophobicContact CB-CG1 4.34Å
95V64.2Low61.1Low31 Ų3182.8 Ų82.819%0.18841%0.411CS..EExtended strand (participates in β ladder)trans-99115.6173.5-175.20000107.7V87 I93 T127 V129 L140 V142V87-V95 HydrophobicContact CB-CG2 4.42Å; V87-V95 HydrophobicContact CG1-CG2 4.42Å; V87-V95 HydrophobicContact CG2-CG2 4.32Å; I93-V95 HydrophobicContact CD1-CG2 3.93Å; V95-T127 HydrophobicContact CG2-CG2 4.32Å; V95-V129 HydrophobicContact CG1-CG2 3.98Å; V95-L140 HydrophobicContact CG1-CD2 4.1Å; V95-V142 HydrophobicContact CG1-CG2 4.46Å; V95-V142 HydrophobicContact CG2-CG1 4.46Å; V95-V142 HydrophobicContact CG2-CG2 4.33Å
96T62.8Low59.5Low53 Ų5390.4 Ų90.433%0.32545%0.447SS..EExtended strand (participates in β ladder)trans-106.8130.8171.849.80000109.1R94 V98 K141R94-T96 HydrophobicContact CG-CG2 4.15Å; T96-V98 PolarHBondContact O-N 3.07Å; T96-K141 PolarHBondContact N-O 3.48Å; T96-K141 PolarHBondContact O-N 2.99Å; T96-K141 PolarHBondContact OG1-O 3.49Å
97Q62.1Low57.8Low91 Ų9191.3 Ų91.343%0.42546%0.456SS..EExtended strand (participates in β ladder)trans-78.7120.1169.5-172171.2-20.600107.1E99 L140Q97-E99 HydrophobicContact CG-CG 4.14Å; Q97-E99 PolarHBondContact O-N 3.08Å; Q97-L140 HydrophobicContact CB-CD2 4.43Å
98V55Low56Low60 Ų6098.4 Ų98.436%0.36449%0.489SS..EExtended strand (participates in β ladder)trans-83.895.4175.7-178.10000105.6T96 C139 K141T96-V98 PolarHBondContact O-N 3.07Å; V98-C139 HydrophobicContact CB-CB 4.46Å; V98-C139 PolarHBondContact N-O 2.88Å; V98-K141 HydrophobicContact CG2-CB 3.75Å
99E54.5Low54Low105 Ų105103 Ų10349%0.49151%0.508SS..  trans-77.8126.4-176.9-74.4171.1164.200110.3Q97 L104Q97-E99 HydrophobicContact CG-CG 4.14Å; Q97-E99 PolarHBondContact O-N 3.08Å; E99-L104 WeakPolarHBondContact OE2-CD1 3.37Å
100N48.5Very low52.4Low112 Ų112105.2 Ų105.260%0.59952%0.515SS*.  trans-70.4126162.2-79-9.7000107.8D102 K103N100-D102 PolarHBondContact O-N 2.94Å; N100-K103 PolarHBondContact O-N 2.9Å
101E42.4Very low51.2Low168 Ų168105 Ų10579%0.78551%0.514SS*.G310 helixtrans-52.6-23.9-171.6-64.7-178.7160.800114.4K103 L104E101-K103 VanDerWaalsContact C-N 3.34Å; E101-K103 PolarHBondContact O-N 2.91Å; E101-L104 WeakPolarHBondContact O-CB 3.21Å; E101-L104 PolarHBondContact O-N 3Å
102D46.3Very low50Low144 Ų144107 Ų10777%0.7753%0.528SS*.G310 helixtrans-72.1-22.4-176.5-53-41.4000114.2N100N100-D102 PolarHBondContact O-N 2.94Å
103K43.5Very low49.1Very low79 Ų79105.7 Ų105.734%0.34351%0.514SS..G310 helixtrans-89.1-10.7178.3-72.7-170.3174.2171.60114.2N100 E101 K105 L107 S135N100-K103 PolarHBondContact O-N 2.9Å; E101-K103 VanDerWaalsContact C-N 3.34Å; E101-K103 PolarHBondContact O-N 2.91Å; K103-K105 VanDerWaalsContact C-N 3.27Å; K103-K105 PolarHBondContact O-N 3.06Å; K103-L107 HydrophobicContact CB-CD1 4.5Å; K103-L107 WeakPolarHBondContact O-CD1 3.24Å; K103-L107 WeakPolarHBondContact O-CG 3.23Å; K103-L107 PolarHBondContact O-N 2.69Å; K103-S135 PolarHBondContact NZ-OG 2.95Å
104L41.8Very low48.4Very low91 Ų91108.6 Ų108.648%0.47653%0.53SS..Hα-helixtrans-66.6-31.7-177.8-15378000111.5E99 E101 E108E99-L104 WeakPolarHBondContact OE2-CD1 3.37Å; E101-L104 WeakPolarHBondContact O-CB 3.21Å; E101-L104 PolarHBondContact O-N 3Å; L104-E108 PolarHBondContact O-N 3.36Å
105K37.9Very low47.7Very low177 Ų177105 Ų10577%0.7752%0.518SS*.Hα-helixtrans-77.9-25.8-177.6-66.7-176.4-179.6175.80114.4K103K103-K105 VanDerWaalsContact C-N 3.27Å; K103-K105 PolarHBondContact O-N 3.06Å
106E44.2Very low46.7Very low160 Ų160109.1 Ų109.175%0.74853%0.534SS*.Hα-helixtrans-85.9-24.3174.6-68.4-160.2158.900112.8
107L43.4Very low45.9Very low83 Ų83108.8 Ų108.844%0.43553%0.534SS..Hα-helixtrans-80.5-18.9-179.8-75.1164.5000113.8K103 Q109 F110K103-L107 HydrophobicContact CB-CD1 4.5Å; K103-L107 WeakPolarHBondContact O-CD1 3.24Å; K103-L107 WeakPolarHBondContact O-CG 3.23Å; K103-L107 PolarHBondContact O-N 2.69Å; L107-Q109 VanDerWaalsContact C-N 3.27Å; L107-Q109 PolarHBondContact O-N 2.81Å; L107-F110 PolarHBondContact O-N 3.48Å
108E41.4Very low45.3Very low150 Ų150106.6 Ų106.670%0.70153%0.529SS*.G310 helixtrans-65.7-29.1171.3-85-173.4147.100112.6L104 F110 S111L104-E108 PolarHBondContact O-N 3.36Å; E108-F110 PolarHBondContact O-N 2.95Å; E108-F110 VanDerWaalsContact O-N 3.12Å; E108-S111 PolarHBondContact O-N 3.24Å
109Q39.5Very low44.8Very low174 Ų174105.1 Ų105.181%0.81352%0.517SS*.G310 helixtrans-64.4-17177.7-162.776.73.500112.7L107L107-Q109 VanDerWaalsContact C-N 3.27Å; L107-Q109 PolarHBondContact O-N 2.81Å
110F40.4Very low44.2Very low69 Ų69106.3 Ų106.330%0.30353%0.526SS..G310 helixtrans-109.323.2-179-76.7-80.7000114.5L107 E108 I112 W113 N114 Y293L107-F110 PolarHBondContact O-N 3.48Å; E108-F110 PolarHBondContact O-N 2.95Å; E108-F110 VanDerWaalsContact O-N 3.12Å; F110-I112 PolarHBondContact O-N 2.78Å; F110-W113 HydrophobicContact CB-CB 4.49Å; F110-W113 HydrophobicContact CD1-CB 4.25Å; F110-W113 PolarHBondContact O-N 2.99Å; F110-N114 PolarHBondContact O-N 2.79Å; F110-Y293 HydrophobicContact CE1-CD1 4.2Å; F110-Y293 AromaticContact CE1-CE1 3.59Å; F110-Y293 HydrophobicContact CE1-CE1 3.59Å; F110-Y293 HydrophobicContact CE2-CE1 4.4Å; F110-Y293 HydrophobicContact CZ-CD1 4.27Å; F110-Y293 AromaticContact CZ-CE1 3.29Å; F110-Y293 HydrophobicContact CZ-CE1 3.29Å; F110-Y293 AromaticContact CZ-CZ 3.78Å
111S45.6Very low43.9Very low84 Ų84108.8 Ų108.859%0.58753%0.532SS*.Hα-helixtrans-44.1-40.6175.7171.50000113.9E108 F115E108-S111 PolarHBondContact O-N 3.24Å; S111-F115 WeakPolarHBondContact O-CB 3.36Å; S111-F115 PolarHBondContact O-N 2.9Å
112I45.3Very low43.9Very low127 Ų127105.3 Ų105.365%0.65152%0.516SS*.Hα-helixtrans-68.3-38.3179.6-59.3170.7000111.8F110 F115 F116F110-I112 PolarHBondContact O-N 2.78Å; I112-F115 WeakPolarHBondContact O-CB 3.2Å; I112-F115 PolarHBondContact O-N 3.12Å; I112-F116 HydrophobicContact CG2-CD2 3.88Å; I112-F116 HydrophobicContact CG2-CE2 3.93Å; I112-F116 VanDerWaalsContact O-CD2 3.29Å; I112-F116 WeakPolarHBondContact O-CD2 3.33Å; I112-F116 PolarHBondContact O-N 3.04Å
113W46.8Very low43.5Very low92 Ų92107.4 Ų107.435%0.34852%0.518SS..Hα-helixtrans-78.5-33.5-179.7-169.5-109.7000112.5F110 F115 F116 S117F110-W113 HydrophobicContact CB-CB 4.49Å; F110-W113 HydrophobicContact CD1-CB 4.25Å; F110-W113 PolarHBondContact O-N 2.99Å; W113-F115 VanDerWaalsContact C-N 3.25Å; W113-F115 PolarHBondContact O-N 3.42Å; W113-F116 PolarHBondContact O-N 2.89Å; W113-S117 WeakPolarHBondContact O-CB 3.45Å; W113-S117 PolarHBondContact O-N 3.12Å; W113-S117 PolarHBondContact O-OG 2.88Å
114N51.2Low43.3Very low88 Ų88109 Ų10947%0.47153%0.529SS..Hα-helixtrans-62.6-37.6169-81.9-22.9000111.3F110 S117 S118F110-N114 PolarHBondContact O-N 2.79Å; N114-S117 WeakPolarHBondContact CA-OG 3.39Å; N114-S117 PolarHBondContact O-OG 3.32Å; N114-S117 VanDerWaalsContact O-OG 3.11Å; N114-S118 WeakPolarHBondContact O-CB 3.3Å; N114-S118 PolarHBondContact O-N 3.17Å; N114-S118 VanDerWaalsContact O-N 3.12Å
115F44.3Very low43.4Very low66 Ų66112.2 Ų112.229%0.28955%0.547SS..Hα-helixtrans-61.2-59.8171.2-177.6-100.6000111S111 I112 W113 S117 S118 F119 L229S111-F115 WeakPolarHBondContact O-CB 3.36Å; S111-F115 PolarHBondContact O-N 2.9Å; I112-F115 WeakPolarHBondContact O-CB 3.2Å; I112-F115 PolarHBondContact O-N 3.12Å; W113-F115 VanDerWaalsContact C-N 3.25Å; W113-F115 PolarHBondContact O-N 3.42Å; F115-S117 PolarHBondContact O-N 3.44Å; F115-S118 WeakPolarHBondContact O-CB 3.33Å; F115-S118 PolarHBondContact O-N 2.95Å; F115-S118 VanDerWaalsContact O-N 3.1Å; F115-S118 PolarHBondContact O-OG 3.25Å; F115-F119 HydrophobicContact CD1-CD2 4.46Å; F115-F119 AromaticContact CD1-CE2 3.67Å; F115-F119 HydrophobicContact CD1-CE2 3.67Å; F115-F119 HydrophobicContact CD1-CZ 4.39Å; F115-F119 HydrophobicContact CD2-CE2 4.05Å; F115-F119 HydrophobicContact CE1-CD2 4.32Å; F115-F119 AromaticContact CE1-CE2 3.25Å; F115-F119 HydrophobicContact CE1-CE2 3.25Å; F115-F119 AromaticContact CE1-CZ 3.53Å; F115-F119 HydrophobicContact CE1-CZ 3.53Å; F115-F119 AromaticContact CE2-CE2 3.67Å; F115-F119 HydrophobicContact CE2-CE2 3.67Å; F115-F119 AromaticContact CE2-CZ 3.98Å; F115-F119 HydrophobicContact CE2-CZ 3.98Å; F115-F119 HydrophobicContact CG-CE2 4.04Å; F115-F119 AromaticContact CZ-CE2 3.22Å; F115-F119 HydrophobicContact CZ-CE2 3.22Å; F115-F119 AromaticContact CZ-CZ 3.26Å; F115-F119 HydrophobicContact CZ-CZ 3.26Å; F115-F119 WeakPolarHBondContact O-CD2 3.45Å; F115-L229 HydrophobicContact CE1-CD1 4.04Å; F115-L229 HydrophobicContact CE1-CD2 3.8Å; F115-L229 HydrophobicContact CE1-CG 4.34Å; F115-L229 HydrophobicContact CE2-CB 4.44Å; F115-L229 HydrophobicContact CE2-CD1 4.29Å; F115-L229 HydrophobicContact CZ-CB 3.73Å; F115-L229 HydrophobicContact CZ-CD1 3.61Å; F115-L229 HydrophobicContact CZ-CD2 3.75Å; F115-L229 HydrophobicContact CZ-CG 3.86Å
116F43.1Very low43.9Very low119 Ų119105.6 Ų105.652%0.52252%0.52SS..Hα-helixtrans-60.1-39.2178.8-86.4-80.4000114.4I112 W113 S118 F119 L120I112-F116 HydrophobicContact CG2-CD2 3.88Å; I112-F116 HydrophobicContact CG2-CE2 3.93Å; I112-F116 VanDerWaalsContact O-CD2 3.29Å; I112-F116 WeakPolarHBondContact O-CD2 3.33Å; I112-F116 PolarHBondContact O-N 3.04Å; W113-F116 PolarHBondContact O-N 2.89Å; F116-S118 PolarHBondContact O-N 2.89Å; F116-F119 WeakPolarHBondContact O-CB 3.43Å; F116-F119 PolarHBondContact O-N 3.17Å; F116-L120 PolarHBondContact O-N 2.92Å
117S46.9Very low44.8Very low45 Ų45100.8 Ų100.832%0.31550%0.502SS..Hα-helixtrans-66.7-27.4177.966.60000112.3W113 N114 F115 F119 L120 K121W113-S117 WeakPolarHBondContact O-CB 3.45Å; W113-S117 PolarHBondContact O-N 3.12Å; W113-S117 PolarHBondContact O-OG 2.88Å; N114-S117 WeakPolarHBondContact CA-OG 3.39Å; N114-S117 PolarHBondContact O-OG 3.32Å; N114-S117 VanDerWaalsContact O-OG 3.11Å; F115-S117 PolarHBondContact O-N 3.44Å; S117-F119 VanDerWaalsContact C-N 3.28Å; S117-F119 PolarHBondContact O-N 3.48Å; S117-L120 PolarHBondContact O-N 3.38Å; S117-K121 WeakPolarHBondContact O-CB 3.47Å; S117-K121 PolarHBondContact O-N 2.94Å
118S48.7Very low45.7Very low46 Ų4698.8 Ų98.832%0.32249%0.489SS..Hα-helixtrans-67.1-26.6170.983.20000113.1N114 F115 F116 Q233N114-S118 WeakPolarHBondContact O-CB 3.3Å; N114-S118 PolarHBondContact O-N 3.17Å; N114-S118 VanDerWaalsContact O-N 3.12Å; F115-S118 WeakPolarHBondContact O-CB 3.33Å; F115-S118 PolarHBondContact O-N 2.95Å; F115-S118 VanDerWaalsContact O-N 3.1Å; F115-S118 PolarHBondContact O-OG 3.25Å; F116-S118 PolarHBondContact O-N 2.89Å; S118-Q233 PolarHBondContact OG-NE2 2.82Å
119F45.1Very low46.9Very low29 Ų2992.7 Ų92.713%0.12746%0.462CS..Hα-helixtrans-71.6-34.5174.1-72-110.3000111.6F115 F116 S117 I232 Q233 F236F115-F119 HydrophobicContact CD1-CD2 4.46Å; F115-F119 AromaticContact CD1-CE2 3.67Å; F115-F119 HydrophobicContact CD1-CE2 3.67Å; F115-F119 HydrophobicContact CD1-CZ 4.39Å; F115-F119 HydrophobicContact CD2-CE2 4.05Å; F115-F119 HydrophobicContact CE1-CD2 4.32Å; F115-F119 AromaticContact CE1-CE2 3.25Å; F115-F119 HydrophobicContact CE1-CE2 3.25Å; F115-F119 AromaticContact CE1-CZ 3.53Å; F115-F119 HydrophobicContact CE1-CZ 3.53Å; F115-F119 AromaticContact CE2-CE2 3.67Å; F115-F119 HydrophobicContact CE2-CE2 3.67Å; F115-F119 AromaticContact CE2-CZ 3.98Å; F115-F119 HydrophobicContact CE2-CZ 3.98Å; F115-F119 HydrophobicContact CG-CE2 4.04Å; F115-F119 AromaticContact CZ-CE2 3.22Å; F115-F119 HydrophobicContact CZ-CE2 3.22Å; F115-F119 AromaticContact CZ-CZ 3.26Å; F115-F119 HydrophobicContact CZ-CZ 3.26Å; F115-F119 WeakPolarHBondContact O-CD2 3.45Å; F116-F119 WeakPolarHBondContact O-CB 3.43Å; F116-F119 PolarHBondContact O-N 3.17Å; S117-F119 VanDerWaalsContact C-N 3.28Å; S117-F119 PolarHBondContact O-N 3.48Å; F119-I232 HydrophobicContact CE1-CB 4.38Å; F119-I232 HydrophobicContact CE1-CG2 3.97Å; F119-Q233 VanDerWaalsContact CD1-CA 3.47Å; F119-Q233 HydrophobicContact CD1-CB 3.78Å; F119-Q233 HydrophobicContact CD1-CG 3.77Å; F119-Q233 HydrophobicContact CD2-CG 4.32Å; F119-Q233 HydrophobicContact CE1-CB 3.27Å; F119-Q233 HydrophobicContact CE1-CG 3.7Å; F119-Q233 VanDerWaalsContact CE1-N 3.26Å; F119-Q233 HydrophobicContact CE2-CB 4.38Å; F119-Q233 HydrophobicContact CE2-CG 4.19Å; F119-Q233 HydrophobicContact CG-CG 4.08Å; F119-Q233 HydrophobicContact CZ-CB 3.57Å; F119-Q233 HydrophobicContact CZ-CG 3.87Å; F119-F236 HydrophobicContact CD1-CB 4.42Å; F119-F236 HydrophobicContact CD1-CD2 4.17Å
120L41.3Very low48Very low129 Ų12987.5 Ų87.568%0.67544%0.439SS*.SBendtrans-91.4-0.3179.6-71.3169.8000113.4F116 S117 E122F116-L120 PolarHBondContact O-N 2.92Å; S117-L120 PolarHBondContact O-N 3.38Å; L120-E122 PolarHBondContact O-N 2.74Å
121K41.9Very low49Very low164 Ų16484.4 Ų84.471%0.71343%0.426SS*.  trans-80.656.2177.3-156.4170.2-174.9179.80110S117 K123S117-K121 WeakPolarHBondContact O-CB 3.47Å; S117-K121 PolarHBondContact O-N 2.94Å; K121-K123 PolarHBondContact O-N 3.29Å
122E42.8Very low49.6Very low96 Ų9682 Ų8245%0.44942%0.415SS..  trans-70.9100.2176.2-160167.3-16000108.6L120 L124L120-E122 PolarHBondContact O-N 2.74Å; E122-L124 PolarHBondContact O-N 3.41Å; E122-L124 VanDerWaalsContact O-N 3.12Å
123K37.7Very low50.2Low187 Ų18776.4 Ų76.481%0.81339%0.386SS*.  trans31.874.2141.8-154-170.6-172.6-171.80115.1K121K121-K123 PolarHBondContact O-N 3.29Å
124L40.9Very low50.5Low112 Ų11278.6 Ų78.659%0.58640%0.395SS*.  trans-97.4134.3155.3-74.4136.5000108.1E122 D126 Y128E122-L124 PolarHBondContact O-N 3.41Å; E122-L124 VanDerWaalsContact O-N 3.12Å; L124-D126 PolarHBondContact O-N 2.97Å; L124-Y128 HydrophobicContact CB-CD2 4.02Å; L124-Y128 HydrophobicContact CB-CE2 3.53Å; L124-Y128 HydrophobicContact CD1-CD2 3.9Å; L124-Y128 HydrophobicContact CD1-CE2 3.6Å; L124-Y128 HydrophobicContact CD2-CE2 3.99Å; L124-Y128 HydrophobicContact CG-CD2 4.49Å; L124-Y128 HydrophobicContact CG-CE2 3.89Å
125N42.3Very low50.9Low159 Ų15975.4 Ų75.485%0.8538%0.38SS*.SBendtrans-62-8.2174-63.3-31.8000112.4
126D49.3Very low51.6Low39 Ų3977.2 Ų77.221%0.20940%0.397CS..SBendtrans-99.6137170.2-39.6-55.9000110.7R86 L124 Y128R86-D126 HydrophobicContact CG-CB 4.34Å; L124-D126 PolarHBondContact O-N 2.97Å; D126-Y128 HydrophobicContact CB-CD2 4.18Å; D126-Y128 HydrophobicContact CB-CE2 3.53Å; D126-Y128 VanDerWaalsContact O-CD2 3.23Å; D126-Y128 WeakPolarHBondContact O-CD2 3.48Å; D126-Y128 PolarHBondContact O-N 3.37Å; D126-Y128 PolarHBondContact OD2-OH 3.5Å
127T63.1Low52.8Low58 Ų5877.5 Ų77.536%0.35640%0.398SS..EExtended strand (participates in β ladder)trans-79.7106.3170.8180000108.5V87 V95V87-T127 PolarHBondContact N-O 3.46Å; V87-T127 PolarHBondContact O-N 2.87Å; V95-T127 HydrophobicContact CG2-CG2 4.32Å
128Y62.9Low54Low41 Ų4176 Ų7616%0.16139%0.387CS..EExtended strand (participates in β ladder)trans-91.9121.8170.3-62.7-92.4000109.2R86 L124 D126R86-Y128 HydrophobicContact CB-CD1 4.4Å; R86-Y128 HydrophobicContact CB-CE1 4.24Å; R86-Y128 HydrophobicContact CG-CE1 4.07Å; R86-Y128 VanDerWaalsContact NE-CE1 3.27Å; R86-Y128 PolarHBondContact NE-OH 2.93Å; R86-Y128 PolarHBondContact NH2-OH 3.43Å; L124-Y128 HydrophobicContact CB-CD2 4.02Å; L124-Y128 HydrophobicContact CB-CE2 3.53Å; L124-Y128 HydrophobicContact CD1-CD2 3.9Å; L124-Y128 HydrophobicContact CD1-CE2 3.6Å; L124-Y128 HydrophobicContact CD2-CE2 3.99Å; L124-Y128 HydrophobicContact CG-CD2 4.49Å; L124-Y128 HydrophobicContact CG-CE2 3.89Å; D126-Y128 HydrophobicContact CB-CD2 4.18Å; D126-Y128 HydrophobicContact CB-CE2 3.53Å; D126-Y128 VanDerWaalsContact O-CD2 3.23Å; D126-Y128 WeakPolarHBondContact O-CD2 3.48Å; D126-Y128 PolarHBondContact O-N 3.37Å; D126-Y128 PolarHBondContact OD2-OH 3.5Å
129V66Low55.2Low22 Ų2275 Ų7513%0.13338%0.38CS..EExtended strand (participates in β ladder)trans-105.6123.7167.3-171.90000108.8I85 V95 L140I85-V129 PolarHBondContact N-O 3.44Å; I85-V129 PolarHBondContact O-N 2.98Å; V95-V129 HydrophobicContact CG1-CG2 3.98Å; V129-L140 HydrophobicContact CB-CD2 3.98Å; V129-L140 HydrophobicContact CG1-CD2 3.79Å; V129-L140 HydrophobicContact CG2-CD2 3.83Å
130N61.7Low56.6Low65 Ų6573.8 Ų73.835%0.34837%0.374SS..EExtended strand (participates in β ladder)trans-83.6124.9179.5-62.1-53.2000108.8R82R82-N130 PolarHBondContact NE-OD1 2.68Å; R82-N130 PolarHBondContact NH2-ND2 2.78Å
131V63.1Low58.1Low5 Ų571.3 Ų71.33%0.0336%0.358CS..EExtended strand (participates in β ladder)trans-102.6124.21751740000108.1Y68 I83 I85 T138Y68-V131 HydrophobicContact CD1-CG1 4.25Å; Y68-V131 HydrophobicContact CE1-CG1 4.43Å; I83-V131 HydrophobicContact CB-CB 4.19Å; I83-V131 HydrophobicContact CG2-CB 4.07Å; I83-V131 HydrophobicContact CG2-CG1 4.46Å; I83-V131 PolarHBondContact O-N 2.92Å; I85-V131 HydrophobicContact CD1-CG2 3.54Å; I85-V131 HydrophobicContact CG1-CG2 3.78Å; V131-T138 HydrophobicContact CB-CG2 4.32Å; V131-T138 HydrophobicContact CG1-CG2 3.59Å; V131-T138 HydrophobicContact CG2-CG2 4.1Å; V131-T138 WeakPolarHBondContact CG2-OG1 3.48Å
132G57.7Low59.6Low34 Ų3463.6 Ų63.635%0.35132%0.324SS..PPolyproline II helixtrans-65.8137.2174.100000110.7Y134 S135G132-Y134 PolarHBondContact O-N 3.36Å; G132-Y134 VanDerWaalsContact O-N 3.13Å; G132-S135 VanDerWaalsContact O-CB 3.3Å; G132-S135 WeakPolarHBondContact O-CB 3.44Å; G132-S135 PolarHBondContact O-N 2.7Å
133L56.5Low60.9Low9 Ų961.7 Ų61.75%0.04732%0.316CS..THydrogen-bonded Turntrans-55.3-33.7-174.1-94.974.3000114.1N70 P74 T81 I83 I298N70-L133 PolarHBondContact ND2-O 3.3Å; P74-L133 HydrophobicContact CB-CD2 4.45Å; T81-L133 VanDerWaalsContact O-CD1 3.22Å; T81-L133 WeakPolarHBondContact O-CD1 3.28Å; I83-L133 HydrophobicContact CD1-CG 4.38Å; I83-L133 HydrophobicContact CG1-CD1 4.41Å; L133-I298 HydrophobicContact CD2-CD1 4.32Å
134Y54.8Low62.4Low137 Ų13755.1 Ų55.154%0.53729%0.289SS..THydrogen-bonded Turntrans-914.6178.4-90.1-92.9000114.2P74 G132 T136 I298P74-Y134 HydrophobicContact CG-CE2 3.8Å; G132-Y134 PolarHBondContact O-N 3.36Å; G132-Y134 VanDerWaalsContact O-N 3.13Å; Y134-T136 PolarHBondContact O-N 2.95Å; Y134-I298 HydrophobicContact CD2-CG1 4.1Å; Y134-I298 HydrophobicContact CD2-CG2 4.16Å; Y134-I298 HydrophobicContact CE2-CB 4.32Å; Y134-I298 HydrophobicContact CE2-CD1 4.05Å; Y134-I298 HydrophobicContact CE2-CG1 3.88Å; Y134-I298 HydrophobicContact CE2-CG2 3.56Å
135S58.5Low63.7Low21 Ų2154.7 Ų54.715%0.14729%0.286CS..  trans-72.6103.9175.2-68.70000110.4K103 G132 K137K103-S135 PolarHBondContact NZ-OG 2.95Å; G132-S135 VanDerWaalsContact O-CB 3.3Å; G132-S135 WeakPolarHBondContact O-CB 3.44Å; G132-S135 PolarHBondContact O-N 2.7Å; S135-K137 PolarHBondContact O-N 2.9Å
136T59.7Low65Low104 Ų10451 Ų5164%0.63826%0.264SS*.SBendtrans-55-39.7179.5510000112.5T69 N70 Y134T69-T136 WeakPolarHBondContact CA-O 3.19Å; N70-T136 PolarHBondContact N-O 3.04Å; Y134-T136 PolarHBondContact O-N 2.95Å
137K68.5Low65.7Low126 Ų12658.6 Ų58.655%0.54830%0.295SS..EExtended strand (participates in β ladder)trans-140.5135.4172.4-54.1-167.1175.41760110Y68 T69 S135Y68-K137 WeakPolarHBondContact O-CA 3.35Å; T69-K137 HydrophobicContact CG2-CD 4.23Å; T69-K137 HydrophobicContact CG2-CG 3.9Å; S135-K137 PolarHBondContact O-N 2.9Å
138T71.8Confident65.7Low13 Ų1361.3 Ų61.38%0.0831%0.307CS..EExtended strand (participates in β ladder)trans-126.6121.2166.749.20000109.3C67 Y68 V131C67-T138 WeakPolarHBondContact CA-O 3.44Å; Y68-T138 PolarHBondContact N-O 2.73Å; Y68-T138 PolarHBondContact O-N 2.7Å; V131-T138 HydrophobicContact CB-CG2 4.32Å; V131-T138 HydrophobicContact CG1-CG2 3.59Å; V131-T138 HydrophobicContact CG2-CG2 4.1Å; V131-T138 WeakPolarHBondContact CG2-OG1 3.48Å
139C74.1Confident66.1Low26 Ų2659.4 Ų59.418%0.17630%0.3CS..EExtended strand (participates in β ladder)trans-109.3136.4179.4-65.20000110.8F66 C67 V98F66-C139 CarbonylContact O-C 3.47Å; F66-C139 VanDerWaalsContact O-CA 3.29Å; F66-C139 WeakPolarHBondContact O-CA 3.22Å; C67-C139 HydrophobicContact CB-CB 4.25Å; C67-C139 WeakPolarHBondContact CB-SG 3.31Å; C67-C139 WeakPolarHBondContact SG-CB 2.91Å; C67-C139 CovalentContact SG-SG 2.05Å; C67-C139 PolarHBondContact SG-SG 2.89Å; V98-C139 HydrophobicContact CB-CB 4.46Å; V98-C139 PolarHBondContact N-O 2.88Å
140L73.3Confident66.8Low3 Ų363.4 Ų63.42%0.01632%0.315CS..EExtended strand (participates in β ladder)trans-123.7131.1-177.2-66.8167.4000107.8Q65 F66 I85 V95 Q97 V129Q65-L140 CarbonylContact C-O 3.6Å; Q65-L140 WeakPolarHBondContact CA-O 3.3Å; F66-L140 PolarHBondContact N-O 2.95Å; F66-L140 PolarHBondContact O-N 2.05Å; I85-L140 HydrophobicContact CB-CD1 3.9Å; I85-L140 HydrophobicContact CD1-CD1 3.4Å; I85-L140 VanDerWaalsContact CD1-CD1 3.4Å; I85-L140 HydrophobicContact CD1-CG 4.41Å; I85-L140 HydrophobicContact CG1-CD1 4.2Å; I85-L140 HydrophobicContact CG2-CD1 3.58Å; V95-L140 HydrophobicContact CG1-CD2 4.1Å; Q97-L140 HydrophobicContact CB-CD2 4.43Å; V129-L140 HydrophobicContact CB-CD2 3.98Å; V129-L140 HydrophobicContact CG1-CD2 3.79Å; V129-L140 HydrophobicContact CG2-CD2 3.83Å
141K73.6Confident67.6Low77 Ų7760.4 Ų60.434%0.33530%0.299SS..EExtended strand (participates in β ladder)trans-104.8121.7169.1-172.2-173-174.9-161.60108T96 V98 E143T96-K141 PolarHBondContact N-O 3.48Å; T96-K141 PolarHBondContact O-N 2.99Å; T96-K141 PolarHBondContact OG1-O 3.49Å; V98-K141 HydrophobicContact CG2-CB 3.75Å; K141-E143 HydrophobicContact CD-CG 4.24Å; K141-E143 VanDerWaalsContact CE-OE1 3.25Å; K141-E143 WeakPolarHBondContact CE-OE1 3.48Å; K141-E143 HydrophobicContact CG-CG 4.25Å; K141-E143 IonicContact NZ-OE1 2.69Å; K141-E143 PolarHBondContact NZ-OE1 3Å
142V72.6Confident68.4Low1 Ų161.1 Ų61.11%0.00630%0.304CS..EExtended strand (participates in β ladder)trans-103.8106.5177.4-1770000108S63 Q64 F66 I93 V95 Y151S63-V142 WeakPolarHBondContact CA-O 3.36Å; S63-V142 PolarHBondContact OG-O 3.25Å; S63-V142 VanDerWaalsContact OG-O 3.12Å; Q64-V142 PolarHBondContact O-N 3.46Å; Q64-V142 VanDerWaalsContact O-N 3.12Å; F66-V142 HydrophobicContact CD2-CG2 3.93Å; F66-V142 HydrophobicContact CE2-CB 4.36Å; F66-V142 HydrophobicContact CE2-CG2 4.04Å; I93-V142 HydrophobicContact CB-CG1 4.48Å; I93-V142 HydrophobicContact CD1-CG1 4.27Å; V95-V142 HydrophobicContact CG1-CG2 4.46Å; V95-V142 HydrophobicContact CG2-CG1 4.46Å; V95-V142 HydrophobicContact CG2-CG2 4.33Å; V142-Y151 HydrophobicContact CB-CE2 4.36Å; V142-Y151 HydrophobicContact CG1-CD2 4.26Å; V142-Y151 HydrophobicContact CG1-CE1 4.37Å; V142-Y151 HydrophobicContact CG1-CE2 4.12Å; V142-Y151 HydrophobicContact CG1-CG 4.45Å
143E70.8Confident69.6Low57 Ų5759.5 Ų59.527%0.26629%0.288SS..EExtended strand (participates in β ladder)trans-94.9130.2176.8-65.3-179.3166.600110.4R94 K141R94-E143 HydrophobicContact CB-CB 4.25Å; R94-E143 PolarHBondContact N-O 2.93Å; R94-E143 PolarHBondContact O-N 3.12Å; K141-E143 HydrophobicContact CD-CG 4.24Å; K141-E143 VanDerWaalsContact CE-OE1 3.25Å; K141-E143 WeakPolarHBondContact CE-OE1 3.48Å; K141-E143 HydrophobicContact CG-CG 4.25Å; K141-E143 IonicContact NZ-OE1 2.69Å; K141-E143 PolarHBondContact NZ-OE1 3Å
144I70.2Confident70.8Confident48 Ų4860.8 Ų60.825%0.24629%0.294CS..EExtended strand (participates in β ladder)trans-88.9125.4178.5-62.1174.5000109.1R61 E146 T149 Y151R61-I144 VanDerWaalsContact O-CD1 3.28Å; R61-I144 WeakPolarHBondContact O-CD1 3.28Å; I144-E146 WeakPolarHBondContact CG2-O 3.46Å; I144-T149 HydrophobicContact CG2-CG2 3.93Å; I144-T149 WeakPolarHBondContact CG2-OG1 3.42Å; I144-Y151 HydrophobicContact CD1-CD1 4.48Å; I144-Y151 HydrophobicContact CD1-CE1 4.13Å; I144-Y151 HydrophobicContact CG1-CE1 4.36Å
145I66.8Low72.2Confident103 Ų10354.3 Ų54.353%0.52827%0.269SS..  trans-91.2-36.9178.3-58172.6000111.2R94R94-I145 HydrophobicContact CB-CD1 4.11Å; R94-I145 HydrophobicContact CB-CG1 4.34Å
146E69.2Low73.2Confident81 Ų8154.7 Ų54.738%0.37927%0.269SS..SBendtrans-106.3145.4-177.9-74.3177.1-175.400112.8K91 I144 T149K91-E146 WeakPolarHBondContact CB-OE2 3.35Å; K91-E146 HydrophobicContact CD-CB 4.35Å; K91-E146 WeakPolarHBondContact CD-OE2 3.34Å; K91-E146 WeakPolarHBondContact CG-OE2 3.43Å; I144-E146 WeakPolarHBondContact CG2-O 3.46Å; E146-T149 HydrophobicContact CB-CG2 3.93Å; E146-T149 VanDerWaalsContact O-CG2 3.3Å; E146-T149 WeakPolarHBondContact O-CG2 3.09Å
147K63.9Low74.2Confident200 Ų20052.8 Ų52.887%0.8725%0.25SS*.SBendtrans-71.6141.7176.6-63.2-179.6-178.3178.90110.5K91K91-K147 PolarHBondContact NZ-O 2.74Å
148D64.3Low74.9Confident114 Ų11453.3 Ų53.361%0.6125%0.249SC*.SBendtrans61.453.6-176.6-163.643.2000114.2K91K91-D148 PolarHBondContact NZ-O 3.04Å
149T71.1Confident75.4Confident1 Ų157.9 Ų57.91%0.00627%0.268CS..  trans-95.4137.7165.668.10000110.3K91 I144 E146K91-T149 HydrophobicContact CB-CG2 3.34Å; K91-T149 HydrophobicContact CD-CG2 3.68Å; K91-T149 HydrophobicContact CG-CG2 4.17Å; I144-T149 HydrophobicContact CG2-CG2 3.93Å; I144-T149 WeakPolarHBondContact CG2-OG1 3.42Å; E146-T149 HydrophobicContact CB-CG2 3.93Å; E146-T149 VanDerWaalsContact O-CG2 3.3Å; E146-T149 WeakPolarHBondContact O-CG2 3.09Å
150K79.9Confident75.7Confident106 Ų10657.4 Ų57.446%0.46126%0.264SS..  trans-105.6131.7165.6-62-177-172.6178.50107.4R61 S90R61-K150 HydrophobicContact CG-CG 4.19Å; R61-K150 VanDerWaalsContact CZ-CE 3.41Å; S90-K150 PolarHBondContact N-O 2.66Å
151Y78.8Confident76.2Confident3 Ų360.6 Ų60.61%0.01228%0.284CS..EExtended strand (participates in β ladder)trans-129.5148.7172.969.8-88.9000110.7E59 K60 A62 F66 V87 N88 V142 I144 V153E59-Y151 WeakPolarHBondContact CA-O 3.14Å; K60-Y151 HydrophobicContact CB-CE1 4Å; K60-Y151 HydrophobicContact CB-CE2 4.06Å; K60-Y151 WeakPolarHBondContact CB-OH 3.14Å; K60-Y151 PolarHBondContact N-O 3.3Å; K60-Y151 WeakPolarHBondContact O-CD1 3.39Å; K60-Y151 PolarHBondContact O-N 2.98Å; A62-Y151 WeakPolarHBondContact O-CE1 3.45Å; A62-Y151 PolarHBondContact O-OH 2.95Å; F66-Y151 AromaticContact CE2-CE2 3.51Å; F66-Y151 HydrophobicContact CE2-CE2 3.51Å; F66-Y151 AromaticContact CE2-CZ 3.86Å; F66-Y151 WeakPolarHBondContact CE2-OH 3.47Å; F66-Y151 AromaticContact CZ-CE2 3.6Å; F66-Y151 HydrophobicContact CZ-CE2 3.6Å; F66-Y151 AromaticContact CZ-CZ 3.97Å; F66-Y151 WeakPolarHBondContact CZ-OH 3.43Å; V87-Y151 HydrophobicContact CG1-CD2 4.27Å; N88-Y151 CarbonylContact O-C 3.49Å; N88-Y151 WeakPolarHBondContact O-CA 3.29Å; V142-Y151 HydrophobicContact CB-CE2 4.36Å; V142-Y151 HydrophobicContact CG1-CD2 4.26Å; V142-Y151 HydrophobicContact CG1-CE1 4.37Å; V142-Y151 HydrophobicContact CG1-CE2 4.12Å; V142-Y151 HydrophobicContact CG1-CG 4.45Å; I144-Y151 HydrophobicContact CD1-CD1 4.48Å; I144-Y151 HydrophobicContact CD1-CE1 4.13Å; I144-Y151 HydrophobicContact CG1-CE1 4.36Å; Y151-V153 HydrophobicContact CD2-CG2 3.74Å; Y151-V153 HydrophobicContact CE2-CG2 3.73Å
152S80.7Confident76.6Confident19 Ų1963.6 Ų63.613%0.13330%0.297CS..EExtended strand (participates in β ladder)trans-118134174.858.70000109.1C58 V87 N88C58-S152 WeakPolarHBondContact O-CA 3.29Å; V87-S152 WeakPolarHBondContact CA-O 3.29Å; N88-S152 PolarHBondContact N-O 2.85Å; N88-S152 PolarHBondContact O-N 3.1Å; N88-S152 PolarHBondContact O-OG 3.05Å
153V82.1Confident77.1Confident0 Ų064.2 Ų64.20%030%0.301CS..EExtended strand (participates in β ladder)trans-113.5127.7175.8-172.60000108.4L52 C58 F66 I85 R86 V87 Y151L52-V153 HydrophobicContact CD1-CG1 3.64Å; L52-V153 HydrophobicContact CD2-CB 4.16Å; L52-V153 HydrophobicContact CD2-CG1 3.88Å; L52-V153 HydrophobicContact CG-CG1 4.44Å; C58-V153 PolarHBondContact N-O 2.82Å; C58-V153 PolarHBondContact O-N 3.04Å; F66-V153 HydrophobicContact CD2-CG2 4.26Å; F66-V153 HydrophobicContact CE1-CG2 4.37Å; F66-V153 HydrophobicContact CE2-CG2 3.97Å; F66-V153 HydrophobicContact CZ-CG2 4.02Å; I85-V153 HydrophobicContact CG2-CG1 3.57Å; R86-V153 WeakPolarHBondContact O-CA 3.43Å; V87-V153 HydrophobicContact CG1-CG2 4.25Å; V87-V153 HydrophobicContact CG2-CG1 4.33Å; V87-V153 HydrophobicContact CG2-CG2 4.29Å; Y151-V153 HydrophobicContact CD2-CG2 3.74Å; Y151-V153 HydrophobicContact CE2-CG2 3.73Å
154I82.9Confident77.9Confident36 Ų3665 Ų6519%0.18530%0.303CS..EExtended strand (participates in β ladder)trans-133.1131.4179.6-49.1177.3000108.7V57 R86 I156V57-I154 HydrophobicContact CB-CD1 4.36Å; V57-I154 HydrophobicContact CB-CG1 4.18Å; V57-I154 HydrophobicContact CG1-CD1 4.02Å; V57-I154 HydrophobicContact CG1-CG1 3.91Å; V57-I154 HydrophobicContact CG2-CD1 3.65Å; V57-I154 HydrophobicContact CG2-CG1 3.86Å; R86-I154 PolarHBondContact N-O 2.85Å; R86-I154 PolarHBondContact O-N 3.09Å; I154-I156 HydrophobicContact CB-CG1 4.35Å; I154-I156 HydrophobicContact CG2-CD1 4.18Å; I154-I156 HydrophobicContact CG2-CG1 3.66Å
155V82.4Confident78.8Confident2 Ų267.8 Ų67.81%0.01232%0.318CS..EExtended strand (participates in β ladder)trans-96.3118.2170.6-172.10000108.7L52 S55 Y68 I83 I85L52-V155 HydrophobicContact CB-CG2 3.76Å; L52-V155 HydrophobicContact CD1-CG2 3.87Å; L52-V155 HydrophobicContact CG-CG2 4.36Å; S55-V155 PolarHBondContact N-O 3.4Å; Y68-V155 HydrophobicContact CD2-CB 4.48Å; Y68-V155 HydrophobicContact CD2-CG1 4.02Å; Y68-V155 HydrophobicContact CD2-CG2 4.05Å; Y68-V155 HydrophobicContact CE2-CG1 3.82Å; Y68-V155 HydrophobicContact CG-CG1 4.47Å; Y68-V155 HydrophobicContact CG-CG2 4.5Å; I83-V155 HydrophobicContact CG2-CG1 3.8Å; I85-V155 HydrophobicContact CG1-CG1 4.41Å; I85-V155 HydrophobicContact CG1-CG2 4.11Å
156I81.3Confident79.8Confident29 Ų2964.7 Ų64.715%0.14930%0.304CS..EExtended strand (participates in β ladder)trans-121.9130.5-178.3-44.4176.4000109Q84 I154 R158Q84-I156 PolarHBondContact N-O 2.72Å; Q84-I156 PolarHBondContact O-N 3.49Å; I154-I156 HydrophobicContact CB-CG1 4.35Å; I154-I156 HydrophobicContact CG2-CD1 4.18Å; I154-I156 HydrophobicContact CG2-CG1 3.66Å; I156-R158 HydrophobicContact CG2-CG 3.75Å
157R80.9Confident80.9Confident64 Ų6461.9 Ų61.924%0.24229%0.29CS..EExtended strand (participates in β ladder)trans-96.7118.1169-168.8178.9-65-152.5-2.2108.5E54 I83E54-R157 IonicContact OE1-CZ 4Å; E54-R157 IonicContact OE1-NE 2.78Å; E54-R157 IonicContact OE1-NH2 3.58Å; E54-R157 PolarHBondContact OE1-NH2 3.07Å; E54-R157 IonicContact OE2-NH2 3.98Å; I83-R157 HydrophobicContact CG1-CG 4.49Å
158R82.2Confident82.2Confident136 Ų13655.4 Ų55.451%0.51327%0.265SS..EExtended strand (participates in β ladder)trans-133.3151.8177.7-71.7-169.5175.1158.5-0.7111.5T81 R82 I156 D160T81-R158 CarbonylContact C-O 3.5Å; T81-R158 WeakPolarHBondContact CA-O 3.48Å; R82-R158 PolarHBondContact N-O 3.31Å; R82-R158 PolarHBondContact O-N 3.42Å; R82-R158 VanDerWaalsContact O-N 3.08Å; I156-R158 HydrophobicContact CG2-CG 3.75Å; R158-D160 PolarHBondContact O-N 3.04Å
159F82.4Confident83.6Confident110 Ų11054.2 Ų54.248%0.48226%0.258SS..EExtended strand (participates in β ladder)trans-66.5126.9167.6-179.1-101.6000109.4W80 P161 F164W80-F159 HydrophobicContact CB-CD2 4.03Å; W80-F159 HydrophobicContact CB-CE2 3.61Å; W80-F159 HydrophobicContact CB-CZ 4.39Å; W80-F159 HydrophobicContact CE3-CE2 4.4Å; W80-F159 HydrophobicContact CG-CE2 4.37Å; F159-P161 HydrophobicContact CD1-CB 4.34Å; F159-P161 HydrophobicContact CE1-CB 4.02Å; F159-P161 WeakPolarHBondContact O-CD 3.32Å; F159-F164 HydrophobicContact CE1-CB 4.43Å; F159-F164 HydrophobicContact CZ-CB 3.76Å; F159-F164 HydrophobicContact CZ-CD2 4.4Å; F159-F164 AromaticContact CZ-CG 3.98Å; F159-F164 HydrophobicContact CZ-CG 3.98Å
160D81.3Confident84.7Confident16 Ų1654.1 Ų54.19%0.08626%0.258CS..  trans-98.297.7176.1-167.8-22.6000109.2W80 R82 R158 K162 L163 F164W80-D160 PolarHBondContact O-N 3.46Å; R82-D160 HydrophobicContact CB-CB 4.1Å; R82-D160 VanDerWaalsContact CD-OD2 3.22Å; R82-D160 WeakPolarHBondContact CD-OD2 3.31Å; R82-D160 IonicContact CZ-OD2 3.92Å; R82-D160 IonicContact NE-OD2 3.58Å; R82-D160 IonicContact NH1-OD2 3.7Å; R82-D160 PolarHBondContact NH1-OD2 3.19Å; R158-D160 PolarHBondContact O-N 3.04Å; D160-K162 PolarHBondContact O-N 3.49Å; D160-K162 VanDerWaalsContact O-N 3.12Å; D160-K162 VanDerWaalsContact OD1-CB 3.32Å; D160-K162 WeakPolarHBondContact OD1-CB 3.22Å; D160-K162 PolarHBondContact OD1-N 2.91Å; D160-K162 VanDerWaalsContact OD1-N 3.1Å; D160-L163 HydrophobicContact CB-CB 4.46Å; D160-L163 HydrophobicContact CB-CD1 4Å; D160-L163 HydrophobicContact CB-CG 4.21Å; D160-L163 PolarHBondContact O-N 2.94Å; D160-F164 PolarHBondContact O-N 3.16Å
161P82.4Confident85.4Confident70 Ų7051.6 Ų51.646%0.45525%0.249SC..Hα-helixtrans-62.7-22.1-177.426-35000112.5F159 F164 L165F159-P161 HydrophobicContact CD1-CB 4.34Å; F159-P161 HydrophobicContact CE1-CB 4.02Å; F159-P161 WeakPolarHBondContact O-CD 3.32Å; P161-F164 PolarHBondContact O-N 2.89Å; P161-L165 VanDerWaalsContact O-CG 3.29Å; P161-L165 WeakPolarHBondContact O-CG 3.42Å; P161-L165 PolarHBondContact O-N 3.47Å
162K82.3Confident86.1Confident139 Ų13956.3 Ų56.360%0.60427%0.272SS*.Hα-helixtrans-68.2-43.1-179.8-58.1179.4-179.7-177.80110.9D160 F164 L165 V166D160-K162 PolarHBondContact O-N 3.49Å; D160-K162 VanDerWaalsContact O-N 3.12Å; D160-K162 VanDerWaalsContact OD1-CB 3.32Å; D160-K162 WeakPolarHBondContact OD1-CB 3.22Å; D160-K162 PolarHBondContact OD1-N 2.91Å; D160-K162 VanDerWaalsContact OD1-N 3.1Å; K162-F164 VanDerWaalsContact C-N 3.32Å; K162-F164 PolarHBondContact O-N 3.39Å; K162-L165 PolarHBondContact O-N 2.82Å; K162-V166 VanDerWaalsContact O-CG2 3.31Å; K162-V166 WeakPolarHBondContact O-CG2 3.25Å; K162-V166 PolarHBondContact O-N 3.37Å
163L83.6Confident86.7Confident15 Ų1556.3 Ų56.38%0.07927%0.271CS..Hα-helixtrans-63.5-41.1177.6-70177.7000111.4D160 V166 F167 Q297D160-L163 HydrophobicContact CB-CB 4.46Å; D160-L163 HydrophobicContact CB-CD1 4Å; D160-L163 HydrophobicContact CB-CG 4.21Å; D160-L163 PolarHBondContact O-N 2.94Å; L163-V166 PolarHBondContact O-N 2.97Å; L163-F167 WeakPolarHBondContact O-CB 3.28Å; L163-F167 PolarHBondContact O-N 3.18Å; L163-Q297 HydrophobicContact CD1-CG 3.83Å
164F87.6Confident87.3Confident73 Ų7356.5 Ų56.532%0.3227%0.272SS..Hα-helixtrans-61.3-45.7174.2177.8-101.8000112.3W80 F159 D160 P161 K162 V166 F167 L168W80-F164 HydrophobicContact CD2-CB 4.5Å; W80-F164 AromaticContact CD2-CD2 3.85Å; W80-F164 HydrophobicContact CD2-CD2 3.85Å; W80-F164 AromaticContact CE2-CD2 3.78Å; W80-F164 HydrophobicContact CE3-CD2 4.12Å; W80-F164 HydrophobicContact CG-CB 4.12Å; W80-F164 HydrophobicContact CG-CD2 4.34Å; W80-F164 HydrophobicContact CH2-CD2 4.27Å; W80-F164 HydrophobicContact CH2-CE2 4.3Å; W80-F164 HydrophobicContact CZ2-CD2 4.01Å; W80-F164 HydrophobicContact CZ2-CE2 4.33Å; W80-F164 HydrophobicContact CZ3-CD2 4.32Å; W80-F164 HydrophobicContact CZ3-CE2 4.48Å; F159-F164 HydrophobicContact CE1-CB 4.43Å; F159-F164 HydrophobicContact CZ-CB 3.76Å; F159-F164 HydrophobicContact CZ-CD2 4.4Å; F159-F164 AromaticContact CZ-CG 3.98Å; F159-F164 HydrophobicContact CZ-CG 3.98Å; D160-F164 PolarHBondContact O-N 3.16Å; P161-F164 PolarHBondContact O-N 2.89Å; K162-F164 VanDerWaalsContact C-N 3.32Å; K162-F164 PolarHBondContact O-N 3.39Å; F164-V166 PolarHBondContact O-N 3.24Å; F164-F167 PolarHBondContact O-N 2.9Å; F164-L168 WeakPolarHBondContact O-CB 3.47Å; F164-L168 PolarHBondContact O-N 3.5Å
165L88.3Confident87.7Confident107 Ų10759 Ų5956%0.5628%0.281SS*.Hα-helixtrans-64.1-39.9177.6-72174.1000112.6P161 K162 F167 L168 L169P161-L165 VanDerWaalsContact O-CG 3.29Å; P161-L165 WeakPolarHBondContact O-CG 3.42Å; P161-L165 PolarHBondContact O-N 3.47Å; K162-L165 PolarHBondContact O-N 2.82Å; L165-F167 VanDerWaalsContact C-N 3.35Å; L165-L168 PolarHBondContact O-N 3.04Å; L165-L169 WeakPolarHBondContact O-CB 3.24Å; L165-L169 PolarHBondContact O-N 3.16Å
166V89.1Confident88.1Confident37 Ų3760.8 Ų60.822%0.22429%0.293CS..Hα-helixtrans-63.2-43175.3171.10000110.8K162 L163 F164 L169 G170 F291K162-V166 VanDerWaalsContact O-CG2 3.31Å; K162-V166 WeakPolarHBondContact O-CG2 3.25Å; K162-V166 PolarHBondContact O-N 3.37Å; L163-V166 PolarHBondContact O-N 2.97Å; F164-V166 PolarHBondContact O-N 3.24Å; V166-L169 PolarHBondContact O-N 3.35Å; V166-G170 PolarHBondContact O-N 3.45Å; V166-F291 HydrophobicContact CG1-CB 4.17Å; V166-F291 HydrophobicContact CG1-CG 4.48Å
167F90.8Very high88.5Confident22 Ų2259.4 Ų59.410%0.09629%0.286CS..Hα-helixtrans-62-46.5175176.1-99000112W80 L163 F164 L165 L169 G170 L171 M292 I296 I305W80-F167 AromaticContact CZ2-CD1 3.71Å; W80-F167 HydrophobicContact CZ2-CD1 3.71Å; W80-F167 AromaticContact CZ2-CE1 3.94Å; W80-F167 HydrophobicContact CZ2-CE1 3.94Å; W80-F167 HydrophobicContact CZ2-CG 4.29Å; L163-F167 WeakPolarHBondContact O-CB 3.28Å; L163-F167 PolarHBondContact O-N 3.18Å; F164-F167 PolarHBondContact O-N 2.9Å; L165-F167 VanDerWaalsContact C-N 3.35Å; F167-L169 VanDerWaalsContact C-N 3.33Å; F167-L169 PolarHBondContact O-N 3.43Å; F167-G170 PolarHBondContact O-N 2.93Å; F167-G170 VanDerWaalsContact O-N 3.15Å; F167-L171 HydrophobicContact CZ-CD1 4.49Å; F167-L171 PolarHBondContact O-N 3.43Å; F167-M292 HydrophobicContact CD2-CB 4.26Å; F167-M292 HydrophobicContact CD2-CG 4.26Å; F167-M292 HydrophobicContact CE2-CB 4.25Å; F167-M292 HydrophobicContact CE2-CE 4.08Å; F167-M292 HydrophobicContact CE2-CG 4.15Å; F167-M292 HydrophobicContact CZ-CE 4.48Å; F167-I296 HydrophobicContact CD2-CD1 3.72Å; F167-I296 HydrophobicContact CD2-CG1 3.9Å; F167-I296 HydrophobicContact CE2-CD1 3.57Å; F167-I296 HydrophobicContact CE2-CG1 4.26Å; F167-I305 HydrophobicContact CE2-CG2 3.95Å; F167-I305 HydrophobicContact CZ-CG2 3.93Å
168L92.6Very high88.9Confident64 Ų6459.2 Ų59.234%0.33529%0.29SS..Hα-helixtrans-61.5-41.6177.9-177.865000111.8F164 L165 G170 L171 M172F164-L168 WeakPolarHBondContact O-CB 3.47Å; F164-L168 PolarHBondContact O-N 3.5Å; L165-L168 PolarHBondContact O-N 3.04Å; L168-G170 VanDerWaalsContact C-N 3.34Å; L168-L171 WeakPolarHBondContact O-CB 3.28Å; L168-L171 PolarHBondContact O-N 2.96Å; L168-M172 HydrophobicContact CD1-CE 4.29Å; L168-M172 WeakPolarHBondContact O-CG 3.32Å; L168-M172 PolarHBondContact O-N 2.74Å
169L93.1Very high89.3Confident89 Ų8958.8 Ų58.847%0.46630%0.297SS..Hα-helixtrans-61-44.2174-179.764.5000111.1L165 V166 F167 L171 M172 L173 F291L165-L169 WeakPolarHBondContact O-CB 3.24Å; L165-L169 PolarHBondContact O-N 3.16Å; V166-L169 PolarHBondContact O-N 3.35Å; F167-L169 VanDerWaalsContact C-N 3.33Å; F167-L169 PolarHBondContact O-N 3.43Å; L169-L171 VanDerWaalsContact C-N 3.33Å; L169-L171 PolarHBondContact O-N 2.81Å; L169-M172 PolarHBondContact O-N 3.17Å; L169-L173 HydrophobicContact CD1-CD1 4.45Å; L169-L173 HydrophobicContact CD1-CG 4.45Å; L169-L173 HydrophobicContact CG-CD1 4.2Å; L169-L173 WeakPolarHBondContact O-CG 3.44Å; L169-L173 PolarHBondContact O-N 3.13Å; L169-F291 HydrophobicContact CD2-CD2 3.97Å; L169-F291 HydrophobicContact CD2-CE2 3.82Å; L169-F291 HydrophobicContact CG-CD2 4.13Å; L169-F291 HydrophobicContact CG-CE2 4.35Å
170G94.3Very high89.6Confident0 Ų055.9 Ų55.90%029%0.287CS..Hα-helixtrans-59.9-43175.800000112.8V166 F167 L168 L173 F174 G288V166-G170 PolarHBondContact O-N 3.45Å; F167-G170 PolarHBondContact O-N 2.93Å; F167-G170 VanDerWaalsContact O-N 3.15Å; L168-G170 VanDerWaalsContact C-N 3.34Å; G170-L173 PolarHBondContact O-N 2.87Å; G170-F174 WeakPolarHBondContact O-CB 3.24Å; G170-F174 PolarHBondContact O-N 3.18Å; G170-G288 WeakPolarHBondContact CA-O 3.4Å; G170-G288 WeakPolarHBondContact O-CA 3.2Å
171L93.7Very high90.1Very high53 Ų5355.5 Ų55.528%0.27729%0.285SS..Hα-helixtrans-60.3-49176.1-163.777.5000111.3F167 L168 L169 L173 F174 F175 M292F167-L171 HydrophobicContact CZ-CD1 4.49Å; F167-L171 PolarHBondContact O-N 3.43Å; L168-L171 WeakPolarHBondContact O-CB 3.28Å; L168-L171 PolarHBondContact O-N 2.96Å; L169-L171 VanDerWaalsContact C-N 3.33Å; L169-L171 PolarHBondContact O-N 2.81Å; L171-L173 PolarHBondContact O-N 2.89Å; L171-F174 PolarHBondContact O-N 3.19Å; L171-F175 HydrophobicContact CD1-CD2 3.97Å; L171-F175 HydrophobicContact CD1-CE2 3.59Å; L171-F175 HydrophobicContact CG-CD2 3.95Å; L171-F175 HydrophobicContact CG-CE2 4.07Å; L171-F175 WeakPolarHBondContact O-CD2 3.29Å; L171-F175 PolarHBondContact O-N 3.47Å; L171-M292 HydrophobicContact CD1-CE 4.21Å; L171-M292 HydrophobicContact CD1-SD 4.39Å
172M93.4Very high90.4Very high102 Ų10261 Ų6150%0.50230%0.297SS..Hα-helixtrans-61.9-42.8178.8-71.5-65177.200111.9L168 L169 F174 C176L168-M172 HydrophobicContact CD1-CE 4.29Å; L168-M172 WeakPolarHBondContact O-CG 3.32Å; L168-M172 PolarHBondContact O-N 2.74Å; L169-M172 PolarHBondContact O-N 3.17Å; M172-F174 VanDerWaalsContact C-N 3.35Å; M172-F174 PolarHBondContact O-N 3.29Å; M172-C176 WeakPolarHBondContact O-CA 3.46Å; M172-C176 WeakPolarHBondContact O-CB 3.33Å; M172-C176 PolarHBondContact O-N 2.89Å
173L93.9Very high90.9Very high19 Ų1956.3 Ų56.310%0.09928%0.282CS..Hα-helixtrans-64.4-38.5177.4-72.1173.8000112.6L169 G170 L171 G177 L180 L284 M287 F291L169-L173 HydrophobicContact CD1-CD1 4.45Å; L169-L173 HydrophobicContact CD1-CG 4.45Å; L169-L173 HydrophobicContact CG-CD1 4.2Å; L169-L173 WeakPolarHBondContact O-CG 3.44Å; L169-L173 PolarHBondContact O-N 3.13Å; G170-L173 PolarHBondContact O-N 2.87Å; L171-L173 PolarHBondContact O-N 2.89Å; L173-G177 WeakPolarHBondContact O-CA 3.36Å; L173-G177 PolarHBondContact O-N 2.83Å; L173-L180 HydrophobicContact CD2-CD2 4.09Å; L173-L284 HydrophobicContact CD2-CD2 4.17Å; L173-M287 HydrophobicContact CD1-CG 4.49Å; L173-M287 HydrophobicContact CD1-SD 4.47Å; L173-F291 HydrophobicContact CD1-CD2 3.8Å; L173-F291 HydrophobicContact CD1-CE2 3.89Å
174F94.3Very high91.2Very high4 Ų461.7 Ų61.72%0.01831%0.306CS..Hα-helixtrans-70.8-46.9-178.9-177.9-99.2000112.6G170 L171 M172 Q285 L289 M292 A309 L310 K313G170-F174 WeakPolarHBondContact O-CB 3.24Å; G170-F174 PolarHBondContact O-N 3.18Å; L171-F174 PolarHBondContact O-N 3.19Å; M172-F174 VanDerWaalsContact C-N 3.35Å; M172-F174 PolarHBondContact O-N 3.29Å; F174-Q285 HydrophobicContact CD2-CB 4.08Å; F174-Q285 HydrophobicContact CD2-CG 4.36Å; F174-Q285 HydrophobicContact CE2-CB 4.41Å; F174-L289 HydrophobicContact CD2-CD1 4.47Å; F174-L289 HydrophobicContact CD2-CD2 3.69Å; F174-L289 HydrophobicContact CD2-CG 3.8Å; F174-L289 HydrophobicContact CE2-CD1 4.19Å; F174-L289 HydrophobicContact CE2-CD2 3.73Å; F174-L289 HydrophobicContact CE2-CG 3.96Å; F174-L289 HydrophobicContact CG-CD2 4.37Å; F174-L289 HydrophobicContact CZ-CD2 4.45Å; F174-M292 HydrophobicContact CB-SD 4.42Å; F174-A309 HydrophobicContact CD1-CB 4.19Å; F174-A309 HydrophobicContact CE1-CB 3.91Å; F174-L310 HydrophobicContact CE2-CD2 4.09Å; F174-L310 HydrophobicContact CZ-CD2 3.88Å; F174-L310 HydrophobicContact CZ-CG 4.42Å; F174-K313 HydrophobicContact CE1-CB 4.09Å; F174-K313 HydrophobicContact CE1-CD 3.9Å; F174-K313 HydrophobicContact CZ-CB 4.34Å; F174-K313 HydrophobicContact CZ-CD 3.95Å; F174-K313 PolarHBondContact O-NZ 3.3Å
175F91.7Very high91.3Very high89 Ų8964.7 Ų64.739%0.3933%0.325SS..Hα-helixtrans-79.1-45.3-179.2-75.7-74.4000112.5L171 G177 A309 T312L171-F175 HydrophobicContact CD1-CD2 3.97Å; L171-F175 HydrophobicContact CD1-CE2 3.59Å; L171-F175 HydrophobicContact CG-CD2 3.95Å; L171-F175 HydrophobicContact CG-CE2 4.07Å; L171-F175 WeakPolarHBondContact O-CD2 3.29Å; L171-F175 PolarHBondContact O-N 3.47Å; F175-G177 VanDerWaalsContact C-N 3.3Å; F175-G177 PolarHBondContact O-N 3.49Å; F175-A309 HydrophobicContact CE2-CB 4.49Å; F175-A309 HydrophobicContact CZ-CB 4.31Å; F175-T312 WeakPolarHBondContact CZ-OG1 3.23Å
176C91.4Very high91.5Very high39 Ų3961.6 Ų61.626%0.26431%0.307SS..Hα-helixtrans-87.86.4-178.7-54.80000113.3M172 D178 L179 L180M172-C176 WeakPolarHBondContact O-CA 3.46Å; M172-C176 WeakPolarHBondContact O-CB 3.33Å; M172-C176 PolarHBondContact O-N 2.89Å; C176-D178 VanDerWaalsContact C-N 3.26Å; C176-D178 PolarHBondContact O-N 3.41Å; C176-L179 PolarHBondContact O-N 3.37Å; C176-L180 HydrophobicContact CB-CD1 3.99Å; C176-L180 WeakPolarHBondContact O-CB 3.47Å; C176-L180 PolarHBondContact O-N 2.95Å
177G89.4Confident91.6Very high0 Ų062.6 Ų62.60%031%0.307CS..Hα-helixtrans-55.1-38.6-178.500000113.8L173 F175 S181L173-G177 WeakPolarHBondContact O-CA 3.36Å; L173-G177 PolarHBondContact O-N 2.83Å; F175-G177 VanDerWaalsContact C-N 3.3Å; F175-G177 PolarHBondContact O-N 3.49Å; G177-S181 VanDerWaalsContact O-CB 3.31Å; G177-S181 WeakPolarHBondContact O-CB 3.4Å; G177-S181 PolarHBondContact O-N 2.84Å; G177-S181 PolarHBondContact O-OG 3.45Å
178D89Confident91.7Very high59 Ų5963.6 Ų63.632%0.31631%0.31SS..Hα-helixtrans-69.7-35.5177.3-61.9-82.2000113C176 S181 R182 T281 Q285 K313C176-D178 VanDerWaalsContact C-N 3.26Å; C176-D178 PolarHBondContact O-N 3.41Å; D178-S181 PolarHBondContact O-OG 2.89Å; D178-R182 WeakPolarHBondContact O-CG 3.13Å; D178-T281 WeakPolarHBondContact OD1-CG2 3.21Å; D178-Q285 PolarHBondContact OD2-NE2 2.97Å; D178-K313 WeakPolarHBondContact OD2-CE 3.36Å; D178-K313 IonicContact OD2-NZ 3.73Å; D178-K313 PolarHBondContact OD2-NZ 3.32Å
179L90.8Very high91.7Very high127 Ų12763.4 Ų63.467%0.66531%0.314SS*.Hα-helixtrans-75.1-41177.3-65.3171.3000110.8C176 S183C176-L179 PolarHBondContact O-N 3.37Å; L179-S183 WeakPolarHBondContact O-CB 3.46Å; L179-S183 PolarHBondContact O-N 2.97Å; L179-S183 VanDerWaalsContact O-N 3.16Å
180L89.5Confident91.7Very high50 Ų5061.7 Ų61.726%0.26231%0.307SS..Hα-helixtrans-66.5-44178.2-102.465.1000111.4L173 C176 R182 S183 F186 L284L173-L180 HydrophobicContact CD2-CD2 4.09Å; C176-L180 HydrophobicContact CB-CD1 3.99Å; C176-L180 WeakPolarHBondContact O-CB 3.47Å; C176-L180 PolarHBondContact O-N 2.95Å; L180-R182 PolarHBondContact O-N 3.41Å; L180-S183 WeakPolarHBondContact O-CB 3.3Å; L180-S183 PolarHBondContact O-N 3.21Å; L180-S183 VanDerWaalsContact O-N 3.1Å; L180-F186 HydrophobicContact CB-CD1 4.2Å; L180-F186 HydrophobicContact CB-CD2 4.26Å; L180-F186 HydrophobicContact CB-CE1 4.48Å; L180-F186 HydrophobicContact CB-CG 4.09Å; L180-F186 HydrophobicContact CD2-CD2 3.74Å; L180-F186 HydrophobicContact CD2-CE2 3.61Å; L180-F186 HydrophobicContact CD2-CG 4.42Å; L180-F186 HydrophobicContact CD2-CZ 4.19Å; L180-F186 HydrophobicContact CG-CB 4.5Å; L180-F186 HydrophobicContact CG-CD2 3.76Å; L180-F186 HydrophobicContact CG-CE2 4.12Å; L180-F186 HydrophobicContact CG-CG 4.01Å; L180-F186 VanDerWaalsContact O-CB 3.29Å; L180-F186 WeakPolarHBondContact O-CB 3.36Å; L180-F186 WeakPolarHBondContact O-CD1 3.13Å; L180-F186 WeakPolarHBondContact O-CG 3.36Å; L180-L284 HydrophobicContact CB-CD1 4.21Å
181S90.3Very high91.6Very high8 Ų862.7 Ų62.76%0.05632%0.318CS..Hα-helixtrans-64.3-28.7-177.665.40000113.4G177 D178 T281G177-S181 VanDerWaalsContact O-CB 3.31Å; G177-S181 WeakPolarHBondContact O-CB 3.4Å; G177-S181 PolarHBondContact O-N 2.84Å; G177-S181 PolarHBondContact O-OG 3.45Å; D178-S181 PolarHBondContact O-OG 2.89Å; S181-T281 WeakPolarHBondContact CB-OG1 3.42Å; S181-T281 PolarHBondContact OG-OG1 3.4Å
182R90.1Very high91.6Very high184 Ų18462.8 Ų62.869%0.69432%0.317SS*.Hα-helixtrans-89.7-13.3176.4-64.2178.2-176.6-147-0.6113.5D178 L180 Q184 I277D178-R182 WeakPolarHBondContact O-CG 3.13Å; L180-R182 PolarHBondContact O-N 3.41Å; R182-Q184 PolarHBondContact O-N 2.84Å; R182-I277 HydrophobicContact CG-CG2 3.88Å
183S91.3Very high91.6Very high42 Ų4261 Ų6129%0.29431%0.314SS..  trans-76123-178.4178.20000111.3L179 L180 I185 F186 Y187L179-S183 WeakPolarHBondContact O-CB 3.46Å; L179-S183 PolarHBondContact O-N 2.97Å; L179-S183 VanDerWaalsContact O-N 3.16Å; L180-S183 WeakPolarHBondContact O-CB 3.3Å; L180-S183 PolarHBondContact O-N 3.21Å; L180-S183 VanDerWaalsContact O-N 3.1Å; S183-I185 VanDerWaalsContact C-N 3.26Å; S183-I185 PolarHBondContact O-N 2.76Å; S183-I185 PolarHBondContact OG-N 3.46Å; S183-F186 PolarHBondContact O-N 3.11Å; S183-Y187 PolarHBondContact O-N 3.43Å
184Q90.3Very high91.5Very high127 Ų12764.4 Ų64.459%0.59334%0.336SS*.Hα-helixtrans-61.6-37174.5-65.6177.3-27.200111.7R182 F186 Y187 Y188R182-Q184 PolarHBondContact O-N 2.84Å; Q184-F186 VanDerWaalsContact C-N 3.31Å; Q184-F186 PolarHBondContact O-N 3.37Å; Q184-Y187 PolarHBondContact O-N 3.35Å; Q184-Y188 HydrophobicContact CB-CE2 4.29Å; Q184-Y188 WeakPolarHBondContact O-CD2 3.46Å; Q184-Y188 PolarHBondContact O-N 2.62Å; Q184-Y188 VanDerWaalsContact O-N 3.08Å
185I90.9Very high91.5Very high137 Ų13765.1 Ų65.170%0.70334%0.344SS*.Hα-helixtrans-62.9-41.9179.2-58.4168000110.1S183 S189S183-I185 VanDerWaalsContact C-N 3.26Å; S183-I185 PolarHBondContact O-N 2.76Å; S183-I185 PolarHBondContact OG-N 3.46Å; I185-S189 WeakPolarHBondContact O-CB 3.45Å; I185-S189 PolarHBondContact O-N 3.12Å
186F91.4Very high91.5Very high42 Ų4262.6 Ų62.618%0.18434%0.335CS..Hα-helixtrans-64.9-41178.1-178.6-103.5000111.7L180 S183 Q184 T190 L280 L284L180-F186 HydrophobicContact CB-CD1 4.2Å; L180-F186 HydrophobicContact CB-CD2 4.26Å; L180-F186 HydrophobicContact CB-CE1 4.48Å; L180-F186 HydrophobicContact CB-CG 4.09Å; L180-F186 HydrophobicContact CD2-CD2 3.74Å; L180-F186 HydrophobicContact CD2-CE2 3.61Å; L180-F186 HydrophobicContact CD2-CG 4.42Å; L180-F186 HydrophobicContact CD2-CZ 4.19Å; L180-F186 HydrophobicContact CG-CB 4.5Å; L180-F186 HydrophobicContact CG-CD2 3.76Å; L180-F186 HydrophobicContact CG-CE2 4.12Å; L180-F186 HydrophobicContact CG-CG 4.01Å; L180-F186 VanDerWaalsContact O-CB 3.29Å; L180-F186 WeakPolarHBondContact O-CB 3.36Å; L180-F186 WeakPolarHBondContact O-CD1 3.13Å; L180-F186 WeakPolarHBondContact O-CG 3.36Å; S183-F186 PolarHBondContact O-N 3.11Å; Q184-F186 VanDerWaalsContact C-N 3.31Å; Q184-F186 PolarHBondContact O-N 3.37Å; F186-T190 WeakPolarHBondContact CE2-OG1 3.38Å; F186-T190 WeakPolarHBondContact CZ-OG1 3.34Å; F186-T190 VanDerWaalsContact O-CB 3.23Å; F186-T190 WeakPolarHBondContact O-CB 3.2Å; F186-T190 PolarHBondContact O-N 2.81Å; F186-T190 PolarHBondContact O-OG1 2.89Å; F186-L280 HydrophobicContact CE1-CD2 4.41Å; F186-L284 HydrophobicContact CE1-CD1 3.79Å; F186-L284 HydrophobicContact CE1-CD2 4.18Å; F186-L284 HydrophobicContact CZ-CD1 4.06Å; F186-L284 HydrophobicContact CZ-CD2 3.73Å
187Y91.1Very high91.4Very high57 Ų5764.7 Ų64.722%0.22435%0.346CS..Hα-helixtrans-59.6-52.6176.1179.6-94.3000111.9S183 Q184 G191 C265 G269 P270 L271S183-Y187 PolarHBondContact O-N 3.43Å; Q184-Y187 PolarHBondContact O-N 3.35Å; Y187-G191 PolarHBondContact O-N 2.96Å; Y187-C265 HydrophobicContact CE1-CB 4.35Å; Y187-G269 WeakPolarHBondContact CE1-O 3.34Å; Y187-G269 PolarHBondContact OH-O 3.49Å; Y187-P270 HydrophobicContact CD1-CB 4.27Å; Y187-P270 HydrophobicContact CG-CB 4.42Å; Y187-L271 HydrophobicContact CD2-CD1 3.69Å; Y187-L271 HydrophobicContact CD2-CG 3.95Å; Y187-L271 HydrophobicContact CE2-CD1 3.92Å; Y187-L271 HydrophobicContact CE2-CG 3.79Å
188Y92.6Very high91.4Very high44 Ų4466.7 Ų66.717%0.17336%0.362CS..Hα-helixtrans-66.6-40.9-179.7-65.6-60.8000112.3Q184 G191 M192 F262 C265 Y266Q184-Y188 HydrophobicContact CB-CE2 4.29Å; Q184-Y188 WeakPolarHBondContact O-CD2 3.46Å; Q184-Y188 PolarHBondContact O-N 2.62Å; Q184-Y188 VanDerWaalsContact O-N 3.08Å; Y188-G191 PolarHBondContact O-N 3.36Å; Y188-M192 WeakPolarHBondContact O-CB 3.35Å; Y188-M192 WeakPolarHBondContact O-CE 3.39Å; Y188-M192 VanDerWaalsContact O-CG 3.24Å; Y188-M192 WeakPolarHBondContact O-CG 3.45Å; Y188-M192 PolarHBondContact O-N 3.1Å; Y188-F262 HydrophobicContact CD1-CD2 4.36Å; Y188-F262 HydrophobicContact CD1-CE2 4.06Å; Y188-F262 HydrophobicContact CG-CE2 4.11Å; Y188-C265 HydrophobicContact CD1-CB 4.11Å; Y188-Y266 HydrophobicContact CE1-CD2 4.49Å
189S93Very high91.5Very high59 Ų5965 Ų6541%0.41336%0.355SS..Hα-helixtrans-64.9-46.2179.1-178.80000112.5I185 M192 S193I185-S189 WeakPolarHBondContact O-CB 3.45Å; I185-S189 PolarHBondContact O-N 3.12Å; S189-M192 PolarHBondContact O-N 2.93Å; S189-S193 WeakPolarHBondContact O-CB 3.11Å; S189-S193 PolarHBondContact O-N 2.97Å; S189-S193 PolarHBondContact O-OG 3.49Å
190T92.5Very high91.3Very high53 Ų5361.4 Ų61.433%0.32534%0.336SS..Hα-helixtrans-67.4-42.6178-54.90000110.5F186 M192 S193 V194F186-T190 WeakPolarHBondContact CE2-OG1 3.38Å; F186-T190 WeakPolarHBondContact CZ-OG1 3.34Å; F186-T190 VanDerWaalsContact O-CB 3.23Å; F186-T190 WeakPolarHBondContact O-CB 3.2Å; F186-T190 PolarHBondContact O-N 2.81Å; F186-T190 PolarHBondContact O-OG1 2.89Å; T190-M192 PolarHBondContact O-N 3.5Å; T190-S193 PolarHBondContact O-N 2.9Å; T190-V194 HydrophobicContact CG2-CG2 4.28Å; T190-V194 WeakPolarHBondContact O-CB 3.43Å; T190-V194 VanDerWaalsContact O-CG2 3.3Å; T190-V194 WeakPolarHBondContact O-CG2 3.44Å; T190-V194 PolarHBondContact O-N 3.25Å
191G92.6Very high91.1Very high21 Ų2161.6 Ų61.622%0.21634%0.338CS..Hα-helixtrans-59.6-45.2175.900000112.9Y187 Y188 G195Y187-G191 PolarHBondContact O-N 2.96Å; Y188-G191 PolarHBondContact O-N 3.36Å; G191-G195 PolarHBondContact O-N 3.38Å
192M94.1Very high90.9Very high56 Ų5666 Ų6628%0.27636%0.36SS..Hα-helixtrans-61.6-45.1173.4-74.4-175.1-65.100112Y188 S189 T190 G195 I196 F262Y188-M192 WeakPolarHBondContact O-CB 3.35Å; Y188-M192 WeakPolarHBondContact O-CE 3.39Å; Y188-M192 VanDerWaalsContact O-CG 3.24Å; Y188-M192 WeakPolarHBondContact O-CG 3.45Å; Y188-M192 PolarHBondContact O-N 3.1Å; S189-M192 PolarHBondContact O-N 2.93Å; T190-M192 PolarHBondContact O-N 3.5Å; M192-G195 PolarHBondContact O-N 3.13Å; M192-I196 VanDerWaalsContact O-CG1 3.3Å; M192-I196 WeakPolarHBondContact O-CG1 3.24Å; M192-I196 PolarHBondContact O-N 3.38Å; M192-F262 HydrophobicContact CG-CB 3.99Å; M192-F262 HydrophobicContact CG-CD2 4.47Å; M192-F262 HydrophobicContact SD-CB 3.81Å; M192-F262 HydrophobicContact SD-CD2 3.92Å; M192-F262 HydrophobicContact SD-CG 4.27Å
193S92.8Very high90.7Very high63 Ų6360.7 Ų60.744%0.44134%0.344SS..Hα-helixtrans-63.3-45.7-179.3-58.40000111.9S189 T190 G195 I196 V197S189-S193 WeakPolarHBondContact O-CB 3.11Å; S189-S193 PolarHBondContact O-N 2.97Å; S189-S193 PolarHBondContact O-OG 3.49Å; T190-S193 PolarHBondContact O-N 2.9Å; S193-G195 VanDerWaalsContact C-N 3.34Å; S193-I196 PolarHBondContact O-N 2.92Å; S193-V197 WeakPolarHBondContact O-CG2 3.3Å; S193-V197 PolarHBondContact O-N 3.44Å; S193-V197 VanDerWaalsContact O-N 3.13Å
194V92.2Very high90.1Very high92 Ų9259.4 Ų59.456%0.55833%0.334SS*.Hα-helixtrans-63.5-41175172.70000110.6T190 V197 A198T190-V194 HydrophobicContact CG2-CG2 4.28Å; T190-V194 WeakPolarHBondContact O-CB 3.43Å; T190-V194 VanDerWaalsContact O-CG2 3.3Å; T190-V194 WeakPolarHBondContact O-CG2 3.44Å; T190-V194 PolarHBondContact O-N 3.25Å; V194-V197 PolarHBondContact O-N 3.49Å; V194-A198 WeakPolarHBondContact O-CB 3.46Å; V194-A198 PolarHBondContact O-N 2.92Å
195G93.7Very high89.5Confident18 Ų1859.9 Ų59.919%0.18633%0.334CS..Hα-helixtrans-61.6-42.1176.300000113.3G191 M192 S193 A198 S199G191-G195 PolarHBondContact O-N 3.38Å; M192-G195 PolarHBondContact O-N 3.13Å; S193-G195 VanDerWaalsContact C-N 3.34Å; G195-A198 PolarHBondContact O-N 3.24Å; G195-S199 WeakPolarHBondContact O-CB 3.44Å; G195-S199 PolarHBondContact O-N 2.96Å; G195-S199 PolarHBondContact O-OG 3.3Å
196I91.9Very high89Confident37 Ų3757.4 Ų57.419%0.1932%0.321CS..Hα-helixtrans-60.6-52.7175-68162.1000110.1M192 S193 A198 S199 L200 Y253 V254 V257M192-I196 VanDerWaalsContact O-CG1 3.3Å; M192-I196 WeakPolarHBondContact O-CG1 3.24Å; M192-I196 PolarHBondContact O-N 3.38Å; S193-I196 PolarHBondContact O-N 2.92Å; I196-A198 PolarHBondContact O-N 3.37Å; I196-S199 PolarHBondContact O-N 3.32Å; I196-S199 PolarHBondContact O-OG 2.82Å; I196-L200 PolarHBondContact O-N 3.48Å; I196-Y253 HydrophobicContact CG2-CE1 3.95Å; I196-Y253 PolarHBondContact O-OH 3.17Å; I196-V254 HydrophobicContact CD1-CG1 4.17Å; I196-V257 HydrophobicContact CB-CG1 4.46Å; I196-V257 HydrophobicContact CG1-CG1 4.01Å
197V89Confident88.3Confident82 Ų8260.4 Ų60.450%0.49734%0.339SS..Hα-helixtrans-62.5-42179.7177.50000111.9S193 V194 L200 L201S193-V197 WeakPolarHBondContact O-CG2 3.3Å; S193-V197 PolarHBondContact O-N 3.44Å; S193-V197 VanDerWaalsContact O-N 3.13Å; V194-V197 PolarHBondContact O-N 3.49Å; V197-L200 WeakPolarHBondContact O-CB 3.47Å; V197-L200 PolarHBondContact O-N 2.76Å; V197-L201 WeakPolarHBondContact O-CG 3.46Å; V197-L201 PolarHBondContact O-N 3.29Å; V197-L201 VanDerWaalsContact O-N 3.08Å
198A89.9Confident87.2Confident42 Ų4258 Ų5835%0.34733%0.33SS..Hα-helixtrans-65.1-42.1178.900000112.1V194 G195 I196 L200 L201 I202V194-A198 WeakPolarHBondContact O-CB 3.46Å; V194-A198 PolarHBondContact O-N 2.92Å; G195-A198 PolarHBondContact O-N 3.24Å; I196-A198 PolarHBondContact O-N 3.37Å; A198-L200 VanDerWaalsContact C-N 3.32Å; A198-L200 PolarHBondContact O-N 3.37Å; A198-L201 WeakPolarHBondContact O-CB 3.22Å; A198-L201 PolarHBondContact O-N 2.85Å; A198-I202 WeakPolarHBondContact O-CG1 3.49Å; A198-I202 PolarHBondContact O-N 2.9Å
199S91.6Very high86.3Confident23 Ų2364 Ų6416%0.16136%0.357CS..Hα-helixtrans-66.6-34.417675.40000112.2G195 I196 L201 I202 I203 Y253 V257G195-S199 WeakPolarHBondContact O-CB 3.44Å; G195-S199 PolarHBondContact O-N 2.96Å; G195-S199 PolarHBondContact O-OG 3.3Å; I196-S199 PolarHBondContact O-N 3.32Å; I196-S199 PolarHBondContact O-OG 2.82Å; S199-L201 VanDerWaalsContact C-N 3.31Å; S199-L201 PolarHBondContact O-N 2.86Å; S199-I202 PolarHBondContact O-N 3.45Å; S199-I203 WeakPolarHBondContact O-CG1 3.48Å; S199-I203 PolarHBondContact O-N 3.27Å; S199-Y253 PolarHBondContact OG-OH 3.04Å; S199-V257 WeakPolarHBondContact OG-CG1 3.38Å
200L86.9Confident85.2Confident52 Ų5269.2 Ų69.227%0.27237%0.373SS..Hα-helixtrans-61.3-44.3174.3-175.365.3000110I196 V197 A198 I202 I203 I204 Y253I196-L200 PolarHBondContact O-N 3.48Å; V197-L200 WeakPolarHBondContact O-CB 3.47Å; V197-L200 PolarHBondContact O-N 2.76Å; A198-L200 VanDerWaalsContact C-N 3.32Å; A198-L200 PolarHBondContact O-N 3.37Å; L200-I202 VanDerWaalsContact C-N 3.33Å; L200-I202 PolarHBondContact O-N 2.8Å; L200-I203 PolarHBondContact O-N 3.35Å; L200-I204 HydrophobicContact CD1-CD1 4.39Å; L200-I204 HydrophobicContact CG-CD1 3.94Å; L200-I204 VanDerWaalsContact O-CB 3.28Å; L200-I204 WeakPolarHBondContact O-CB 3.34Å; L200-I204 VanDerWaalsContact O-CG1 3.25Å; L200-I204 WeakPolarHBondContact O-CG1 3.25Å; L200-I204 PolarHBondContact O-N 3.02Å; L200-Y253 VanDerWaalsContact CA-OH 3.29Å; L200-Y253 WeakPolarHBondContact CA-OH 3.04Å; L200-Y253 WeakPolarHBondContact CB-OH 3.3Å; L200-Y253 PolarHBondContact N-OH 3.44Å
201L84.9Confident84Confident55 Ų5572.1 Ų72.129%0.28838%0.384SS..Hα-helixtrans-60.6-40.9174.3-73.7176.8000112.3V197 A198 S199 I204 F205 I232V197-L201 WeakPolarHBondContact O-CG 3.46Å; V197-L201 PolarHBondContact O-N 3.29Å; V197-L201 VanDerWaalsContact O-N 3.08Å; A198-L201 WeakPolarHBondContact O-CB 3.22Å; A198-L201 PolarHBondContact O-N 2.85Å; S199-L201 VanDerWaalsContact C-N 3.31Å; S199-L201 PolarHBondContact O-N 2.86Å; L201-I204 PolarHBondContact O-N 3.01Å; L201-F205 VanDerWaalsContact O-CB 3.32Å; L201-F205 WeakPolarHBondContact O-CB 3.27Å; L201-F205 PolarHBondContact O-N 3.35Å; L201-I232 HydrophobicContact CD2-CD1 3.55Å; L201-I232 HydrophobicContact CD2-CG1 3.95Å; L201-I232 HydrophobicContact CG-CD1 4.39Å
202I86.8Confident82.7Confident101 Ų10175.4 Ų75.452%0.51840%0.402SS..Hα-helixtrans-65.1-46.2176.5-66.6165.7000111A198 S199 L200 I204 F205 I206A198-I202 WeakPolarHBondContact O-CG1 3.49Å; A198-I202 PolarHBondContact O-N 2.9Å; S199-I202 PolarHBondContact O-N 3.45Å; L200-I202 VanDerWaalsContact C-N 3.33Å; L200-I202 PolarHBondContact O-N 2.8Å; I202-I204 VanDerWaalsContact C-N 3.33Å; I202-I204 PolarHBondContact O-N 3.47Å; I202-F205 WeakPolarHBondContact O-CB 3.1Å; I202-F205 PolarHBondContact O-N 3.47Å; I202-I206 HydrophobicContact CG2-CD1 3.89Å; I202-I206 HydrophobicContact CG2-CG1 4.46Å; I202-I206 WeakPolarHBondContact O-CG1 3.33Å; I202-I206 PolarHBondContact O-N 3.08Å
203I84.8Confident81.2Confident72 Ų7280.7 Ų80.737%0.36942%0.423SS..Hα-helixtrans-60.4-46.6177.8-70167000110.1S199 L200 F205 I206 L207 Y253S199-I203 WeakPolarHBondContact O-CG1 3.48Å; S199-I203 PolarHBondContact O-N 3.27Å; L200-I203 PolarHBondContact O-N 3.35Å; I203-F205 VanDerWaalsContact C-N 3.31Å; I203-F205 PolarHBondContact O-N 2.97Å; I203-I206 PolarHBondContact O-N 3.48Å; I203-L207 HydrophobicContact CG2-CD1 4Å; I203-L207 HydrophobicContact CG2-CG 4.37Å; I203-L207 WeakPolarHBondContact O-CG 3.42Å; I203-L207 PolarHBondContact O-N 3.3Å; I203-Y253 HydrophobicContact CD1-CD2 4.31Å; I203-Y253 HydrophobicContact CD1-CE2 3.57Å
204I78.9Confident79.8Confident15 Ų1587.6 Ų87.68%0.07745%0.445CS..Hα-helixtrans-56.4-46.7174.8-79.5169.1000110.9L200 L201 I202 I206 L207 S208 F227 L231L200-I204 HydrophobicContact CD1-CD1 4.39Å; L200-I204 HydrophobicContact CG-CD1 3.94Å; L200-I204 VanDerWaalsContact O-CB 3.28Å; L200-I204 WeakPolarHBondContact O-CB 3.34Å; L200-I204 VanDerWaalsContact O-CG1 3.25Å; L200-I204 WeakPolarHBondContact O-CG1 3.25Å; L200-I204 PolarHBondContact O-N 3.02Å; L201-I204 PolarHBondContact O-N 3.01Å; I202-I204 VanDerWaalsContact C-N 3.33Å; I202-I204 PolarHBondContact O-N 3.47Å; I204-I206 VanDerWaalsContact C-N 3.34Å; I204-I206 PolarHBondContact O-N 3.34Å; I204-L207 PolarHBondContact O-N 3.42Å; I204-S208 WeakPolarHBondContact O-CB 3.33Å; I204-S208 PolarHBondContact O-N 2.91Å; I204-F227 HydrophobicContact CG2-CE1 4.49Å; I204-L231 HydrophobicContact CB-CD1 4.37Å; I204-L231 HydrophobicContact CD1-CB 4.18Å; I204-L231 HydrophobicContact CG2-CB 4.03Å; I204-L231 HydrophobicContact CG2-CD1 3.17Å; I204-L231 HydrophobicContact CG2-CG 4.25Å
205F77.9Confident78.5Confident136 Ų13685.1 Ų85.160%0.59643%0.432SS*.Hα-helixtrans-62.2-41.3177.4179-99.3000111.8L201 I202 I203 S208 K209L201-F205 VanDerWaalsContact O-CB 3.32Å; L201-F205 WeakPolarHBondContact O-CB 3.27Å; L201-F205 PolarHBondContact O-N 3.35Å; I202-F205 WeakPolarHBondContact O-CB 3.1Å; I202-F205 PolarHBondContact O-N 3.47Å; I203-F205 VanDerWaalsContact C-N 3.31Å; I203-F205 PolarHBondContact O-N 2.97Å; F205-S208 PolarHBondContact O-N 2.87Å; F205-S208 PolarHBondContact O-OG 3.49Å; F205-K209 PolarHBondContact O-N 2.87Å
206I81.2Confident76.9Confident86 Ų8689.3 Ų89.344%0.44146%0.456SS..Hα-helixtrans-64.6-47.5176.3-69.6169000110.9I202 I203 I204 S208 K209 F210I202-I206 HydrophobicContact CG2-CD1 3.89Å; I202-I206 HydrophobicContact CG2-CG1 4.46Å; I202-I206 WeakPolarHBondContact O-CG1 3.33Å; I202-I206 PolarHBondContact O-N 3.08Å; I203-I206 PolarHBondContact O-N 3.48Å; I204-I206 VanDerWaalsContact C-N 3.34Å; I204-I206 PolarHBondContact O-N 3.34Å; I206-S208 PolarHBondContact O-N 2.88Å; I206-K209 WeakPolarHBondContact O-CB 3.28Å; I206-K209 PolarHBondContact O-N 3.19Å; I206-F210 HydrophobicContact CG2-CD2 4.23Å; I206-F210 HydrophobicContact CG2-CE2 3.62Å; I206-F210 WeakPolarHBondContact O-CD2 3.31Å
207L75.5Confident75.5Confident104 Ų10492.1 Ų92.155%0.54547%0.47SS..Hα-helixtrans-58.6-37.6176.9-71.4174.4000112I203 I204 K209 F210I203-L207 HydrophobicContact CG2-CD1 4Å; I203-L207 HydrophobicContact CG2-CG 4.37Å; I203-L207 WeakPolarHBondContact O-CG 3.42Å; I203-L207 PolarHBondContact O-N 3.3Å; I204-L207 PolarHBondContact O-N 3.42Å; L207-K209 VanDerWaalsContact C-N 3.26Å; L207-K209 PolarHBondContact O-N 3.42Å; L207-F210 PolarHBondContact O-N 3.18Å; L207-F210 VanDerWaalsContact O-N 3.16Å
208S68.6Low74.4Confident7 Ų792.7 Ų92.75%0.04946%0.464CS..Hα-helixtrans-63.7-31.9177.281.80000113.1I204 F205 I206 F210 M211 L221I204-S208 WeakPolarHBondContact O-CB 3.33Å; I204-S208 PolarHBondContact O-N 2.91Å; F205-S208 PolarHBondContact O-N 2.87Å; F205-S208 PolarHBondContact O-OG 3.49Å; I206-S208 PolarHBondContact O-N 2.88Å; S208-F210 PolarHBondContact O-N 3.19Å; S208-M211 WeakPolarHBondContact O-CB 3.45Å; S208-M211 PolarHBondContact O-N 3.46Å; S208-L221 VanDerWaalsContact O-CD2 3.27Å; S208-L221 WeakPolarHBondContact O-CD2 3.34Å; S208-L221 VanDerWaalsContact OG-CD1 3.3Å; S208-L221 WeakPolarHBondContact OG-CD1 3.32Å
209K73.4Confident73.2Confident171 Ų17196 Ų9674%0.74348%0.48SS*.Hα-helixtrans-68.7-22.9177.3-170.9174.31781760112.7F205 I206 L207 M211F205-K209 PolarHBondContact O-N 2.87Å; I206-K209 WeakPolarHBondContact O-CB 3.28Å; I206-K209 PolarHBondContact O-N 3.19Å; L207-K209 VanDerWaalsContact C-N 3.26Å; L207-K209 PolarHBondContact O-N 3.42Å; K209-M211 VanDerWaalsContact C-N 3.34Å
210F70.6Confident72Confident167 Ų16799.9 Ų99.973%0.73250%0.498SS*.THydrogen-bonded Turntrans-85.7-4.8176.3-67.8-71.5000113.6I206 L207 S208I206-F210 HydrophobicContact CG2-CD2 4.23Å; I206-F210 HydrophobicContact CG2-CE2 3.62Å; I206-F210 WeakPolarHBondContact O-CD2 3.31Å; L207-F210 PolarHBondContact O-N 3.18Å; L207-F210 VanDerWaalsContact O-N 3.16Å; S208-F210 PolarHBondContact O-N 3.19Å
211M66.4Low70.8Confident115 Ų11598.9 Ų98.957%0.56749%0.492SS*.SBendtrans-73.6140.8178.2-71.6-70.8175.200111.7S208 K209 K213S208-M211 WeakPolarHBondContact O-CB 3.45Å; S208-M211 PolarHBondContact O-N 3.46Å; K209-M211 VanDerWaalsContact C-N 3.34Å; M211-K213 PolarHBondContact O-N 2.86Å
212P65.4Low69.9Low90 Ų90101.5 Ų101.558%0.58451%0.51SS*.  trans-63.2124.6-175.723.1-31.9000111.5K214 S215P212-K214 PolarHBondContact O-N 2.58Å; P212-S215 PolarHBondContact O-N 2.92Å
213K63.1Low68.7Low166 Ų16699 Ų9972%0.72251%0.51SS*.THydrogen-bonded Turntrans-56.4-8.8-176.4-64-176.8177.5-179.70115.8M211 Y218M211-K213 PolarHBondContact O-N 2.86Å; K213-Y218 HydrophobicContact CG-CD2 4.36Å; K213-Y218 HydrophobicContact CG-CE2 4.01Å
214K62.6Low68.1Low209 Ų20997.5 Ų97.591%0.90951%0.512SS*.THydrogen-bonded Turntrans-93.9-6.3-176.2-62.2-166177.6-175.10114.4P212P212-K214 PolarHBondContact O-N 2.58Å
215S64.8Low67.8Low40 Ų40107.7 Ų107.728%0.2855%0.55SS..SBendtrans-84.5141.8178.8178.40000111.2P212 I217 Y218P212-S215 PolarHBondContact O-N 2.92Å; S215-I217 PolarHBondContact O-N 3.27Å; S215-I217 WeakPolarHBondContact OG-CG1 3.39Å; S215-I217 PolarHBondContact OG-N 3.4Å; S215-Y218 WeakPolarHBondContact O-CB 3.46Å; S215-Y218 PolarHBondContact O-N 3.32Å
216P61Low67.6Low105 Ų105105.3 Ų105.368%0.68255%0.549SS*.THydrogen-bonded Turntrans-55.7-17.9172.223.1-34000113.3Y218 V219P216-Y218 VanDerWaalsContact C-N 3.27Å; P216-Y218 PolarHBondContact O-N 3.36Å; P216-V219 PolarHBondContact O-N 3.47Å
217I62.6Low67.2Low96 Ų96102.3 Ų102.349%0.49253%0.533SS..Hα-helixtrans-64.4-28.8173.4-58.5170.8000111.9S215 V219 I220 L221 F227S215-I217 PolarHBondContact O-N 3.27Å; S215-I217 WeakPolarHBondContact OG-CG1 3.39Å; S215-I217 PolarHBondContact OG-N 3.4Å; I217-V219 VanDerWaalsContact C-N 3.3Å; I217-V219 PolarHBondContact O-N 2.93Å; I217-I220 PolarHBondContact O-N 2.98Å; I217-L221 WeakPolarHBondContact O-CB 3.3Å; I217-L221 PolarHBondContact O-N 3.37Å; I217-F227 HydrophobicContact CG2-CE2 4.48Å
218Y65.8Low67.2Low94 Ų9499 Ų9937%0.36952%0.519SS..Hα-helixtrans-66.1-30.6177.5-176.2-94.9000112.5K213 S215 P216 L221 V222K213-Y218 HydrophobicContact CG-CD2 4.36Å; K213-Y218 HydrophobicContact CG-CE2 4.01Å; S215-Y218 WeakPolarHBondContact O-CB 3.46Å; S215-Y218 PolarHBondContact O-N 3.32Å; P216-Y218 VanDerWaalsContact C-N 3.27Å; P216-Y218 PolarHBondContact O-N 3.36Å; Y218-L221 HydrophobicContact CD2-CD2 4.27Å; Y218-L221 WeakPolarHBondContact O-CB 3.14Å; Y218-L221 PolarHBondContact O-N 3.04Å; Y218-V222 HydrophobicContact CE1-CG2 4.25Å; Y218-V222 PolarHBondContact O-N 3.34Å
219V64.4Low67.5Low112 Ų112101.8 Ų101.868%0.67953%0.533SS*.Hα-helixtrans-70.7-38.6175.6-179.90000110.8P216 I217 L221 V222P216-V219 PolarHBondContact O-N 3.47Å; I217-V219 VanDerWaalsContact C-N 3.3Å; I217-V219 PolarHBondContact O-N 2.93Å; V219-L221 VanDerWaalsContact C-N 3.29Å; V219-V222 PolarHBondContact O-N 3.27Å
220I66.3Low67.5Low105 Ų105100.1 Ų100.154%0.53852%0.523SS..Hα-helixtrans-67.1-34173.3-61172.4000110.6I217 V222 G223 F227I217-I220 PolarHBondContact O-N 2.98Å; I220-V222 PolarHBondContact O-N 3.18Å; I220-G223 WeakPolarHBondContact O-CA 3.32Å; I220-G223 PolarHBondContact O-N 3.4Å; I220-F227 HydrophobicContact CG2-CD2 4.29Å
221L62.2Low67.7Low31 Ų3193.7 Ų93.716%0.16250%0.496CS..Hα-helixtrans-65.1-36.1178.5179.961.6000113.4S208 I217 Y218 V219 G223 F227S208-L221 VanDerWaalsContact O-CD2 3.27Å; S208-L221 WeakPolarHBondContact O-CD2 3.34Å; S208-L221 VanDerWaalsContact OG-CD1 3.3Å; S208-L221 WeakPolarHBondContact OG-CD1 3.32Å; I217-L221 WeakPolarHBondContact O-CB 3.3Å; I217-L221 PolarHBondContact O-N 3.37Å; Y218-L221 HydrophobicContact CD2-CD2 4.27Å; Y218-L221 WeakPolarHBondContact O-CB 3.14Å; Y218-L221 PolarHBondContact O-N 3.04Å; V219-L221 VanDerWaalsContact C-N 3.29Å; L221-G223 PolarHBondContact O-N 3.3Å; L221-F227 HydrophobicContact CD1-CD1 3.38Å; L221-F227 HydrophobicContact CD1-CD2 4.21Å; L221-F227 HydrophobicContact CD1-CE1 3.23Å; L221-F227 HydrophobicContact CD1-CE2 4.1Å; L221-F227 HydrophobicContact CD1-CG 3.87Å; L221-F227 HydrophobicContact CD1-CZ 3.61Å
222V65Low68.1Low109 Ų10989.8 Ų89.866%0.66148%0.477SS*.Hα-helixtrans-69.6-17.9172.7176.60000111.4Y218 V219 I220 G224Y218-V222 HydrophobicContact CE1-CG2 4.25Å; Y218-V222 PolarHBondContact O-N 3.34Å; V219-V222 PolarHBondContact O-N 3.27Å; I220-V222 PolarHBondContact O-N 3.18Å; V222-G224 PolarHBondContact O-N 3.35Å; V222-G224 VanDerWaalsContact O-N 3.1Å
223G63.3Low68.6Low49 Ų4988.3 Ų88.351%0.50546%0.463SS..THydrogen-bonded Turntrans-72.19.6-177.700000117.2I220 L221I220-G223 WeakPolarHBondContact O-CA 3.32Å; I220-G223 PolarHBondContact O-N 3.4Å; L221-G223 PolarHBondContact O-N 3.3Å
224G71.9Confident69.1Low40 Ų4083.8 Ų83.841%0.41245%0.446SS..THydrogen-bonded Turntrans72.5-139.116900000115.5V222 S226 F227V222-G224 PolarHBondContact O-N 3.35Å; V222-G224 VanDerWaalsContact O-N 3.1Å; G224-S226 PolarHBondContact O-N 2.9Å; G224-F227 PolarHBondContact O-N 3.23Å
225W71.6Confident69.7Low230 Ų23075.9 Ų75.987%0.87142%0.415SS*.Hα-helixtrans-54.4-30.3-166.7-71.719000113.8F227 S228 L229W225-F227 VanDerWaalsContact C-N 3.3Å; W225-F227 PolarHBondContact O-N 2.85Å; W225-S228 PolarHBondContact O-N 3.27Å; W225-L229 WeakPolarHBondContact O-CB 3.27Å; W225-L229 WeakPolarHBondContact O-CG 3.4Å; W225-L229 PolarHBondContact O-N 3.32Å
226S73.3Confident70.1Confident85 Ų8579.2 Ų79.259%0.59443%0.425SS*.Hα-helixtrans-60-34.5178.3-55.40000113.8G224 Y230G224-S226 PolarHBondContact O-N 2.9Å; S226-Y230 WeakPolarHBondContact O-CB 3.35Å; S226-Y230 PolarHBondContact O-N 2.82Å
227F74.2Confident70.6Confident23 Ų2381.2 Ų81.210%0.10142%0.423CS..Hα-helixtrans-73.7-41.8178178.6-99000112.1I204 I217 I220 L221 G224 W225 L229 Y230 L231I204-F227 HydrophobicContact CG2-CE1 4.49Å; I217-F227 HydrophobicContact CG2-CE2 4.48Å; I220-F227 HydrophobicContact CG2-CD2 4.29Å; L221-F227 HydrophobicContact CD1-CD1 3.38Å; L221-F227 HydrophobicContact CD1-CD2 4.21Å; L221-F227 HydrophobicContact CD1-CE1 3.23Å; L221-F227 HydrophobicContact CD1-CE2 4.1Å; L221-F227 HydrophobicContact CD1-CG 3.87Å; L221-F227 HydrophobicContact CD1-CZ 3.61Å; G224-F227 PolarHBondContact O-N 3.23Å; W225-F227 VanDerWaalsContact C-N 3.3Å; W225-F227 PolarHBondContact O-N 2.85Å; F227-L229 VanDerWaalsContact C-N 3.28Å; F227-L229 PolarHBondContact O-N 2.97Å; F227-Y230 PolarHBondContact O-N 3.46Å; F227-L231 HydrophobicContact CD1-CD1 4.02Å; F227-L231 HydrophobicContact CE1-CD1 3.22Å; F227-L231 HydrophobicContact CE1-CG 4.07Å; F227-L231 HydrophobicContact CE2-CD1 4.12Å; F227-L231 HydrophobicContact CE2-CG 4.3Å; F227-L231 HydrophobicContact CZ-CD1 3.3Å; F227-L231 HydrophobicContact CZ-CG 3.96Å; F227-L231 PolarHBondContact O-N 3.39Å
228S75.6Confident71.3Confident36 Ų3680 Ų8025%0.25242%0.417SS..Hα-helixtrans-59.7-43.9175-65.90000110.5W225 L231 I232W225-S228 PolarHBondContact O-N 3.27Å; S228-L231 PolarHBondContact O-N 3.3Å; S228-I232 WeakPolarHBondContact O-CB 3.41Å; S228-I232 WeakPolarHBondContact O-CD1 3.45Å; S228-I232 VanDerWaalsContact O-CG1 3.22Å; S228-I232 WeakPolarHBondContact O-CG1 3.38Å; S228-I232 PolarHBondContact O-N 3.47Å
229L73.9Confident71.8Confident65 Ų6578.4 Ų78.434%0.3442%0.415SS..Hα-helixtrans-61-44.7174.3-80.5-175.1000113.2F115 W225 F227 L231 I232 Q233F115-L229 HydrophobicContact CE1-CD1 4.04Å; F115-L229 HydrophobicContact CE1-CD2 3.8Å; F115-L229 HydrophobicContact CE1-CG 4.34Å; F115-L229 HydrophobicContact CE2-CB 4.44Å; F115-L229 HydrophobicContact CE2-CD1 4.29Å; F115-L229 HydrophobicContact CZ-CB 3.73Å; F115-L229 HydrophobicContact CZ-CD1 3.61Å; F115-L229 HydrophobicContact CZ-CD2 3.75Å; F115-L229 HydrophobicContact CZ-CG 3.86Å; W225-L229 WeakPolarHBondContact O-CB 3.27Å; W225-L229 WeakPolarHBondContact O-CG 3.4Å; W225-L229 PolarHBondContact O-N 3.32Å; F227-L229 VanDerWaalsContact C-N 3.28Å; F227-L229 PolarHBondContact O-N 2.97Å; L229-L231 PolarHBondContact O-N 3.02Å; L229-I232 PolarHBondContact O-N 3.47Å; L229-Q233 WeakPolarHBondContact O-CB 3.15Å; L229-Q233 PolarHBondContact O-N 3.4Å
230Y74.4Confident72.3Confident135 Ų13580 Ų8053%0.52942%0.415SS..Hα-helixtrans-61.8-41.1175.5174-100.2000112.7S226 F227 Q233 L234S226-Y230 WeakPolarHBondContact O-CB 3.35Å; S226-Y230 PolarHBondContact O-N 2.82Å; F227-Y230 PolarHBondContact O-N 3.46Å; Y230-Q233 VanDerWaalsContact O-CB 3.28Å; Y230-Q233 WeakPolarHBondContact O-CB 3.4Å; Y230-Q233 PolarHBondContact O-N 3.47Å; Y230-L234 PolarHBondContact O-N 2.96Å
231L73.7Confident72.9Confident33 Ų3379.4 Ų79.417%0.17341%0.41CS..Hα-helixtrans-74-36.4178.7-72.8-175.9000112.9I204 F227 S228 L229 Q233 L234 V235I204-L231 HydrophobicContact CB-CD1 4.37Å; I204-L231 HydrophobicContact CD1-CB 4.18Å; I204-L231 HydrophobicContact CG2-CB 4.03Å; I204-L231 HydrophobicContact CG2-CD1 3.17Å; I204-L231 HydrophobicContact CG2-CG 4.25Å; F227-L231 HydrophobicContact CD1-CD1 4.02Å; F227-L231 HydrophobicContact CE1-CD1 3.22Å; F227-L231 HydrophobicContact CE1-CG 4.07Å; F227-L231 HydrophobicContact CE2-CD1 4.12Å; F227-L231 HydrophobicContact CE2-CG 4.3Å; F227-L231 HydrophobicContact CZ-CD1 3.3Å; F227-L231 HydrophobicContact CZ-CG 3.96Å; F227-L231 PolarHBondContact O-N 3.39Å; S228-L231 PolarHBondContact O-N 3.3Å; L229-L231 PolarHBondContact O-N 3.02Å; L231-Q233 PolarHBondContact O-N 2.85Å; L231-L234 HydrophobicContact CD2-CD2 3.91Å; L231-L234 WeakPolarHBondContact O-CB 3.38Å; L231-L234 PolarHBondContact O-N 3.34Å; L231-L234 VanDerWaalsContact O-N 3.16Å; L231-V235 WeakPolarHBondContact O-CG2 3.35Å; L231-V235 PolarHBondContact O-N 3.05Å
232I75.3Confident73.9Confident33 Ų3380.2 Ų80.217%0.16941%0.414CS..Hα-helixtrans-56.5-43.9167.6-69.5163.1000109.1F119 L201 S228 L229 L234 V235 F236F119-I232 HydrophobicContact CE1-CB 4.38Å; F119-I232 HydrophobicContact CE1-CG2 3.97Å; L201-I232 HydrophobicContact CD2-CD1 3.55Å; L201-I232 HydrophobicContact CD2-CG1 3.95Å; L201-I232 HydrophobicContact CG-CD1 4.39Å; S228-I232 WeakPolarHBondContact O-CB 3.41Å; S228-I232 WeakPolarHBondContact O-CD1 3.45Å; S228-I232 VanDerWaalsContact O-CG1 3.22Å; S228-I232 WeakPolarHBondContact O-CG1 3.38Å; S228-I232 PolarHBondContact O-N 3.47Å; L229-I232 PolarHBondContact O-N 3.47Å; I232-L234 VanDerWaalsContact C-N 3.29Å; I232-L234 PolarHBondContact O-N 3.29Å; I232-V235 PolarHBondContact O-N 3.47Å; I232-F236 HydrophobicContact CG2-CD2 3.47Å; I232-F236 VanDerWaalsContact CG2-CD2 3.47Å; I232-F236 HydrophobicContact CG2-CE2 3.43Å; I232-F236 VanDerWaalsContact CG2-CE2 3.43Å; I232-F236 VanDerWaalsContact O-CD2 3.24Å; I232-F236 WeakPolarHBondContact O-CD2 3.44Å; I232-F236 PolarHBondContact O-N 3.01Å
233Q75Confident74.6Confident59 Ų5983.2 Ų83.228%0.27641%0.413SS..Hα-helixtrans-61.1-41.1177.8-162.8179.45.600111.8S118 F119 L229 Y230 L231 F236 K237S118-Q233 PolarHBondContact OG-NE2 2.82Å; F119-Q233 VanDerWaalsContact CD1-CA 3.47Å; F119-Q233 HydrophobicContact CD1-CB 3.78Å; F119-Q233 HydrophobicContact CD1-CG 3.77Å; F119-Q233 HydrophobicContact CD2-CG 4.32Å; F119-Q233 HydrophobicContact CE1-CB 3.27Å; F119-Q233 HydrophobicContact CE1-CG 3.7Å; F119-Q233 VanDerWaalsContact CE1-N 3.26Å; F119-Q233 HydrophobicContact CE2-CB 4.38Å; F119-Q233 HydrophobicContact CE2-CG 4.19Å; F119-Q233 HydrophobicContact CG-CG 4.08Å; F119-Q233 HydrophobicContact CZ-CB 3.57Å; F119-Q233 HydrophobicContact CZ-CG 3.87Å; L229-Q233 WeakPolarHBondContact O-CB 3.15Å; L229-Q233 PolarHBondContact O-N 3.4Å; Y230-Q233 VanDerWaalsContact O-CB 3.28Å; Y230-Q233 WeakPolarHBondContact O-CB 3.4Å; Y230-Q233 PolarHBondContact O-N 3.47Å; L231-Q233 PolarHBondContact O-N 2.85Å; Q233-F236 PolarHBondContact O-N 3.15Å; Q233-K237 WeakPolarHBondContact O-CB 3.39Å; Q233-K237 PolarHBondContact O-N 3.26Å
234L73.7Confident75.5Confident71 Ų7189.6 Ų89.637%0.37242%0.422SS..Hα-helixtrans-64.1-41.3176.6-173.967.1000112.2Y230 L231 I232 N238Y230-L234 PolarHBondContact O-N 2.96Å; L231-L234 HydrophobicContact CD2-CD2 3.91Å; L231-L234 WeakPolarHBondContact O-CB 3.38Å; L231-L234 PolarHBondContact O-N 3.34Å; L231-L234 VanDerWaalsContact O-N 3.16Å; I232-L234 VanDerWaalsContact C-N 3.29Å; I232-L234 PolarHBondContact O-N 3.29Å; L234-N238 WeakPolarHBondContact CD1-ND2 3.33Å; L234-N238 PolarHBondContact O-N 3.48Å; L234-N238 PolarHBondContact O-ND2 2.81Å
235V76.5Confident76.3Confident43 Ų4390.9 Ų90.926%0.26142%0.424SS..Hα-helixtrans-65-48.6176.7172.70000110.4L231 I232 K237 N238 L239 I242L231-V235 WeakPolarHBondContact O-CG2 3.35Å; L231-V235 PolarHBondContact O-N 3.05Å; I232-V235 PolarHBondContact O-N 3.47Å; V235-K237 PolarHBondContact O-N 2.96Å; V235-N238 CarbonylContact O-C 3.54Å; V235-N238 PolarHBondContact O-N 2.9Å; V235-L239 WeakPolarHBondContact O-CA 3.37Å; V235-L239 PolarHBondContact O-N 2.8Å; V235-I242 HydrophobicContact CG1-CD1 4.36Å
236F72.8Confident77Confident110 Ų11086.4 Ų86.448%0.48241%0.408SS..Hα-helixtrans-62-41.5178-83-73.5000112.4F119 I232 Q233 N238 L239F119-F236 HydrophobicContact CD1-CB 4.42Å; F119-F236 HydrophobicContact CD1-CD2 4.17Å; I232-F236 HydrophobicContact CG2-CD2 3.47Å; I232-F236 VanDerWaalsContact CG2-CD2 3.47Å; I232-F236 HydrophobicContact CG2-CE2 3.43Å; I232-F236 VanDerWaalsContact CG2-CE2 3.43Å; I232-F236 VanDerWaalsContact O-CD2 3.24Å; I232-F236 WeakPolarHBondContact O-CD2 3.44Å; I232-F236 PolarHBondContact O-N 3.01Å; Q233-F236 PolarHBondContact O-N 3.15Å; F236-N238 VanDerWaalsContact C-N 3.26Å; F236-N238 PolarHBondContact O-N 3.35Å; F236-L239 HydrophobicContact CD1-CD2 4.28Å; F236-L239 VanDerWaalsContact O-CB 3.24Å; F236-L239 WeakPolarHBondContact O-CB 3.43Å; F236-L239 PolarHBondContact O-N 2.85Å
237K71.1Confident77.7Confident146 Ų14689 Ų8964%0.63541%0.405SS*.Hα-helixtrans-63.2-30.9178.1-177.8178.2175.6-179.70113.4Q233 V235Q233-K237 WeakPolarHBondContact O-CB 3.39Å; Q233-K237 PolarHBondContact O-N 3.26Å; V235-K237 PolarHBondContact O-N 2.96Å
238N77.1Confident78.5Confident71 Ų7194 Ų9438%0.3843%0.429SS..THydrogen-bonded Turntrans-103.611178.8-62-67.2000112.2L234 V235 F236 Q240 E241 I242L234-N238 WeakPolarHBondContact CD1-ND2 3.33Å; L234-N238 PolarHBondContact O-N 3.48Å; L234-N238 PolarHBondContact O-ND2 2.81Å; V235-N238 CarbonylContact O-C 3.54Å; V235-N238 PolarHBondContact O-N 2.9Å; F236-N238 VanDerWaalsContact C-N 3.26Å; F236-N238 PolarHBondContact O-N 3.35Å; N238-Q240 VanDerWaalsContact C-N 3.28Å; N238-Q240 PolarHBondContact O-N 3.31Å; N238-E241 PolarHBondContact O-N 3.48Å; N238-E241 VanDerWaalsContact O-N 3.09Å; N238-I242 HydrophobicContact CB-CD1 4.32Å; N238-I242 VanDerWaalsContact O-CG1 3.29Å; N238-I242 WeakPolarHBondContact O-CG1 3.33Å; N238-I242 PolarHBondContact O-N 3.06Å
239L76.8Confident79.1Confident61 Ų61100.5 Ų100.532%0.31945%0.448SS..Hα-helixtrans-62.2-37.9-172.5-171.467.1000111.6V235 F236 E241 I242 W243V235-L239 WeakPolarHBondContact O-CA 3.37Å; V235-L239 PolarHBondContact O-N 2.8Å; F236-L239 HydrophobicContact CD1-CD2 4.28Å; F236-L239 VanDerWaalsContact O-CB 3.24Å; F236-L239 WeakPolarHBondContact O-CB 3.43Å; F236-L239 PolarHBondContact O-N 2.85Å; L239-E241 VanDerWaalsContact C-N 3.32Å; L239-E241 PolarHBondContact O-N 3.02Å; L239-I242 PolarHBondContact O-N 2.92Å; L239-W243 WeakPolarHBondContact O-CB 3.49Å; L239-W243 PolarHBondContact O-N 3.25Å
240Q75.6Confident79.8Confident144 Ų14499.4 Ų99.467%0.67344%0.443SS*.Hα-helixtrans-61.9-40.1176.8-169.4178.74.600112.1N238 R244N238-Q240 VanDerWaalsContact C-N 3.28Å; N238-Q240 PolarHBondContact O-N 3.31Å; Q240-R244 WeakPolarHBondContact O-CB 3.47Å; Q240-R244 PolarHBondContact O-N 2.93Å; Q240-R244 VanDerWaalsContact O-N 3.11Å
241E79.1Confident80.6Confident94 Ų9496.7 Ų96.744%0.43944%0.437SS..Hα-helixtrans-71.5-41.1177.2-165.862.4-141.400111.1N238 L239 W243 R244 C245N238-E241 PolarHBondContact O-N 3.48Å; N238-E241 VanDerWaalsContact O-N 3.09Å; L239-E241 VanDerWaalsContact C-N 3.32Å; L239-E241 PolarHBondContact O-N 3.02Å; E241-W243 VanDerWaalsContact C-N 3.34Å; E241-W243 PolarHBondContact O-N 3.43Å; E241-R244 PolarHBondContact O-N 3.18Å; E241-R244 IonicContact OE1-NH2 3.93Å; E241-C245 WeakPolarHBondContact O-CB 3.47Å; E241-C245 PolarHBondContact O-N 3.41Å; E241-C245 PolarHBondContact OE1-SG 3.04Å
242I81.6Confident81.5Confident47 Ų4798.3 Ų98.324%0.24145%0.451CS..Hα-helixtrans-60.6-44.9175.4-65.9165.1000110.3V235 N238 L239 R244 Y246 W247 L250V235-I242 HydrophobicContact CG1-CD1 4.36Å; N238-I242 HydrophobicContact CB-CD1 4.32Å; N238-I242 VanDerWaalsContact O-CG1 3.29Å; N238-I242 WeakPolarHBondContact O-CG1 3.33Å; N238-I242 PolarHBondContact O-N 3.06Å; L239-I242 PolarHBondContact O-N 2.92Å; I242-R244 VanDerWaalsContact C-N 3.32Å; I242-R244 PolarHBondContact O-N 3.38Å; I242-Y246 CarbonylContact O-C 3.29Å; I242-Y246 VanDerWaalsContact O-C 3.29Å; I242-Y246 VanDerWaalsContact O-CA 3.28Å; I242-Y246 WeakPolarHBondContact O-CA 3.46Å; I242-Y246 WeakPolarHBondContact O-CB 3.29Å; I242-Y246 PolarHBondContact O-N 3.45Å; I242-W247 PolarHBondContact O-N 3.44Å; I242-L250 HydrophobicContact CG2-CD2 4.48Å
243W80.8Confident82.3Confident172 Ų17299 Ų9965%0.65245%0.452SS*.Hα-helixtrans-66.7-33.4179.7-161.6-72.7000112.2L239 E241 W247 L250L239-W243 WeakPolarHBondContact O-CB 3.49Å; L239-W243 PolarHBondContact O-N 3.25Å; E241-W243 VanDerWaalsContact C-N 3.34Å; E241-W243 PolarHBondContact O-N 3.43Å; W243-W247 WeakPolarHBondContact O-CB 3.37Å; W243-L250 HydrophobicContact CD2-CD2 4.34Å; W243-L250 HydrophobicContact CE3-CD2 3.64Å; W243-L250 HydrophobicContact CZ3-CD2 3.97Å
244R82.3Confident83.1Confident184 Ų18498.9 Ų98.969%0.69446%0.455SS*.Hα-helixtrans-81.3-43.2-179.1-164175.571.9155.51.3112.8Q240 E241 I242Q240-R244 WeakPolarHBondContact O-CB 3.47Å; Q240-R244 PolarHBondContact O-N 2.93Å; Q240-R244 VanDerWaalsContact O-N 3.11Å; E241-R244 PolarHBondContact O-N 3.18Å; E241-R244 IonicContact OE1-NH2 3.93Å; I242-R244 VanDerWaalsContact C-N 3.32Å; I242-R244 PolarHBondContact O-N 3.38Å
245C88Confident84.1Confident66 Ų66100.7 Ų100.745%0.44647%0.465SS..Hα-helixtrans-98.4-24.7-171.1-67.70000113.7E241E241-C245 WeakPolarHBondContact O-CB 3.47Å; E241-C245 PolarHBondContact O-N 3.41Å; E241-C245 PolarHBondContact OE1-SG 3.04Å
246Y86.8Confident85Confident136 Ų136102.3 Ų102.353%0.53348%0.475SS..SBendtrans-127.824.3-172.6-59.8-83.7000113.7I242 Q248 Y249 L250I242-Y246 CarbonylContact O-C 3.29Å; I242-Y246 VanDerWaalsContact O-C 3.29Å; I242-Y246 VanDerWaalsContact O-CA 3.28Å; I242-Y246 WeakPolarHBondContact O-CA 3.46Å; I242-Y246 WeakPolarHBondContact O-CB 3.29Å; I242-Y246 PolarHBondContact O-N 3.45Å; Y246-Q248 VanDerWaalsContact C-N 3.25Å; Y246-Q248 PolarHBondContact O-N 2.9Å; Y246-Q248 VanDerWaalsContact O-N 3.15Å; Y246-Y249 HydrophobicContact CD1-CD2 4.04Å; Y246-Y249 HydrophobicContact CD1-CE2 4.37Å; Y246-Y249 PolarHBondContact O-N 2.83Å; Y246-Y249 VanDerWaalsContact O-N 3.09Å; Y246-L250 PolarHBondContact O-N 3.23Å; Y246-L250 VanDerWaalsContact O-N 3.07Å
247W87.3Confident86.1Confident140 Ų14098.2 Ų98.253%0.5346%0.459SS..Hα-helixtrans-55-36.5-174.290.2-90.3000113.9I242 W243 L250 L251I242-W247 PolarHBondContact O-N 3.44Å; W243-W247 WeakPolarHBondContact O-CB 3.37Å; W247-L250 PolarHBondContact O-N 3.08Å; W247-L251 HydrophobicContact CE3-CB 4.46Å; W247-L251 HydrophobicContact CE3-CD2 4.39Å; W247-L251 HydrophobicContact CH2-CD2 4.33Å; W247-L251 HydrophobicContact CZ3-CD2 3.69Å; W247-L251 WeakPolarHBondContact O-CB 3.19Å; W247-L251 PolarHBondContact O-N 3.49Å
248Q92Very high87.2Confident129 Ų12991.8 Ų91.860%0.60343%0.434SS*.Hα-helixtrans-66.5-41.6179.5-65.4178.6-21.500112.2Y246 L251 S252Y246-Q248 VanDerWaalsContact C-N 3.25Å; Y246-Q248 PolarHBondContact O-N 2.9Å; Y246-Q248 VanDerWaalsContact O-N 3.15Å; Q248-L251 PolarHBondContact O-N 2.87Å; Q248-S252 WeakPolarHBondContact O-CB 3.36Å; Q248-S252 PolarHBondContact O-N 3.26Å
249Y88.3Confident88.1Confident171 Ų17195.3 Ų95.367%0.67145%0.446SS*.Hα-helixtrans-68.5-40.6176.8-64.9-79000111.2Y246 S252 Y253Y246-Y249 HydrophobicContact CD1-CD2 4.04Å; Y246-Y249 HydrophobicContact CD1-CE2 4.37Å; Y246-Y249 PolarHBondContact O-N 2.83Å; Y246-Y249 VanDerWaalsContact O-N 3.09Å; Y249-S252 PolarHBondContact O-N 2.89Å; Y249-Y253 WeakPolarHBondContact O-CB 3.39Å; Y249-Y253 PolarHBondContact O-N 3.43Å
250L87.9Confident88.9Confident42 Ų4298.1 Ų98.122%0.2246%0.459CS..Hα-helixtrans-61.1-46.3174.7-177.965.1000111.2I242 W243 Y246 W247 Y253 V254I242-L250 HydrophobicContact CG2-CD2 4.48Å; W243-L250 HydrophobicContact CD2-CD2 4.34Å; W243-L250 HydrophobicContact CE3-CD2 3.64Å; W243-L250 HydrophobicContact CZ3-CD2 3.97Å; Y246-L250 PolarHBondContact O-N 3.23Å; Y246-L250 VanDerWaalsContact O-N 3.07Å; W247-L250 PolarHBondContact O-N 3.08Å; L250-Y253 PolarHBondContact O-N 3.27Å; L250-V254 WeakPolarHBondContact O-CG2 3.45Å; L250-V254 PolarHBondContact O-N 3.35Å
251L90.8Very high89.9Confident79 Ų7992 Ų9241%0.41443%0.432SS..Hα-helixtrans-62.7-46.6177.8-178.166.1000111.5W247 Q248 Y253 V254 L255W247-L251 HydrophobicContact CE3-CB 4.46Å; W247-L251 HydrophobicContact CE3-CD2 4.39Å; W247-L251 HydrophobicContact CH2-CD2 4.33Å; W247-L251 HydrophobicContact CZ3-CD2 3.69Å; W247-L251 WeakPolarHBondContact O-CB 3.19Å; W247-L251 PolarHBondContact O-N 3.49Å; Q248-L251 PolarHBondContact O-N 2.87Å; L251-Y253 VanDerWaalsContact C-N 3.31Å; L251-Y253 PolarHBondContact O-N 2.92Å; L251-V254 PolarHBondContact O-N 3.32Å; L251-L255 HydrophobicContact CD1-CD1 4.14Å; L251-L255 HydrophobicContact CD1-CG 4.2Å; L251-L255 HydrophobicContact CD2-CD1 4.49Å; L251-L255 HydrophobicContact CG-CD1 3.93Å; L251-L255 HydrophobicContact CG-CG 4.38Å; L251-L255 WeakPolarHBondContact O-CB 3.23Å; L251-L255 WeakPolarHBondContact O-CG 3.46Å; L251-L255 PolarHBondContact O-N 2.76Å
252S92.5Very high90.6Very high67 Ų6791.2 Ų91.247%0.46943%0.427SS..Hα-helixtrans-59-42.9177.4-178.90000111.8Q248 Y249 L255 T256Q248-S252 WeakPolarHBondContact O-CB 3.36Å; Q248-S252 PolarHBondContact O-N 3.26Å; Y249-S252 PolarHBondContact O-N 2.89Å; S252-L255 PolarHBondContact O-N 3.49Å; S252-T256 WeakPolarHBondContact O-CB 3.45Å; S252-T256 VanDerWaalsContact O-CG2 3.3Å; S252-T256 WeakPolarHBondContact O-CG2 3.29Å; S252-T256 PolarHBondContact O-N 2.82Å; S252-T256 PolarHBondContact O-OG1 3.01Å
253Y92.3Very high91.2Very high46 Ų4691 Ų9118%0.1843%0.433CS..Hα-helixtrans-61.1-51.2175.4170.2-104.6000112I196 S199 L200 I203 Y249 L250 L251 L255 T256 V257I196-Y253 HydrophobicContact CG2-CE1 3.95Å; I196-Y253 PolarHBondContact O-OH 3.17Å; S199-Y253 PolarHBondContact OG-OH 3.04Å; L200-Y253 VanDerWaalsContact CA-OH 3.29Å; L200-Y253 WeakPolarHBondContact CA-OH 3.04Å; L200-Y253 WeakPolarHBondContact CB-OH 3.3Å; L200-Y253 PolarHBondContact N-OH 3.44Å; I203-Y253 HydrophobicContact CD1-CD2 4.31Å; I203-Y253 HydrophobicContact CD1-CE2 3.57Å; Y249-Y253 WeakPolarHBondContact O-CB 3.39Å; Y249-Y253 PolarHBondContact O-N 3.43Å; L250-Y253 PolarHBondContact O-N 3.27Å; L251-Y253 VanDerWaalsContact C-N 3.31Å; L251-Y253 PolarHBondContact O-N 2.92Å; Y253-L255 VanDerWaalsContact C-N 3.32Å; Y253-L255 PolarHBondContact O-N 3.05Å; Y253-T256 PolarHBondContact O-N 3.25Å; Y253-T256 PolarHBondContact O-OG1 3.32Å; Y253-V257 HydrophobicContact CD2-CG2 3.75Å; Y253-V257 HydrophobicContact CE2-CB 4.34Å; Y253-V257 HydrophobicContact CE2-CG2 3.48Å; Y253-V257 VanDerWaalsContact CE2-CG2 3.48Å; Y253-V257 VanDerWaalsContact O-CB 3.28Å; Y253-V257 WeakPolarHBondContact O-CB 3.35Å; Y253-V257 WeakPolarHBondContact O-CG2 3.38Å; Y253-V257 PolarHBondContact O-N 2.89Å
254V92.8Very high91.8Very high57 Ų5786.4 Ų86.435%0.34542%0.423SS..Hα-helixtrans-61.2-40.7-180170.80000111.4I196 L250 L251 G258I196-V254 HydrophobicContact CD1-CG1 4.17Å; L250-V254 WeakPolarHBondContact O-CG2 3.45Å; L250-V254 PolarHBondContact O-N 3.35Å; L251-V254 PolarHBondContact O-N 3.32Å; V254-G258 WeakPolarHBondContact O-CA 3.24Å; V254-G258 PolarHBondContact O-N 3.15Å
255L94.7Very high92.3Very high109 Ų10978.4 Ų78.457%0.57140%0.396SS*.Hα-helixtrans-68.9-49.1179.1-71.8175.5000112.3L251 S252 Y253 F259L251-L255 HydrophobicContact CD1-CD1 4.14Å; L251-L255 HydrophobicContact CD1-CG 4.2Å; L251-L255 HydrophobicContact CD2-CD1 4.49Å; L251-L255 HydrophobicContact CG-CD1 3.93Å; L251-L255 HydrophobicContact CG-CG 4.38Å; L251-L255 WeakPolarHBondContact O-CB 3.23Å; L251-L255 WeakPolarHBondContact O-CG 3.46Å; L251-L255 PolarHBondContact O-N 2.76Å; S252-L255 PolarHBondContact O-N 3.49Å; Y253-L255 VanDerWaalsContact C-N 3.32Å; Y253-L255 PolarHBondContact O-N 3.05Å; L255-F259 VanDerWaalsContact O-CB 3.24Å; L255-F259 WeakPolarHBondContact O-CB 3.15Å; L255-F259 PolarHBondContact O-N 3.36Å
256T94.3Very high92.5Very high78 Ų7882.9 Ų82.948%0.47940%0.404SS..Hα-helixtrans-66-49.4-177.451.30000111.6S252 Y253 F259 M260S252-T256 WeakPolarHBondContact O-CB 3.45Å; S252-T256 VanDerWaalsContact O-CG2 3.3Å; S252-T256 WeakPolarHBondContact O-CG2 3.29Å; S252-T256 PolarHBondContact O-N 2.82Å; S252-T256 PolarHBondContact O-OG1 3.01Å; Y253-T256 PolarHBondContact O-N 3.25Å; Y253-T256 PolarHBondContact O-OG1 3.32Å; T256-F259 PolarHBondContact O-N 3.04Å; T256-M260 WeakPolarHBondContact O-CG 3.19Å; T256-M260 PolarHBondContact O-N 3.07Å
257V95.4Very high92.8Very high24 Ų2484.9 Ų84.915%0.14542%0.416CS..Hα-helixtrans-70.6-38.1178.1172.20000111.6I196 S199 Y253 F259 M260 S261I196-V257 HydrophobicContact CB-CG1 4.46Å; I196-V257 HydrophobicContact CG1-CG1 4.01Å; S199-V257 WeakPolarHBondContact OG-CG1 3.38Å; Y253-V257 HydrophobicContact CD2-CG2 3.75Å; Y253-V257 HydrophobicContact CE2-CB 4.34Å; Y253-V257 HydrophobicContact CE2-CG2 3.48Å; Y253-V257 VanDerWaalsContact CE2-CG2 3.48Å; Y253-V257 VanDerWaalsContact O-CB 3.28Å; Y253-V257 WeakPolarHBondContact O-CB 3.35Å; Y253-V257 WeakPolarHBondContact O-CG2 3.38Å; Y253-V257 PolarHBondContact O-N 2.89Å; V257-F259 VanDerWaalsContact C-N 3.33Å; V257-F259 PolarHBondContact O-N 3.34Å; V257-M260 PolarHBondContact O-N 3.04Å; V257-S261 VanDerWaalsContact O-CB 3.27Å; V257-S261 WeakPolarHBondContact O-CB 3.49Å; V257-S261 PolarHBondContact O-N 3.49Å; V257-S261 PolarHBondContact O-OG 3.46Å
258G94.8Very high92.8Very high10 Ų1086.9 Ų86.910%0.10343%0.425CS..Hα-helixtrans-59.5-45.2175.100000111.3V254 S261 F262V254-G258 WeakPolarHBondContact O-CA 3.24Å; V254-G258 PolarHBondContact O-N 3.15Å; G258-S261 PolarHBondContact O-N 3.23Å; G258-F262 WeakPolarHBondContact O-CB 3.35Å; G258-F262 PolarHBondContact O-N 3.36Å
259F95.4Very high92.5Very high145 Ų14581.6 Ų81.664%0.63641%0.405SS*.Hα-helixtrans-64.1-44.7175.7-174.4-99.5000112.5L255 T256 V257 S261 F262 A263L255-F259 VanDerWaalsContact O-CB 3.24Å; L255-F259 WeakPolarHBondContact O-CB 3.15Å; L255-F259 PolarHBondContact O-N 3.36Å; T256-F259 PolarHBondContact O-N 3.04Å; V257-F259 VanDerWaalsContact C-N 3.33Å; V257-F259 PolarHBondContact O-N 3.34Å; F259-S261 VanDerWaalsContact C-N 3.35Å; F259-S261 PolarHBondContact O-N 3Å; F259-F262 WeakPolarHBondContact O-CB 3.39Å; F259-F262 PolarHBondContact O-N 3.34Å; F259-A263 PolarHBondContact O-N 3.01Å
260M95.1Very high92.4Very high121 Ų12175.3 Ų75.360%0.59639%0.385SS*.Hα-helixtrans-62.2-42.7175.5-71.3-60.5-66.400112T256 V257 F262 A263 V264T256-M260 WeakPolarHBondContact O-CG 3.19Å; T256-M260 PolarHBondContact O-N 3.07Å; V257-M260 PolarHBondContact O-N 3.04Å; M260-F262 VanDerWaalsContact C-N 3.34Å; M260-A263 PolarHBondContact O-N 3.27Å; M260-V264 VanDerWaalsContact O-CG2 3.31Å; M260-V264 WeakPolarHBondContact O-CG2 3.5Å; M260-V264 PolarHBondContact O-N 2.78Å
261S95.4Very high92Very high16 Ų1676.5 Ų76.511%0.11239%0.391CS..Hα-helixtrans-64.8-40.3176.8-57.10000111V257 G258 F259 V264 C265V257-S261 VanDerWaalsContact O-CB 3.27Å; V257-S261 WeakPolarHBondContact O-CB 3.49Å; V257-S261 PolarHBondContact O-N 3.49Å; V257-S261 PolarHBondContact O-OG 3.46Å; G258-S261 PolarHBondContact O-N 3.23Å; F259-S261 VanDerWaalsContact C-N 3.35Å; F259-S261 PolarHBondContact O-N 3Å; S261-V264 PolarHBondContact O-N 3.42Å; S261-C265 WeakPolarHBondContact O-CB 3.48Å; S261-C265 PolarHBondContact O-N 3.37Å; S261-C265 PolarHBondContact O-SG 2.89Å
262F94.5Very high91.7Very high76 Ų7680.7 Ų80.733%0.33341%0.409SS..Hα-helixtrans-60.8-46.8173.5-179.4-101.1000111.7Y188 M192 G258 F259 M260 V264 C265 Y266Y188-F262 HydrophobicContact CD1-CD2 4.36Å; Y188-F262 HydrophobicContact CD1-CE2 4.06Å; Y188-F262 HydrophobicContact CG-CE2 4.11Å; M192-F262 HydrophobicContact CG-CB 3.99Å; M192-F262 HydrophobicContact CG-CD2 4.47Å; M192-F262 HydrophobicContact SD-CB 3.81Å; M192-F262 HydrophobicContact SD-CD2 3.92Å; M192-F262 HydrophobicContact SD-CG 4.27Å; G258-F262 WeakPolarHBondContact O-CB 3.35Å; G258-F262 PolarHBondContact O-N 3.36Å; F259-F262 WeakPolarHBondContact O-CB 3.39Å; F259-F262 PolarHBondContact O-N 3.34Å; M260-F262 VanDerWaalsContact C-N 3.34Å; F262-V264 VanDerWaalsContact C-N 3.29Å; F262-V264 PolarHBondContact O-N 3.26Å; F262-C265 PolarHBondContact O-N 3.45Å; F262-Y266 HydrophobicContact CZ-CD2 4.33Å; F262-Y266 VanDerWaalsContact O-CB 3.24Å; F262-Y266 WeakPolarHBondContact O-CB 3.44Å; F262-Y266 PolarHBondContact O-N 3.31Å
263A93.8Very high91.4Very high44 Ų4483.2 Ų83.236%0.36442%0.417SS..Hα-helixtrans-60.2-39.9178.100000112F259 M260 K267F259-A263 PolarHBondContact O-N 3.01Å; M260-A263 PolarHBondContact O-N 3.27Å; A263-K267 WeakPolarHBondContact O-CB 3.38Å; A263-K267 PolarHBondContact O-N 3.35Å
264V93.7Very high91.3Very high74 Ų7488.4 Ų88.445%0.44844%0.443SS..Hα-helixtrans-65.2-51.1175174.80000110.7M260 S261 F262 Y266 K267 Y268M260-V264 VanDerWaalsContact O-CG2 3.31Å; M260-V264 WeakPolarHBondContact O-CG2 3.5Å; M260-V264 PolarHBondContact O-N 2.78Å; S261-V264 PolarHBondContact O-N 3.42Å; F262-V264 VanDerWaalsContact C-N 3.29Å; F262-V264 PolarHBondContact O-N 3.26Å; V264-Y266 VanDerWaalsContact C-N 3.28Å; V264-Y266 PolarHBondContact O-N 3.3Å; V264-K267 WeakPolarHBondContact O-CB 3.49Å; V264-K267 PolarHBondContact O-N 3.46Å; V264-Y268 HydrophobicContact CG1-CD2 3.79Å; V264-Y268 HydrophobicContact CG1-CE2 3.56Å; V264-Y268 WeakPolarHBondContact O-CD2 3.23Å; V264-Y268 PolarHBondContact O-N 2.84Å; V264-Y268 VanDerWaalsContact O-N 3.15Å
265C91.9Very high91.1Very high17 Ų1796.3 Ų96.312%0.11547%0.466CS..Hα-helixtrans-61.5-35.2177.3-69.30000112.8Y187 Y188 S261 F262 Y268 G269Y187-C265 HydrophobicContact CE1-CB 4.35Å; Y188-C265 HydrophobicContact CD1-CB 4.11Å; S261-C265 WeakPolarHBondContact O-CB 3.48Å; S261-C265 PolarHBondContact O-N 3.37Å; S261-C265 PolarHBondContact O-SG 2.89Å; F262-C265 PolarHBondContact O-N 3.45Å; C265-Y268 PolarHBondContact O-N 3.4Å; C265-G269 PolarHBondContact O-N 2.92Å
266Y92.5Very high90.8Very high159 Ų15992.6 Ų92.662%0.62445%0.449SS*.Hα-helixtrans-66.5-39.4176-172.8-95.1000111.7Y188 F262 V264 G269Y188-Y266 HydrophobicContact CE1-CD2 4.49Å; F262-Y266 HydrophobicContact CZ-CD2 4.33Å; F262-Y266 VanDerWaalsContact O-CB 3.24Å; F262-Y266 WeakPolarHBondContact O-CB 3.44Å; F262-Y266 PolarHBondContact O-N 3.31Å; V264-Y266 VanDerWaalsContact C-N 3.28Å; V264-Y266 PolarHBondContact O-N 3.3Å; Y266-G269 PolarHBondContact O-N 2.97Å
267K93.1Very high90.6Very high178 Ų17890 Ų9077%0.77443%0.432SS*.Hα-helixtrans-65.6-39.6176.5-175.9179.2178.8-179.60112.9A263 V264A263-K267 WeakPolarHBondContact O-CB 3.38Å; A263-K267 PolarHBondContact O-N 3.35Å; V264-K267 WeakPolarHBondContact O-CB 3.49Å; V264-K267 PolarHBondContact O-N 3.46Å
268Y88.1Confident90.4Very high183 Ų18392.4 Ų92.472%0.71844%0.444SS*.Hα-helixtrans-76.7-25.8178.8-73.5-70.2000113.1V264 C265V264-Y268 HydrophobicContact CG1-CD2 3.79Å; V264-Y268 HydrophobicContact CG1-CE2 3.56Å; V264-Y268 WeakPolarHBondContact O-CD2 3.23Å; V264-Y268 PolarHBondContact O-N 2.84Å; V264-Y268 VanDerWaalsContact O-N 3.15Å; C265-Y268 PolarHBondContact O-N 3.4Å
269G85.5Confident90.3Very high18 Ų1897.5 Ų97.519%0.18647%0.469CS..  trans78.3162179.200000113.4Y187 C265 Y266Y187-G269 WeakPolarHBondContact CE1-O 3.34Å; Y187-G269 PolarHBondContact OH-O 3.49Å; C265-G269 PolarHBondContact O-N 2.92Å; Y266-G269 PolarHBondContact O-N 2.97Å
270P86.1Confident90.1Very high39 Ų3992.6 Ų92.625%0.25345%0.449SS..SBendtrans-67.1161.7177.428.8-32.9000112Y187 E272Y187-P270 HydrophobicContact CD1-CB 4.27Å; Y187-P270 HydrophobicContact CG-CB 4.42Å; P270-E272 PolarHBondContact O-N 3.5Å; P270-E272 VanDerWaalsContact O-N 3.08Å
271L80.5Confident90Very high66 Ų6687.1 Ų87.135%0.34642%0.422SS..  trans-66.6105.6-179.6-66.1147.2000110.5Y187 S276 I277 L280Y187-L271 HydrophobicContact CD2-CD1 3.69Å; Y187-L271 HydrophobicContact CD2-CG 3.95Å; Y187-L271 HydrophobicContact CE2-CD1 3.92Å; Y187-L271 HydrophobicContact CE2-CG 3.79Å; L271-S276 WeakPolarHBondContact CD2-OG 3.48Å; L271-I277 HydrophobicContact CB-CG1 4.18Å; L271-I277 WeakPolarHBondContact O-CD1 3.29Å; L271-L280 HydrophobicContact CD1-CD2 3.66Å
272E82.9Confident89.9Confident168 Ų16894.8 Ų94.879%0.78545%0.449SS*.  trans-90-27.7176.3-69.8178.3177.900113P270 E274P270-E272 PolarHBondContact O-N 3.5Å; P270-E272 VanDerWaalsContact O-N 3.08Å; E272-E274 PolarHBondContact O-N 2.92Å
273N86.6Confident89.8Confident120 Ų12094.4 Ų94.464%0.64245%0.453SS*.  trans-72.9120.1-176.1-65.8-57.6000111R275 S276 I277N273-R275 PolarHBondContact O-N 2.83Å; N273-R275 VanDerWaalsContact O-N 3.12Å; N273-S276 WeakPolarHBondContact O-CA 3.37Å; N273-S276 WeakPolarHBondContact O-CB 3.44Å; N273-S276 PolarHBondContact O-N 2.96Å; N273-S276 PolarHBondContact O-OG 3.38Å; N273-I277 PolarHBondContact O-N 3.18Å; N273-I277 VanDerWaalsContact O-N 3.07Å
274E89.6Confident89.8Confident155 Ų15592.9 Ų92.972%0.72444%0.438SS*.Hα-helixtrans-51.9-39.1177.3-66.8-170.5165.400113E272 S276 I277 N278E272-E274 PolarHBondContact O-N 2.92Å; E274-S276 VanDerWaalsContact C-N 3.28Å; E274-S276 PolarHBondContact O-N 3.07Å; E274-I277 PolarHBondContact O-N 2.96Å; E274-N278 WeakPolarHBondContact O-CB 3.5Å; E274-N278 VanDerWaalsContact O-CG 3.24Å; E274-N278 PolarHBondContact O-N 3.44Å
275R90.4Very high89.8Confident223 Ų22390.6 Ų90.684%0.84242%0.423SS*.Hα-helixtrans-58.5-40.7176.1-176.2176.8179.61671112.4N273 L279N273-R275 PolarHBondContact O-N 2.83Å; N273-R275 VanDerWaalsContact O-N 3.12Å; R275-L279 WeakPolarHBondContact O-CB 3.49Å; R275-L279 PolarHBondContact O-N 2.98Å
276S88.2Confident89.9Confident30 Ų3095.7 Ų95.721%0.2145%0.448CS..Hα-helixtrans-75.5-36.8-178.970.20000112.1L271 N273 E274 L279 L280L271-S276 WeakPolarHBondContact CD2-OG 3.48Å; N273-S276 WeakPolarHBondContact O-CA 3.37Å; N273-S276 WeakPolarHBondContact O-CB 3.44Å; N273-S276 PolarHBondContact O-N 2.96Å; N273-S276 PolarHBondContact O-OG 3.38Å; E274-S276 VanDerWaalsContact C-N 3.28Å; E274-S276 PolarHBondContact O-N 3.07Å; S276-L279 PolarHBondContact O-N 3.15Å; S276-L280 WeakPolarHBondContact O-CB 3.27Å; S276-L280 PolarHBondContact O-N 3.45Å
277I89.8Confident89.9Confident24 Ų2492.4 Ų92.412%0.12344%0.44CS..Hα-helixtrans-62.7-45.6172.1-63170.8000110R182 L271 N273 E274 L280 T281R182-I277 HydrophobicContact CG-CG2 3.88Å; L271-I277 HydrophobicContact CB-CG1 4.18Å; L271-I277 WeakPolarHBondContact O-CD1 3.29Å; N273-I277 PolarHBondContact O-N 3.18Å; N273-I277 VanDerWaalsContact O-N 3.07Å; E274-I277 PolarHBondContact O-N 2.96Å; I277-L280 PolarHBondContact O-N 2.92Å; I277-T281 WeakPolarHBondContact O-CB 3.41Å; I277-T281 PolarHBondContact O-N 2.95Å; I277-T281 PolarHBondContact O-OG1 3.38Å
278N91Very high89.9Confident75 Ų7584 Ų8440%0.40140%0.403SS..Hα-helixtrans-61.6-49176.2-71.4-13.2000110.1E274 L280 T281 W282E274-N278 WeakPolarHBondContact O-CB 3.5Å; E274-N278 VanDerWaalsContact O-CG 3.24Å; E274-N278 PolarHBondContact O-N 3.44Å; N278-L280 VanDerWaalsContact C-N 3.32Å; N278-L280 PolarHBondContact O-N 3.45Å; N278-T281 WeakPolarHBondContact O-CA 3.49Å; N278-T281 VanDerWaalsContact O-CB 3.29Å; N278-T281 WeakPolarHBondContact O-CB 3.49Å; N278-T281 PolarHBondContact O-N 3.5Å; N278-W282 PolarHBondContact O-N 2.83Å
279L92.4Very high90.1Very high117 Ų11776.8 Ų76.861%0.61338%0.377SS*.Hα-helixtrans-55.4-46.2177.5-170.972.7000112.1R275 S276 T281 W282 T283R275-L279 WeakPolarHBondContact O-CB 3.49Å; R275-L279 PolarHBondContact O-N 2.98Å; S276-L279 PolarHBondContact O-N 3.15Å; L279-T281 VanDerWaalsContact C-N 3.31Å; L279-T281 PolarHBondContact O-N 3.37Å; L279-W282 PolarHBondContact O-N 3.16Å; L279-T283 WeakPolarHBondContact O-CG2 3.42Å; L279-T283 PolarHBondContact O-N 3.06Å; L279-T283 PolarHBondContact O-OG1 3.16Å
280L91.1Very high90.4Very high42 Ų4279.4 Ų79.422%0.2239%0.391CS..Hα-helixtrans-62.5-38.9176.1-179.462.6000111.9F186 L271 S276 I277 N278 T283 L284F186-L280 HydrophobicContact CE1-CD2 4.41Å; L271-L280 HydrophobicContact CD1-CD2 3.66Å; S276-L280 WeakPolarHBondContact O-CB 3.27Å; S276-L280 PolarHBondContact O-N 3.45Å; I277-L280 PolarHBondContact O-N 2.92Å; N278-L280 VanDerWaalsContact C-N 3.32Å; N278-L280 PolarHBondContact O-N 3.45Å; L280-T283 WeakPolarHBondContact CA-OG1 3.36Å; L280-T283 PolarHBondContact O-N 3.24Å; L280-T283 PolarHBondContact O-OG1 3.03Å; L280-L284 HydrophobicContact CD1-CD1 4.29Å; L280-L284 HydrophobicContact CD1-CG 4.24Å; L280-L284 HydrophobicContact CG-CD1 4.03Å; L280-L284 HydrophobicContact CG-CG 4.41Å; L280-L284 WeakPolarHBondContact O-CB 3.25Å; L280-L284 VanDerWaalsContact O-CG 3.22Å; L280-L284 WeakPolarHBondContact O-CG 3.45Å; L280-L284 PolarHBondContact O-N 2.96Å
281T92.1Very high90.6Very high6 Ų680.3 Ų80.34%0.03739%0.392CS..Hα-helixtrans-62.3-48.2176.2-58.50000110.9D178 S181 I277 N278 L279 T283 L284 Q285D178-T281 WeakPolarHBondContact OD1-CG2 3.21Å; S181-T281 WeakPolarHBondContact CB-OG1 3.42Å; S181-T281 PolarHBondContact OG-OG1 3.4Å; I277-T281 WeakPolarHBondContact O-CB 3.41Å; I277-T281 PolarHBondContact O-N 2.95Å; I277-T281 PolarHBondContact O-OG1 3.38Å; N278-T281 WeakPolarHBondContact O-CA 3.49Å; N278-T281 VanDerWaalsContact O-CB 3.29Å; N278-T281 WeakPolarHBondContact O-CB 3.49Å; N278-T281 PolarHBondContact O-N 3.5Å; L279-T281 VanDerWaalsContact C-N 3.31Å; L279-T281 PolarHBondContact O-N 3.37Å; T281-T283 VanDerWaalsContact C-N 3.33Å; T281-T283 PolarHBondContact O-N 3.44Å; T281-L284 PolarHBondContact O-N 3.41Å; T281-Q285 HydrophobicContact CG2-CG 4.47Å; T281-Q285 WeakPolarHBondContact O-CB 3.41Å; T281-Q285 WeakPolarHBondContact O-CG 3.41Å; T281-Q285 PolarHBondContact O-N 2.91Å
282W93.3Very high91.1Very high177 Ų17777.2 Ų77.267%0.6738%0.375SS*.Hα-helixtrans-61.1-40.9176.5-73103.3000111.8N278 L279 Q285 L286N278-W282 PolarHBondContact O-N 2.83Å; L279-W282 PolarHBondContact O-N 3.16Å; W282-Q285 PolarHBondContact O-N 2.83Å; W282-L286 VanDerWaalsContact O-CB 3.26Å; W282-L286 WeakPolarHBondContact O-CB 3.31Å; W282-L286 PolarHBondContact O-N 3.29Å
283T93.6Very high91.4Very high67 Ų6773 Ų7341%0.41135%0.353SS..Hα-helixtrans-68.6-41178.6580000112.1L279 L280 T281 L286 M287L279-T283 WeakPolarHBondContact O-CG2 3.42Å; L279-T283 PolarHBondContact O-N 3.06Å; L279-T283 PolarHBondContact O-OG1 3.16Å; L280-T283 WeakPolarHBondContact CA-OG1 3.36Å; L280-T283 PolarHBondContact O-N 3.24Å; L280-T283 PolarHBondContact O-OG1 3.03Å; T281-T283 VanDerWaalsContact C-N 3.33Å; T281-T283 PolarHBondContact O-N 3.44Å; T283-L286 PolarHBondContact O-N 3.16Å; T283-M287 VanDerWaalsContact O-CB 3.25Å; T283-M287 WeakPolarHBondContact O-CB 3.18Å; T283-M287 PolarHBondContact O-N 3.24Å
284L92.6Very high91.3Very high12 Ų1268.3 Ų68.36%0.06333%0.329CS..Hα-helixtrans-64-42.1174.9-70.4171.3000111.7L173 L180 F186 L280 T281 M287 G288L173-L284 HydrophobicContact CD2-CD2 4.17Å; L180-L284 HydrophobicContact CB-CD1 4.21Å; F186-L284 HydrophobicContact CE1-CD1 3.79Å; F186-L284 HydrophobicContact CE1-CD2 4.18Å; F186-L284 HydrophobicContact CZ-CD1 4.06Å; F186-L284 HydrophobicContact CZ-CD2 3.73Å; L280-L284 HydrophobicContact CD1-CD1 4.29Å; L280-L284 HydrophobicContact CD1-CG 4.24Å; L280-L284 HydrophobicContact CG-CD1 4.03Å; L280-L284 HydrophobicContact CG-CG 4.41Å; L280-L284 WeakPolarHBondContact O-CB 3.25Å; L280-L284 VanDerWaalsContact O-CG 3.22Å; L280-L284 WeakPolarHBondContact O-CG 3.45Å; L280-L284 PolarHBondContact O-N 2.96Å; T281-L284 PolarHBondContact O-N 3.41Å; L284-M287 PolarHBondContact O-N 3.03Å; L284-G288 PolarHBondContact O-N 3.48Å
285Q93.9Very high91Very high26 Ų2660.9 Ų60.912%0.12130%0.295CS..Hα-helixtrans-65.5-45.2176.5-71.6174.513.400111.7F174 D178 T281 W282 M287 G288 L289F174-Q285 HydrophobicContact CD2-CB 4.08Å; F174-Q285 HydrophobicContact CD2-CG 4.36Å; F174-Q285 HydrophobicContact CE2-CB 4.41Å; D178-Q285 PolarHBondContact OD2-NE2 2.97Å; T281-Q285 HydrophobicContact CG2-CG 4.47Å; T281-Q285 WeakPolarHBondContact O-CB 3.41Å; T281-Q285 WeakPolarHBondContact O-CG 3.41Å; T281-Q285 PolarHBondContact O-N 2.91Å; W282-Q285 PolarHBondContact O-N 2.83Å; Q285-M287 VanDerWaalsContact C-N 3.32Å; Q285-M287 PolarHBondContact O-N 3.44Å; Q285-G288 WeakPolarHBondContact O-CA 3.42Å; Q285-G288 PolarHBondContact O-N 3.46Å; Q285-G288 VanDerWaalsContact O-N 3.15Å; Q285-L289 WeakPolarHBondContact O-CG 3.22Å; Q285-L289 PolarHBondContact O-N 2.89Å
286L93.9Very high90.7Very high124 Ų12450.7 Ų50.765%0.64926%0.257SS*.Hα-helixtrans-62-41.5176.5-176.367.4000111.5W282 T283 G288 L289 C290W282-L286 VanDerWaalsContact O-CB 3.26Å; W282-L286 WeakPolarHBondContact O-CB 3.31Å; W282-L286 PolarHBondContact O-N 3.29Å; T283-L286 PolarHBondContact O-N 3.16Å; L286-G288 VanDerWaalsContact C-N 3.34Å; L286-L289 PolarHBondContact O-N 3.12Å; L286-C290 PolarHBondContact O-N 3.5Å
287M92.3Very high90.1Very high91 Ų9151.9 Ų51.945%0.44826%0.259SS..Hα-helixtrans-63.5-41173.9-172-178.1-61.200111.4L173 T283 L284 Q285 L289 C290 F291L173-M287 HydrophobicContact CD1-CG 4.49Å; L173-M287 HydrophobicContact CD1-SD 4.47Å; T283-M287 VanDerWaalsContact O-CB 3.25Å; T283-M287 WeakPolarHBondContact O-CB 3.18Å; T283-M287 PolarHBondContact O-N 3.24Å; L284-M287 PolarHBondContact O-N 3.03Å; Q285-M287 VanDerWaalsContact C-N 3.32Å; Q285-M287 PolarHBondContact O-N 3.44Å; M287-L289 PolarHBondContact O-N 3.33Å; M287-C290 WeakPolarHBondContact O-CB 3.34Å; M287-C290 PolarHBondContact O-N 3.1Å; M287-F291 HydrophobicContact CG-CD2 4.44Å; M287-F291 HydrophobicContact CG-CE1 4.48Å; M287-F291 HydrophobicContact CG-CE2 4.02Å; M287-F291 HydrophobicContact CG-CZ 4.04Å; M287-F291 PolarHBondContact O-N 2.92Å; M287-F291 HydrophobicContact SD-CE2 4.23Å; M287-F291 HydrophobicContact SD-CZ 4.26Å
288G93.9Very high89.4Confident0 Ų050.8 Ų50.80%025%0.253CS..Hα-helixtrans-58.2-46.3174.100000112.5G170 L284 Q285 L286 C290 F291 M292G170-G288 WeakPolarHBondContact CA-O 3.4Å; G170-G288 WeakPolarHBondContact O-CA 3.2Å; L284-G288 PolarHBondContact O-N 3.48Å; Q285-G288 WeakPolarHBondContact O-CA 3.42Å; Q285-G288 PolarHBondContact O-N 3.46Å; Q285-G288 VanDerWaalsContact O-N 3.15Å; L286-G288 VanDerWaalsContact C-N 3.34Å; G288-C290 VanDerWaalsContact C-N 3.35Å; G288-C290 PolarHBondContact O-N 3.27Å; G288-F291 PolarHBondContact O-N 3Å; G288-M292 WeakPolarHBondContact O-CG 3.41Å; G288-M292 PolarHBondContact O-N 2.77Å
289L93.3Very high88.9Confident33 Ų3349.7 Ų49.717%0.17325%0.251CS..Hα-helixtrans-61.4-41.4175.2-67.6178.1000112.3F174 Q285 L286 M287 M292 Y293 I306 L310F174-L289 HydrophobicContact CD2-CD1 4.47Å; F174-L289 HydrophobicContact CD2-CD2 3.69Å; F174-L289 HydrophobicContact CD2-CG 3.8Å; F174-L289 HydrophobicContact CE2-CD1 4.19Å; F174-L289 HydrophobicContact CE2-CD2 3.73Å; F174-L289 HydrophobicContact CE2-CG 3.96Å; F174-L289 HydrophobicContact CG-CD2 4.37Å; F174-L289 HydrophobicContact CZ-CD2 4.45Å; Q285-L289 WeakPolarHBondContact O-CG 3.22Å; Q285-L289 PolarHBondContact O-N 2.89Å; L286-L289 PolarHBondContact O-N 3.12Å; M287-L289 PolarHBondContact O-N 3.33Å; L289-M292 HydrophobicContact CD2-SD 4.48Å; L289-M292 PolarHBondContact O-N 3.01Å; L289-Y293 WeakPolarHBondContact O-CB 3.12Å; L289-Y293 PolarHBondContact O-N 3.45Å; L289-I306 HydrophobicContact CD2-CG1 4.27Å; L289-I306 HydrophobicContact CD2-CG2 3.89Å; L289-L310 HydrophobicContact CD1-CD2 4.5Å
290C90.8Very high88.4Confident72 Ų7250.7 Ų50.749%0.48625%0.252SS..Hα-helixtrans-62.4-42.4176.2-174.40000112L286 M287 G288 Y293 S294L286-C290 PolarHBondContact O-N 3.5Å; M287-C290 WeakPolarHBondContact O-CB 3.34Å; M287-C290 PolarHBondContact O-N 3.1Å; G288-C290 VanDerWaalsContact C-N 3.35Å; G288-C290 PolarHBondContact O-N 3.27Å; C290-Y293 PolarHBondContact O-N 2.81Å; C290-S294 WeakPolarHBondContact O-CB 3.46Å; C290-S294 PolarHBondContact O-N 3.34Å; C290-S294 PolarHBondContact O-OG 2.81Å
291F90.2Very high88.1Confident59 Ų5950.5 Ų50.526%0.25925%0.25SS..Hα-helixtrans-69.2-37.9175.4-72.3-11.7000112.8V166 L169 L173 M287 G288 Y293 S294 G295V166-F291 HydrophobicContact CG1-CB 4.17Å; V166-F291 HydrophobicContact CG1-CG 4.48Å; L169-F291 HydrophobicContact CD2-CD2 3.97Å; L169-F291 HydrophobicContact CD2-CE2 3.82Å; L169-F291 HydrophobicContact CG-CD2 4.13Å; L169-F291 HydrophobicContact CG-CE2 4.35Å; L173-F291 HydrophobicContact CD1-CD2 3.8Å; L173-F291 HydrophobicContact CD1-CE2 3.89Å; M287-F291 HydrophobicContact CG-CD2 4.44Å; M287-F291 HydrophobicContact CG-CE1 4.48Å; M287-F291 HydrophobicContact CG-CE2 4.02Å; M287-F291 HydrophobicContact CG-CZ 4.04Å; M287-F291 PolarHBondContact O-N 2.92Å; M287-F291 HydrophobicContact SD-CE2 4.23Å; M287-F291 HydrophobicContact SD-CZ 4.26Å; G288-F291 PolarHBondContact O-N 3Å; F291-Y293 VanDerWaalsContact C-N 3.33Å; F291-Y293 PolarHBondContact O-N 3.1Å; F291-S294 PolarHBondContact O-N 3.26Å; F291-G295 PolarHBondContact O-N 3.48Å
292M91.1Very high87.9Confident1 Ų150.2 Ų50.21%0.00525%0.249CC..Hα-helixtrans-60.6-44.3173.2-73.9176.264.200111.4F167 L171 F174 G288 L289 G295 I305 I306 A309F167-M292 HydrophobicContact CD2-CB 4.26Å; F167-M292 HydrophobicContact CD2-CG 4.26Å; F167-M292 HydrophobicContact CE2-CB 4.25Å; F167-M292 HydrophobicContact CE2-CE 4.08Å; F167-M292 HydrophobicContact CE2-CG 4.15Å; F167-M292 HydrophobicContact CZ-CE 4.48Å; L171-M292 HydrophobicContact CD1-CE 4.21Å; L171-M292 HydrophobicContact CD1-SD 4.39Å; F174-M292 HydrophobicContact CB-SD 4.42Å; G288-M292 WeakPolarHBondContact O-CG 3.41Å; G288-M292 PolarHBondContact O-N 2.77Å; L289-M292 HydrophobicContact CD2-SD 4.48Å; L289-M292 PolarHBondContact O-N 3.01Å; M292-G295 PolarHBondContact O-N 3.09Å; M292-I305 HydrophobicContact CE-CG2 3.66Å; M292-I306 HydrophobicContact CB-CG1 4.4Å; M292-I306 HydrophobicContact CE-CG1 4.42Å; M292-A309 HydrophobicContact CE-CB 4Å
293Y89.4Confident87.7Confident78 Ų7846 Ų4631%0.30624%0.239SC..Hα-helixtrans-62.7-44.5175.4-176.4-112.2000112F110 L289 C290 F291 G295 I296 P299 A302 I306F110-Y293 HydrophobicContact CE1-CD1 4.2Å; F110-Y293 AromaticContact CE1-CE1 3.59Å; F110-Y293 HydrophobicContact CE1-CE1 3.59Å; F110-Y293 HydrophobicContact CE2-CE1 4.4Å; F110-Y293 HydrophobicContact CZ-CD1 4.27Å; F110-Y293 AromaticContact CZ-CE1 3.29Å; F110-Y293 HydrophobicContact CZ-CE1 3.29Å; F110-Y293 AromaticContact CZ-CZ 3.78Å; L289-Y293 WeakPolarHBondContact O-CB 3.12Å; L289-Y293 PolarHBondContact O-N 3.45Å; C290-Y293 PolarHBondContact O-N 2.81Å; F291-Y293 VanDerWaalsContact C-N 3.33Å; F291-Y293 PolarHBondContact O-N 3.1Å; Y293-G295 VanDerWaalsContact C-N 3.35Å; Y293-G295 PolarHBondContact O-N 3.49Å; Y293-I296 PolarHBondContact O-N 3.24Å; Y293-I296 VanDerWaalsContact O-O 3.12Å; Y293-P299 HydrophobicContact CE2-CB 4.44Å; Y293-A302 HydrophobicContact CD2-CB 3.83Å; Y293-A302 HydrophobicContact CE2-CB 4.34Å; Y293-I306 HydrophobicContact CD2-CD1 4.41Å
294S83.4Confident87.6Confident22 Ų2245 Ų4515%0.15424%0.237CC..Hα-helixtrans-74-23.9-178.4-54.40000113.6C290 F291 I296C290-S294 WeakPolarHBondContact O-CB 3.46Å; C290-S294 PolarHBondContact O-N 3.34Å; C290-S294 PolarHBondContact O-OG 2.81Å; F291-S294 PolarHBondContact O-N 3.26Å; S294-I296 VanDerWaalsContact C-N 3.29Å
295G84.5Confident87.5Confident0 Ų046.3 Ų46.30%024%0.244CC..Hα-helixtrans-77-13.8178.200000113.8F291 M292 Y293F291-G295 PolarHBondContact O-N 3.48Å; M292-G295 PolarHBondContact O-N 3.09Å; Y293-G295 VanDerWaalsContact C-N 3.35Å; Y293-G295 PolarHBondContact O-N 3.49Å
296I83.9Confident87.4Confident9 Ų946.1 Ų46.15%0.04624%0.244CC..  trans-115.6124.9-178.9-64.2165.4000109.2I79 F167 Y293 S294 I298 A302 I305I79-I296 HydrophobicContact CG2-CG1 4.02Å; I79-I296 HydrophobicContact CG2-CG2 4.02Å; F167-I296 HydrophobicContact CD2-CD1 3.72Å; F167-I296 HydrophobicContact CD2-CG1 3.9Å; F167-I296 HydrophobicContact CE2-CD1 3.57Å; F167-I296 HydrophobicContact CE2-CG1 4.26Å; Y293-I296 PolarHBondContact O-N 3.24Å; Y293-I296 VanDerWaalsContact O-O 3.12Å; S294-I296 VanDerWaalsContact C-N 3.29Å; I296-I298 VanDerWaalsContact C-N 3.27Å; I296-I298 HydrophobicContact CG2-CB 4.3Å; I296-I298 WeakPolarHBondContact CG2-O 3.41Å; I296-I298 PolarHBondContact O-N 3.28Å; I296-A302 HydrophobicContact CB-CB 3.83Å; I296-A302 HydrophobicContact CD1-CB 4.16Å; I296-A302 HydrophobicContact CG2-CB 3.87Å; I296-I305 HydrophobicContact CD1-CD1 3.73Å
297Q74.9Confident87.3Confident55 Ų5545 Ų4526%0.25724%0.238SC..SBendtrans-74.5-17.7-179.8-67.6179.14700113.5T81 L163T81-Q297 PolarHBondContact O-NE2 2.81Å; L163-Q297 HydrophobicContact CD1-CG 3.83Å
298I76Confident87.3Confident0 Ų045.6 Ų45.60%024%0.241CC..  trans-100.5109.4-175.9-58.1169.9000109.3P74 L133 Y134 I296 H300 I301 A302P74-I298 HydrophobicContact CB-CD1 4.23Å; P74-I298 HydrophobicContact CG-CD1 4.39Å; L133-I298 HydrophobicContact CD2-CD1 4.32Å; Y134-I298 HydrophobicContact CD2-CG1 4.1Å; Y134-I298 HydrophobicContact CD2-CG2 4.16Å; Y134-I298 HydrophobicContact CE2-CB 4.32Å; Y134-I298 HydrophobicContact CE2-CD1 4.05Å; Y134-I298 HydrophobicContact CE2-CG1 3.88Å; Y134-I298 HydrophobicContact CE2-CG2 3.56Å; I296-I298 VanDerWaalsContact C-N 3.27Å; I296-I298 HydrophobicContact CG2-CB 4.3Å; I296-I298 WeakPolarHBondContact CG2-O 3.41Å; I296-I298 PolarHBondContact O-N 3.28Å; I298-H300 PolarHBondContact O-N 3.5Å; I298-I301 HydrophobicContact CB-CB 4.21Å; I298-I301 HydrophobicContact CB-CD1 4.16Å; I298-I301 HydrophobicContact CB-CG1 4.29Å; I298-I301 HydrophobicContact CD1-CD1 3.73Å; I298-I301 HydrophobicContact CG2-CB 4.08Å; I298-I301 HydrophobicContact CG2-CD1 3.89Å; I298-I301 HydrophobicContact CG2-CG1 3.76Å; I298-I301 PolarHBondContact O-N 2.88Å; I298-A302 WeakPolarHBondContact O-CB 3.28Å; I298-A302 PolarHBondContact O-N 3.24Å
299P79.8Confident87.1Confident53 Ų5345.9 Ų45.934%0.34424%0.243SC..Hα-helixtrans-63-39.4-171.723.6-33.2000112.6Y293 I301 A302 L303Y293-P299 HydrophobicContact CE2-CB 4.44Å; P299-I301 PolarHBondContact O-N 3.29Å; P299-A302 WeakPolarHBondContact O-CB 3.35Å; P299-A302 PolarHBondContact O-N 3.09Å; P299-L303 WeakPolarHBondContact O-CB 3.32Å; P299-L303 VanDerWaalsContact O-CG 3.29Å; P299-L303 WeakPolarHBondContact O-CG 3.44Å; P299-L303 PolarHBondContact O-N 2.83Å
300H82.9Confident87Confident137 Ų13747.4 Ų47.463%0.63425%0.251SS*.Hα-helixtrans-64.4-42.6179.7-59-60.8000113.1I298 L303 A304I298-H300 PolarHBondContact O-N 3.5Å; H300-L303 PolarHBondContact O-N 3.09Å; H300-A304 WeakPolarHBondContact O-CB 3.19Å; H300-A304 PolarHBondContact O-N 2.89Å
301I85.2Confident86.8Confident38 Ų3847 Ų4720%0.19525%0.249CC..Hα-helixtrans-69.6-40.4177.6-63.3178.2000109.9I79 I298 P299 L303 A304 I305I79-I301 HydrophobicContact CD1-CG2 4.15Å; I79-I301 HydrophobicContact CG1-CD1 4.39Å; I79-I301 HydrophobicContact CG1-CG2 4.41Å; I298-I301 HydrophobicContact CB-CB 4.21Å; I298-I301 HydrophobicContact CB-CD1 4.16Å; I298-I301 HydrophobicContact CB-CG1 4.29Å; I298-I301 HydrophobicContact CD1-CD1 3.73Å; I298-I301 HydrophobicContact CG2-CB 4.08Å; I298-I301 HydrophobicContact CG2-CD1 3.89Å; I298-I301 HydrophobicContact CG2-CG1 3.76Å; I298-I301 PolarHBondContact O-N 2.88Å; P299-I301 PolarHBondContact O-N 3.29Å; I301-L303 VanDerWaalsContact C-N 3.35Å; I301-L303 PolarHBondContact O-N 3.02Å; I301-A304 PolarHBondContact O-N 2.74Å; I301-I305 HydrophobicContact CG2-CD1 3.77Å; I301-I305 HydrophobicContact CG2-CG1 4.35Å; I301-I305 WeakPolarHBondContact O-CB 3.2Å; I301-I305 WeakPolarHBondContact O-CG1 3.39Å; I301-I305 PolarHBondContact O-N 3.33Å
302A87.3Confident86.7Confident0 Ų047.6 Ų47.60%026%0.258CS..Hα-helixtrans-57.5-47.8175.300000111.5Y293 I296 I298 P299 I305 I306Y293-A302 HydrophobicContact CD2-CB 3.83Å; Y293-A302 HydrophobicContact CE2-CB 4.34Å; I296-A302 HydrophobicContact CB-CB 3.83Å; I296-A302 HydrophobicContact CD1-CB 4.16Å; I296-A302 HydrophobicContact CG2-CB 3.87Å; I298-A302 WeakPolarHBondContact O-CB 3.28Å; I298-A302 PolarHBondContact O-N 3.24Å; P299-A302 WeakPolarHBondContact O-CB 3.35Å; P299-A302 PolarHBondContact O-N 3.09Å; A302-I305 PolarHBondContact O-N 2.71Å; A302-I306 VanDerWaalsContact O-CG1 3.27Å; A302-I306 WeakPolarHBondContact O-CG1 3.29Å; A302-I306 PolarHBondContact O-N 3.36Å
303L89Confident86.3Confident89 Ų8950 Ų5047%0.46627%0.268SS..Hα-helixtrans-64.2-43.1176.8-70.1174.3000112.2P299 H300 I301 I305 I306 I307P299-L303 WeakPolarHBondContact O-CB 3.32Å; P299-L303 VanDerWaalsContact O-CG 3.29Å; P299-L303 WeakPolarHBondContact O-CG 3.44Å; P299-L303 PolarHBondContact O-N 2.83Å; H300-L303 PolarHBondContact O-N 3.09Å; I301-L303 VanDerWaalsContact C-N 3.35Å; I301-L303 PolarHBondContact O-N 3.02Å; L303-I305 VanDerWaalsContact C-N 3.34Å; L303-I305 PolarHBondContact O-N 2.72Å; L303-I306 PolarHBondContact O-N 3.37Å; L303-I307 VanDerWaalsContact O-CG1 3.28Å; L303-I307 WeakPolarHBondContact O-CG1 3.36Å; L303-I307 PolarHBondContact O-N 2.87Å
304A91.4Very high85.9Confident46 Ų4651.3 Ų51.338%0.3828%0.28SS..Hα-helixtrans-59.6-44.7176.500000111.7H300 I301 I307 I308H300-A304 WeakPolarHBondContact O-CB 3.19Å; H300-A304 PolarHBondContact O-N 2.89Å; I301-A304 PolarHBondContact O-N 2.74Å; A304-I307 PolarHBondContact O-N 3.34Å; A304-I308 WeakPolarHBondContact O-CD1 3.26Å; A304-I308 VanDerWaalsContact O-CG1 3.23Å; A304-I308 WeakPolarHBondContact O-CG1 3.46Å; A304-I308 PolarHBondContact O-N 2.88Å
305I90.6Very high85.5Confident40 Ų4054.1 Ų54.121%0.20529%0.293CS..Hα-helixtrans-65.9-38.3177.5-69.3172.6000111.3F167 M292 I296 I301 A302 L303 I308 A309F167-I305 HydrophobicContact CE2-CG2 3.95Å; F167-I305 HydrophobicContact CZ-CG2 3.93Å; M292-I305 HydrophobicContact CE-CG2 3.66Å; I296-I305 HydrophobicContact CD1-CD1 3.73Å; I301-I305 HydrophobicContact CG2-CD1 3.77Å; I301-I305 HydrophobicContact CG2-CG1 4.35Å; I301-I305 WeakPolarHBondContact O-CB 3.2Å; I301-I305 WeakPolarHBondContact O-CG1 3.39Å; I301-I305 PolarHBondContact O-N 3.33Å; A302-I305 PolarHBondContact O-N 2.71Å; L303-I305 VanDerWaalsContact C-N 3.34Å; L303-I305 PolarHBondContact O-N 2.72Å; I305-I308 PolarHBondContact O-N 3.44Å; I305-A309 WeakPolarHBondContact O-CB 3.22Å; I305-A309 PolarHBondContact O-N 3.46Å
306I92.6Very high85Confident22 Ų2260.9 Ų60.911%0.11332%0.324CS..Hα-helixtrans-62.6-45.2174.1-74.2165.1000111.1L289 M292 Y293 A302 L303 I308 A309 L310L289-I306 HydrophobicContact CD2-CG1 4.27Å; L289-I306 HydrophobicContact CD2-CG2 3.89Å; M292-I306 HydrophobicContact CB-CG1 4.4Å; M292-I306 HydrophobicContact CE-CG1 4.42Å; Y293-I306 HydrophobicContact CD2-CD1 4.41Å; A302-I306 VanDerWaalsContact O-CG1 3.27Å; A302-I306 WeakPolarHBondContact O-CG1 3.29Å; A302-I306 PolarHBondContact O-N 3.36Å; L303-I306 PolarHBondContact O-N 3.37Å; I306-I308 VanDerWaalsContact C-N 3.34Å; I306-I308 PolarHBondContact O-N 3.03Å; I306-A309 PolarHBondContact O-N 2.88Å; I306-L310 HydrophobicContact CG2-CD1 3.98Å; I306-L310 HydrophobicContact CG2-CG 4.49Å; I306-L310 WeakPolarHBondContact O-CG 3.44Å; I306-L310 PolarHBondContact O-N 3.32Å
307I91.8Very high84.3Confident101 Ų10169.1 Ų69.152%0.51836%0.356SS..Hα-helixtrans-61.2-46.3176.4-67.9164.5000109.9L303 A304 A309 L310 C311L303-I307 VanDerWaalsContact O-CG1 3.28Å; L303-I307 WeakPolarHBondContact O-CG1 3.36Å; L303-I307 PolarHBondContact O-N 2.87Å; A304-I307 PolarHBondContact O-N 3.34Å; I307-A309 VanDerWaalsContact C-N 3.33Å; I307-A309 PolarHBondContact O-N 3.38Å; I307-L310 PolarHBondContact O-N 3.32Å; I307-C311 WeakPolarHBondContact O-CB 3.38Å; I307-C311 PolarHBondContact O-N 2.93Å; I307-C311 PolarHBondContact O-SG 3.07Å
308I91.3Very high84.4Confident103 Ų10369.1 Ų69.153%0.52836%0.361SS..Hα-helixtrans-58.7-45.7176.3-68.4163.2000110.4A304 I305 I306 L310 C311 T312A304-I308 WeakPolarHBondContact O-CD1 3.26Å; A304-I308 VanDerWaalsContact O-CG1 3.23Å; A304-I308 WeakPolarHBondContact O-CG1 3.46Å; A304-I308 PolarHBondContact O-N 2.88Å; I305-I308 PolarHBondContact O-N 3.44Å; I306-I308 VanDerWaalsContact C-N 3.34Å; I306-I308 PolarHBondContact O-N 3.03Å; I308-L310 PolarHBondContact O-N 2.87Å; I308-C311 WeakPolarHBondContact O-CB 3.34Å; I308-C311 PolarHBondContact O-N 3.35Å; I308-T312 HydrophobicContact CG2-CG2 4.28Å; I308-T312 WeakPolarHBondContact O-CG2 3.41Å; I308-T312 PolarHBondContact O-N 3.1Å; I308-T312 PolarHBondContact O-OG1 2.85Å
309A90.8Very high84.6Confident5 Ų573.6 Ų73.64%0.04138%0.384CS..Hα-helixtrans-61.2-45.5178.300000111.8F174 F175 M292 I305 I306 I307 C311 T312 K313F174-A309 HydrophobicContact CD1-CB 4.19Å; F174-A309 HydrophobicContact CE1-CB 3.91Å; F175-A309 HydrophobicContact CE2-CB 4.49Å; F175-A309 HydrophobicContact CZ-CB 4.31Å; M292-A309 HydrophobicContact CE-CB 4Å; I305-A309 WeakPolarHBondContact O-CB 3.22Å; I305-A309 PolarHBondContact O-N 3.46Å; I306-A309 PolarHBondContact O-N 2.88Å; I307-A309 VanDerWaalsContact C-N 3.33Å; I307-A309 PolarHBondContact O-N 3.38Å; A309-C311 PolarHBondContact O-N 2.97Å; A309-T312 WeakPolarHBondContact CA-OG1 3.36Å; A309-T312 PolarHBondContact O-N 3.35Å; A309-T312 PolarHBondContact O-OG1 3.12Å; A309-K313 PolarHBondContact O-N 3.33Å; A309-K313 VanDerWaalsContact O-N 3.09Å
310L90.3Very high84.5Confident65 Ų6576.7 Ų76.734%0.3439%0.394SS..Hα-helixtrans-61.1-43.3174.8-73168.5000112F174 L289 I306 I307 I308 N314F174-L310 HydrophobicContact CE2-CD2 4.09Å; F174-L310 HydrophobicContact CZ-CD2 3.88Å; F174-L310 HydrophobicContact CZ-CG 4.42Å; L289-L310 HydrophobicContact CD1-CD2 4.5Å; I306-L310 HydrophobicContact CG2-CD1 3.98Å; I306-L310 HydrophobicContact CG2-CG 4.49Å; I306-L310 WeakPolarHBondContact O-CG 3.44Å; I306-L310 PolarHBondContact O-N 3.32Å; I307-L310 PolarHBondContact O-N 3.32Å; I308-L310 PolarHBondContact O-N 2.87Å; L310-N314 WeakPolarHBondContact O-CB 3.45Å; L310-N314 PolarHBondContact O-N 2.96Å; L310-N314 PolarHBondContact O-ND2 3.36Å
311C87.3Confident84.6Confident65 Ų6577.7 Ų77.744%0.43939%0.392SS..Hα-helixtrans-58.4-59173.7-71.50000109.2I307 I308 A309 K313 N314 L315I307-C311 WeakPolarHBondContact O-CB 3.38Å; I307-C311 PolarHBondContact O-N 2.93Å; I307-C311 PolarHBondContact O-SG 3.07Å; I308-C311 WeakPolarHBondContact O-CB 3.34Å; I308-C311 PolarHBondContact O-N 3.35Å; A309-C311 PolarHBondContact O-N 2.97Å; C311-K313 PolarHBondContact O-N 3.08Å; C311-K313 VanDerWaalsContact O-N 3.09Å; C311-N314 CarbonylContact O-C 3.48Å; C311-N314 PolarHBondContact O-N 2.68Å; C311-L315 WeakPolarHBondContact O-CA 3.4Å; C311-L315 WeakPolarHBondContact O-CB 3.31Å; C311-L315 PolarHBondContact O-N 3.45Å
312T87.1Confident84.7Confident71 Ų7181.3 Ų81.344%0.43641%0.411SS..Hα-helixtrans-53-38.1-176.455.70000113.7F175 I308 A309F175-T312 WeakPolarHBondContact CZ-OG1 3.23Å; I308-T312 HydrophobicContact CG2-CG2 4.28Å; I308-T312 WeakPolarHBondContact O-CG2 3.41Å; I308-T312 PolarHBondContact O-N 3.1Å; I308-T312 PolarHBondContact O-OG1 2.85Å; A309-T312 WeakPolarHBondContact CA-OG1 3.36Å; A309-T312 PolarHBondContact O-N 3.35Å; A309-T312 PolarHBondContact O-OG1 3.12Å
313K83.3Confident84.6Confident51 Ų5188.3 Ų88.322%0.22244%0.439CS..Hα-helixtrans-75.8-36.8178.7-169.9167.3-170.7164.40113.3F174 D178 A309 C311F174-K313 HydrophobicContact CE1-CB 4.09Å; F174-K313 HydrophobicContact CE1-CD 3.9Å; F174-K313 HydrophobicContact CZ-CB 4.34Å; F174-K313 HydrophobicContact CZ-CD 3.95Å; F174-K313 PolarHBondContact O-NZ 3.3Å; D178-K313 WeakPolarHBondContact OD2-CE 3.36Å; D178-K313 IonicContact OD2-NZ 3.73Å; D178-K313 PolarHBondContact OD2-NZ 3.32Å; A309-K313 PolarHBondContact O-N 3.33Å; A309-K313 VanDerWaalsContact O-N 3.09Å; C311-K313 PolarHBondContact O-N 3.08Å; C311-K313 VanDerWaalsContact O-N 3.09Å
314N80.8Confident84.5Confident105 Ų10588 Ų8856%0.56144%0.437SS*.Hα-helixtrans-97.33-177.4-64-31.2000113.4L310 C311 P318L310-N314 WeakPolarHBondContact O-CB 3.45Å; L310-N314 PolarHBondContact O-N 2.96Å; L310-N314 PolarHBondContact O-ND2 3.36Å; C311-N314 CarbonylContact O-C 3.48Å; C311-N314 PolarHBondContact O-N 2.68Å; N314-P318 WeakPolarHBondContact O-CD 3.2Å
315L75.4Confident84.2Confident81 Ų8188.3 Ų88.342%0.42443%0.434SS..  trans-76.5-23.4-172.4-164.164.2000113.2C311 Y317 P318 I319C311-L315 WeakPolarHBondContact O-CA 3.4Å; C311-L315 WeakPolarHBondContact O-CB 3.31Å; C311-L315 PolarHBondContact O-N 3.45Å; L315-Y317 VanDerWaalsContact C-N 3.3Å; L315-Y317 PolarHBondContact O-N 3.37Å; L315-P318 VanDerWaalsContact C-CD 3.5Å; L315-P318 HydrophobicContact CD1-CG 4.28Å; L315-P318 WeakPolarHBondContact O-CD 2.97Å; L315-P318 VanDerWaalsContact O-CG 3.29Å; L315-P318 WeakPolarHBondContact O-CG 3.29Å; L315-I319 HydrophobicContact CD1-CD1 4.29Å; L315-I319 HydrophobicContact CD1-CG1 4.3Å; L315-I319 HydrophobicContact CD2-CD1 3.67Å; L315-I319 HydrophobicContact CG-CD1 3.47Å; L315-I319 VanDerWaalsContact CG-CD1 3.47Å; L315-I319 HydrophobicContact CG-CG1 3.89Å; L315-I319 WeakPolarHBondContact O-CB 3.44Å; L315-I319 VanDerWaalsContact O-CG1 3.31Å; L315-I319 WeakPolarHBondContact O-CG1 3.49Å; L315-I319 PolarHBondContact O-N 3.3Å; L315-I319 VanDerWaalsContact O-N 3.1Å
316E73.3Confident84.1Confident142 Ų14293.7 Ų93.766%0.66445%0.453SS*.Hα-helixtrans-59-42.9-178.7-65.7-179.3176.700111.9Q320E316-Q320 WeakPolarHBondContact O-CB 3.38Å; E316-Q320 VanDerWaalsContact O-CG 3.23Å; E316-Q320 WeakPolarHBondContact O-CG 3.33Å; E316-Q320 PolarHBondContact O-N 2.86Å
317Y68.6Low83.9Confident182 Ų18298.9 Ų98.971%0.71447%0.471SS*.Hα-helixtrans-66.2-52.1-178.8-166.4-94000114.2L315 I319 Q320 W321L315-Y317 VanDerWaalsContact C-N 3.3Å; L315-Y317 PolarHBondContact O-N 3.37Å; Y317-I319 VanDerWaalsContact C-N 3.34Å; Y317-I319 PolarHBondContact O-N 2.87Å; Y317-Q320 PolarHBondContact O-N 3.49Å; Y317-W321 WeakPolarHBondContact O-CB 3.18Å; Y317-W321 PolarHBondContact O-N 2.8Å
318P78.3Confident83.4Confident55 Ų55101.1 Ų101.136%0.35748%0.477SS..Hα-helixtrans-66.4-32.817726.6-35000112.6N314 L315 W321 L322N314-P318 WeakPolarHBondContact O-CD 3.2Å; L315-P318 VanDerWaalsContact C-CD 3.5Å; L315-P318 HydrophobicContact CD1-CG 4.28Å; L315-P318 WeakPolarHBondContact O-CD 2.97Å; L315-P318 VanDerWaalsContact O-CG 3.29Å; L315-P318 WeakPolarHBondContact O-CG 3.29Å; P318-W321 PolarHBondContact O-N 3.37Å; P318-L322 WeakPolarHBondContact O-CB 3.42Å; P318-L322 PolarHBondContact O-N 3.44Å
319I79.3Confident83Confident95 Ų95100.8 Ų100.849%0.48748%0.479SS..Hα-helixtrans-66.5-46.3174.7-71.4179000110.8L315 Y317 W321 L322 Y323L315-I319 HydrophobicContact CD1-CD1 4.29Å; L315-I319 HydrophobicContact CD1-CG1 4.3Å; L315-I319 HydrophobicContact CD2-CD1 3.67Å; L315-I319 HydrophobicContact CG-CD1 3.47Å; L315-I319 VanDerWaalsContact CG-CD1 3.47Å; L315-I319 HydrophobicContact CG-CG1 3.89Å; L315-I319 WeakPolarHBondContact O-CB 3.44Å; L315-I319 VanDerWaalsContact O-CG1 3.31Å; L315-I319 WeakPolarHBondContact O-CG1 3.49Å; L315-I319 PolarHBondContact O-N 3.3Å; L315-I319 VanDerWaalsContact O-N 3.1Å; Y317-I319 VanDerWaalsContact C-N 3.34Å; Y317-I319 PolarHBondContact O-N 2.87Å; I319-W321 VanDerWaalsContact C-N 3.29Å; I319-W321 PolarHBondContact O-N 2.85Å; I319-L322 PolarHBondContact O-N 3.35Å; I319-Y323 WeakPolarHBondContact O-CB 3.43Å; I319-Y323 PolarHBondContact O-N 2.85Å
320Q78.3Confident82.5Confident117 Ų117107.4 Ų107.455%0.54750%0.504SS..Hα-helixtrans-60.4-42.1175.8-76.7175.6-300111.2E316 Y317 Y323 I324E316-Q320 WeakPolarHBondContact O-CB 3.38Å; E316-Q320 VanDerWaalsContact O-CG 3.23Å; E316-Q320 WeakPolarHBondContact O-CG 3.33Å; E316-Q320 PolarHBondContact O-N 2.86Å; Y317-Q320 PolarHBondContact O-N 3.49Å; Q320-Y323 PolarHBondContact O-N 3.46Å; Q320-I324 WeakPolarHBondContact O-CB 3.48Å; Q320-I324 WeakPolarHBondContact O-CD1 3.27Å; Q320-I324 WeakPolarHBondContact O-CG1 3.22Å; Q320-I324 PolarHBondContact O-N 3.39Å
321W85Confident81.5Confident159 Ų159109.4 Ų109.460%0.60251%0.51SS*.Hα-helixtrans-64.5-43.1176.4-172.384.1000112.7Y317 P318 I319 I324 T325Y317-W321 WeakPolarHBondContact O-CB 3.18Å; Y317-W321 PolarHBondContact O-N 2.8Å; P318-W321 PolarHBondContact O-N 3.37Å; I319-W321 VanDerWaalsContact C-N 3.29Å; I319-W321 PolarHBondContact O-N 2.85Å; W321-I324 PolarHBondContact O-N 2.95Å; W321-T325 WeakPolarHBondContact O-CB 3.35Å; W321-T325 PolarHBondContact O-N 2.93Å; W321-T325 PolarHBondContact O-OG1 3.41Å
322L87Confident80.5Confident113 Ų113110.3 Ų110.359%0.59252%0.522SS*.Hα-helixtrans-60.5-44.4172.9-107.8155.4000111.5P318 I319 T325 Y326P318-L322 WeakPolarHBondContact O-CB 3.42Å; P318-L322 PolarHBondContact O-N 3.44Å; I319-L322 PolarHBondContact O-N 3.35Å; L322-T325 PolarHBondContact O-N 2.83Å; L322-Y326 WeakPolarHBondContact O-CB 3.31Å; L322-Y326 PolarHBondContact O-N 3.3Å
323Y86.1Confident79.3Confident147 Ų147112.2 Ų112.258%0.57653%0.534SS*.Hα-helixtrans-64.9-44.2178.1177.3-103.3000112.2I319 Q320 T325 Y326 R327I319-Y323 WeakPolarHBondContact O-CB 3.43Å; I319-Y323 PolarHBondContact O-N 2.85Å; Q320-Y323 PolarHBondContact O-N 3.46Å; Y323-T325 VanDerWaalsContact C-N 3.33Å; Y323-T325 PolarHBondContact O-N 3.43Å; Y323-Y326 PolarHBondContact O-N 3.44Å; Y323-R327 VanDerWaalsContact O-CB 3.27Å; Y323-R327 WeakPolarHBondContact O-CB 3.33Å; Y323-R327 PolarHBondContact O-N 2.94Å
324I85.3Confident78.5Confident83 Ų83116 Ų11643%0.42655%0.552SS.*Hα-helixtrans-61.9-44.2175.7-69.7163.1000110.2Q320 W321 R327 K328Q320-I324 WeakPolarHBondContact O-CB 3.48Å; Q320-I324 WeakPolarHBondContact O-CD1 3.27Å; Q320-I324 WeakPolarHBondContact O-CG1 3.22Å; Q320-I324 PolarHBondContact O-N 3.39Å; W321-I324 PolarHBondContact O-N 2.95Å; I324-R327 PolarHBondContact O-N 2.92Å; I324-K328 HydrophobicContact CG2-CD 4.18Å; I324-K328 WeakPolarHBondContact O-CB 3.31Å; I324-K328 VanDerWaalsContact O-CG 3.31Å; I324-K328 WeakPolarHBondContact O-CG 3.4Å; I324-K328 PolarHBondContact O-N 3.45Å
325T86.6Confident77.7Confident52 Ų52120 Ų12032%0.31957%0.565SS.*Hα-helixtrans-66.3-46179.6-560000110.9W321 L322 Y323 R327 K328 V329W321-T325 WeakPolarHBondContact O-CB 3.35Å; W321-T325 PolarHBondContact O-N 2.93Å; W321-T325 PolarHBondContact O-OG1 3.41Å; L322-T325 PolarHBondContact O-N 2.83Å; Y323-T325 VanDerWaalsContact C-N 3.33Å; Y323-T325 PolarHBondContact O-N 3.43Å; T325-R327 PolarHBondContact O-N 3.46Å; T325-K328 PolarHBondContact O-N 3.32Å; T325-V329 WeakPolarHBondContact O-CG2 3.35Å; T325-V329 PolarHBondContact O-N 2.89Å
326Y87.3Confident77.2Confident154 Ų154122 Ų12260%0.60458%0.582SS**Hα-helixtrans-57.1-48.4174.1176-99.8000111.7L322 Y323 K328 V329 Y330L322-Y326 WeakPolarHBondContact O-CB 3.31Å; L322-Y326 PolarHBondContact O-N 3.3Å; Y323-Y326 PolarHBondContact O-N 3.44Å; Y326-K328 VanDerWaalsContact C-N 3.34Å; Y326-K328 PolarHBondContact O-N 2.93Å; Y326-V329 PolarHBondContact O-N 3.21Å; Y326-Y330 WeakPolarHBondContact O-CB 3.32Å; Y326-Y330 PolarHBondContact O-N 2.92Å
327R87.9Confident77Confident131 Ų131121.6 Ų121.649%0.49459%0.589SS.*Hα-helixtrans-61-41177.1-173.6-175.6-171.1-1483.8112Y323 I324 T325 K331Y323-R327 VanDerWaalsContact O-CB 3.27Å; Y323-R327 WeakPolarHBondContact O-CB 3.33Å; Y323-R327 PolarHBondContact O-N 2.94Å; I324-R327 PolarHBondContact O-N 2.92Å; T325-R327 PolarHBondContact O-N 3.46Å; R327-K331 HydrophobicContact CG-CD 4.23Å; R327-K331 HydrophobicContact CG-CG 4.5Å; R327-K331 VanDerWaalsContact O-CB 3.31Å; R327-K331 WeakPolarHBondContact O-CB 3.32Å; R327-K331 WeakPolarHBondContact O-CG 3.26Å; R327-K331 PolarHBondContact O-N 2.76Å
328K81.8Confident77.2Confident148 Ų148118 Ų11864%0.64359%0.588SS**Hα-helixtrans-66.1-43178.2-79.4-179178.8-175.80111.6I324 T325 Y326 A332I324-K328 HydrophobicContact CG2-CD 4.18Å; I324-K328 WeakPolarHBondContact O-CB 3.31Å; I324-K328 VanDerWaalsContact O-CG 3.31Å; I324-K328 WeakPolarHBondContact O-CG 3.4Å; I324-K328 PolarHBondContact O-N 3.45Å; T325-K328 PolarHBondContact O-N 3.32Å; Y326-K328 VanDerWaalsContact C-N 3.34Å; Y326-K328 PolarHBondContact O-N 2.93Å; K328-A332 WeakPolarHBondContact O-CB 3.45Å; K328-A332 PolarHBondContact O-N 3.16Å
329V83.7Confident76.9Confident95 Ų95121 Ų12158%0.57661%0.608SS**Hα-helixtrans-66.5-43.7177.51730000111.1T325 Y326 A332 T333T325-V329 WeakPolarHBondContact O-CG2 3.35Å; T325-V329 PolarHBondContact O-N 2.89Å; Y326-V329 PolarHBondContact O-N 3.21Å; V329-A332 PolarHBondContact O-N 3.26Å; V329-T333 PolarHBondContact O-N 3.28Å; V329-T333 PolarHBondContact O-OG1 2.89Å
330Y79.5Confident76.9Confident145 Ų145125.7 Ų125.757%0.56962%0.619SS**Hα-helixtrans-63.3-47.3177.3-170.9-97.3000111.9Y326 A332 T333Y326-Y330 WeakPolarHBondContact O-CB 3.32Å; Y326-Y330 PolarHBondContact O-N 2.92Å; Y330-A332 PolarHBondContact O-N 2.92Å; Y330-T333 VanDerWaalsContact O-CB 3.26Å; Y330-T333 WeakPolarHBondContact O-CB 3.17Å; Y330-T333 PolarHBondContact O-N 3.15Å; Y330-T333 VanDerWaalsContact O-N 3.15Å
331K69.7Low77.3Confident107 Ų107127.4 Ų127.447%0.46563%0.632SS.*Hα-helixtrans-70.3-29.9177.9-73.3-170.7169.5-153.70114.1R327 T333 E334R327-K331 HydrophobicContact CG-CD 4.23Å; R327-K331 HydrophobicContact CG-CG 4.5Å; R327-K331 VanDerWaalsContact O-CB 3.31Å; R327-K331 WeakPolarHBondContact O-CB 3.32Å; R327-K331 WeakPolarHBondContact O-CG 3.26Å; R327-K331 PolarHBondContact O-N 2.76Å; K331-T333 PolarHBondContact O-N 3.34Å; K331-E334 PolarHBondContact O-N 3.45Å; K331-E334 VanDerWaalsContact O-N 3.16Å
332A65.7Low77.3Confident83 Ų83124.1 Ų124.169%0.68663%0.625SS**Hα-helixtrans-67.6-16.417300000112.7K328 V329 Y330K328-A332 WeakPolarHBondContact O-CB 3.45Å; K328-A332 PolarHBondContact O-N 3.16Å; V329-A332 PolarHBondContact O-N 3.26Å; Y330-A332 PolarHBondContact O-N 2.92Å
333T62.7Low77.5Confident111 Ų111121.7 Ų121.768%0.68162%0.615SS**Hα-helixtrans-79.4-22.1174.7-50.90000111.6V329 Y330 K331 K335V329-T333 PolarHBondContact O-N 3.28Å; V329-T333 PolarHBondContact O-OG1 2.89Å; Y330-T333 VanDerWaalsContact O-CB 3.26Å; Y330-T333 WeakPolarHBondContact O-CB 3.17Å; Y330-T333 PolarHBondContact O-N 3.15Å; Y330-T333 VanDerWaalsContact O-N 3.15Å; K331-T333 PolarHBondContact O-N 3.34Å; T333-K335 PolarHBondContact O-N 3.5Å
334E66.4Low77.5Confident130 Ų130122.9 Ų122.961%0.60763%0.626SS**SBendtrans-80.997.7170.3-70.4176.916400109.4K331 P336K331-E334 PolarHBondContact O-N 3.45Å; K331-E334 VanDerWaalsContact O-N 3.16Å; E334-P336 WeakPolarHBondContact O-CD 3.41Å
335K64.3Low77.7Confident191 Ų191123.4 Ų123.483%0.8363%0.627SS**PPolyproline II helixtrans-62.1123174.1-69.9-179.7179.6179.40109.4T333 V337T333-K335 PolarHBondContact O-N 3.5Å; K335-V337 PolarHBondContact O-N 3.27Å
336P65Low77.9Confident121 Ų121124.5 Ų124.579%0.78663%0.628SS**PPolyproline II helixtrans-64.6124.9173.225.5-30.9000109.2E334E334-P336 WeakPolarHBondContact O-CD 3.41Å
337V68.3Low78.1Confident134 Ų134125.2 Ų125.281%0.81263%0.631SS**PPolyproline II helixtrans-67.8124.6176.5-1780000107.8K335K335-V337 PolarHBondContact O-N 3.27Å
338P73.1Confident78.1Confident106 Ų106124.6 Ų124.669%0.68863%0.628SS**PPolyproline II helixtrans-61.9141.9178.125.1-32.5000110R340P338-R340 PolarHBondContact O-N 2.84Å
339P72.3Confident78.7Confident119 Ų119121.4 Ų121.477%0.77362%0.618SS**PPolyproline II helixtrans-59.9137.4177.325.1-32.4000109.9L341P339-L341 PolarHBondContact O-N 3.43Å
340R80.1Confident79.2Confident194 Ų194122 Ų12273%0.73261%0.614SS**PPolyproline II helixtrans-63.1129.1177.6170.3174162.9171.7-8.8109.5P338 E346P338-R340 PolarHBondContact O-N 2.84Å; R340-E346 IonicContact NH2-OE1 3.52Å; R340-E346 PolarHBondContact NH2-OE1 3.41Å; R340-E346 IonicContact NH2-OE2 3.66Å
341L84.9Confident79.9Confident153 Ų153116.7 Ų116.780%0.80160%0.604SS**PPolyproline II helixtrans-69.6146.9170.7-63.2176.6000109.9P339P339-L341 PolarHBondContact O-N 3.43Å
342L86.9Confident81Confident89 Ų89116.7 Ų116.747%0.46661%0.605SS.*PPolyproline II helixtrans-65.3138.5175.4-154.365.4000109.1E346 Y347L342-E346 HydrophobicContact CD1-CB 3.52Å; L342-E346 HydrophobicContact CD1-CG 4.26Å; L342-E346 HydrophobicContact CD2-CB 4.21Å; L342-E346 HydrophobicContact CG-CB 3.5Å; L342-E346 VanDerWaalsContact CG-CB 3.5Å; L342-Y347 HydrophobicContact CD2-CD2 4.49Å
343T89.3Confident82.5Confident62 Ų62115.9 Ų115.938%0.3859%0.592SS.*PPolyproline II helixtrans-71.8156.5170.458.50000110.2E345 E346 Y347T343-E345 PolarHBondContact O-N 2.69Å; T343-E346 PolarHBondContact N-OE2 2.89Å; T343-E346 PolarHBondContact O-N 3.03Å; T343-E346 VanDerWaalsContact O-N 3.14Å; T343-E346 WeakPolarHBondContact OG1-CB 3.33Å; T343-E346 WeakPolarHBondContact OG1-CG 3.38Å; T343-E346 PolarHBondContact OG1-N 3.44Å; T343-E346 PolarHBondContact OG1-OE2 3.41Å; T343-Y347 PolarHBondContact O-N 3.33Å
344E86.8Confident84.1Confident173 Ų173115.3 Ų115.381%0.80858%0.581SS**Hα-helixtrans-56.2-39.1179.7-177.1173.2-17300112.2Y347 R348E344-Y347 WeakPolarHBondContact O-CB 3.2Å; E344-Y347 PolarHBondContact O-N 3.14Å; E344-R348 WeakPolarHBondContact O-CB 3.36Å; E344-R348 PolarHBondContact O-N 2.98Å
345E88.8Confident85.4Confident94 Ų94112.7 Ų112.744%0.43957%0.574SS.*Hα-helixtrans-68.7-42.5177.1-175.659.1-167.400112.3T343 Y347 R348 I349T343-E345 PolarHBondContact O-N 2.69Å; E345-Y347 VanDerWaalsContact C-N 3.27Å; E345-Y347 PolarHBondContact O-N 3.4Å; E345-R348 PolarHBondContact O-N 2.83Å; E345-R348 IonicContact OE1-CZ 2.7Å; E345-R348 IonicContact OE1-NE 2.92Å; E345-R348 IonicContact OE1-NH2 3.41Å; E345-R348 PolarHBondContact OE1-NH2 2.94Å; E345-R348 IonicContact OE2-CZ 2.85Å; E345-R348 IonicContact OE2-NE 2.72Å; E345-R348 PolarHBondContact OE2-NE 3.45Å; E345-R348 IonicContact OE2-NH2 3.94Å; E345-R348 PolarHBondContact OE2-NH2 2.92Å; E345-I349 HydrophobicContact CG-CD1 4Å; E345-I349 WeakPolarHBondContact O-CB 3.15Å; E345-I349 VanDerWaalsContact O-CG1 3.28Å; E345-I349 WeakPolarHBondContact O-CG1 3.28Å; E345-I349 PolarHBondContact O-N 2.99Å
346E91.4Very high86.8Confident74 Ų74110.8 Ų110.835%0.34656%0.562SS.*Hα-helixtrans-62.3-36.7174.1-75.6163.8164.800111.2R340 L342 T343 Q350R340-E346 IonicContact NH2-OE1 3.52Å; R340-E346 PolarHBondContact NH2-OE1 3.41Å; R340-E346 IonicContact NH2-OE2 3.66Å; L342-E346 HydrophobicContact CD1-CB 3.52Å; L342-E346 HydrophobicContact CD1-CG 4.26Å; L342-E346 HydrophobicContact CD2-CB 4.21Å; L342-E346 HydrophobicContact CG-CB 3.5Å; L342-E346 VanDerWaalsContact CG-CB 3.5Å; T343-E346 PolarHBondContact N-OE2 2.89Å; T343-E346 PolarHBondContact O-N 3.03Å; T343-E346 VanDerWaalsContact O-N 3.14Å; T343-E346 WeakPolarHBondContact OG1-CB 3.33Å; T343-E346 WeakPolarHBondContact OG1-CG 3.38Å; T343-E346 PolarHBondContact OG1-N 3.44Å; T343-E346 PolarHBondContact OG1-OE2 3.41Å; E346-Q350 VanDerWaalsContact O-CB 3.28Å; E346-Q350 WeakPolarHBondContact O-CB 3.41Å; E346-Q350 PolarHBondContact O-N 3.28Å
347Y91.3Very high88.3Confident169 Ų169109.8 Ų109.866%0.66355%0.545SS*.Hα-helixtrans-65.7-45.5174.4175.9-100.9000112L342 T343 E344 E345 Q350 G351L342-Y347 HydrophobicContact CD2-CD2 4.49Å; T343-Y347 PolarHBondContact O-N 3.33Å; E344-Y347 WeakPolarHBondContact O-CB 3.2Å; E344-Y347 PolarHBondContact O-N 3.14Å; E345-Y347 VanDerWaalsContact C-N 3.27Å; E345-Y347 PolarHBondContact O-N 3.4Å; Y347-Q350 PolarHBondContact O-N 3.39Å; Y347-G351 PolarHBondContact O-N 3.02Å
348R88.5Confident89.6Confident118 Ų118106 Ų10645%0.44553%0.528SS..Hα-helixtrans-61-49.8178.3-170.9-178.471.288.6-4.6111.5E344 E345 Q350 G351 E352E344-R348 WeakPolarHBondContact O-CB 3.36Å; E344-R348 PolarHBondContact O-N 2.98Å; E345-R348 PolarHBondContact O-N 2.83Å; E345-R348 IonicContact OE1-CZ 2.7Å; E345-R348 IonicContact OE1-NE 2.92Å; E345-R348 IonicContact OE1-NH2 3.41Å; E345-R348 PolarHBondContact OE1-NH2 2.94Å; E345-R348 IonicContact OE2-CZ 2.85Å; E345-R348 IonicContact OE2-NE 2.72Å; E345-R348 PolarHBondContact OE2-NE 3.45Å; E345-R348 IonicContact OE2-NH2 3.94Å; E345-R348 PolarHBondContact OE2-NH2 2.92Å; R348-Q350 VanDerWaalsContact C-N 3.32Å; R348-Q350 PolarHBondContact O-N 3.46Å; R348-G351 PolarHBondContact O-N 2.97Å; R348-G351 VanDerWaalsContact O-N 3.16Å; R348-E352 IonicContact CZ-OE1 3.78Å; R348-E352 IonicContact NH1-OE1 2.7Å; R348-E352 PolarHBondContact NH1-OE1 2.86Å; R348-E352 PolarHBondContact O-N 3.29Å
349I93.8Very high90.7Very high81 Ų81102.7 Ų102.742%0.41550%0.504SS..Hα-helixtrans-60.1-43.8177.9-67.7168.4000110.6E345 G351 E352 V353E345-I349 HydrophobicContact CG-CD1 4Å; E345-I349 WeakPolarHBondContact O-CB 3.15Å; E345-I349 VanDerWaalsContact O-CG1 3.28Å; E345-I349 WeakPolarHBondContact O-CG1 3.28Å; E345-I349 PolarHBondContact O-N 2.99Å; I349-G351 VanDerWaalsContact C-N 3.32Å; I349-G351 PolarHBondContact O-N 3.35Å; I349-E352 PolarHBondContact O-N 3.46Å; I349-V353 HydrophobicContact CG2-CG2 4.34Å; I349-V353 WeakPolarHBondContact O-CG2 3.43Å; I349-V353 PolarHBondContact O-N 3.06Å
350Q94.8Very high91.7Very high107 Ų107101.8 Ų101.850%0.549%0.49SS..Hα-helixtrans-63.1-40.3177.9-173.5173.4-12.100111.6E346 Y347 R348 V353 E354E346-Q350 VanDerWaalsContact O-CB 3.28Å; E346-Q350 WeakPolarHBondContact O-CB 3.41Å; E346-Q350 PolarHBondContact O-N 3.28Å; Y347-Q350 PolarHBondContact O-N 3.39Å; R348-Q350 VanDerWaalsContact C-N 3.32Å; R348-Q350 PolarHBondContact O-N 3.46Å; Q350-V353 PolarHBondContact O-N 3.09Å; Q350-E354 HydrophobicContact CG-CG 4.34Å; Q350-E354 WeakPolarHBondContact O-CB 3.5Å; Q350-E354 WeakPolarHBondContact O-CG 3.28Å; Q350-E354 PolarHBondContact O-N 3.01Å
351G94.6Very high92.4Very high34 Ų3497.5 Ų97.535%0.35148%0.478SS..Hα-helixtrans-59.2-46.1173.800000112.5Y347 R348 I349 T355Y347-G351 PolarHBondContact O-N 3.02Å; R348-G351 PolarHBondContact O-N 2.97Å; R348-G351 VanDerWaalsContact O-N 3.16Å; I349-G351 VanDerWaalsContact C-N 3.32Å; I349-G351 PolarHBondContact O-N 3.35Å; G351-T355 WeakPolarHBondContact O-CB 3.37Å; G351-T355 PolarHBondContact O-N 3.27Å; G351-T355 PolarHBondContact O-OG1 3.5Å
352E93.1Very high92.8Very high108 Ų10894 Ų9451%0.50546%0.46SS..Hα-helixtrans-63.4-45.6178.1-71.8175.9-168.900112.3R348 I349 R356R348-E352 IonicContact CZ-OE1 3.78Å; R348-E352 IonicContact NH1-OE1 2.7Å; R348-E352 PolarHBondContact NH1-OE1 2.86Å; R348-E352 PolarHBondContact O-N 3.29Å; I349-E352 PolarHBondContact O-N 3.46Å; E352-R356 WeakPolarHBondContact O-CB 3.48Å; E352-R356 PolarHBondContact O-N 3.47Å
353V96.3Very high93Very high65 Ų6592.8 Ų92.839%0.39445%0.449SS..Hα-helixtrans-66.3-48.2-178171.90000111.5I349 Q350 R356 K357I349-V353 HydrophobicContact CG2-CG2 4.34Å; I349-V353 WeakPolarHBondContact O-CG2 3.43Å; I349-V353 PolarHBondContact O-N 3.06Å; Q350-V353 PolarHBondContact O-N 3.09Å; V353-R356 PolarHBondContact O-N 2.93Å; V353-K357 WeakPolarHBondContact O-CB 3.3Å; V353-K357 PolarHBondContact O-N 3.16Å
354E96Very high93.1Very high99 Ų9996.6 Ų96.646%0.46346%0.462SS..Hα-helixtrans-69.1-36.8179.8-68.9-63.7166.200111.6Q350 K357 A358Q350-E354 HydrophobicContact CG-CG 4.34Å; Q350-E354 WeakPolarHBondContact O-CB 3.5Å; Q350-E354 WeakPolarHBondContact O-CG 3.28Å; Q350-E354 PolarHBondContact O-N 3.01Å; E354-K357 PolarHBondContact O-N 3.32Å; E354-A358 VanDerWaalsContact O-CB 3.3Å; E354-A358 WeakPolarHBondContact O-CB 3.43Å; E354-A358 PolarHBondContact O-N 2.96Å
355T94.5Very high93.3Very high75 Ų7593.5 Ų93.546%0.4645%0.446SS..Hα-helixtrans-63.5-46.5175.4-59.80000110.9G351 K357 A358 L359G351-T355 WeakPolarHBondContact O-CB 3.37Å; G351-T355 PolarHBondContact O-N 3.27Å; G351-T355 PolarHBondContact O-OG1 3.5Å; T355-K357 VanDerWaalsContact C-N 3.34Å; T355-K357 PolarHBondContact O-N 3.21Å; T355-A358 PolarHBondContact O-N 3.3Å; T355-L359 HydrophobicContact CG2-CD1 3.99Å; T355-L359 HydrophobicContact CG2-CG 4.46Å; T355-L359 WeakPolarHBondContact O-CB 3.38Å; T355-L359 VanDerWaalsContact O-CG 3.25Å; T355-L359 WeakPolarHBondContact O-CG 3.4Å; T355-L359 PolarHBondContact O-N 3.5Å
356R93.4Very high93.3Very high152 Ų15290.2 Ų90.257%0.57443%0.433SS*.Hα-helixtrans-59.1-47.7176.4-179.3-178.661.9-177.6-2.5111.1E352 V353 A358 L359 E360E352-R356 WeakPolarHBondContact O-CB 3.48Å; E352-R356 PolarHBondContact O-N 3.47Å; V353-R356 PolarHBondContact O-N 2.93Å; R356-A358 PolarHBondContact O-N 2.93Å; R356-L359 PolarHBondContact O-N 3.23Å; R356-E360 WeakPolarHBondContact O-CG 3.35Å; R356-E360 PolarHBondContact O-N 3.39Å
357K96.4Very high93.1Very high99 Ų9992.1 Ų92.143%0.4345%0.446SS..Hα-helixtrans-60.3-46.8179.5-173.6-174.7175.1-158.70111.7V353 E354 T355 L359 E360 E361V353-K357 WeakPolarHBondContact O-CB 3.3Å; V353-K357 PolarHBondContact O-N 3.16Å; E354-K357 PolarHBondContact O-N 3.32Å; T355-K357 VanDerWaalsContact C-N 3.34Å; T355-K357 PolarHBondContact O-N 3.21Å; K357-L359 VanDerWaalsContact C-N 3.31Å; K357-L359 PolarHBondContact O-N 3.05Å; K357-E360 PolarHBondContact O-N 3.25Å; K357-E361 WeakPolarHBondContact CE-OE1 3.45Å; K357-E361 IonicContact NZ-OE1 3.25Å; K357-E361 WeakPolarHBondContact O-CG 3.25Å; K357-E361 PolarHBondContact O-N 3.42Å
358A96.1Very high92.9Very high54 Ų5485.6 Ų85.645%0.44643%0.425SS..Hα-helixtrans-63.4-35.7178.300000112.7E354 T355 R356 L362E354-A358 VanDerWaalsContact O-CB 3.3Å; E354-A358 WeakPolarHBondContact O-CB 3.43Å; E354-A358 PolarHBondContact O-N 2.96Å; T355-A358 PolarHBondContact O-N 3.3Å; R356-A358 PolarHBondContact O-N 2.93Å; A358-L362 VanDerWaalsContact O-CB 3.27Å; A358-L362 WeakPolarHBondContact O-CB 3.45Å; A358-L362 PolarHBondContact O-N 2.91Å
359L95.2Very high92.7Very high38 Ų3886.2 Ų86.220%0.19944%0.444CS..Hα-helixtrans-69.4-36.9175.4-70.8170000112.5T355 R356 K357 L362 R363 F389 H395T355-L359 HydrophobicContact CG2-CD1 3.99Å; T355-L359 HydrophobicContact CG2-CG 4.46Å; T355-L359 WeakPolarHBondContact O-CB 3.38Å; T355-L359 VanDerWaalsContact O-CG 3.25Å; T355-L359 WeakPolarHBondContact O-CG 3.4Å; T355-L359 PolarHBondContact O-N 3.5Å; R356-L359 PolarHBondContact O-N 3.23Å; K357-L359 VanDerWaalsContact C-N 3.31Å; K357-L359 PolarHBondContact O-N 3.05Å; L359-L362 PolarHBondContact O-N 3.45Å; L359-R363 WeakPolarHBondContact O-CG 3.27Å; L359-R363 PolarHBondContact O-N 3.45Å; L359-R363 VanDerWaalsContact O-N 3.09Å; L359-F389 HydrophobicContact CD2-CE2 4.17Å; L359-F389 HydrophobicContact CD2-CZ 4.03Å; L359-H395 WeakPolarHBondContact CD1-CE1 3.37Å; L359-H395 WeakPolarHBondContact CD1-ND1 3.49Å; L359-H395 HydrophobicContact CD2-CB 4.46Å
360E93.9Very high92.1Very high99 Ų9988.9 Ų88.946%0.46346%0.459SS..Hα-helixtrans-66.1-48.9173.5-73.9170.7-173.900111.1R356 K357 L362 R363 E364R356-E360 WeakPolarHBondContact O-CG 3.35Å; R356-E360 PolarHBondContact O-N 3.39Å; K357-E360 PolarHBondContact O-N 3.25Å; E360-L362 VanDerWaalsContact C-N 3.25Å; E360-L362 PolarHBondContact O-N 2.94Å; E360-R363 WeakPolarHBondContact O-CB 3.15Å; E360-R363 PolarHBondContact O-N 3.23Å; E360-E364 PolarHBondContact O-N 3.48Å
361E94.6Very high91.7Very high105 Ų10584.6 Ų84.649%0.49144%0.441SS..Hα-helixtrans-57.5-39.2174.7-72.5177.6-174.900111.7K357 E364 F365K357-E361 WeakPolarHBondContact CE-OE1 3.45Å; K357-E361 IonicContact NZ-OE1 3.25Å; K357-E361 WeakPolarHBondContact O-CG 3.25Å; K357-E361 PolarHBondContact O-N 3.42Å; E361-E364 PolarHBondContact O-N 3.21Å; E361-F365 WeakPolarHBondContact O-CB 3.36Å; E361-F365 PolarHBondContact O-N 3.07Å
362L92.8Very high91.2Very high79 Ų7986 Ų8641%0.41445%0.445SS..Hα-helixtrans-63.7-41.6175.6-179.163000112A358 L359 E360 F365 C366 F389A358-L362 VanDerWaalsContact O-CB 3.27Å; A358-L362 WeakPolarHBondContact O-CB 3.45Å; A358-L362 PolarHBondContact O-N 2.91Å; L359-L362 PolarHBondContact O-N 3.45Å; E360-L362 VanDerWaalsContact C-N 3.25Å; E360-L362 PolarHBondContact O-N 2.94Å; L362-F365 PolarHBondContact O-N 2.65Å; L362-C366 WeakPolarHBondContact O-CB 3.47Å; L362-C366 PolarHBondContact O-N 3.25Å; L362-C366 PolarHBondContact O-SG 3.06Å; L362-F389 HydrophobicContact CD2-CE1 3.98Å; L362-F389 HydrophobicContact CD2-CZ 4.21Å; L362-F389 HydrophobicContact CG-CE1 4.27Å
363R91.8Very high90.8Very high64 Ų6483.6 Ų83.624%0.24244%0.444CS..Hα-helixtrans-65.2-44.8176.7-74.1170.7172.9-180-4111.6L359 E360 F365 C366 N367 F389 G392 S393L359-R363 WeakPolarHBondContact O-CG 3.27Å; L359-R363 PolarHBondContact O-N 3.45Å; L359-R363 VanDerWaalsContact O-N 3.09Å; E360-R363 WeakPolarHBondContact O-CB 3.15Å; E360-R363 PolarHBondContact O-N 3.23Å; R363-F365 VanDerWaalsContact C-N 3.32Å; R363-F365 PolarHBondContact O-N 3.48Å; R363-C366 PolarHBondContact O-N 2.92Å; R363-N367 PolarHBondContact O-N 2.7Å; R363-N367 PolarHBondContact O-ND2 2.97Å; R363-N367 VanDerWaalsContact O-ND2 3.16Å; R363-F389 HydrophobicContact CG-CD1 4.47Å; R363-F389 HydrophobicContact CG-CE1 3.79Å; R363-F389 HydrophobicContact CG-CE2 4.12Å; R363-F389 HydrophobicContact CG-CZ 3.6Å; R363-F389 VanDerWaalsContact NE-CE2 3.34Å; R363-F389 PolarHBondContact NE-O 2.89Å; R363-F389 VanDerWaalsContact NE-O 3.14Å; R363-G392 VanDerWaalsContact NH2-C 3.34Å; R363-G392 PolarHBondContact NH2-O 3.08Å; R363-S393 PolarHBondContact NH2-O 3.01Å
364E91.6Very high90.1Very high142 Ų14291 Ų9166%0.66447%0.465SS*.Hα-helixtrans-59.6-44.9175.6-71.7-174.3173.300111.1E360 E361 C366 N367 S368E360-E364 PolarHBondContact O-N 3.48Å; E361-E364 PolarHBondContact O-N 3.21Å; E364-C366 PolarHBondContact O-N 3.27Å; E364-N367 PolarHBondContact O-N 3.16Å; E364-S368 PolarHBondContact O-N 3.13Å
365F91.3Very high89.6Confident108 Ų10891.9 Ų91.947%0.47447%0.467SS..Hα-helixtrans-59.3-45.9175.2178.3-103.3000111.7E361 L362 R363 N367 S368 D370 C371E361-F365 WeakPolarHBondContact O-CB 3.36Å; E361-F365 PolarHBondContact O-N 3.07Å; L362-F365 PolarHBondContact O-N 2.65Å; R363-F365 VanDerWaalsContact C-N 3.32Å; R363-F365 PolarHBondContact O-N 3.48Å; F365-N367 VanDerWaalsContact C-N 3.26Å; F365-N367 PolarHBondContact O-N 3.41Å; F365-S368 WeakPolarHBondContact O-CB 3.49Å; F365-S368 PolarHBondContact O-N 2.9Å; F365-S368 VanDerWaalsContact O-N 3.07Å; F365-S368 PolarHBondContact O-OG 3.49Å; F365-D370 HydrophobicContact CE2-CB 4.48Å; F365-C371 HydrophobicContact CD1-CB 4.32Å; F365-C371 HydrophobicContact CE1-CB 4.02Å; F365-C371 HydrophobicContact CZ-CB 4.28Å; F365-C371 VanDerWaalsContact O-CB 3.25Å; F365-C371 WeakPolarHBondContact O-CB 3.47Å
366C88.4Confident89.3Confident24 Ų2490.2 Ų90.216%0.16246%0.457CS..Hα-helixtrans-64.3-27.9178.7-70.10000114L362 R363 E364 F386 V390L362-C366 WeakPolarHBondContact O-CB 3.47Å; L362-C366 PolarHBondContact O-N 3.25Å; L362-C366 PolarHBondContact O-SG 3.06Å; R363-C366 PolarHBondContact O-N 2.92Å; E364-C366 PolarHBondContact O-N 3.27Å; C366-F386 HydrophobicContact CB-CZ 4.44Å; C366-V390 HydrophobicContact CB-CG1 4.09Å; C366-V390 HydrophobicContact CB-CG2 3.79Å
367N85.9Confident89Confident114 Ų11485.1 Ų85.161%0.6144%0.443SS*.Hα-helixtrans-84.8-11174.5-73.9-44.4000113.5R363 E364 F365 V390R363-N367 PolarHBondContact O-N 2.7Å; R363-N367 PolarHBondContact O-ND2 2.97Å; R363-N367 VanDerWaalsContact O-ND2 3.16Å; E364-N367 PolarHBondContact O-N 3.16Å; F365-N367 VanDerWaalsContact C-N 3.26Å; F365-N367 PolarHBondContact O-N 3.41Å; N367-V390 WeakPolarHBondContact OD1-CG1 3.25Å
368S88.6Confident88.5Confident32 Ų3284.8 Ų84.822%0.22445%0.453CS..SBendtrans-77.8152.3179.680.30000112.2E364 F365 D370 C371E364-S368 PolarHBondContact O-N 3.13Å; F365-S368 WeakPolarHBondContact O-CB 3.49Å; F365-S368 PolarHBondContact O-N 2.9Å; F365-S368 VanDerWaalsContact O-N 3.07Å; F365-S368 PolarHBondContact O-OG 3.49Å; S368-D370 PolarHBondContact O-N 2.66Å; S368-D370 VanDerWaalsContact O-N 3.13Å; S368-D370 PolarHBondContact OG-N 2.72Å; S368-C371 PolarHBondContact O-N 2.95Å
369P83.1Confident88.2Confident131 Ų13191.3 Ų91.385%0.85147%0.466SS*.THydrogen-bonded Turntrans-65.4-12.9175.728.8-35.9000113.4C371P369-C371 VanDerWaalsContact C-N 3.32Å
370D82.4Confident87.9Confident137 Ų13791.9 Ų91.973%0.73347%0.469SS*.THydrogen-bonded Turntrans-80.1-14.5179.2-63-35.5000112.6F365 S368F365-D370 HydrophobicContact CE2-CB 4.48Å; S368-D370 PolarHBondContact O-N 2.66Å; S368-D370 VanDerWaalsContact O-N 3.13Å; S368-D370 PolarHBondContact OG-N 2.72Å
371C84.8Confident87.6Confident17 Ų1796.6 Ų96.612%0.11549%0.491CS..SBendtrans-86.2116175.3-167.70000111.5F365 S368 P369 A373F365-C371 HydrophobicContact CD1-CB 4.32Å; F365-C371 HydrophobicContact CE1-CB 4.02Å; F365-C371 HydrophobicContact CZ-CB 4.28Å; F365-C371 VanDerWaalsContact O-CB 3.25Å; F365-C371 WeakPolarHBondContact O-CB 3.47Å; S368-C371 PolarHBondContact O-N 2.95Å; P369-C371 VanDerWaalsContact C-N 3.32Å; C371-A373 PolarHBondContact O-N 3.39Å
372S85Confident87.4Confident63 Ų6394.3 Ų94.344%0.44149%0.486SS..  trans-73.984.6173.759.30000111.6W374 K375 T376S372-W374 PolarHBondContact O-N 2.92Å; S372-K375 PolarHBondContact O-N 3Å; S372-K375 VanDerWaalsContact O-N 3.09Å; S372-K375 WeakPolarHBondContact OG-CB 3.37Å; S372-T376 PolarHBondContact O-N 3Å; S372-T376 PolarHBondContact O-OG1 3.14Å
373A84.1Confident87.2Confident58 Ų5893.4 Ų93.448%0.47949%0.485SS..Hα-helixtrans-48.1-49.4-173.700000114C371 K375 T376 V377C371-A373 PolarHBondContact O-N 3.39Å; A373-K375 PolarHBondContact O-N 3.36Å; A373-T376 PolarHBondContact O-N 3.09Å; A373-V377 WeakPolarHBondContact O-CB 3.07Å; A373-V377 VanDerWaalsContact O-CG2 3.27Å; A373-V377 WeakPolarHBondContact O-CG2 3.46Å; A373-V377 PolarHBondContact O-N 2.91Å
374W82Confident87Confident221 Ų22198.1 Ų98.184%0.83751%0.507SS*.Hα-helixtrans-67.7-33-177.8-66.2118.4000114.1S372 S378S372-W374 PolarHBondContact O-N 2.92Å; W374-S378 WeakPolarHBondContact O-CB 3.43Å; W374-S378 PolarHBondContact O-N 3.36Å; W374-S378 VanDerWaalsContact O-N 3.08Å
375K86.2Confident86.9Confident117 Ų11795.5 Ų95.551%0.50949%0.492SS..Hα-helixtrans-73-37.3176.4-175.3-179.4179.6-1770110.7S372 A373 S378 R379S372-K375 PolarHBondContact O-N 3Å; S372-K375 VanDerWaalsContact O-N 3.09Å; S372-K375 WeakPolarHBondContact OG-CB 3.37Å; A373-K375 PolarHBondContact O-N 3.36Å; K375-S378 PolarHBondContact O-OG 3.47Å; K375-R379 WeakPolarHBondContact O-CG 3.49Å
376T86.7Confident86.8Confident40 Ų4092.6 Ų92.625%0.24548%0.479CS..Hα-helixtrans-66.1-48.5174.1-54.40000110.6S372 A373 S378 R379 I380 F386S372-T376 PolarHBondContact O-N 3Å; S372-T376 PolarHBondContact O-OG1 3.14Å; A373-T376 PolarHBondContact O-N 3.09Å; T376-S378 VanDerWaalsContact C-N 3.28Å; T376-S378 PolarHBondContact O-N 3.03Å; T376-R379 PolarHBondContact O-N 3.17Å; T376-I380 PolarHBondContact O-N 3.02Å; T376-F386 HydrophobicContact CG2-CE1 4.19Å; T376-F386 HydrophobicContact CG2-CE2 4.48Å; T376-F386 HydrophobicContact CG2-CZ 3.87Å
377V87.3Confident86.9Confident46 Ų4694 Ų9428%0.27949%0.492SS..Hα-helixtrans-59.1-35.7178.5169.60000112.7A373 R379 I380 P383A373-V377 WeakPolarHBondContact O-CB 3.07Å; A373-V377 VanDerWaalsContact O-CG2 3.27Å; A373-V377 WeakPolarHBondContact O-CG2 3.46Å; A373-V377 PolarHBondContact O-N 2.91Å; V377-R379 PolarHBondContact O-N 3.04Å; V377-I380 HydrophobicContact CG2-CD1 4.4Å; V377-I380 VanDerWaalsContact O-CG1 3.3Å; V377-I380 WeakPolarHBondContact O-CG1 3.48Å; V377-P383 HydrophobicContact CG1-CB 4.02Å; V377-P383 HydrophobicContact CG1-CG 4.16Å
378S86.8Confident87.1Confident92 Ų9291.7 Ų91.764%0.64348%0.48SS*.THydrogen-bonded Turntrans-67.7-18.4176.770.20000115.1W374 K375 T376W374-S378 WeakPolarHBondContact O-CB 3.43Å; W374-S378 PolarHBondContact O-N 3.36Å; W374-S378 VanDerWaalsContact O-N 3.08Å; K375-S378 PolarHBondContact O-OG 3.47Å; T376-S378 VanDerWaalsContact C-N 3.28Å; T376-S378 PolarHBondContact O-N 3.03Å
379R89.5Confident87.2Confident191 Ų19191 Ų9172%0.72147%0.472SS*.THydrogen-bonded Turntrans-103.4-17.5-173-70.8176.6175.1-161.4-5.9113.5K375 T376 V377K375-R379 WeakPolarHBondContact O-CG 3.49Å; T376-R379 PolarHBondContact O-N 3.17Å; V377-R379 PolarHBondContact O-N 3.04Å
380I89.6Confident87.6Confident49 Ų4985.9 Ų85.925%0.25144%0.439SS..  trans-89.9143.8-176.656177.7000111.1T376 V377 P383 F386T376-I380 PolarHBondContact O-N 3.02Å; V377-I380 HydrophobicContact CG2-CD1 4.4Å; V377-I380 VanDerWaalsContact O-CG1 3.3Å; V377-I380 WeakPolarHBondContact O-CG1 3.48Å; I380-P383 HydrophobicContact CD1-CB 4.37Å; I380-P383 HydrophobicContact CG1-CG 4.29Å; I380-F386 HydrophobicContact CD1-CB 3.45Å; I380-F386 VanDerWaalsContact CD1-CB 3.45Å; I380-F386 HydrophobicContact CD1-CD1 3.52Å; I380-F386 HydrophobicContact CD1-CD2 4.32Å; I380-F386 HydrophobicContact CD1-CE1 4.35Å; I380-F386 HydrophobicContact CD1-CG 3.5Å; I380-F386 VanDerWaalsContact CD1-CG 3.5Å
381Q88.1Confident87.8Confident199 Ų19987.3 Ų87.393%0.9344%0.441SS*.SBendtrans-70.5-36.6-178.3-69.7-177.9-400112.9
382S88.9Confident87.9Confident56 Ų5688.6 Ų88.639%0.39246%0.457SS..  trans-127.485.6-17753.20000112K384 R385 F386S382-K384 VanDerWaalsContact C-N 3.26Å; S382-K384 PolarHBondContact O-N 3.09Å; S382-R385 PolarHBondContact O-N 3.2Å; S382-F386 PolarHBondContact O-N 3.38Å
383P89.3Confident88.1Confident60 Ų6088.6 Ų88.639%0.3946%0.457SS..Hα-helixtrans-55.2-36.5-179.9-29.937000114.9V377 I380 F386 A387V377-P383 HydrophobicContact CG1-CB 4.02Å; V377-P383 HydrophobicContact CG1-CG 4.16Å; I380-P383 HydrophobicContact CD1-CB 4.37Å; I380-P383 HydrophobicContact CG1-CG 4.29Å; P383-F386 PolarHBondContact O-N 2.77Å; P383-A387 PolarHBondContact O-N 3.3Å
384K87.9Confident88.3Confident163 Ų16389.6 Ų89.671%0.70946%0.46SS*.Hα-helixtrans-64.3-49.8179.9-171.9-177.8177.6-175.70112.1S382 F386 A387 D388S382-K384 VanDerWaalsContact C-N 3.26Å; S382-K384 PolarHBondContact O-N 3.09Å; K384-F386 VanDerWaalsContact C-N 3.25Å; K384-F386 PolarHBondContact O-N 3.23Å; K384-A387 PolarHBondContact O-N 3.18Å; K384-A387 VanDerWaalsContact O-N 3.14Å; K384-D388 VanDerWaalsContact O-CG 3.27Å; K384-D388 PolarHBondContact O-N 3.07Å
385R89.3Confident88.6Confident88 Ų8882.5 Ų82.533%0.33244%0.436SS..Hα-helixtrans-61.2-36.7178.4-178.3-179.7168.61760.5111.8S382 F389 H395 E400S382-R385 PolarHBondContact O-N 3.2Å; R385-F389 WeakPolarHBondContact O-CB 3.27Å; R385-F389 PolarHBondContact O-N 3.25Å; R385-F389 VanDerWaalsContact O-N 3.07Å; R385-H395 PolarHBondContact NH2-O 2.94Å; R385-E400 IonicContact CZ-OE1 2.74Å; R385-E400 IonicContact CZ-OE2 3.55Å; R385-E400 IonicContact NH1-OE1 2.72Å; R385-E400 PolarHBondContact NH1-OE1 3.49Å; R385-E400 IonicContact NH1-OE2 3.09Å; R385-E400 VanDerWaalsContact NH2-CD 3.3Å; R385-E400 IonicContact NH2-OE1 3.43Å; R385-E400 PolarHBondContact NH2-OE1 3.04Å; R385-E400 VanDerWaalsContact NH2-OE1 3.09Å; R385-E400 IonicContact NH2-OE2 3.34Å; R385-E400 PolarHBondContact NH2-OE2 2.82Å
386F90.2Very high88.7Confident47 Ų4780.4 Ų80.421%0.20643%0.43CS..Hα-helixtrans-66.6-43.7174.9176.2-103.3000112.3C366 T376 I380 S382 P383 K384 F389 V390C366-F386 HydrophobicContact CB-CZ 4.44Å; T376-F386 HydrophobicContact CG2-CE1 4.19Å; T376-F386 HydrophobicContact CG2-CE2 4.48Å; T376-F386 HydrophobicContact CG2-CZ 3.87Å; I380-F386 HydrophobicContact CD1-CB 3.45Å; I380-F386 VanDerWaalsContact CD1-CB 3.45Å; I380-F386 HydrophobicContact CD1-CD1 3.52Å; I380-F386 HydrophobicContact CD1-CD2 4.32Å; I380-F386 HydrophobicContact CD1-CE1 4.35Å; I380-F386 HydrophobicContact CD1-CG 3.5Å; I380-F386 VanDerWaalsContact CD1-CG 3.5Å; S382-F386 PolarHBondContact O-N 3.38Å; P383-F386 PolarHBondContact O-N 2.77Å; K384-F386 VanDerWaalsContact C-N 3.25Å; K384-F386 PolarHBondContact O-N 3.23Å; F386-F389 WeakPolarHBondContact O-CB 3.45Å; F386-F389 PolarHBondContact O-N 3Å; F386-V390 HydrophobicContact CD1-CG2 4.4Å; F386-V390 HydrophobicContact CD2-CG2 4.45Å; F386-V390 HydrophobicContact CE1-CG2 3.97Å; F386-V390 HydrophobicContact CE2-CG2 4.02Å; F386-V390 HydrophobicContact CZ-CG2 3.77Å; F386-V390 WeakPolarHBondContact O-CG2 3.49Å; F386-V390 PolarHBondContact O-N 3.21Å
387A88.7Confident88.8Confident52 Ų5280.8 Ų80.843%0.4343%0.433SS..Hα-helixtrans-60.1-46.9175.700000111.5P383 K384 F389 V390 E391P383-A387 PolarHBondContact O-N 3.3Å; K384-A387 PolarHBondContact O-N 3.18Å; K384-A387 VanDerWaalsContact O-N 3.14Å; A387-F389 VanDerWaalsContact C-N 3.26Å; A387-F389 PolarHBondContact O-N 2.99Å; A387-V390 PolarHBondContact O-N 3.36Å; A387-V390 VanDerWaalsContact O-N 3.17Å; A387-E391 PolarHBondContact O-N 3.02Å
388D89.9Confident88.9Confident67 Ų6784 Ų8436%0.35846%0.455SS..Hα-helixtrans-59.5-37.5177.5-60.6-24.4000111.5K384 G392 S393K384-D388 VanDerWaalsContact O-CG 3.27Å; K384-D388 PolarHBondContact O-N 3.07Å; D388-G392 PolarHBondContact O-N 3.28Å; D388-S393 WeakPolarHBondContact O-CB 3.45Å; D388-S393 PolarHBondContact O-N 3.1Å; D388-S393 PolarHBondContact O-OG 2.96Å; D388-S393 VanDerWaalsContact O-OG 3.04Å
389F92.4Very high89.1Confident16 Ų1685 Ų857%0.0745%0.453CS..Hα-helixtrans-66.3-43.4175.6165.3-102.9000113.1L359 L362 R363 R385 F386 A387 E391 G392 H395L359-F389 HydrophobicContact CD2-CE2 4.17Å; L359-F389 HydrophobicContact CD2-CZ 4.03Å; L362-F389 HydrophobicContact CD2-CE1 3.98Å; L362-F389 HydrophobicContact CD2-CZ 4.21Å; L362-F389 HydrophobicContact CG-CE1 4.27Å; R363-F389 HydrophobicContact CG-CD1 4.47Å; R363-F389 HydrophobicContact CG-CE1 3.79Å; R363-F389 HydrophobicContact CG-CE2 4.12Å; R363-F389 HydrophobicContact CG-CZ 3.6Å; R363-F389 VanDerWaalsContact NE-CE2 3.34Å; R363-F389 PolarHBondContact NE-O 2.89Å; R363-F389 VanDerWaalsContact NE-O 3.14Å; R385-F389 WeakPolarHBondContact O-CB 3.27Å; R385-F389 PolarHBondContact O-N 3.25Å; R385-F389 VanDerWaalsContact O-N 3.07Å; F386-F389 WeakPolarHBondContact O-CB 3.45Å; F386-F389 PolarHBondContact O-N 3Å; A387-F389 VanDerWaalsContact C-N 3.26Å; A387-F389 PolarHBondContact O-N 2.99Å; F389-E391 VanDerWaalsContact C-N 3.27Å; F389-E391 PolarHBondContact O-N 3.27Å; F389-G392 PolarHBondContact O-N 3.41Å; F389-G392 VanDerWaalsContact O-N 3.09Å; F389-H395 HydrophobicContact CD2-CB 3.64Å; F389-H395 HydrophobicContact CE2-CB 3.75Å
390V89.8Confident89.1Confident25 Ų2579.2 Ų79.215%0.15243%0.434CS..Hα-helixtrans-65.9-33.1178.31750000111C366 N367 F386 A387 G392C366-V390 HydrophobicContact CB-CG1 4.09Å; C366-V390 HydrophobicContact CB-CG2 3.79Å; N367-V390 WeakPolarHBondContact OD1-CG1 3.25Å; F386-V390 HydrophobicContact CD1-CG2 4.4Å; F386-V390 HydrophobicContact CD2-CG2 4.45Å; F386-V390 HydrophobicContact CE1-CG2 3.97Å; F386-V390 HydrophobicContact CE2-CG2 4.02Å; F386-V390 HydrophobicContact CZ-CG2 3.77Å; F386-V390 WeakPolarHBondContact O-CG2 3.49Å; F386-V390 PolarHBondContact O-N 3.21Å; A387-V390 PolarHBondContact O-N 3.36Å; A387-V390 VanDerWaalsContact O-N 3.17Å; V390-G392 PolarHBondContact O-N 2.73Å
391E88.1Confident89.1Confident167 Ų16780 Ų8078%0.7844%0.441SS*.THydrogen-bonded Turntrans-72.5-11.4174.3-166.2169.2-169.700113.3A387 F389A387-E391 PolarHBondContact O-N 3.02Å; F389-E391 VanDerWaalsContact C-N 3.27Å; F389-E391 PolarHBondContact O-N 3.27Å
392G86.5Confident89.1Confident43 Ų4373.2 Ų73.244%0.44342%0.415SS..THydrogen-bonded Turntrans120.2-2.8172.200000115.1R363 D388 F389 V390R363-G392 VanDerWaalsContact NH2-C 3.34Å; R363-G392 PolarHBondContact NH2-O 3.08Å; D388-G392 PolarHBondContact O-N 3.28Å; F389-G392 PolarHBondContact O-N 3.41Å; F389-G392 VanDerWaalsContact O-N 3.09Å; V390-G392 PolarHBondContact O-N 2.73Å
393S89.2Confident89.2Confident63 Ų6373.7 Ų73.744%0.44142%0.416SS..  trans-67.5156.5177-53.60000112.1R363 D388 H395R363-S393 PolarHBondContact NH2-O 3.01Å; D388-S393 WeakPolarHBondContact O-CB 3.45Å; D388-S393 PolarHBondContact O-N 3.1Å; D388-S393 PolarHBondContact O-OG 2.96Å; D388-S393 VanDerWaalsContact O-OG 3.04Å; S393-H395 PolarHBondContact O-N 3.44Å
394S87.9Confident89.1Confident79 Ų7976.4 Ų76.455%0.55242%0.423SS*.  trans-55.3139.6177.3-177.90000111.6L396S394-L396 WeakPolarHBondContact CB-O 3.22Å; S394-L396 PolarHBondContact O-N 3.48Å; S394-L396 PolarHBondContact OG-N 3.31Å; S394-L396 PolarHBondContact OG-O 2.85Å
395H87.8Confident89Confident72 Ų7274.9 Ų74.933%0.33342%0.419SS..SBendtrans-68.7-20.5173.566.9-71.5000112.4L359 R385 F389 S393L359-H395 WeakPolarHBondContact CD1-CE1 3.37Å; L359-H395 WeakPolarHBondContact CD1-ND1 3.49Å; L359-H395 HydrophobicContact CD2-CB 4.46Å; R385-H395 PolarHBondContact NH2-O 2.94Å; F389-H395 HydrophobicContact CD2-CB 3.64Å; F389-H395 HydrophobicContact CE2-CB 3.75Å; S393-H395 PolarHBondContact O-N 3.44Å
396L89.8Confident88.7Confident73 Ų7378.1 Ų78.138%0.38244%0.437SS..SBendtrans-102.1138.1177.6-56.8176.1000110.6S394 V401S394-L396 WeakPolarHBondContact CB-O 3.22Å; S394-L396 PolarHBondContact O-N 3.48Å; S394-L396 PolarHBondContact OG-N 3.31Å; S394-L396 PolarHBondContact OG-O 2.85Å; L396-V401 HydrophobicContact CB-CG2 3.77Å; L396-V401 HydrophobicContact CD1-CG2 4.11Å
397T88.9Confident88.4Confident48 Ų4881 Ų8129%0.29445%0.451SS..  trans-79.6150.4171.162.10000110.3N399 E400 V401T397-N399 PolarHBondContact O-N 3.31Å; T397-N399 VanDerWaalsContact O-N 3.13Å; T397-E400 PolarHBondContact N-OE2 3.36Å; T397-E400 PolarHBondContact O-N 3.48Å; T397-E400 WeakPolarHBondContact OG1-CG 3.4Å; T397-E400 PolarHBondContact OG1-N 3.33Å; T397-E400 PolarHBondContact OG1-OE2 3.01Å; T397-V401 PolarHBondContact O-N 2.84Å; T397-V401 VanDerWaalsContact O-N 3.08Å
398P89.1Confident87.8Confident114 Ų11485.5 Ų85.574%0.7446%0.458SS*.Hα-helixtrans-55.9-32.6178.3-26.935000113.6V401 S402P398-V401 PolarHBondContact O-N 3.49Å; P398-S402 WeakPolarHBondContact O-CB 3.05Å; P398-S402 PolarHBondContact O-N 2.84Å; P398-S402 PolarHBondContact O-OG 3.48Å
399N90.2Very high87.2Confident112 Ų11283 Ų8360%0.59945%0.448SS*.Hα-helixtrans-70.3-37.5176.7-171.275000112.7T397 V401 S402 V403T397-N399 PolarHBondContact O-N 3.31Å; T397-N399 VanDerWaalsContact O-N 3.13Å; N399-V401 VanDerWaalsContact C-N 3.35Å; N399-S402 WeakPolarHBondContact CA-OG 3.33Å; N399-S402 PolarHBondContact O-N 2.82Å; N399-S402 PolarHBondContact O-OG 2.7Å; N399-V403 WeakPolarHBondContact O-CB 3.5Å; N399-V403 WeakPolarHBondContact O-CG2 3.34Å; N399-V403 PolarHBondContact O-N 3.09Å
400E90.1Very high86.2Confident71 Ų7188.6 Ų88.633%0.33248%0.478SS..Hα-helixtrans-67.1-39.1174.4-73.2161.1158.400111.1R385 T397 V403 H404R385-E400 IonicContact CZ-OE1 2.74Å; R385-E400 IonicContact CZ-OE2 3.55Å; R385-E400 IonicContact NH1-OE1 2.72Å; R385-E400 PolarHBondContact NH1-OE1 3.49Å; R385-E400 IonicContact NH1-OE2 3.09Å; R385-E400 VanDerWaalsContact NH2-CD 3.3Å; R385-E400 IonicContact NH2-OE1 3.43Å; R385-E400 PolarHBondContact NH2-OE1 3.04Å; R385-E400 VanDerWaalsContact NH2-OE1 3.09Å; R385-E400 IonicContact NH2-OE2 3.34Å; R385-E400 PolarHBondContact NH2-OE2 2.82Å; T397-E400 PolarHBondContact N-OE2 3.36Å; T397-E400 PolarHBondContact O-N 3.48Å; T397-E400 WeakPolarHBondContact OG1-CG 3.4Å; T397-E400 PolarHBondContact OG1-N 3.33Å; T397-E400 PolarHBondContact OG1-OE2 3.01Å; E400-V403 PolarHBondContact O-N 3.29Å; E400-H404 WeakPolarHBondContact O-CB 3.49Å; E400-H404 PolarHBondContact O-N 3.14Å
401V89.3Confident85.2Confident66 Ų6690 Ų9040%0.450%0.498SS..Hα-helixtrans-64.3-45.3175.4179.60000110.5L396 T397 P398 N399 V403 H404 E405L396-V401 HydrophobicContact CB-CG2 3.77Å; L396-V401 HydrophobicContact CD1-CG2 4.11Å; T397-V401 PolarHBondContact O-N 2.84Å; T397-V401 VanDerWaalsContact O-N 3.08Å; P398-V401 PolarHBondContact O-N 3.49Å; N399-V401 VanDerWaalsContact C-N 3.35Å; V401-V403 PolarHBondContact O-N 3.13Å; V401-H404 PolarHBondContact O-N 3.08Å; V401-E405 WeakPolarHBondContact O-CB 3.19Å; V401-E405 PolarHBondContact O-N 3.21Å
402S87.8Confident84.1Confident55 Ų5583 Ų8339%0.38547%0.468SS..Hα-helixtrans-66.3-37.9178.964.30000112.8P398 N399 E405 Q406P398-S402 WeakPolarHBondContact O-CB 3.05Å; P398-S402 PolarHBondContact O-N 2.84Å; P398-S402 PolarHBondContact O-OG 3.48Å; N399-S402 WeakPolarHBondContact CA-OG 3.33Å; N399-S402 PolarHBondContact O-N 2.82Å; N399-S402 PolarHBondContact O-OG 2.7Å; S402-E405 PolarHBondContact O-N 3.29Å; S402-Q406 VanDerWaalsContact O-CB 3.28Å; S402-Q406 WeakPolarHBondContact O-CB 3.44Å; S402-Q406 PolarHBondContact O-N 3.36Å
403V90.4Very high83.1Confident67 Ų6785 Ų8541%0.40647%0.467SS..Hα-helixtrans-65.6-44.3175170.20000110.4N399 E400 V401 E405 Q406 E407N399-V403 WeakPolarHBondContact O-CB 3.5Å; N399-V403 WeakPolarHBondContact O-CG2 3.34Å; N399-V403 PolarHBondContact O-N 3.09Å; E400-V403 PolarHBondContact O-N 3.29Å; V401-V403 PolarHBondContact O-N 3.13Å; V403-E405 PolarHBondContact O-N 3.11Å; V403-Q406 PolarHBondContact O-N 3.49Å; V403-E407 WeakPolarHBondContact O-CB 3.42Å; V403-E407 PolarHBondContact O-N 3.33Å
404H87.3Confident82.1Confident117 Ų11786 Ų8654%0.54247%0.467SS..Hα-helixtrans-64-40.5176.6-178-76.4000112.2E400 V401 Q406 E407 Y408E400-H404 WeakPolarHBondContact O-CB 3.49Å; E400-H404 PolarHBondContact O-N 3.14Å; V401-H404 PolarHBondContact O-N 3.08Å; H404-Q406 VanDerWaalsContact C-N 3.32Å; H404-E407 PolarHBondContact O-N 3.44Å; H404-Y408 AromaticContact CD2-CD2 3.8Å; H404-Y408 AromaticContact NE2-CD2 3.9Å; H404-Y408 WeakPolarHBondContact O-CA 3.3Å; H404-Y408 WeakPolarHBondContact O-CB 3.3Å; H404-Y408 PolarHBondContact O-N 3.2Å
405E86Confident81.1Confident131 Ų13184.2 Ų84.261%0.61246%0.457SS*.Hα-helixtrans-67.9-32.9175.4-170.8173.5-171.500111.9V401 S402 V403 G409V401-E405 WeakPolarHBondContact O-CB 3.19Å; V401-E405 PolarHBondContact O-N 3.21Å; S402-E405 PolarHBondContact O-N 3.29Å; V403-E405 PolarHBondContact O-N 3.11Å; E405-G409 WeakPolarHBondContact O-CA 3.28Å; E405-G409 PolarHBondContact O-N 3.29Å
406Q84.3Confident79.9Confident155 Ų15585.7 Ų85.772%0.72446%0.464SS*.Hα-helixtrans-71.8-34.2173.6-175177.1-500112.6S402 V403 H404 S412S402-Q406 VanDerWaalsContact O-CB 3.28Å; S402-Q406 WeakPolarHBondContact O-CB 3.44Å; S402-Q406 PolarHBondContact O-N 3.36Å; V403-Q406 PolarHBondContact O-N 3.49Å; H404-Q406 VanDerWaalsContact C-N 3.32Å; Q406-S412 WeakPolarHBondContact O-CB 3.45Å
407E82.1Confident78.6Confident107 Ų10787.1 Ų87.150%0.547%0.472SS..Hα-helixtrans-87.4-34.2-176.9-169168.8-16200112.8V403 H404 S412V403-E407 WeakPolarHBondContact O-CB 3.42Å; V403-E407 PolarHBondContact O-N 3.33Å; H404-E407 PolarHBondContact O-N 3.44Å; E407-S412 WeakPolarHBondContact O-CB 3.41Å; E407-S412 PolarHBondContact O-OG 2.94Å
408Y77Confident77.4Confident147 Ų14791.2 Ų91.258%0.57649%0.488SS*.Hα-helixtrans-126.70.4-173.1-59.5-77000114.2H404H404-Y408 AromaticContact CD2-CD2 3.8Å; H404-Y408 AromaticContact NE2-CD2 3.9Å; H404-Y408 WeakPolarHBondContact O-CA 3.3Å; H404-Y408 WeakPolarHBondContact O-CB 3.3Å; H404-Y408 PolarHBondContact O-N 3.2Å
409G76.3Confident76.1Confident14 Ų1491 Ų9114%0.14448%0.479CS..SBendtrans-79.2174.6175.900000113E405 G411 S412 I413E405-G409 WeakPolarHBondContact O-CA 3.28Å; E405-G409 PolarHBondContact O-N 3.29Å; G409-G411 PolarHBondContact O-N 3.23Å; G409-G411 VanDerWaalsContact O-N 3.1Å; G409-S412 WeakPolarHBondContact O-CB 3.34Å; G409-S412 PolarHBondContact O-N 3.37Å; G409-I413 PolarHBondContact O-N 2.89Å
410L72.8Confident74.6Confident134 Ų13494 Ų9470%0.70248%0.483SS*.Hα-helixtrans-55.5-33.4-175.3-164.475000113I413 I414L410-I413 PolarHBondContact O-N 2.69Å; L410-I414 HydrophobicContact CD2-CD1 4.3Å; L410-I414 HydrophobicContact CG-CD1 3.94Å; L410-I414 WeakPolarHBondContact O-CD1 3.38Å; L410-I414 WeakPolarHBondContact O-CG1 3.38Å; L410-I414 PolarHBondContact O-N 2.94Å
411G68.3Low73.1Confident55 Ų5597.6 Ų97.657%0.56750%0.5SS*.Hα-helixtrans-68.3-29.7177.200000114.5G409 A415G409-G411 PolarHBondContact O-N 3.23Å; G409-G411 VanDerWaalsContact O-N 3.1Å; G411-A415 VanDerWaalsContact O-CB 3.3Å; G411-A415 WeakPolarHBondContact O-CB 3.21Å; G411-A415 PolarHBondContact O-N 2.89Å; G411-A415 VanDerWaalsContact O-N 3.11Å
412S64.4Low71.5Confident21 Ų21101.4 Ų101.415%0.14751%0.514CS..Hα-helixtrans-74-40.9174.3-174.40000111.5Q406 E407 G409 A415 Q416Q406-S412 WeakPolarHBondContact O-CB 3.45Å; E407-S412 WeakPolarHBondContact O-CB 3.41Å; E407-S412 PolarHBondContact O-OG 2.94Å; G409-S412 WeakPolarHBondContact O-CB 3.34Å; G409-S412 PolarHBondContact O-N 3.37Å; S412-A415 PolarHBondContact O-N 2.72Å; S412-Q416 WeakPolarHBondContact O-CB 3.43Å; S412-Q416 WeakPolarHBondContact O-CG 3.44Å; S412-Q416 PolarHBondContact O-N 3.4Å
413I65.9Low70Confident84 Ų84101.4 Ų101.443%0.43152%0.517SS..Hα-helixtrans-65.5-43.4178.6-60.2170.5000110.2G409 L410 Q416 D417G409-I413 PolarHBondContact O-N 2.89Å; L410-I413 PolarHBondContact O-N 2.69Å; I413-Q416 PolarHBondContact O-N 2.9Å; I413-D417 PolarHBondContact O-N 3.49Å
414I68.3Low68.2Low84 Ų84101.2 Ų101.243%0.43152%0.519SS..Hα-helixtrans-65.9-41.9175.7-65.8165.3000111.2L410 Q416 D417 E418L410-I414 HydrophobicContact CD2-CD1 4.3Å; L410-I414 HydrophobicContact CG-CD1 3.94Å; L410-I414 WeakPolarHBondContact O-CD1 3.38Å; L410-I414 WeakPolarHBondContact O-CG1 3.38Å; L410-I414 PolarHBondContact O-N 2.94Å; I414-Q416 VanDerWaalsContact C-N 3.34Å; I414-Q416 PolarHBondContact O-N 2.96Å; I414-D417 PolarHBondContact O-N 3.36Å; I414-E418 WeakPolarHBondContact O-CG 3.47Å; I414-E418 PolarHBondContact O-N 3.41Å
415A66.4Low66.5Low42 Ų42100 Ų10035%0.34752%0.523SS..Hα-helixtrans-66.6-34.9176.500000112.5G411 S412 I419G411-A415 VanDerWaalsContact O-CB 3.3Å; G411-A415 WeakPolarHBondContact O-CB 3.21Å; G411-A415 PolarHBondContact O-N 2.89Å; G411-A415 VanDerWaalsContact O-N 3.11Å; S412-A415 PolarHBondContact O-N 2.72Å; A415-I419 WeakPolarHBondContact O-CB 3.21Å; A415-I419 VanDerWaalsContact O-CD1 3.31Å; A415-I419 WeakPolarHBondContact O-CD1 3.31Å; A415-I419 WeakPolarHBondContact O-CG1 3.3Å; A415-I419 PolarHBondContact O-N 2.88Å
416Q63.3Low64.8Low103 Ų103102.1 Ų102.148%0.48153%0.533SS..Hα-helixtrans-66-46.2171.1-81.31732.400110.9S412 I413 I414 E418 I419 Y420S412-Q416 WeakPolarHBondContact O-CB 3.43Å; S412-Q416 WeakPolarHBondContact O-CG 3.44Å; S412-Q416 PolarHBondContact O-N 3.4Å; I413-Q416 PolarHBondContact O-N 2.9Å; I414-Q416 VanDerWaalsContact C-N 3.34Å; I414-Q416 PolarHBondContact O-N 2.96Å; Q416-E418 VanDerWaalsContact C-N 3.32Å; Q416-E418 PolarHBondContact O-N 2.86Å; Q416-I419 PolarHBondContact O-N 3.35Å; Q416-Y420 WeakPolarHBondContact O-CB 3.15Å; Q416-Y420 VanDerWaalsContact O-CD2 3.23Å; Q416-Y420 WeakPolarHBondContact O-CD2 3.47Å; Q416-Y420 PolarHBondContact O-N 2.73Å
417D61.8Low62.9Low103 Ų103103 Ų10355%0.55154%0.537SS*.Hα-helixtrans-59.9-39.5175.7-84.5-10.8000112.1I413 I414 Y420 E421I413-D417 PolarHBondContact O-N 3.49Å; I414-D417 PolarHBondContact O-N 3.36Å; D417-Y420 PolarHBondContact O-N 2.96Å; D417-E421 WeakPolarHBondContact O-CG 3.42Å; D417-E421 PolarHBondContact O-N 3.2Å
418E63.9Low60.9Low133 Ų133106.1 Ų106.162%0.62155%0.552SS**Hα-helixtrans-65.1-41.3174.4-75.5-179.7176.900112.5I414 Q416 Y420 E421 E422I414-E418 WeakPolarHBondContact O-CG 3.47Å; I414-E418 PolarHBondContact O-N 3.41Å; Q416-E418 VanDerWaalsContact C-N 3.32Å; Q416-E418 PolarHBondContact O-N 2.86Å; E418-Y420 VanDerWaalsContact C-N 3.35Å; E418-E421 PolarHBondContact O-N 3.22Å; E418-E422 WeakPolarHBondContact O-CB 3.49Å; E418-E422 PolarHBondContact O-N 3.04Å
419I62.2Low58.9Low111 Ų111106.8 Ų106.857%0.56957%0.565SS**Hα-helixtrans-67.6-36.1175.4-68.2163.6000111.2A415 Q416 A423A415-I419 WeakPolarHBondContact O-CB 3.21Å; A415-I419 VanDerWaalsContact O-CD1 3.31Å; A415-I419 WeakPolarHBondContact O-CD1 3.31Å; A415-I419 WeakPolarHBondContact O-CG1 3.3Å; A415-I419 PolarHBondContact O-N 2.88Å; Q416-I419 PolarHBondContact O-N 3.35Å; I419-A423 VanDerWaalsContact O-CB 3.26Å; I419-A423 WeakPolarHBondContact O-CB 3.44Å; I419-A423 PolarHBondContact O-N 2.83Å
420Y57.9Low56.8Low173 Ų173111.1 Ų111.168%0.67859%0.593SS**Hα-helixtrans-70.1-37.6175.4-92.2-80.1000111.9Q416 D417 E418 S424Q416-Y420 WeakPolarHBondContact O-CB 3.15Å; Q416-Y420 VanDerWaalsContact O-CD2 3.23Å; Q416-Y420 WeakPolarHBondContact O-CD2 3.47Å; Q416-Y420 PolarHBondContact O-N 2.73Å; D417-Y420 PolarHBondContact O-N 2.96Å; E418-Y420 VanDerWaalsContact C-N 3.35Å; Y420-S424 VanDerWaalsContact O-CB 3.3Å; Y420-S424 WeakPolarHBondContact O-CB 3.26Å; Y420-S424 PolarHBondContact O-N 3.44Å; Y420-S424 PolarHBondContact O-OG 3.2Å
421E58.5Low55Low148 Ų148114.9 Ų114.969%0.69260%0.6SS**Hα-helixtrans-67.1-43.2172.9-77.2-127.5159.700111.8D417 E418 A423 S424 S425D417-E421 WeakPolarHBondContact O-CG 3.42Å; D417-E421 PolarHBondContact O-N 3.2Å; E418-E421 PolarHBondContact O-N 3.22Å; E421-A423 PolarHBondContact O-N 3.49Å; E421-S424 WeakPolarHBondContact CA-OG 3.23Å; E421-S424 PolarHBondContact O-N 2.95Å; E421-S424 PolarHBondContact O-OG 2.76Å; E421-S425 PolarHBondContact O-N 2.83Å
422E56.4Low53.4Low145 Ų145116.8 Ų116.868%0.67861%0.605SS**Hα-helixtrans-65.3-40.4178.4-156.3167.8-151.400111.5E418 S425E418-E422 WeakPolarHBondContact O-CB 3.49Å; E418-E422 PolarHBondContact O-N 3.04Å; E422-S425 PolarHBondContact O-N 3.49Å; E422-S425 PolarHBondContact O-OG 3.48Å
423A56.8Low52Low56 Ų56127.1 Ų127.146%0.46364%0.64SS.*Hα-helixtrans-68.8-31.2173.300000113.6I419 E421 S425 E426I419-A423 VanDerWaalsContact O-CB 3.26Å; I419-A423 WeakPolarHBondContact O-CB 3.44Å; I419-A423 PolarHBondContact O-N 2.83Å; E421-A423 PolarHBondContact O-N 3.49Å; A423-S425 VanDerWaalsContact C-N 3.29Å; A423-S425 PolarHBondContact O-N 3.45Å; A423-E426 PolarHBondContact O-N 3.38Å
424S52.9Low50.2Low63 Ų63129.1 Ų129.144%0.44166%0.66SS.*Hα-helixtrans-71.2-24.6176.774.20000113.2Y420 E421 E426Y420-S424 VanDerWaalsContact O-CB 3.3Å; Y420-S424 WeakPolarHBondContact O-CB 3.26Å; Y420-S424 PolarHBondContact O-N 3.44Å; Y420-S424 PolarHBondContact O-OG 3.2Å; E421-S424 WeakPolarHBondContact CA-OG 3.23Å; E421-S424 PolarHBondContact O-N 2.95Å; E421-S424 PolarHBondContact O-OG 2.76Å; S424-E426 VanDerWaalsContact C-N 3.3Å; S424-E426 PolarHBondContact O-N 2.99Å
425S51Low48.9Very low91 Ų91131.3 Ų131.364%0.63668%0.68SS**THydrogen-bonded Turntrans-75.4-15.7178.774.80000114.2E421 E422 A423E421-S425 PolarHBondContact O-N 2.83Å; E422-S425 PolarHBondContact O-N 3.49Å; E422-S425 PolarHBondContact O-OG 3.48Å; A423-S425 VanDerWaalsContact C-N 3.29Å; A423-S425 PolarHBondContact O-N 3.45Å
426E49.7Very low47.2Very low175 Ų175134.1 Ų134.182%0.81870%0.704SS**THydrogen-bonded Turntrans-95.9-9.5176.6-65.2-167163.300113.7A423 S424A423-E426 PolarHBondContact O-N 3.38Å; S424-E426 VanDerWaalsContact C-N 3.3Å; S424-E426 PolarHBondContact O-N 2.99Å
427E45.6Very low45.8Very low173 Ų173137.5 Ų137.581%0.80872%0.723SS**  trans-127.219.5-173.1-67.2-161.8169.300116D429E427-D429 PolarHBondContact O-N 3.21Å
428E39.6Very low44.4Very low174 Ų174138.7 Ų138.781%0.81373%0.734SS**  trans-87.276.7167.9-80.1-159.3158.100112.5
429D35.4Very low42.9Very low160 Ų160140.4 Ų140.486%0.85674%0.742SS**  trans-158.983.9153.8-102.1-24.2000110.3E427E427-D429 PolarHBondContact O-N 3.21Å
430S31.7Very low41.6Very low105 Ų105142.1 Ų142.173%0.73475%0.753SS**  trans166.195.4139176.20000114.7
431Y35.1Very low40.6Very low213 Ų213140.6 Ų140.684%0.83576%0.756SS**  trans52.3121.2131-76.7-79.2000124.1
432S35.3Very low39.6Very low96 Ų96143.3 Ų143.367%0.67177%0.766SS**  90.9107.4118.6-83.30000123.6
433R33.5Very low38.8Very low237 Ų237144 Ų14489%0.89477%0.774SS**  72.4109.6107-152.2174.9-154.1159.26.1120.1
434C29.5Very low37.8Very low126 Ų126151.1 Ų151.185%0.85181%0.811SS**PPolyproline II helixtrans-86.7156.4162.5-590000113.1
435P40Very low37.1Very low131 Ų131155.5 Ų155.585%0.85183%0.83SS**PPolyproline II helixtrans-102.7158.7169.436.5-28000114.5
436A32.1Very low36.3Very low101 Ų101158.9 Ų158.984%0.83584%0.84SS**PPolyproline II helixtrans-91.7160.6-171.300000115
437I32.1Very low35.6Very low173 Ų173158 Ų15889%0.88784%0.841SS**PPolyproline II helixtrans-92.8133.9-179.2-67.3168.3000111
438T33.6Very low35Very low128 Ų128157.1 Ų157.179%0.78584%0.843SS**PPolyproline II helixtrans-90.4135.1179.3-37.90000112.7
439Q32.3Very low34.7Very low170 Ų170156.1 Ų156.179%0.79485%0.845SS**PPolyproline II helixtrans-98.3128.1177.1-170.4-18013.900109.6
440N34.2Very low34.7Very low147 Ų147155.8 Ų155.879%0.78685%0.845SS**  trans-112.3117.2172.1-86.9-6.5000111.1
441N36.9Very low34.9Very low141 Ų141159.4 Ų159.475%0.75485%0.852SS**  trans-84.7142.7161.6-78.1-28.4000109.6
442F38.7Very low34.9Very low205 Ų205155.3 Ų155.390%0.89985%0.854SS**  trans-138.8124150.9-99.3-81.8000109.8
443L38.2Very low34.9Very low159 Ų159160.3 Ų160.383%0.83287%0.869SS**  trans-126.2146.4171.7-156.1145.3000105.6
444T37.3Very low35Very low205 Ų205153.3 Ų153.3100%1.25887%0.867SS**  trans96.90179.7-17.70000115.9

Retrieved 444 of 444 residues in 757.9 ms (Link to these results)