A0A087Y6C9_POEFO Loading...

Forkhead box N4

AlphaFold DB , UniProt , Accession A0A087Y6C9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 515 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
1L49.3Very low50.6Low179 Ų179106.3 Ų106.394%0.93761%0.609SS**  0-530-166.857.5000111.1V3 L4 T5L1-V3 VanDerWaalsContact C-N 3.33Å; L1-V3 PolarHBondContact O-N 3.11Å; L1-V3 VanDerWaalsContact O-N 3.14Å; L1-L4 WeakPolarHBondContact O-CB 3.32Å; L1-L4 PolarHBondContact O-N 2.95Å; L1-T5 PolarHBondContact O-N 3.14Å
2E40.8Very low51.5Low165 Ų165109.7 Ų109.777%0.77161%0.612SS**Hα-helixtrans-50.8-38.9-172.6-60.6159.9135.100115.9L4 T5 A6E2-L4 VanDerWaalsContact C-N 3.26Å; E2-L4 PolarHBondContact O-N 3.23Å; E2-T5 CarbonylContact O-C 3.59Å; E2-T5 WeakPolarHBondContact O-CA 3.35Å; E2-T5 WeakPolarHBondContact O-CB 3.26Å; E2-T5 PolarHBondContact O-N 2.98Å; E2-A6 PolarHBondContact O-N 2.93Å
3V48.2Very low51.9Low117 Ų117113.7 Ų113.771%0.70961%0.614SS**Hα-helixtrans-60.4-35.1176.9-179.50000112.2L1 C7L1-V3 VanDerWaalsContact C-N 3.33Å; L1-V3 PolarHBondContact O-N 3.11Å; L1-V3 VanDerWaalsContact O-N 3.14Å; V3-C7 PolarHBondContact O-N 2.87Å; V3-C7 VanDerWaalsContact O-N 3.09Å; V3-C7 PolarHBondContact O-SG 3.01Å
4L50.7Low52.3Low109 Ų109113.4 Ų113.457%0.57161%0.611SS**Hα-helixtrans-69.2-43.5172.7-72.9164.3000110.5L1 E2 A6 C7 F8L1-L4 WeakPolarHBondContact O-CB 3.32Å; L1-L4 PolarHBondContact O-N 2.95Å; E2-L4 VanDerWaalsContact C-N 3.26Å; E2-L4 PolarHBondContact O-N 3.23Å; L4-A6 VanDerWaalsContact C-N 3.31Å; L4-A6 PolarHBondContact O-N 3.16Å; L4-C7 PolarHBondContact O-N 2.92Å; L4-F8 VanDerWaalsContact O-CD2 3.31Å; L4-F8 WeakPolarHBondContact O-CD2 3.42Å; L4-F8 PolarHBondContact O-N 3.06Å
5T58.8Low53Low91 Ų91116.5 Ų116.556%0.55861%0.612SS**Hα-helixtrans-57.4-43.5176-43.80000111.6L1 E2 F8 G9L1-T5 PolarHBondContact O-N 3.14Å; E2-T5 CarbonylContact O-C 3.59Å; E2-T5 WeakPolarHBondContact O-CA 3.35Å; E2-T5 WeakPolarHBondContact O-CB 3.26Å; E2-T5 PolarHBondContact O-N 2.98Å; T5-F8 PolarHBondContact O-N 3.07Å; T5-G9 PolarHBondContact O-N 3Å
6A46.9Very low53.3Low58 Ų58118.5 Ų118.548%0.47961%0.611SS.*Hα-helixtrans-64.1-42.4175.700000112.5E2 L4 G9 C10E2-A6 PolarHBondContact O-N 2.93Å; L4-A6 VanDerWaalsContact C-N 3.31Å; L4-A6 PolarHBondContact O-N 3.16Å; A6-G9 PolarHBondContact O-N 2.97Å; A6-C10 PolarHBondContact O-N 3.13Å; A6-C10 PolarHBondContact O-SG 3.02Å
7C49.3Very low53.3Low67 Ų67115.7 Ų115.745%0.45360%0.597SS.*Hα-helixtrans-63.3-44.8175-68.40000112V3 L4 C10 L11V3-C7 PolarHBondContact O-N 2.87Å; V3-C7 VanDerWaalsContact O-N 3.09Å; V3-C7 PolarHBondContact O-SG 3.01Å; L4-C7 PolarHBondContact O-N 2.92Å; C7-C10 PolarHBondContact O-N 3.36Å; C7-L11 VanDerWaalsContact O-CG 3.3Å; C7-L11 WeakPolarHBondContact O-CG 3.41Å; C7-L11 PolarHBondContact O-N 2.75Å
8F61.1Low53.5Low143 Ų143116.2 Ų116.263%0.62760%0.596SS**Hα-helixtrans-64.4-41.2176.4-86.1-72000112.1L4 T5 L11 F12L4-F8 VanDerWaalsContact O-CD2 3.31Å; L4-F8 WeakPolarHBondContact O-CD2 3.42Å; L4-F8 PolarHBondContact O-N 3.06Å; T5-F8 PolarHBondContact O-N 3.07Å; F8-L11 PolarHBondContact O-N 3.27Å; F8-F12 WeakPolarHBondContact O-CB 3.49Å; F8-F12 PolarHBondContact O-N 3.36Å
9G49.9Very low53.6Low42 Ų42114.8 Ų114.843%0.43359%0.586SS.*Hα-helixtrans-58.7-47173.800000112.7T5 A6 L11 F12 Y13T5-G9 PolarHBondContact O-N 3Å; A6-G9 PolarHBondContact O-N 2.97Å; G9-L11 VanDerWaalsContact C-N 3.35Å; G9-L11 PolarHBondContact O-N 3.22Å; G9-F12 PolarHBondContact O-N 3.26Å; G9-Y13 WeakPolarHBondContact O-CB 3.46Å; G9-Y13 PolarHBondContact O-N 2.93Å
10C45.8Very low53.2Low80 Ų80112.4 Ų112.454%0.54158%0.575SS.*Hα-helixtrans-62.7-39.3176.6-66.90000112.6A6 C7 N14A6-C10 PolarHBondContact O-N 3.13Å; A6-C10 PolarHBondContact O-SG 3.02Å; C7-C10 PolarHBondContact O-N 3.36Å; C10-N14 WeakPolarHBondContact O-CB 3.27Å; C10-N14 PolarHBondContact O-N 3.08Å; C10-N14 VanDerWaalsContact O-N 3.1Å; C10-N14 PolarHBondContact O-ND2 3.15Å
11L56.1Low52.9Low118 Ų118114.3 Ų114.362%0.61858%0.579SS**Hα-helixtrans-67.5-42.5176.6-72.6168.4000111.9C7 F8 G9 N14 Y15C7-L11 VanDerWaalsContact O-CG 3.3Å; C7-L11 WeakPolarHBondContact O-CG 3.41Å; C7-L11 PolarHBondContact O-N 2.75Å; F8-L11 PolarHBondContact O-N 3.27Å; G9-L11 VanDerWaalsContact C-N 3.35Å; G9-L11 PolarHBondContact O-N 3.22Å; L11-N14 PolarHBondContact O-N 3.21Å; L11-Y15 WeakPolarHBondContact O-CB 3.3Å; L11-Y15 PolarHBondContact O-N 3.1Å
12F61.4Low52.7Low147 Ų147111.2 Ų111.265%0.64556%0.56SS**Hα-helixtrans-67-41.1178.9-147.3-89.5000111.7F8 G9 Y15 Y16F8-F12 WeakPolarHBondContact O-CB 3.49Å; F8-F12 PolarHBondContact O-N 3.36Å; G9-F12 PolarHBondContact O-N 3.26Å; F12-Y15 PolarHBondContact O-N 3.31Å; F12-Y16 WeakPolarHBondContact O-CB 3.19Å; F12-Y16 PolarHBondContact O-N 3.41Å
13Y56.8Low52.9Low162 Ų162108.7 Ų108.764%0.63555%0.548SS*.Hα-helixtrans-63.9-40.2175.9-171.4-99000112.4G9 N17G9-Y13 WeakPolarHBondContact O-CB 3.46Å; G9-Y13 PolarHBondContact O-N 2.93Å; Y13-N17 VanDerWaalsContact CE1-ND2 3.3Å; Y13-N17 WeakPolarHBondContact CE1-ND2 3.32Å; Y13-N17 WeakPolarHBondContact O-CB 3.46Å; Y13-N17 PolarHBondContact O-N 3.48Å; Y13-N17 VanDerWaalsContact O-N 3.07Å; Y13-N17 PolarHBondContact O-ND2 2.95Å
14N57.6Low52.5Low109 Ų109110.8 Ų110.858%0.58355%0.552SS**Hα-helixtrans-67.6-40.6174.3-85.3-88.8000112.2C10 L11 H18C10-N14 WeakPolarHBondContact O-CB 3.27Å; C10-N14 PolarHBondContact O-N 3.08Å; C10-N14 VanDerWaalsContact O-N 3.1Å; C10-N14 PolarHBondContact O-ND2 3.15Å; L11-N14 PolarHBondContact O-N 3.21Å; N14-H18 WeakPolarHBondContact O-CB 3.47Å; N14-H18 PolarHBondContact O-N 3.44Å
15Y63Low52.2Low160 Ų160111.8 Ų111.863%0.62756%0.557SS**Hα-helixtrans-61.5-47.7175.8-175.7-94.3000111.6L11 F12 N17 H18 H19L11-Y15 WeakPolarHBondContact O-CB 3.3Å; L11-Y15 PolarHBondContact O-N 3.1Å; F12-Y15 PolarHBondContact O-N 3.31Å; Y15-N17 PolarHBondContact O-N 2.87Å; Y15-H18 PolarHBondContact O-N 3.2Å; Y15-H19 PolarHBondContact O-N 3.19Å
16Y56.6Low51.5Low149 Ų149116.2 Ų116.258%0.58457%0.571SS**Hα-helixtrans-64-41.3-179.7-162-98000112.4F12 H19 N20F12-Y16 WeakPolarHBondContact O-CB 3.19Å; F12-Y16 PolarHBondContact O-N 3.41Å; Y16-H19 PolarHBondContact O-N 2.94Å; Y16-N20 WeakPolarHBondContact CD1-ND2 3.35Å; Y16-N20 VanDerWaalsContact CE1-ND2 3.31Å; Y16-N20 WeakPolarHBondContact CE1-ND2 3.08Å; Y16-N20 PolarHBondContact O-N 3.43Å; Y16-N20 VanDerWaalsContact O-N 3.12Å; Y16-N20 PolarHBondContact O-ND2 3.28Å
17N54.7Low51.2Low71 Ų71116.7 Ų116.738%0.3858%0.581SS.*Hα-helixtrans-67-36.2174.3-84.5-84.8000112.9Y13 Y15 K21Y13-N17 VanDerWaalsContact CE1-ND2 3.3Å; Y13-N17 WeakPolarHBondContact CE1-ND2 3.32Å; Y13-N17 WeakPolarHBondContact O-CB 3.46Å; Y13-N17 PolarHBondContact O-N 3.48Å; Y13-N17 VanDerWaalsContact O-N 3.07Å; Y13-N17 PolarHBondContact O-ND2 2.95Å; Y15-N17 PolarHBondContact O-N 2.87Å; N17-K21 WeakPolarHBondContact O-CB 3.26Å; N17-K21 PolarHBondContact O-N 2.64Å
18H56.6Low50.7Low124 Ų124115.9 Ų115.957%0.57459%0.585SS**Hα-helixtrans-69.6-36.5177-164.1-65.6000112N14 Y15 Q22N14-H18 WeakPolarHBondContact O-CB 3.47Å; N14-H18 PolarHBondContact O-N 3.44Å; Y15-H18 PolarHBondContact O-N 3.2Å; H18-Q22 PolarHBondContact CE1-OE1 3.43Å; H18-Q22 PolarHBondContact ND1-OE1 2.74Å; H18-Q22 PolarHBondContact O-N 2.99Å
19H54.5Low49.4Very low90 Ų90117.1 Ų117.142%0.41760%0.596SS.*Hα-helixtrans-65.7-53176.3-156.8-78000111.4Y15 Y16 K21 Q22 E23Y15-H19 PolarHBondContact O-N 3.19Å; Y16-H19 PolarHBondContact O-N 2.94Å; H19-K21 VanDerWaalsContact C-N 3.26Å; H19-K21 PolarHBondContact O-N 2.97Å; H19-Q22 WeakPolarHBondContact O-CA 3.38Å; H19-Q22 WeakPolarHBondContact O-CB 3.09Å; H19-Q22 PolarHBondContact O-N 2.81Å; H19-E23 IonicContact CE1-OE1 2.66Å; H19-E23 IonicContact CE1-OE2 3.91Å; H19-E23 PolarHBondContact CE1-OE2 2.9Å; H19-E23 IonicContact CG-OE2 3.91Å; H19-E23 IonicContact ND1-OE1 2.68Å; H19-E23 IonicContact ND1-OE2 3.79Å; H19-E23 PolarHBondContact ND1-OE2 2.99Å; H19-E23 PolarHBondContact O-N 3.02Å; H19-E23 VanDerWaalsContact O-N 3.08Å
20N46.3Very low48.6Very low66 Ų66121.7 Ų121.735%0.35362%0.616SS.*Hα-helixtrans-61-33.7178.2-77.9-92.6000112.4Y16 Q22 E23 M24Y16-N20 WeakPolarHBondContact CD1-ND2 3.35Å; Y16-N20 VanDerWaalsContact CE1-ND2 3.31Å; Y16-N20 WeakPolarHBondContact CE1-ND2 3.08Å; Y16-N20 PolarHBondContact O-N 3.43Å; Y16-N20 VanDerWaalsContact O-N 3.12Å; Y16-N20 PolarHBondContact O-ND2 3.28Å; N20-Q22 VanDerWaalsContact C-N 3.32Å; N20-Q22 PolarHBondContact O-N 3.04Å; N20-E23 PolarHBondContact O-N 3.28Å; N20-M24 WeakPolarHBondContact O-CB 3.39Å; N20-M24 PolarHBondContact O-N 3.35Å
21K47.5Very low47.9Very low154 Ų154122.9 Ų122.967%0.6763%0.625SS**Hα-helixtrans-68.3-24.9172.1-93.8-169.8171.9-178.80114.1N17 H19 I25N17-K21 WeakPolarHBondContact O-CB 3.26Å; N17-K21 PolarHBondContact O-N 2.64Å; H19-K21 VanDerWaalsContact C-N 3.26Å; H19-K21 PolarHBondContact O-N 2.97Å; K21-I25 WeakPolarHBondContact O-CD1 3.45Å; K21-I25 WeakPolarHBondContact O-CG1 3.34Å
22Q45.2Very low46.6Very low114 Ų114128.8 Ų128.853%0.53364%0.639SS.*Hα-helixtrans-78.3-43.2172.6-73.1-175.7-115.300111.2H18 H19 N20 M24 I25 E26H18-Q22 PolarHBondContact CE1-OE1 3.43Å; H18-Q22 PolarHBondContact ND1-OE1 2.74Å; H18-Q22 PolarHBondContact O-N 2.99Å; H19-Q22 WeakPolarHBondContact O-CA 3.38Å; H19-Q22 WeakPolarHBondContact O-CB 3.09Å; H19-Q22 PolarHBondContact O-N 2.81Å; N20-Q22 VanDerWaalsContact C-N 3.32Å; N20-Q22 PolarHBondContact O-N 3.04Å; Q22-M24 VanDerWaalsContact C-N 3.32Å; Q22-M24 PolarHBondContact O-N 2.67Å; Q22-I25 PolarHBondContact O-N 2.74Å; Q22-E26 PolarHBondContact O-N 2.66Å
23E44Very low45.1Very low112 Ų112129.9 Ų129.952%0.52365%0.649SS.*Hα-helixtrans-64-35.2177.6-70.6170117.600112.4H19 N20 I25H19-E23 IonicContact CE1-OE1 2.66Å; H19-E23 IonicContact CE1-OE2 3.91Å; H19-E23 PolarHBondContact CE1-OE2 2.9Å; H19-E23 IonicContact CG-OE2 3.91Å; H19-E23 IonicContact ND1-OE1 2.68Å; H19-E23 IonicContact ND1-OE2 3.79Å; H19-E23 PolarHBondContact ND1-OE2 2.99Å; H19-E23 PolarHBondContact O-N 3.02Å; H19-E23 VanDerWaalsContact O-N 3.08Å; N20-E23 PolarHBondContact O-N 3.28Å; E23-I25 VanDerWaalsContact C-N 3.25Å; E23-I25 PolarHBondContact O-N 3.12Å
24M40.1Very low43.8Very low160 Ų160128 Ų12879%0.78866%0.659SS**Hα-helixtrans-69.9-13.5170.8-80.2-166.170.900114.9N20 Q22N20-M24 WeakPolarHBondContact O-CB 3.39Å; N20-M24 PolarHBondContact O-N 3.35Å; Q22-M24 VanDerWaalsContact C-N 3.32Å; Q22-M24 PolarHBondContact O-N 2.67Å
25I44.6Very low42.3Very low131 Ų131126 Ų12667%0.67266%0.663SS**Hα-helixtrans-99.7-26.4-177.7-72.4173.8000112.2K21 Q22 E23K21-I25 WeakPolarHBondContact O-CD1 3.45Å; K21-I25 WeakPolarHBondContact O-CG1 3.34Å; Q22-I25 PolarHBondContact O-N 2.74Å; E23-I25 VanDerWaalsContact C-N 3.25Å; E23-I25 PolarHBondContact O-N 3.12Å
26E42.8Very low40.7Very low183 Ų183126.1 Ų126.186%0.85567%0.674SS**Hα-helixtrans-77.7-12.4167.6-64.8-170.4137.200112.3Q22 G28Q22-E26 PolarHBondContact O-N 2.66Å; E26-G28 PolarHBondContact O-N 3.32Å
27G41.4Very low39.5Very low68 Ų68126.4 Ų126.470%0.70168%0.683SS**THydrogen-bonded Turntrans-81.914.7-176.900000117.8
28G38.4Very low38.3Very low51 Ų51129.7 Ų129.753%0.52670%0.701SS.*  trans168173.7170.800000119E26E26-G28 PolarHBondContact O-N 3.32Å
29I35Very low37Very low168 Ų168131.7 Ų131.786%0.86272%0.716SS**  trans71.9103.9171.7-46.1173000116
30T31.9Very low35.9Very low138 Ų138132.6 Ų132.685%0.84774%0.739SS**  trans-132.6141.814948.70000110.1
31S30.9Very low35.1Very low106 Ų106132.4 Ų132.474%0.74175%0.753SS**  trans67.7131.9-179-136.50000114.7
32R30.1Very low34.3Very low242 Ų242134.4 Ų134.491%0.91376%0.764SS**  cis-137.4-178.434.1-92.1-175.5159.5-167-6114.6
33M30.1Very low33.7Very low170 Ų170137.2 Ų137.284%0.83778%0.777SS**  trans-104.2155.5-163.1-61159.263.900115
34S29Very low33.2Very low123 Ų123137.8 Ų137.886%0.8679%0.79SS**  trans24.5133.8142.6-48.50000122.4
35G25.6Very low32.7Very low65 Ų65134.7 Ų134.767%0.6778%0.784SS**  trans-172.5156.6156.900000111.6
36I29.3Very low32.5Very low164 Ų164133.8 Ų133.884%0.84179%0.787SS**  trans69105.5-178.8-48.8168.5000112.1
37I32.6Very low32Very low154 Ų154132.1 Ų132.179%0.7978%0.779SS**  cis84.3131.438.9-52.3173.6000113.6
38D29.1Very low31.4Very low140 Ų140136.4 Ų136.475%0.74979%0.786SS**  trans-51.6141.7-165.3-51.9-91.6000118.3
39N29.4Very low31.2Very low167 Ų167143.7 Ų143.789%0.89380%0.799SS**  -168.8110.8125.2-107.7-51.6000111.9
40A31.1Very low30.9Very low108 Ų108147.1 Ų147.189%0.89380%0.801SS**  trans-156.371.8173.800000112.3
41G28.2Very low31.2Very low63 Ų63148.7 Ų148.765%0.64980%0.804SS**  trans-100.9116.5166.100000110.9
42H31.4Very low31.1Very low195 Ų195151.3 Ų151.390%0.90381%0.808SS**  trans170.9133.4133.4-9484.2000111.3
43H32.2Very low31.5Very low174 Ų174146.5 Ų146.581%0.80681%0.806SS**  trans-75.8158.2166.1-113.4-80.4000110.5
44P33.9Very low31.6Very low123 Ų123144.5 Ų144.580%0.79980%0.804SS**  -127.1-179.2104.62.818.4000114.7
45S28.9Very low31.6Very low95 Ų95143.9 Ų143.966%0.66479%0.791SS**  trans-101.5152.5-178.5-178.10000111.6
46P41Very low32.2Very low112 Ų112147.1 Ų147.173%0.72780%0.8SS**  trans-81126.2178.931.5-35.1000113.8
47Q31.7Very low32.6Very low148 Ų148143.2 Ų143.269%0.69279%0.787SS**  trans-169.8117.4153.5-109.7142.1101.500109.8
48D29.3Very low33.1Very low159 Ų159144 Ų14485%0.8579%0.788SS**  179.7117.6124.3-100.9-13.6000110.9
49Y33.5Very low33.3Very low203 Ų203145.7 Ų145.780%0.79680%0.796SS**  trans-104.4105.9174.324.8-97.3000108.5
50R30.2Very low33.5Very low240 Ų240149.3 Ų149.391%0.90680%0.797SS**  trans-138.7119.2173.1-141.6173.3-170.6-179.62.6112.9
51L36.8Very low34.3Very low171 Ų171150.5 Ų150.590%0.89579%0.793SS**  trans-66.6127.1172.3-70.3159.4000110.2
52L30.7Very low35.2Very low161 Ų161155.3 Ų155.384%0.84380%0.798SS**  trans-134.9126148-79.8-179.5000109.5
53T36.6Very low35.9Very low141 Ų141153.6 Ų153.687%0.86580%0.796SS**  trans-79.8134.9167.41690000108.8
54T33.1Very low36.3Very low128 Ų128152.4 Ų152.479%0.78580%0.795SS**  trans-144.8149.5171.7-24.80000110.6
55D29.3Very low36.8Very low111 Ų111152.1 Ų152.159%0.59479%0.793SS**  trans-75.9138.9-166.8179.671.2000114.3S57D55-S57 VanDerWaalsContact C-N 3.26Å; D55-S57 PolarHBondContact O-N 2.81Å; D55-S57 WeakPolarHBondContact OD2-CB 3.13Å; D55-S57 PolarHBondContact OD2-OG 3.19Å
56P36.9Very low37.4Very low133 Ų133151.2 Ų151.286%0.86480%0.798SS**THydrogen-bonded Turntrans-84.144.8-174.336.4-38.5000114.3
57S38.7Very low37.7Very low82 Ų82152.9 Ų152.957%0.57380%0.801SS**THydrogen-bonded Turntrans-119.4-2.6-179.269.20000115.8D55D55-S57 VanDerWaalsContact C-N 3.26Å; D55-S57 PolarHBondContact O-N 2.81Å; D55-S57 WeakPolarHBondContact OD2-CB 3.13Å; D55-S57 PolarHBondContact OD2-OG 3.19Å
58Q42.3Very low38.4Very low170 Ų170151.4 Ų151.479%0.79480%0.797SS**  trans-12850.1-167.2-73.1-76.8-11.200113.9
59L34.1Very low39.2Very low175 Ų175152.1 Ų152.192%0.91680%0.796SS**  trans-120.7119.2165.3-82.3173.1000111.1
60R33.3Very low39.7Very low243 Ų243147.3 Ų147.392%0.91779%0.791SS**  trans-79.4143.3177-138.3-177.3-166.9-178.23.1109.3E62R60-E62 PolarHBondContact O-N 2.93Å
61V48.5Very low40.6Very low134 Ų134140.1 Ų140.181%0.81277%0.77SS**SBendtrans-81.1102168.8-179.90000108.3
62E47.4Very low41.2Very low163 Ų163136 Ų13676%0.76276%0.756SS**  trans-163.3164.4146.8-84.1-43.4145.400107R60R60-E62 PolarHBondContact O-N 2.93Å
63D46.3Very low41.9Very low159 Ų159137.2 Ų137.285%0.8575%0.75SS**  trans60.371.9178.7-68.2-45.7000116.9
64L39.9Very low42.1Very low150 Ų150135.6 Ų135.679%0.78574%0.735SS**  trans-131.1133.7157.7-135.878.2000109.6
65P43.2Very low42.8Very low117 Ų117135.2 Ų135.276%0.7673%0.733SS**  trans-66.8137.3-177.625.6-34.2000112.5D67P65-D67 VanDerWaalsContact C-N 3.26Å; P65-D67 PolarHBondContact O-N 3.09Å
66G43.4Very low43.5Very low75 Ų75134.6 Ų134.677%0.77374%0.737SS**SBendtrans-74.330.4-160.400000118.8
67D46.1Very low43.8Very low148 Ų148133.9 Ų133.979%0.79173%0.73SS**THydrogen-bonded Turntrans-97.813.1-172.3-148.823.5000114.3P65P65-D67 VanDerWaalsContact C-N 3.26Å; P65-D67 PolarHBondContact O-N 3.09Å
68L46.1Very low44Very low117 Ų117135.1 Ų135.161%0.61373%0.73SS**THydrogen-bonded Turntrans-112.92.1-178.9-70.7176.6000115S70 L71L68-S70 PolarHBondContact O-N 2.95Å; L68-L71 HydrophobicContact CD2-CD1 4.11Å; L68-L71 PolarHBondContact O-N 2.89Å
69Q47Very low44.3Very low174 Ų174133.4 Ų133.481%0.81372%0.724SS**G310 helixtrans-71.9-12-177.7-158.3152.417.600113.7L71Q69-L71 VanDerWaalsContact C-N 3.32Å; Q69-L71 PolarHBondContact O-N 2.89Å
70S44.2Very low44.8Very low101 Ų101129.7 Ų129.771%0.70671%0.71SS**G310 helixtrans-80.82.3178.4-58.20000115.3L68L68-S70 PolarHBondContact O-N 2.95Å
71L48.6Very low45.3Very low89 Ų89126.3 Ų126.347%0.46670%0.698SS.*G310 helixtrans-1118-175.5-63.9179.9000115L68 Q69 W73 L74L68-L71 HydrophobicContact CD2-CD1 4.11Å; L68-L71 PolarHBondContact O-N 2.89Å; Q69-L71 VanDerWaalsContact C-N 3.32Å; Q69-L71 PolarHBondContact O-N 2.89Å; L71-W73 PolarHBondContact O-N 3.03Å; L71-W73 VanDerWaalsContact O-N 3.09Å; L71-L74 HydrophobicContact CD2-CD1 4.29Å; L71-L74 WeakPolarHBondContact O-CB 3.26Å; L71-L74 PolarHBondContact O-N 2.96Å
72S49.9Very low45.2Very low86 Ų86126 Ų12660%0.60169%0.691SS**G310 helixtrans-61.8-18.7-177.959.50000115.1L74 T75S72-L74 VanDerWaalsContact C-N 3.29Å; S72-L74 PolarHBondContact O-N 3.3Å; S72-T75 PolarHBondContact O-OG1 3.26Å
73W44.4Very low45Very low185 Ų185123.8 Ų123.870%0.70168%0.68SS**G310 helixtrans-72.8-19.7175.569.1-90.7000113.6L71L71-W73 PolarHBondContact O-N 3.03Å; L71-W73 VanDerWaalsContact O-N 3.09Å
74L41.8Very low45.1Very low108 Ų108123.3 Ų123.357%0.56567%0.673SS**G310 helixtrans-84-9.7-173.7-109.2160.4000114.1L71 S72L71-L74 HydrophobicContact CD2-CD1 4.29Å; L71-L74 WeakPolarHBondContact O-CB 3.26Å; L71-L74 PolarHBondContact O-N 2.96Å; S72-L74 VanDerWaalsContact C-N 3.29Å; S72-L74 PolarHBondContact O-N 3.3Å
75T47.4Very low45Very low119 Ų119122.8 Ų122.873%0.7367%0.668SS**SBendtrans-108.1-8.8-17748.20000114.4S72 V77S72-T75 PolarHBondContact O-OG1 3.26Å; T75-V77 PolarHBondContact O-N 3.13Å; T75-V77 VanDerWaalsContact O-N 3.07Å
76S44.2Very low45Very low99 Ų99120.3 Ų120.369%0.69266%0.658SS**  trans-87.468.8-174.1-63.60000113
77V43.3Very low45Very low118 Ų118122.7 Ų122.772%0.71565%0.653SS**  trans-91.8109.1164.5179.60000108.7T75 M79T75-V77 PolarHBondContact O-N 3.13Å; T75-V77 VanDerWaalsContact O-N 3.07Å; V77-M79 VanDerWaalsContact C-N 3.31Å; V77-M79 PolarHBondContact O-N 2.81Å
78D41.8Very low44.7Very low107 Ų107120.3 Ų120.357%0.57265%0.648SS**  trans-75.774.4-172.6-170.327.4000112.6R81D78-R81 PolarHBondContact O-N 2.69Å; D78-R81 VanDerWaalsContact O-N 3.12Å
79M49.8Very low44.6Very low135 Ų135126.5 Ų126.567%0.66566%0.663SS**THydrogen-bonded Turntrans-47.7-40.9-176.1-88.3-69.7-173.900116.2V77 R81 L82V77-M79 VanDerWaalsContact C-N 3.31Å; V77-M79 PolarHBondContact O-N 2.81Å; M79-R81 PolarHBondContact O-N 2.86Å; M79-R81 VanDerWaalsContact O-N 3.14Å; M79-L82 PolarHBondContact O-N 3.32Å
80P44.6Very low44.1Very low96 Ų96120.8 Ų120.862%0.62365%0.651SS**Hα-helixtrans-57.2-30.2179.6-26.635.7000114
81R42.9Very low43.5Very low173 Ų173125.6 Ų125.665%0.65366%0.662SS**Hα-helixtrans-79.7-17.3-173-158.3171.7-176.5-169.2-0.4114D78 M79D78-R81 PolarHBondContact O-N 2.69Å; D78-R81 VanDerWaalsContact O-N 3.12Å; M79-R81 PolarHBondContact O-N 2.86Å; M79-R81 VanDerWaalsContact O-N 3.14Å
82L45.9Very low42.6Very low128 Ų128126.4 Ų126.467%0.6768%0.675SS**Hα-helixtrans-83.9-36.7176-168.263.8000111.8M79 Q84 M85M79-L82 PolarHBondContact O-N 3.32Å; L82-Q84 VanDerWaalsContact C-N 3.32Å; L82-Q84 PolarHBondContact O-N 3.42Å; L82-M85 PolarHBondContact O-N 3.01Å
83Q44.7Very low41.6Very low116 Ų116130.2 Ų130.254%0.54269%0.688SS.*Hα-helixtrans-59.8-42.2176.6-175.359.748.300111.6M85 A86 D87Q83-M85 PolarHBondContact O-N 2.68Å; Q83-A86 WeakPolarHBondContact O-CB 3.43Å; Q83-A86 PolarHBondContact O-N 2.79Å; Q83-D87 PolarHBondContact NE2-OD2 2.89Å
84Q47.2Very low40.8Very low148 Ų148124.8 Ų124.869%0.69269%0.69SS**Hα-helixtrans-63.7-14.7-177.2-160.1171.542.400114.4L82L82-Q84 VanDerWaalsContact C-N 3.32Å; L82-Q84 PolarHBondContact O-N 3.42Å
85M38.8Very low40.9Very low139 Ų139125.5 Ų125.569%0.68570%0.702SS**Hα-helixtrans-87.1-19.6173.6-61.5-170.4-17300113.5L82 Q83L82-M85 PolarHBondContact O-N 3.01Å; Q83-M85 PolarHBondContact O-N 2.68Å
86A44Very low39.9Very low66 Ų66125.3 Ų125.355%0.54571%0.705SS.*Hα-helixtrans-74.1-41.7178.500000111.8Q83 S88Q83-A86 WeakPolarHBondContact O-CB 3.43Å; Q83-A86 PolarHBondContact O-N 2.79Å; A86-S88 PolarHBondContact O-N 3.04Å; A86-S88 VanDerWaalsContact O-N 3.14Å
87D43.3Very low39.2Very low124 Ų124129.9 Ų129.966%0.66372%0.715SS**THydrogen-bonded Turntrans-78.12.8-171-58.5-50.6000114.3Q83Q83-D87 PolarHBondContact NE2-OD2 2.89Å
88S38.5Very low38.4Very low98 Ų98127.8 Ų127.869%0.68572%0.718SS**THydrogen-bonded Turntrans-96.714.6-178.5-63.80000114.8A86A86-S88 PolarHBondContact O-N 3.04Å; A86-S88 VanDerWaalsContact O-N 3.14Å
89R44.6Very low37.8Very low247 Ų247128 Ų12893%0.93273%0.727SS**SBendtrans-133.580.1173.4-84.6-167.1169.6-158-2.1113
90G35.9Very low36.8Very low55 Ų55128.4 Ų128.457%0.56773%0.732SS**  trans-178.1154.5166.300000112.5
91H31.5Very low36.1Very low201 Ų201130.1 Ų130.193%0.93174%0.735SS**  trans70.392.9170.3-45.699.3000117.4
92S29.4Very low35.4Very low106 Ų106128.8 Ų128.874%0.74174%0.736SS**  trans-118.2124.4141.547.60000109.5
93N30.2Very low34.8Very low166 Ų166130 Ų13089%0.88874%0.739SS**  trans65.1119.9166.8-53.7-15.7000119.2
94G27.5Very low34.1Very low72 Ų72132.8 Ų132.874%0.74275%0.751SS**  trans-97.2-138.9155.800000110.3
95P43.3Very low33.1Very low123 Ų123132.2 Ų132.280%0.79976%0.758SS**  cis-131.3174.8-7.342.2-28000114
96S26.7Very low32.8Very low114 Ų114129.5 Ų129.580%0.79776%0.758SS**  trans165.6146.9134.447.20000116.1
97Q29Very low32.1Very low195 Ų195134.6 Ų134.691%0.91177%0.77SS**  trans46.5127.3146.5-59.7-72.112.400122.5
98G27.5Very low31.4Very low75 Ų75135.2 Ų135.277%0.77377%0.773SS**  trans172.3129.5162.600000116.4
99S29.1Very low31.1Very low110 Ų110137.4 Ų137.477%0.76978%0.777SS**  trans-45.8148.6177.1-158.20000115.1
100L28.7Very low30.4Very low145 Ų145130.9 Ų130.976%0.75977%0.769SS**  cis75.7141.734.9-167.7148000114.6
101L28.9Very low30Very low132 Ų132136.8 Ų136.869%0.69178%0.784SS**  trans77.1150.4-167.2-113.865.4000113.8
102E29.5Very low29.9Very low144 Ų144133.1 Ų133.167%0.67378%0.776SS**  cis-153.9138.97.8-166.7142.446.900115
103Q32Very low30Very low155 Ų155135.7 Ų135.772%0.72478%0.78SS**  trans60.599.7137.8-159.3171.8113.800125.6
104Q30Very low31.1Very low174 Ų174133 Ų13381%0.81377%0.771SS**  31.8126.2111.1-175.7178.895.800122.6
105T26.7Very low31.2Very low136 Ų136135.7 Ų135.783%0.83477%0.773SS**  trans160.1140.7141.7-73.50000108.1
106A31.9Very low30.5Very low81 Ų81134.1 Ų134.167%0.66977%0.765SS**  cis-123.4158.96.200000109.8
107Q30Very low30.8Very low174 Ų174137.1 Ų137.181%0.81377%0.767SS**  46.313472.5-63.8-162.50.400115
108L29.4Very low30.9Very low136 Ų136133 Ų13371%0.71276%0.759SS**  cis-159.1-176.7-0-121.9171.7000111.4
109N32.2Very low31.2Very low145 Ų145134.7 Ų134.778%0.77576%0.759SS**  trans82.5142.5174.7-52.9-15.5000117.5
110S28.9Very low31.2Very low110 Ų110136.7 Ų136.777%0.76976%0.758SS**  cis-170144.1-42.141.50000111
111M27.8Very low31.5Very low178 Ų178136.7 Ų136.788%0.87776%0.758SS**  trans-31.8150.5177.1-53.3165.9-166.500117.4
112T28.5Very low31.7Very low124 Ų124137.9 Ų137.976%0.76176%0.76SS**  178.4115.687.9-66.70000108.2
113I31.8Very low31.8Very low160 Ų160137.1 Ų137.182%0.82176%0.76SS**  76.7145.389.5-74.8-68.2000115.3
114P54Low31.7Very low109 Ų109137 Ų13771%0.70876%0.759SS**  trans-127.4178.1-144.544.3-30.7000117.6
115V29.5Very low31.8Very low129 Ų129132.9 Ų132.978%0.78275%0.75SS**  trans-162.4139.4164.1139.80000106.3
116S29.1Very low32.1Very low91 Ų91131.8 Ų131.864%0.63674%0.743SS**  cis111.7104.2979.10000115.8
117Q32.9Very low32.3Very low177 Ų177135.1 Ų135.183%0.82775%0.746SS**  trans-179.7130150.2-98.2153.1102.600107.9
118S30.2Very low32.4Very low108 Ų108133.9 Ų133.976%0.75574%0.741SS**  67.6116.565-53.50000110.6
119S34.1Very low32.4Very low111 Ų111135 Ų13578%0.77674%0.742SS**  cis-177.8177.238.4-81.60000108.4
120M29.4Very low32.4Very low151 Ų151133 Ų13374%0.74474%0.739SS**  cis-164.7155.6-4.1-124.9-158.8-45.300110.8
121L34.8Very low33.6Very low145 Ų145132.8 Ų132.876%0.75974%0.735SS**  trans61.8150.4157.1-56.5171.1000117.6
122H33.4Very low33.8Very low157 Ų157131.1 Ų131.173%0.72773%0.729SS**  cis-152.313027.5-171.1-121.2000108.6
123L30.3Very low33.9Very low128 Ų128132.8 Ų132.867%0.6773%0.731SS**  44.7130.597.3-125.368.6000114.7
124Q31Very low34Very low153 Ų153129.9 Ų129.972%0.71572%0.724SS**  cis-152.3155.834.4174.687.2-1.800112.8
125S32.3Very low33.7Very low88 Ų88129.7 Ų129.762%0.61572%0.723SS**  trans-40.2173158.3-117.90000116.3
126T33.8Very low33.8Very low113 Ų113132.7 Ų132.769%0.69373%0.726SS**  cis-163.714032.10.70000108.3
127M34.8Very low33.8Very low150 Ų150133.2 Ų133.274%0.73973%0.73SS**  61.3135.387.5-63.3-81.797.100116.2
128Q33Very low33.8Very low149 Ų149132.6 Ų132.670%0.69673%0.729SS**  cis-116.9-120.1-5.9-60.2-174.1-3.900111.9
129H28.8Very low33.9Very low158 Ų158134.7 Ų134.773%0.73173%0.732SS**  cis-147.7173.54.7-109.2-44000112.2
130S32.3Very low33.7Very low104 Ų104133.1 Ų133.173%0.72773%0.733SS**  trans-158.9-175.2175.5-630000106.5
131P53.7Low33.9Very low105 Ų105134.1 Ų134.168%0.68274%0.74SS**  cis-150.6-176.710.244.1-22.6000118.9
132L32.8Very low34.3Very low144 Ų144132.8 Ų132.875%0.75474%0.74SS**  trans75.4138.3136.6-83.3161.2000125.1
133M30.1Very low34.5Very low159 Ų159130.5 Ų130.578%0.78374%0.742SS**  trans85.1114.1147.4-69.6-69.6101.200123.2
134S34.7Very low35.1Very low98 Ų98129.9 Ų129.969%0.68575%0.746SS**  trans-86.9165.8150.357.30000111.3
135P47.6Very low35Very low106 Ų106125.8 Ų125.869%0.68875%0.745SS**  -159.8173.19343.2-24.1000119.2
136F31.4Very low35.1Very low191 Ų191131.5 Ų131.584%0.83875%0.754SS**  trans64.2109.1154.4-60.3-53.4000124.7
137S29.5Very low34.9Very low103 Ų103134.7 Ų134.772%0.7276%0.761SS**  48.4117.3123-50.20000124.3
138M32.3Very low34.6Very low164 Ų164133.3 Ų133.381%0.80877%0.765SS**  175.7147.1105.4-100.2-62.5-170.300115.7
139N32.8Very low35Very low152 Ų152131.9 Ų131.981%0.81377%0.768SS**  trans20.3132.3157.3-64.3-12000123.6
140G28.6Very low35Very low77 Ų77130.5 Ų130.579%0.79477%0.771SS**  trans168127.9154.100000116.6
141L34.9Very low35Very low172 Ų172131.1 Ų131.190%0.90178%0.775SS**  trans-93.9173162.2-85.296.9000109.8
142P43Very low33.9Very low117 Ų117131.5 Ų131.576%0.7678%0.776SS**  cis-133.8-169.28.340.1-20.6000115.5
143S36.4Very low33.6Very low110 Ų110134 Ų13477%0.76978%0.776SS**  trans-62159170.2-33.90000113.7
144P42.8Very low33.8Very low115 Ų115132.9 Ų132.975%0.74777%0.769SS**  -142.8-174.181.639.1-22.2000114.4
145G29.5Very low34.2Very low67 Ų67134 Ų13469%0.69177%0.774SS**  trans-111.1171.8-171.900000116.7
146Y33.5Very low33.3Very low208 Ų208133.9 Ų133.982%0.81678%0.782SS**  trans-135.8134.6174.9-65.3-88.6000107.6
147Q29.6Very low33.3Very low180 Ų180129.8 Ų129.884%0.84178%0.777SS**  56108.268.1-71-73.69.200112.4
148C30Very low33.3Very low121 Ų121132.5 Ų132.582%0.81878%0.779SS**  trans-111.2128.4-178.6-172.60000110.3
149P40.8Very low33.1Very low118 Ų118130.9 Ų130.977%0.76677%0.769SS**  trans-87.1147.4-174.533.5-35.1000114
150T29.2Very low32.7Very low129 Ų129129.6 Ų129.679%0.79177%0.767SS**  trans-69.8149167.7-52.30000111.6V152T150-V152 HydrophobicContact CG2-CG2 4.13Å
151S32.1Very low32.7Very low117 Ų117136 Ų13682%0.81877%0.768SS**  trans-116152.7163.7-169.40000110.9
152V30.6Very low32.3Very low114 Ų114133.1 Ų133.169%0.69176%0.762SS**  trans-141165.4-162.8-178.80000110.1T150T150-V152 HydrophobicContact CG2-CG2 4.13Å
153Y27.1Very low31.4Very low195 Ų195135.6 Ų135.677%0.76577%0.768SS**  trans87.5141161.4-134.9-95.1000116.4
154Q33.1Very low31.1Very low136 Ų136136.7 Ų136.764%0.63677%0.771SS**  cis-164.5159.8-32-160.4141.3-57.900107
155P42.4Very low30.6Very low122 Ų122140.1 Ų140.179%0.79278%0.777SS**  trans-95.7171.8-162.737.9-36.5000116.5
156A29.4Very low30.6Very low103 Ų103143.4 Ų143.485%0.85178%0.784SS**  trans-106.9-179.8168.500000112
157S31.1Very low30.4Very low105 Ų105137 Ų13773%0.73478%0.781SS**  trans-139.6160.7-145.262.10000118.3
158Q29.8Very low30.4Very low161 Ų161137.8 Ų137.875%0.75279%0.785SS**  trans67.4128.8163.8-54.7-171.316.300119.9
159Q27.6Very low30.3Very low129 Ų129140.5 Ų140.560%0.60379%0.785SS**  -172.1152.991.2-91.8-72.4-51.500109.5
160V26.1Very low29.7Very low126 Ų126140.8 Ų140.876%0.76479%0.788SS**  trans-137.8129.1179.9175.80000109.5
161Y27.7Very low29.8Very low210 Ų210140.9 Ų140.982%0.82479%0.794SS**  trans-112.1125172.5-73.5-79.2000110.7
162S26.9Very low29.8Very low112 Ų112140.2 Ų140.278%0.78380%0.796SS**  trans-104.5136.4168.9-600000108.9
163L24.2Very low29.8Very low169 Ų169138.9 Ų138.989%0.88581%0.805SS**  trans-124.1130.8170.9-153.676.1000110.3
164T29.3Very low29.9Very low133 Ų133133.1 Ų133.182%0.81681%0.806SS**  trans-86.5152.917843.90000111.1
165Q33.1Very low29.8Very low187 Ų187133.7 Ų133.787%0.87481%0.812SS**  trans-134.8144.5157.9-103-172.784.800112.1
166T28.7Very low29.3Very low137 Ų137137.9 Ų137.984%0.8481%0.813SS**  trans-67.5144.2-174.845.40000113.2
167G29.5Very low29.3Very low73 Ų73139 Ų13975%0.75382%0.815SS**  trans-96.1155.4165.400000112.6
168Q29.1Very low29.5Very low197 Ų197141.5 Ų141.592%0.92182%0.82SS**  trans-147174.2160.2-115.8174.913.300110.8
169Q29.5Very low29.7Very low177 Ų177139.8 Ų139.883%0.82782%0.82SS**  trans-83.9168.9-159.5-61.3166.2-13.100111.7
170C27.4Very low30.1Very low124 Ų124138.4 Ų138.484%0.83883%0.825SS**  -164164.770.2-78.70000113.3
171S32.1Very low30.6Very low131 Ų131142.4 Ų142.492%0.91683%0.833SS**  trans-110.8136.7-174.9-54.80000113.8
172A31.4Very low31Very low104 Ų104138.8 Ų138.886%0.8683%0.827SS**  trans-157.8146.4152.600000108.2
173G30Very low31.3Very low85 Ų85140.6 Ų140.688%0.87683%0.828SS**  cis108.6737.300000111.5
174G30.3Very low32.2Very low75 Ų75140.4 Ų140.477%0.77382%0.823SS**  trans-173.1109.4-175.800000113.5
175L30.6Very low32.4Very low147 Ų147139.4 Ų139.477%0.7782%0.821SS**  trans-56.2144.3-176.9-65.1161.7000114.6
176Y30.9Very low32.9Very low210 Ų210137.7 Ų137.782%0.82482%0.818SS**  trans-53.4145.2162.16.8-97.8000112.2
177S30.6Very low33.5Very low126 Ų126140.9 Ų140.988%0.88182%0.82SS**  trans-144.6146.8162.9-75.90000109.4
178N34.1Very low33.8Very low158 Ų158143.9 Ų143.985%0.84582%0.824SS**  trans-135.9-173.2-174.4-165.1-0.9000108.3
179V34.3Very low34.4Very low125 Ų125141.7 Ų141.776%0.75881%0.814SS**  trans96.7117.9178.6-175.60000114.3
180S37.3Very low35.2Very low100 Ų100139.6 Ų139.670%0.69982%0.816SS**  trans-71.5163.5172.1-34.30000112.3
181F35.2Very low35.9Very low211 Ų211144 Ų14493%0.92581%0.814SS**  -159.7161.3127-107.8-68.1000112.3
182N37Very low36.5Very low133 Ų133145.7 Ų145.771%0.71181%0.813SS**  trans-95.6139.7-176.2171.727.6000110.8
183N32.4Very low36.9Very low151 Ų151144.9 Ų144.981%0.80781%0.805SS**  trans-160.1161.8145.2-122-42.7000115.1
184Q43Very low37.6Very low164 Ų164147 Ų14777%0.76680%0.804SS**  trans-87.7163.3-179.2-53.5178.230.600112.2
185S33.7Very low37.9Very low112 Ų112152.1 Ų152.178%0.78381%0.808SS**  trans-146.1134.3157.4-170.20000111.2
186L44.6Very low38.3Very low152 Ų152154 Ų15480%0.79681%0.813SS**  trans-103.5123177.4-72159000108.6
187F41.1Very low38.7Very low203 Ų203151 Ų15189%0.8981%0.806SS**  trans-143.6149.5161-103.9-77.9000112.5
188T35.6Very low39.3Very low136 Ų136153.1 Ų153.183%0.83480%0.802SS**  trans-102.9161.2-170.4-60.40000111.5
189Q41.3Very low40Very low152 Ų152152.8 Ų152.871%0.7180%0.8SS**  trans-56.6171.5-175.8-53.8-176.70.600114.9
190P45.5Very low40.4Very low133 Ų133154 Ų15486%0.86480%0.797SS**  -118.7148.7104.634.6-35000114.7
191R43.4Very low41.2Very low215 Ų215154.6 Ų154.681%0.81180%0.799SS**  trans-88.4136.1-177.3174.4-178.7173.8-173.7-1110.9
192L43.7Very low42.4Very low168 Ų168150.6 Ų150.688%0.8878%0.781SS**  trans-117.6170.3165.2-69.7177000111.1
193A40Very low44.3Very low86 Ų86149.9 Ų149.971%0.71179%0.786SS**  trans-71.5161.8-160.600000114.7Q195A193-Q195 PolarHBondContact O-N 3.37Å; A193-Q195 VanDerWaalsContact O-N 3.14Å
194P44.1Very low46.8Very low131 Ų131145.5 Ų145.585%0.85176%0.76SS**  trans-67.1111.2172.3-10.726.9000109.6
195Q36.8Very low49.1Very low182 Ų182140.3 Ų140.385%0.8574%0.74SS**  trans-81.5121.4169.4-169.7175.716.700108.6A193 Q197A193-Q195 PolarHBondContact O-N 3.37Å; A193-Q195 VanDerWaalsContact O-N 3.14Å; Q195-Q197 PolarHBondContact O-N 2.86Å
196E40.3Very low51.9Low187 Ų187141.2 Ų141.287%0.87473%0.73SS**  trans-63.5108174-68.4-176.7109.300109E198E196-E198 VanDerWaalsContact C-N 3.26Å; E196-E198 PolarHBondContact O-N 3.33Å
197Q39.2Very low54.2Low146 Ų146134.3 Ų134.368%0.68269%0.694SS**  trans-85.168.2-168.2-167.1179.374.900110.9Q195 L199Q195-Q197 PolarHBondContact O-N 2.86Å; Q197-L199 PolarHBondContact O-N 3.43Å; Q197-L199 VanDerWaalsContact O-N 3.08Å
198E41.9Very low56.7Low170 Ų170127.5 Ų127.579%0.79467%0.667SS**  trans-65108.7179.4-169169.6111.800111.6E196 Q200E196-E198 VanDerWaalsContact C-N 3.26Å; E196-E198 PolarHBondContact O-N 3.33Å; E198-Q200 VanDerWaalsContact C-N 3.34Å; E198-Q200 PolarHBondContact O-N 3.35Å
199L50.2Low59.5Low152 Ų152121.4 Ų121.480%0.79663%0.628SS**  trans46.839.7146.8-54.4179.2000118.6Q197 P201Q197-L199 PolarHBondContact O-N 3.43Å; Q197-L199 VanDerWaalsContact O-N 3.08Å; L199-P201 WeakPolarHBondContact O-CD 3.49Å
200Q42.6Very low62.1Low151 Ų151116.8 Ų116.871%0.70661%0.613SS**  trans-56.5124.7142.9-78.1-62.2-45.300108.2E198 K202E198-Q200 VanDerWaalsContact C-N 3.34Å; E198-Q200 PolarHBondContact O-N 3.35Å; Q200-K202 VanDerWaalsContact C-N 3.31Å; Q200-K202 PolarHBondContact O-N 2.99Å
201P53.4Low64.5Low112 Ų112113.1 Ų113.173%0.72758%0.582SS**  trans-69.891.4-179.127.8-33.4000109L199 S203L199-P201 WeakPolarHBondContact O-CD 3.49Å; P201-S203 PolarHBondContact O-N 2.85Å
202K60.8Low67Low127 Ų127103.4 Ų103.455%0.55255%0.548SS*.  trans-52.9105.7176.7-73.9167.5-179.9170.80107.8Q200 F204Q200-K202 VanDerWaalsContact C-N 3.31Å; Q200-K202 PolarHBondContact O-N 2.99Å; K202-F204 VanDerWaalsContact C-N 3.35Å; K202-F204 HydrophobicContact CB-CE2 4.05Å; K202-F204 HydrophobicContact CB-CZ 4.36Å; K202-F204 WeakPolarHBondContact O-CD2 3.48Å; K202-F204 VanDerWaalsContact O-CE2 3.31Å; K202-F204 WeakPolarHBondContact O-CE2 3.23Å; K202-F204 PolarHBondContact O-N 3.25Å
203S76.6Confident69.5Low117 Ų11795.5 Ų95.582%0.81851%0.506SS*.  trans-7591-174.4-1700000108.7P201P201-S203 PolarHBondContact O-N 2.85Å
204F86.1Confident72.2Confident60 Ų6091.5 Ų91.526%0.26347%0.473SS..PPolyproline II helixtrans-63.4122.4-178.4-70.7-89.7000109K202 P241 M310K202-F204 VanDerWaalsContact C-N 3.35Å; K202-F204 HydrophobicContact CB-CE2 4.05Å; K202-F204 HydrophobicContact CB-CZ 4.36Å; K202-F204 WeakPolarHBondContact O-CD2 3.48Å; K202-F204 VanDerWaalsContact O-CE2 3.31Å; K202-F204 WeakPolarHBondContact O-CE2 3.23Å; K202-F204 PolarHBondContact O-N 3.25Å; F204-P241 HydrophobicContact CB-CB 4.45Å; F204-P241 HydrophobicContact CD1-CG 4.26Å; F204-P241 HydrophobicContact CD2-CB 3.5Å; F204-P241 VanDerWaalsContact CD2-CB 3.5Å; F204-P241 HydrophobicContact CD2-CG 3.8Å; F204-P241 HydrophobicContact CE1-CG 4.27Å; F204-P241 HydrophobicContact CE2-CB 3.84Å; F204-P241 HydrophobicContact CE2-CG 3.81Å; F204-P241 HydrophobicContact CG-CB 3.97Å; F204-P241 HydrophobicContact CG-CG 4.03Å; F204-P241 HydrophobicContact CZ-CG 4.05Å; F204-M310 WeakPolarHBondContact CE1-O 3.2Å
205P91.1Very high74.7Confident54 Ų5485.2 Ų85.235%0.35143%0.432SS..PPolyproline II helixtrans-61.915117826.9-35000110.2R308 S309P205-R308 WeakPolarHBondContact CD-O 3.35Å; P205-R308 HydrophobicContact CG-CB 4.2Å; P205-S309 WeakPolarHBondContact O-CB 3.38Å
206K92Very high77.5Confident131 Ų13176.6 Ų76.657%0.5739%0.392SS*.PPolyproline II helixtrans-51.3127.8172.8-179.7-179.6173.1-172.30109.7I208 Y242K206-I208 PolarHBondContact O-N 3.08Å; K206-Y242 HydrophobicContact CB-CD1 4.33Å; K206-Y242 HydrophobicContact CB-CD2 4.16Å; K206-Y242 HydrophobicContact CB-CE1 4Å; K206-Y242 HydrophobicContact CB-CE2 3.82Å; K206-Y242 HydrophobicContact CB-CG 4.41Å; K206-Y242 HydrophobicContact CD-CE1 4.41Å; K206-Y242 HydrophobicContact CG-CD1 4.28Å; K206-Y242 HydrophobicContact CG-CE1 3.76Å; K206-Y242 HydrophobicContact CG-CE2 4.45Å
207P92.6Very high80.1Confident7 Ų767.7 Ų67.75%0.04535%0.35CS..PPolyproline II helixtrans-58.5139.1177.5-25.735.4000111.7Y209 F240 F243P207-Y209 VanDerWaalsContact C-N 3.25Å; P207-Y209 PolarHBondContact O-N 3.09Å; P207-F240 HydrophobicContact CB-CD1 3.8Å; P207-F240 HydrophobicContact CB-CE1 4.15Å; P207-F240 HydrophobicContact CB-CG 4.43Å; P207-F240 HydrophobicContact CG-CB 3.67Å; P207-F240 HydrophobicContact CG-CD1 3.44Å; P207-F240 VanDerWaalsContact CG-CD1 3.44Å; P207-F240 HydrophobicContact CG-CE1 4.28Å; P207-F240 HydrophobicContact CG-CG 3.75Å; P207-F243 HydrophobicContact CG-CE2 3.89Å; P207-F243 HydrophobicContact CG-CZ 4.26Å
208I93Very high82.8Confident61 Ų6160.8 Ų60.831%0.31332%0.318SS..SBendtrans-71.3-25.2176.4-61.7-167.7000111.2K206 S210 W298 D302 A305K206-I208 PolarHBondContact O-N 3.08Å; I208-S210 PolarHBondContact O-N 3.14Å; I208-W298 HydrophobicContact CG2-CD2 4.1Å; I208-W298 HydrophobicContact CG2-CE3 3.31Å; I208-W298 HydrophobicContact CG2-CH2 3.9Å; I208-W298 HydrophobicContact CG2-CZ3 3.18Å; I208-D302 HydrophobicContact CD1-CB 4.34Å; I208-A305 HydrophobicContact CD1-CB 3.42Å; I208-A305 VanDerWaalsContact CD1-CB 3.42Å; I208-A305 HydrophobicContact CG1-CB 4.25Å
209Y94.4Very high85.3Confident7 Ų752.8 Ų52.83%0.02728%0.281CS..SBendtrans-57.9133.8174.2-78.4-55.3000112.7P207 C213 L214 M217 F240 M295 W298 I306 L316 I320P207-Y209 VanDerWaalsContact C-N 3.25Å; P207-Y209 PolarHBondContact O-N 3.09Å; Y209-C213 HydrophobicContact CD1-CB 3.68Å; Y209-C213 HydrophobicContact CG-CB 4.15Å; Y209-L214 HydrophobicContact CD2-CD2 4.44Å; Y209-L214 HydrophobicContact CG-CD2 4.49Å; Y209-M217 HydrophobicContact CD2-CE 4.21Å; Y209-M217 HydrophobicContact CE2-CE 3.79Å; Y209-F240 HydrophobicContact CD2-CE1 4.33Å; Y209-F240 HydrophobicContact CD2-CZ 4.21Å; Y209-M295 HydrophobicContact CE1-CB 4.37Å; Y209-M295 HydrophobicContact CE1-CG 3.75Å; Y209-M295 WeakPolarHBondContact CE1-O 3.45Å; Y209-M295 PolarHBondContact OH-O 3.39Å; Y209-M295 VanDerWaalsContact OH-O 3.11Å; Y209-W298 HydrophobicContact CD1-CB 3.91Å; Y209-W298 HydrophobicContact CD1-CG 4.25Å; Y209-W298 HydrophobicContact CE1-CB 3.53Å; Y209-W298 HydrophobicContact CE1-CG 4.32Å; Y209-I306 HydrophobicContact CD2-CG1 4.5Å; Y209-I306 HydrophobicContact CD2-CG2 4.14Å; Y209-I306 HydrophobicContact CE1-CD1 4.39Å; Y209-I306 HydrophobicContact CE2-CB 4.45Å; Y209-I306 HydrophobicContact CE2-CD1 4Å; Y209-I306 HydrophobicContact CE2-CG1 4.1Å; Y209-I306 HydrophobicContact CE2-CG2 3.46Å; Y209-I306 VanDerWaalsContact CE2-CG2 3.46Å; Y209-L316 HydrophobicContact CE2-CD1 4.18Å; Y209-I320 VanDerWaalsContact OH-CD1 3.3Å; Y209-I320 WeakPolarHBondContact OH-CD1 3.46Å
210S95.6Very high87.3Confident55 Ų5546.6 Ų46.639%0.38525%0.247SC..  trans-64.7156.5171.775.50000111.3I208 S212 C213 L214I208-S210 PolarHBondContact O-N 3.14Å; S210-S212 PolarHBondContact O-N 3.42Å; S210-S212 VanDerWaalsContact O-N 3.15Å; S210-C213 WeakPolarHBondContact O-CA 3.44Å; S210-C213 WeakPolarHBondContact O-CB 3.19Å; S210-C213 PolarHBondContact O-N 3.25Å; S210-C213 PolarHBondContact OG-N 2.89Å; S210-C213 PolarHBondContact OG-SG 2.85Å; S210-L214 WeakPolarHBondContact O-CG 3.4Å; S210-L214 PolarHBondContact O-N 2.8Å
211Y96.8Very high89.6Confident56 Ų5642.1 Ų42.122%0.2223%0.228CC..Hα-helixtrans-53.1-36.8175-70.1-65.5000112.5L214 I215 M236 F243 W250 V254Y211-L214 PolarHBondContact O-N 2.88Å; Y211-I215 WeakPolarHBondContact O-CB 3.39Å; Y211-I215 VanDerWaalsContact O-CD1 3.3Å; Y211-I215 WeakPolarHBondContact O-CD1 3.3Å; Y211-I215 WeakPolarHBondContact O-CG1 3.49Å; Y211-I215 PolarHBondContact O-N 2.93Å; Y211-M236 HydrophobicContact CD1-CE 4.04Å; Y211-M236 HydrophobicContact CE1-CE 4.2Å; Y211-F243 HydrophobicContact CE1-CE1 4.02Å; Y211-F243 HydrophobicContact CE1-CZ 4.37Å; Y211-W250 HydrophobicContact CE1-CB 4.29Å; Y211-V254 HydrophobicContact CD1-CG2 3.88Å; Y211-V254 HydrophobicContact CE1-CG2 4.3Å
212S96.4Very high91.4Very high12 Ų1237.3 Ų37.38%0.08420%0.198CC..Hα-helixtrans-63.3-41.8174-72.50000112.9S210 A216 N257 N261 F264S210-S212 PolarHBondContact O-N 3.42Å; S210-S212 VanDerWaalsContact O-N 3.15Å; S212-A216 VanDerWaalsContact O-CB 3.3Å; S212-A216 WeakPolarHBondContact O-CB 3.31Å; S212-A216 PolarHBondContact O-N 3.05Å; S212-N257 PolarHBondContact N-OD1 3.5Å; S212-N257 PolarHBondContact OG-OD1 3.07Å; S212-N261 PolarHBondContact OG-ND2 2.82Å; S212-F264 WeakPolarHBondContact O-CZ 3.43Å
213C95.9Very high92.6Very high1 Ų140.3 Ų40.31%0.00721%0.21CC..Hα-helixtrans-63.8-42174.3-60.40000111.6Y209 S210 A216 M217Y209-C213 HydrophobicContact CD1-CB 3.68Å; Y209-C213 HydrophobicContact CG-CB 4.15Å; S210-C213 WeakPolarHBondContact O-CA 3.44Å; S210-C213 WeakPolarHBondContact O-CB 3.19Å; S210-C213 PolarHBondContact O-N 3.25Å; S210-C213 PolarHBondContact OG-N 2.89Å; S210-C213 PolarHBondContact OG-SG 2.85Å; C213-A216 PolarHBondContact O-N 2.99Å; C213-M217 WeakPolarHBondContact O-CB 3.42Å; C213-M217 PolarHBondContact O-N 3.5Å
214L96Very high93.1Very high2 Ų240 Ų401%0.0120%0.204CC..Hα-helixtrans-65.5-43.1179.9-65.6171.6000112.4Y209 S210 Y211 M217 A218 M236 F240 F243Y209-L214 HydrophobicContact CD2-CD2 4.44Å; Y209-L214 HydrophobicContact CG-CD2 4.49Å; S210-L214 WeakPolarHBondContact O-CG 3.4Å; S210-L214 PolarHBondContact O-N 2.8Å; Y211-L214 PolarHBondContact O-N 2.88Å; L214-M217 PolarHBondContact O-N 2.91Å; L214-A218 PolarHBondContact O-N 3.48Å; L214-A218 VanDerWaalsContact O-N 3.13Å; L214-M236 HydrophobicContact CB-CG 4.45Å; L214-M236 HydrophobicContact CD1-CE 4.14Å; L214-F240 HydrophobicContact CD2-CD2 3.77Å; L214-F240 HydrophobicContact CD2-CE1 4.16Å; L214-F240 HydrophobicContact CD2-CE2 3.4Å; L214-F240 HydrophobicContact CD2-CG 4.32Å; L214-F240 HydrophobicContact CD2-CZ 3.61Å; L214-F243 HydrophobicContact CD1-CE2 3.81Å; L214-F243 HydrophobicContact CD1-CZ 3.66Å
215I96.8Very high93.2Very high0 Ų038.2 Ų38.20%020%0.202CC..Hα-helixtrans-62.1-45.1173.6-68.9160.3000110.4Y211 M217 A218 L219 I232 V254 N257 L258 F264Y211-I215 WeakPolarHBondContact O-CB 3.39Å; Y211-I215 VanDerWaalsContact O-CD1 3.3Å; Y211-I215 WeakPolarHBondContact O-CD1 3.3Å; Y211-I215 WeakPolarHBondContact O-CG1 3.49Å; Y211-I215 PolarHBondContact O-N 2.93Å; I215-M217 PolarHBondContact O-N 3.18Å; I215-A218 WeakPolarHBondContact O-CB 3.44Å; I215-A218 PolarHBondContact O-N 2.98Å; I215-L219 HydrophobicContact CG2-CD1 3.8Å; I215-L219 HydrophobicContact CG2-CG 4.38Å; I215-L219 WeakPolarHBondContact O-CG 3.44Å; I215-L219 PolarHBondContact O-N 2.75Å; I215-I232 HydrophobicContact CG1-CG2 4.05Å; I215-I232 HydrophobicContact CG2-CD1 4.43Å; I215-V254 HydrophobicContact CD1-CG1 4.17Å; I215-V254 HydrophobicContact CG1-CG1 4.22Å; I215-N257 HydrophobicContact CD1-CB 3.61Å; I215-L258 HydrophobicContact CD1-CD2 4.32Å; I215-L258 HydrophobicContact CD1-CG 4.16Å; I215-L258 HydrophobicContact CG2-CD2 3.61Å; I215-F264 HydrophobicContact CB-CE1 4.11Å; I215-F264 HydrophobicContact CB-CE2 4.36Å; I215-F264 HydrophobicContact CB-CZ 3.82Å; I215-F264 HydrophobicContact CD1-CE2 4.29Å; I215-F264 HydrophobicContact CG2-CD1 3.82Å; I215-F264 HydrophobicContact CG2-CD2 4.4Å; I215-F264 HydrophobicContact CG2-CE1 3.44Å; I215-F264 VanDerWaalsContact CG2-CE1 3.44Å; I215-F264 HydrophobicContact CG2-CE2 4.06Å; I215-F264 HydrophobicContact CG2-CG 4.3Å; I215-F264 HydrophobicContact CG2-CZ 3.58Å
216A95.6Very high93.3Very high0 Ų036.2 Ų36.20%019%0.189CC..Hα-helixtrans-65.6-38.8-179.700000112.8S212 C213 A218 L219 K220 F264 L283 M291S212-A216 VanDerWaalsContact O-CB 3.3Å; S212-A216 WeakPolarHBondContact O-CB 3.31Å; S212-A216 PolarHBondContact O-N 3.05Å; C213-A216 PolarHBondContact O-N 2.99Å; A216-A218 VanDerWaalsContact C-N 3.34Å; A216-L219 PolarHBondContact O-N 3.39Å; A216-K220 WeakPolarHBondContact O-CB 3.06Å; A216-K220 WeakPolarHBondContact O-CG 3.31Å; A216-K220 PolarHBondContact O-N 3.41Å; A216-F264 HydrophobicContact CB-CE1 4.24Å; A216-L283 HydrophobicContact CB-CD1 4.01Å; A216-M291 HydrophobicContact CB-CB 4.46Å; A216-M291 HydrophobicContact CB-CG 3.16Å; A216-M291 HydrophobicContact CB-SD 3.91Å
217M94.9Very high93.4Very high0 Ų031.3 Ų31.30%017%0.169CC..Hα-helixtrans-59.9-44.2173.2-167.5-174.6-74.800110.9Y209 C213 L214 I215 N221 F235 F240 M295 L316 L319 I320Y209-M217 HydrophobicContact CD2-CE 4.21Å; Y209-M217 HydrophobicContact CE2-CE 3.79Å; C213-M217 WeakPolarHBondContact O-CB 3.42Å; C213-M217 PolarHBondContact O-N 3.5Å; L214-M217 PolarHBondContact O-N 2.91Å; I215-M217 PolarHBondContact O-N 3.18Å; M217-N221 PolarHBondContact O-N 2.72Å; M217-N221 PolarHBondContact O-ND2 2.89Å; M217-F235 HydrophobicContact CB-CE1 4.2Å; M217-F235 HydrophobicContact CB-CZ 4.44Å; M217-F235 HydrophobicContact CG-CE1 4.02Å; M217-F235 HydrophobicContact CG-CZ 3.89Å; M217-F235 HydrophobicContact SD-CE1 4.23Å; M217-F235 HydrophobicContact SD-CZ 4.3Å; M217-F240 HydrophobicContact CE-CZ 4.28Å; M217-F240 HydrophobicContact SD-CE2 4.01Å; M217-F240 HydrophobicContact SD-CZ 3.98Å; M217-M295 HydrophobicContact CB-SD 4.04Å; M217-M295 HydrophobicContact CE-CG 4.31Å; M217-M295 HydrophobicContact CE-SD 3.54Å; M217-M295 VanDerWaalsContact CE-SD 3.54Å; M217-M295 HydrophobicContact CG-SD 4.2Å; M217-L316 HydrophobicContact CE-CD1 4.35Å; M217-L319 HydrophobicContact CG-CB 4.03Å; M217-L319 HydrophobicContact SD-CB 4.08Å; M217-L319 HydrophobicContact SD-CD1 4.04Å; M217-I320 HydrophobicContact CE-CG1 4.28Å
218A95.6Very high93.5Very high1 Ų132.6 Ų32.61%0.00818%0.178CC..Hα-helixtrans-61.2-45.5174.800000112.5L214 I215 A216 N221 S222 L227 F235L214-A218 PolarHBondContact O-N 3.48Å; L214-A218 VanDerWaalsContact O-N 3.13Å; I215-A218 WeakPolarHBondContact O-CB 3.44Å; I215-A218 PolarHBondContact O-N 2.98Å; A216-A218 VanDerWaalsContact C-N 3.34Å; A218-N221 PolarHBondContact O-N 2.91Å; A218-S222 PolarHBondContact O-N 2.99Å; A218-L227 HydrophobicContact CB-CD1 4.2Å; A218-L227 WeakPolarHBondContact O-CD1 3.44Å; A218-F235 HydrophobicContact CB-CB 3.94Å; A218-F235 HydrophobicContact CB-CD1 3.4Å; A218-F235 VanDerWaalsContact CB-CD1 3.4Å; A218-F235 HydrophobicContact CB-CD2 4.2Å; A218-F235 HydrophobicContact CB-CE1 3.94Å; A218-F235 HydrophobicContact CB-CG 3.56Å
219L94.6Very high93.6Very high2 Ų231.2 Ų31.21%0.0117%0.172CC..Hα-helixtrans-68.4-42.1-178.6-69.4172.2000112.6I215 A216 N221 S222 L227 I232 F264 W281 L283I215-L219 HydrophobicContact CG2-CD1 3.8Å; I215-L219 HydrophobicContact CG2-CG 4.38Å; I215-L219 WeakPolarHBondContact O-CG 3.44Å; I215-L219 PolarHBondContact O-N 2.75Å; A216-L219 PolarHBondContact O-N 3.39Å; L219-N221 VanDerWaalsContact C-N 3.33Å; L219-N221 PolarHBondContact O-N 3.34Å; L219-S222 WeakPolarHBondContact O-CB 3.46Å; L219-S222 PolarHBondContact O-N 3.33Å; L219-S222 PolarHBondContact O-OG 3.33Å; L219-L227 HydrophobicContact CD2-CB 3.95Å; L219-L227 HydrophobicContact CD2-CD1 4.42Å; L219-L227 HydrophobicContact CD2-CG 4.21Å; L219-I232 HydrophobicContact CD2-CD1 4.5Å; L219-F264 HydrophobicContact CD1-CD1 3.7Å; L219-F264 HydrophobicContact CD1-CE1 4.03Å; L219-W281 WeakPolarHBondContact CD2-O 3.16Å; L219-L283 HydrophobicContact CB-CB 4.36Å; L219-L283 HydrophobicContact CD1-CB 4.34Å
220K91.7Very high93.6Very high22 Ų2233.7 Ų33.710%0.09619%0.191CC..Hα-helixtrans-58.5-42.4174.9-83.3-175.568.6-149.50112.5A216 S222 L283 E292 M295 I320A216-K220 WeakPolarHBondContact O-CB 3.06Å; A216-K220 WeakPolarHBondContact O-CG 3.31Å; A216-K220 PolarHBondContact O-N 3.41Å; K220-S222 PolarHBondContact O-N 2.99Å; K220-L283 HydrophobicContact CG-CD2 4.17Å; K220-E292 WeakPolarHBondContact CE-OE2 3.2Å; K220-E292 IonicContact NZ-OE2 2.73Å; K220-E292 PolarHBondContact NZ-OE2 3.15Å; K220-M295 HydrophobicContact CD-CE 4.05Å; K220-I320 PolarHBondContact NZ-O 2.94Å
221N90.9Very high93.6Very high57 Ų5735.2 Ų35.231%0.30519%0.192SC..THydrogen-bonded Turntrans-84.32.6-177.4-69.8-80.4000113.1M217 A218 L219 F235 L319M217-N221 PolarHBondContact O-N 2.72Å; M217-N221 PolarHBondContact O-ND2 2.89Å; A218-N221 PolarHBondContact O-N 2.91Å; L219-N221 VanDerWaalsContact C-N 3.33Å; L219-N221 PolarHBondContact O-N 3.34Å; N221-F235 HydrophobicContact CB-CE2 4.08Å; N221-L319 HydrophobicContact CB-CD2 4.15Å; N221-L319 VanDerWaalsContact CG-CD2 3.47Å; N221-L319 PolarHBondContact ND2-O 3.39Å; N221-L319 WeakPolarHBondContact OD1-CD2 3.43Å
222S91.4Very high93.5Very high12 Ų1232.6 Ų32.68%0.08418%0.181CC..SBendtrans-78.2133.217376.40000111.7A218 L219 K220 T224 G225 S226A218-S222 PolarHBondContact O-N 2.99Å; L219-S222 WeakPolarHBondContact O-CB 3.46Å; L219-S222 PolarHBondContact O-N 3.33Å; L219-S222 PolarHBondContact O-OG 3.33Å; K220-S222 PolarHBondContact O-N 2.99Å; S222-T224 PolarHBondContact O-N 3.16Å; S222-G225 PolarHBondContact O-N 2.99Å; S222-G225 VanDerWaalsContact O-N 3.15Å; S222-G225 VanDerWaalsContact OG-CA 3.27Å; S222-G225 WeakPolarHBondContact OG-CA 3Å; S222-G225 PolarHBondContact OG-N 2.98Å; S222-G225 VanDerWaalsContact OG-N 3.1Å; S222-S226 PolarHBondContact OG-N 3.06Å; S222-S226 VanDerWaalsContact OG-N 3.09Å
223K87.1Confident93.5Very high189 Ų18934.1 Ų34.182%0.82219%0.185SC*.THydrogen-bonded Turntrans-57.3-23.1-179.7-62.7178.7-178.6176.80113.8N326K223-N326 PolarHBondContact O-ND2 2.95Å
224T86.9Confident93.5Very high111 Ų11136.2 Ų36.268%0.68120%0.2SC*.THydrogen-bonded Turntrans-107.5-5.5-173.2-42.20000113.1S222 S226S222-T224 PolarHBondContact O-N 3.16Å; T224-S226 PolarHBondContact O-N 2.83Å
225G88.1Confident93.5Very high22 Ų2237.1 Ų37.123%0.22720%0.204CC..SBendtrans67.59.7-17100000114.8S222S222-G225 PolarHBondContact O-N 2.99Å; S222-G225 VanDerWaalsContact O-N 3.15Å; S222-G225 VanDerWaalsContact OG-CA 3.27Å; S222-G225 WeakPolarHBondContact OG-CA 3Å; S222-G225 PolarHBondContact OG-N 2.98Å; S222-G225 VanDerWaalsContact OG-N 3.1Å
226S92.5Very high93.4Very high12 Ų1237.1 Ų37.18%0.08420%0.204CC..EExtended strand (participates in β ladder)trans-153.1147.6178.854.70000111.6S222 T224 W281S222-S226 PolarHBondContact OG-N 3.06Å; S222-S226 VanDerWaalsContact OG-N 3.09Å; T224-S226 PolarHBondContact O-N 2.83Å; S226-W281 CarbonylContact C-O 3.52Å; S226-W281 WeakPolarHBondContact CA-O 3.45Å; S226-W281 VanDerWaalsContact CB-O 3.26Å; S226-W281 WeakPolarHBondContact CB-O 3.43Å
227L94.4Very high93.4Very high28 Ų2841 Ų4115%0.14722%0.221CC..EExtended strand (participates in β ladder)trans-140.4147.2-177.2-68.7178.2000111.5A218 L219 E231 I232 W281A218-L227 HydrophobicContact CB-CD1 4.2Å; A218-L227 WeakPolarHBondContact O-CD1 3.44Å; L219-L227 HydrophobicContact CD2-CB 3.95Å; L219-L227 HydrophobicContact CD2-CD1 4.42Å; L219-L227 HydrophobicContact CD2-CG 4.21Å; L227-E231 HydrophobicContact CB-CB 4.24Å; L227-E231 HydrophobicContact CD1-CB 4.17Å; L227-E231 HydrophobicContact CD2-CB 3.89Å; L227-E231 HydrophobicContact CD2-CG 4.26Å; L227-E231 HydrophobicContact CG-CB 4.33Å; L227-I232 HydrophobicContact CB-CG1 4.12Å; L227-I232 HydrophobicContact CD1-CG1 4.27Å; L227-W281 PolarHBondContact N-O 3.33Å; L227-W281 PolarHBondContact O-N 3.02Å
228P94.9Very high93.3Very high35 Ų3546.7 Ų46.723%0.22725%0.248CC..EExtended strand (participates in β ladder)trans-73160.1162.134.3-34000110.1S230 E231 L280P228-S230 PolarHBondContact O-N 3.17Å; P228-S230 VanDerWaalsContact O-N 3.09Å; P228-E231 HydrophobicContact CG-CG 3.9Å; P228-E231 PolarHBondContact O-N 3.41Å; P228-E231 VanDerWaalsContact O-N 3.08Å; P228-L280 HydrophobicContact CB-CD2 4.08Å; P228-L280 HydrophobicContact CG-CD2 4.32Å
229V94.8Very high93.2Very high32 Ų3247.5 Ų47.519%0.19425%0.251CS..Hα-helixtrans-59.7-26.8-175.5-165.30000113I232 Y233 R255 L258V229-I232 PolarHBondContact O-N 3.27Å; V229-Y233 HydrophobicContact CG1-CD1 4.46Å; V229-Y233 HydrophobicContact CG1-CE1 3.81Å; V229-Y233 HydrophobicContact CG1-CE2 3.99Å; V229-Y233 WeakPolarHBondContact O-CD2 2.85Å; V229-Y233 PolarHBondContact O-N 3.01Å; V229-Y233 VanDerWaalsContact O-N 3.14Å; V229-R255 HydrophobicContact CG1-CG 4.39Å; V229-L258 HydrophobicContact CG1-CD1 4.1Å; V229-L258 HydrophobicContact CG2-CD1 4.08Å
230S94.8Very high93.2Very high59 Ų5947.4 Ų47.441%0.41325%0.251SS..Hα-helixtrans-59.6-44.7174.957.30000112.8P228 I232 Y233 S234P228-S230 PolarHBondContact O-N 3.17Å; P228-S230 VanDerWaalsContact O-N 3.09Å; S230-I232 VanDerWaalsContact C-N 3.34Å; S230-Y233 WeakPolarHBondContact O-CB 3.45Å; S230-Y233 PolarHBondContact O-N 3.46Å; S230-S234 PolarHBondContact O-N 3.11Å; S230-S234 PolarHBondContact O-OG 2.82Å
231E95.2Very high93.3Very high87 Ų8747 Ų4741%0.40725%0.251SS..Hα-helixtrans-72.3-31.3-178.4-60.7-35112.400111.6L227 P228 Y233 S234 F235L227-E231 HydrophobicContact CB-CB 4.24Å; L227-E231 HydrophobicContact CD1-CB 4.17Å; L227-E231 HydrophobicContact CD2-CB 3.89Å; L227-E231 HydrophobicContact CD2-CG 4.26Å; L227-E231 HydrophobicContact CG-CB 4.33Å; P228-E231 HydrophobicContact CG-CG 3.9Å; P228-E231 PolarHBondContact O-N 3.41Å; P228-E231 VanDerWaalsContact O-N 3.08Å; E231-Y233 VanDerWaalsContact C-N 3.33Å; E231-S234 PolarHBondContact O-N 3.1Å; E231-F235 WeakPolarHBondContact O-CB 3.43Å; E231-F235 PolarHBondContact O-N 3.39Å
232I96.1Very high93.4Very high0 Ų047.3 Ų47.30%025%0.248CC..Hα-helixtrans-62.7-43.1172.5-57.5174.2000109.8I215 L219 L227 V229 S230 S234 M236 V254 L258I215-I232 HydrophobicContact CG1-CG2 4.05Å; I215-I232 HydrophobicContact CG2-CD1 4.43Å; L219-I232 HydrophobicContact CD2-CD1 4.5Å; L227-I232 HydrophobicContact CB-CG1 4.12Å; L227-I232 HydrophobicContact CD1-CG1 4.27Å; V229-I232 PolarHBondContact O-N 3.27Å; S230-I232 VanDerWaalsContact C-N 3.34Å; I232-S234 PolarHBondContact O-N 3.42Å; I232-M236 HydrophobicContact CG2-SD 4.19Å; I232-M236 WeakPolarHBondContact O-CB 3.23Å; I232-M236 VanDerWaalsContact O-CG 3.29Å; I232-M236 WeakPolarHBondContact O-CG 3.35Å; I232-M236 PolarHBondContact O-N 3.11Å; I232-V254 HydrophobicContact CG2-CG1 4.07Å; I232-L258 HydrophobicContact CD1-CD1 4.12Å; I232-L258 HydrophobicContact CD1-CD2 4.14Å
233Y95.6Very high93.5Very high44 Ų4447.1 Ų47.117%0.17325%0.245CC..Hα-helixtrans-63.9-37.8173.1-57.4-34.6000112.6V229 S230 E231 K237 W250 K251 V254 R255V229-Y233 HydrophobicContact CG1-CD1 4.46Å; V229-Y233 HydrophobicContact CG1-CE1 3.81Å; V229-Y233 HydrophobicContact CG1-CE2 3.99Å; V229-Y233 WeakPolarHBondContact O-CD2 2.85Å; V229-Y233 PolarHBondContact O-N 3.01Å; V229-Y233 VanDerWaalsContact O-N 3.14Å; S230-Y233 WeakPolarHBondContact O-CB 3.45Å; S230-Y233 PolarHBondContact O-N 3.46Å; E231-Y233 VanDerWaalsContact C-N 3.33Å; Y233-K237 WeakPolarHBondContact O-CE 3.37Å; Y233-K237 WeakPolarHBondContact O-CG 3.18Å; Y233-K237 PolarHBondContact O-N 3.04Å; Y233-W250 AromaticContact CD1-CH2 3.98Å; Y233-W250 HydrophobicContact CD1-CH2 3.98Å; Y233-W250 AromaticContact CD1-CZ3 3.7Å; Y233-W250 HydrophobicContact CD1-CZ3 3.7Å; Y233-W250 HydrophobicContact CE1-CZ3 4.44Å; Y233-W250 HydrophobicContact CG-CH2 4.26Å; Y233-W250 HydrophobicContact CG-CZ3 4.42Å; Y233-K251 HydrophobicContact CD1-CG 4.4Å; Y233-K251 HydrophobicContact CE1-CB 3.89Å; Y233-K251 HydrophobicContact CE1-CG 4.15Å; Y233-V254 HydrophobicContact CD1-CG1 4.31Å; Y233-V254 HydrophobicContact CE1-CB 4.19Å; Y233-V254 HydrophobicContact CE1-CG1 3.97Å; Y233-R255 WeakPolarHBondContact OH-CG 3.29Å; Y233-R255 PolarHBondContact OH-NH1 3.39Å; Y233-R255 VanDerWaalsContact OH-NH1 3.11Å
234S95.9Very high93.7Very high46 Ų4644.6 Ų44.632%0.32223%0.234SC..Hα-helixtrans-65.1-54.2176.6-65.70000111.5S230 E231 I232 M236 K237 E238S230-S234 PolarHBondContact O-N 3.11Å; S230-S234 PolarHBondContact O-OG 2.82Å; E231-S234 PolarHBondContact O-N 3.1Å; I232-S234 PolarHBondContact O-N 3.42Å; S234-M236 VanDerWaalsContact C-N 3.31Å; S234-M236 PolarHBondContact O-N 3.2Å; S234-K237 PolarHBondContact O-N 3.46Å; S234-K237 VanDerWaalsContact O-N 3.12Å; S234-E238 WeakPolarHBondContact O-CB 3.31Å; S234-E238 PolarHBondContact O-N 3.48Å
235F95.7Very high93.9Very high21 Ų2145.1 Ų45.19%0.09224%0.238CC..Hα-helixtrans-54.2-45.4178.3-178.5-83.2000112M217 A218 N221 E231 E238 H239 L319M217-F235 HydrophobicContact CB-CE1 4.2Å; M217-F235 HydrophobicContact CB-CZ 4.44Å; M217-F235 HydrophobicContact CG-CE1 4.02Å; M217-F235 HydrophobicContact CG-CZ 3.89Å; M217-F235 HydrophobicContact SD-CE1 4.23Å; M217-F235 HydrophobicContact SD-CZ 4.3Å; A218-F235 HydrophobicContact CB-CB 3.94Å; A218-F235 HydrophobicContact CB-CD1 3.4Å; A218-F235 VanDerWaalsContact CB-CD1 3.4Å; A218-F235 HydrophobicContact CB-CD2 4.2Å; A218-F235 HydrophobicContact CB-CE1 3.94Å; A218-F235 HydrophobicContact CB-CG 3.56Å; N221-F235 HydrophobicContact CB-CE2 4.08Å; E231-F235 WeakPolarHBondContact O-CB 3.43Å; E231-F235 PolarHBondContact O-N 3.39Å; F235-E238 PolarHBondContact O-N 3.04Å; F235-H239 AromaticContact CD1-ND1 3.81Å; F235-H239 AromaticContact CD2-CE1 3.35Å; F235-H239 WeakPolarHBondContact CD2-CE1 3.45Å; F235-H239 AromaticContact CD2-ND1 3.48Å; F235-H239 WeakPolarHBondContact CD2-ND1 3.46Å; F235-H239 AromaticContact CE1-ND1 3.81Å; F235-H239 AromaticContact CE2-CE1 3.23Å; F235-H239 WeakPolarHBondContact CE2-CE1 3.35Å; F235-H239 AromaticContact CE2-ND1 3.49Å; F235-H239 WeakPolarHBondContact CE2-ND1 3.43Å; F235-H239 AromaticContact CE2-NE2 3.78Å; F235-H239 AromaticContact CG-CE1 3.99Å; F235-H239 AromaticContact CG-ND1 3.64Å; F235-H239 AromaticContact CZ-CE1 3.78Å; F235-H239 AromaticContact CZ-CG 3.98Å; F235-H239 AromaticContact CZ-ND1 3.64Å; F235-H239 PolarHBondContact O-N 3.07Å; F235-H239 PolarHBondContact O-ND1 3.11Å; F235-L319 HydrophobicContact CE2-CD2 4.2Å; F235-L319 HydrophobicContact CZ-CD2 4.07Å
236M95.4Very high94Very high0 Ų044.6 Ų44.60%023%0.231CC..Hα-helixtrans-61.5-45.4177.8-75.7176.863.300112.1Y211 L214 I232 S234 F240 F243 W250 V254Y211-M236 HydrophobicContact CD1-CE 4.04Å; Y211-M236 HydrophobicContact CE1-CE 4.2Å; L214-M236 HydrophobicContact CB-CG 4.45Å; L214-M236 HydrophobicContact CD1-CE 4.14Å; I232-M236 HydrophobicContact CG2-SD 4.19Å; I232-M236 WeakPolarHBondContact O-CB 3.23Å; I232-M236 VanDerWaalsContact O-CG 3.29Å; I232-M236 WeakPolarHBondContact O-CG 3.35Å; I232-M236 PolarHBondContact O-N 3.11Å; S234-M236 VanDerWaalsContact C-N 3.31Å; S234-M236 PolarHBondContact O-N 3.2Å; M236-F240 CarbonylContact O-C 3.51Å; M236-F240 WeakPolarHBondContact O-CA 3.4Å; M236-F240 WeakPolarHBondContact O-CB 3.37Å; M236-F240 PolarHBondContact O-N 2.93Å; M236-F240 VanDerWaalsContact O-O 3.1Å; M236-F243 HydrophobicContact CB-CD2 3.95Å; M236-F243 HydrophobicContact CB-CE2 4.44Å; M236-F243 HydrophobicContact CB-CG 4.45Å; M236-F243 HydrophobicContact CE-CD1 4.04Å; M236-F243 HydrophobicContact CE-CD2 3.93Å; M236-F243 HydrophobicContact CE-CE1 3.76Å; M236-F243 HydrophobicContact CE-CE2 3.64Å; M236-F243 HydrophobicContact CE-CG 4.12Å; M236-F243 HydrophobicContact CE-CZ 3.56Å; M236-W250 HydrophobicContact CB-CZ3 4.47Å; M236-W250 HydrophobicContact CE-CE3 3.84Å; M236-W250 HydrophobicContact CE-CZ3 3.82Å; M236-W250 HydrophobicContact SD-CZ3 4.04Å; M236-V254 HydrophobicContact CE-CG2 3.75Å; M236-V254 HydrophobicContact SD-CG2 3.63Å
237K94.5Very high93.9Very high80 Ų8049.3 Ų49.335%0.34826%0.262SS..Hα-helixtrans-66-37.1177.1-74177.3-68.8160.20112.8Y233 S234 F243 K244 W250Y233-K237 WeakPolarHBondContact O-CE 3.37Å; Y233-K237 WeakPolarHBondContact O-CG 3.18Å; Y233-K237 PolarHBondContact O-N 3.04Å; S234-K237 PolarHBondContact O-N 3.46Å; S234-K237 VanDerWaalsContact O-N 3.12Å; K237-F243 HydrophobicContact CG-CB 4.12Å; K237-K244 HydrophobicContact CB-CG 4.03Å; K237-K244 HydrophobicContact CG-CG 4.34Å; K237-K244 WeakPolarHBondContact O-CE 3.47Å; K237-W250 HydrophobicContact CD-CZ2 4.49Å; K237-W250 HydrophobicContact CG-CH2 4.31Å; K237-W250 HydrophobicContact CG-CZ2 4.19Å
238E94.3Very high93.6Very high120 Ų12052.9 Ų52.956%0.56128%0.281SS*.Hα-helixtrans-65.3-57.8-179.2178.8172.7-13900110.9S234 F235 A311S234-E238 WeakPolarHBondContact O-CB 3.31Å; S234-E238 PolarHBondContact O-N 3.48Å; F235-E238 PolarHBondContact O-N 3.04Å; E238-A311 WeakPolarHBondContact O-CB 3.48Å
239H92.6Very high93.6Very high19 Ų1953.4 Ų53.49%0.08829%0.293CS..Hα-helixtrans-78.9-29.8-173.8-61.982.8000113.2F235 M310 A311F235-H239 AromaticContact CD1-ND1 3.81Å; F235-H239 AromaticContact CD2-CE1 3.35Å; F235-H239 WeakPolarHBondContact CD2-CE1 3.45Å; F235-H239 AromaticContact CD2-ND1 3.48Å; F235-H239 WeakPolarHBondContact CD2-ND1 3.46Å; F235-H239 AromaticContact CE1-ND1 3.81Å; F235-H239 AromaticContact CE2-CE1 3.23Å; F235-H239 WeakPolarHBondContact CE2-CE1 3.35Å; F235-H239 AromaticContact CE2-ND1 3.49Å; F235-H239 WeakPolarHBondContact CE2-ND1 3.43Å; F235-H239 AromaticContact CE2-NE2 3.78Å; F235-H239 AromaticContact CG-CE1 3.99Å; F235-H239 AromaticContact CG-ND1 3.64Å; F235-H239 AromaticContact CZ-CE1 3.78Å; F235-H239 AromaticContact CZ-CG 3.98Å; F235-H239 AromaticContact CZ-ND1 3.64Å; F235-H239 PolarHBondContact O-N 3.07Å; F235-H239 PolarHBondContact O-ND1 3.11Å; H239-M310 CarbonylContact O-C 3.48Å; H239-M310 WeakPolarHBondContact O-CA 2.94Å; H239-A311 PolarHBondContact O-N 3.37Å
240F94.4Very high93.6Very high0 Ų052.4 Ų52.40%029%0.286CS..  trans-127.886.7-177.8-56.2-87.9000110.3P207 Y209 L214 M217 M236 Y242 F243 M310P207-F240 HydrophobicContact CB-CD1 3.8Å; P207-F240 HydrophobicContact CB-CE1 4.15Å; P207-F240 HydrophobicContact CB-CG 4.43Å; P207-F240 HydrophobicContact CG-CB 3.67Å; P207-F240 HydrophobicContact CG-CD1 3.44Å; P207-F240 VanDerWaalsContact CG-CD1 3.44Å; P207-F240 HydrophobicContact CG-CE1 4.28Å; P207-F240 HydrophobicContact CG-CG 3.75Å; Y209-F240 HydrophobicContact CD2-CE1 4.33Å; Y209-F240 HydrophobicContact CD2-CZ 4.21Å; L214-F240 HydrophobicContact CD2-CD2 3.77Å; L214-F240 HydrophobicContact CD2-CE1 4.16Å; L214-F240 HydrophobicContact CD2-CE2 3.4Å; L214-F240 HydrophobicContact CD2-CG 4.32Å; L214-F240 HydrophobicContact CD2-CZ 3.61Å; M217-F240 HydrophobicContact CE-CZ 4.28Å; M217-F240 HydrophobicContact SD-CE2 4.01Å; M217-F240 HydrophobicContact SD-CZ 3.98Å; M236-F240 CarbonylContact O-C 3.51Å; M236-F240 WeakPolarHBondContact O-CA 3.4Å; M236-F240 WeakPolarHBondContact O-CB 3.37Å; M236-F240 PolarHBondContact O-N 2.93Å; M236-F240 VanDerWaalsContact O-O 3.1Å; F240-Y242 PolarHBondContact O-N 2.77Å; F240-F243 HydrophobicContact CB-CD2 3.84Å; F240-F243 HydrophobicContact CB-CE2 3.91Å; F240-F243 WeakPolarHBondContact O-CD2 3.43Å; F240-F243 PolarHBondContact O-N 3.23Å; F240-M310 HydrophobicContact CD1-CG 3.61Å; F240-M310 HydrophobicContact CE1-CG 3.29Å; F240-M310 HydrophobicContact CE1-SD 4Å; F240-M310 HydrophobicContact CZ-CG 3.98Å; F240-M310 HydrophobicContact CZ-SD 4.22Å
241P93.1Very high93.6Very high14 Ų1452.5 Ų52.59%0.09128%0.279CS..THydrogen-bonded Turntrans-62.3-14.2-168.6-25.134.7000115.6F204 F243 K244 A311F204-P241 HydrophobicContact CB-CB 4.45Å; F204-P241 HydrophobicContact CD1-CG 4.26Å; F204-P241 HydrophobicContact CD2-CB 3.5Å; F204-P241 VanDerWaalsContact CD2-CB 3.5Å; F204-P241 HydrophobicContact CD2-CG 3.8Å; F204-P241 HydrophobicContact CE1-CG 4.27Å; F204-P241 HydrophobicContact CE2-CB 3.84Å; F204-P241 HydrophobicContact CE2-CG 3.81Å; F204-P241 HydrophobicContact CG-CB 3.97Å; F204-P241 HydrophobicContact CG-CG 4.03Å; F204-P241 HydrophobicContact CZ-CG 4.05Å; P241-F243 PolarHBondContact O-N 3.41Å; P241-K244 HydrophobicContact CB-CD 4.17Å; P241-K244 VanDerWaalsContact O-CB 3.23Å; P241-K244 WeakPolarHBondContact O-CB 3.35Å; P241-K244 WeakPolarHBondContact O-CG 3.32Å; P241-K244 PolarHBondContact O-N 3.29Å; P241-A311 HydrophobicContact CG-CB 3.73Å
242Y93.3Very high93.7Very high63 Ų6352.9 Ų52.925%0.24728%0.283CS..Hα-helixtrans-44.9-41.1166.1174.1-100.9000112.6K206 F240 K244 T245 A246K206-Y242 HydrophobicContact CB-CD1 4.33Å; K206-Y242 HydrophobicContact CB-CD2 4.16Å; K206-Y242 HydrophobicContact CB-CE1 4Å; K206-Y242 HydrophobicContact CB-CE2 3.82Å; K206-Y242 HydrophobicContact CB-CG 4.41Å; K206-Y242 HydrophobicContact CD-CE1 4.41Å; K206-Y242 HydrophobicContact CG-CD1 4.28Å; K206-Y242 HydrophobicContact CG-CE1 3.76Å; K206-Y242 HydrophobicContact CG-CE2 4.45Å; F240-Y242 PolarHBondContact O-N 2.77Å; Y242-K244 PolarHBondContact O-N 3.11Å; Y242-T245 PolarHBondContact O-N 3.48Å; Y242-T245 PolarHBondContact O-OG1 2.87Å; Y242-A246 HydrophobicContact CD1-CB 4.11Å; Y242-A246 HydrophobicContact CE1-CB 3.71Å; Y242-A246 HydrophobicContact CE2-CB 4.42Å; Y242-A246 VanDerWaalsContact O-CB 3.3Å; Y242-A246 WeakPolarHBondContact O-CB 3.47Å; Y242-A246 PolarHBondContact O-N 2.99Å
243F93.3Very high93.7Very high7 Ų754.8 Ų54.83%0.03130%0.297CS..Hα-helixtrans-73.8-4.5179.7-59.8-66.9000114.5P207 Y211 L214 M236 K237 F240 P241 W250P207-F243 HydrophobicContact CG-CE2 3.89Å; P207-F243 HydrophobicContact CG-CZ 4.26Å; Y211-F243 HydrophobicContact CE1-CE1 4.02Å; Y211-F243 HydrophobicContact CE1-CZ 4.37Å; L214-F243 HydrophobicContact CD1-CE2 3.81Å; L214-F243 HydrophobicContact CD1-CZ 3.66Å; M236-F243 HydrophobicContact CB-CD2 3.95Å; M236-F243 HydrophobicContact CB-CE2 4.44Å; M236-F243 HydrophobicContact CB-CG 4.45Å; M236-F243 HydrophobicContact CE-CD1 4.04Å; M236-F243 HydrophobicContact CE-CD2 3.93Å; M236-F243 HydrophobicContact CE-CE1 3.76Å; M236-F243 HydrophobicContact CE-CE2 3.64Å; M236-F243 HydrophobicContact CE-CG 4.12Å; M236-F243 HydrophobicContact CE-CZ 3.56Å; K237-F243 HydrophobicContact CG-CB 4.12Å; F240-F243 HydrophobicContact CB-CD2 3.84Å; F240-F243 HydrophobicContact CB-CE2 3.91Å; F240-F243 WeakPolarHBondContact O-CD2 3.43Å; F240-F243 PolarHBondContact O-N 3.23Å; P241-F243 PolarHBondContact O-N 3.41Å; F243-W250 HydrophobicContact CB-CD2 4.44Å; F243-W250 HydrophobicContact CB-CH2 4.25Å; F243-W250 HydrophobicContact CB-CZ2 3.93Å; F243-W250 HydrophobicContact CD1-CB 4.29Å; F243-W250 AromaticContact CD1-CD2 3.78Å; F243-W250 HydrophobicContact CD1-CD2 3.78Å; F243-W250 HydrophobicContact CD1-CE3 4.03Å; F243-W250 AromaticContact CD1-CG 3.9Å; F243-W250 HydrophobicContact CD1-CG 3.9Å; F243-W250 HydrophobicContact CE1-CB 4.41Å; F243-W250 HydrophobicContact CE1-CG 4.49Å; F243-W250 HydrophobicContact CG-CD2 4.44Å; F243-W250 PolarHBondContact O-NE1 3.18Å
244K92.5Very high93.7Very high136 Ų13652.7 Ų52.759%0.59129%0.288SS*.Hα-helixtrans-78.2-27.8169.8-56.7-178.7-169.9-177.40112K237 P241 Y242K237-K244 HydrophobicContact CB-CG 4.03Å; K237-K244 HydrophobicContact CG-CG 4.34Å; K237-K244 WeakPolarHBondContact O-CE 3.47Å; P241-K244 HydrophobicContact CB-CD 4.17Å; P241-K244 VanDerWaalsContact O-CB 3.23Å; P241-K244 WeakPolarHBondContact O-CB 3.35Å; P241-K244 WeakPolarHBondContact O-CG 3.32Å; P241-K244 PolarHBondContact O-N 3.29Å; Y242-K244 PolarHBondContact O-N 3.11Å
245T90.5Very high93.8Very high122 Ų12255.9 Ų55.975%0.74829%0.293SS*.Hα-helixtrans-115.1-14-177.453.70000113.8Y242Y242-T245 PolarHBondContact O-N 3.48Å; Y242-T245 PolarHBondContact O-OG1 2.87Å
246A90.2Very high93.8Very high12 Ų1259.7 Ų59.710%0.09931%0.312CS..SBendtrans-67.5142179.100000113.3Y242 W250Y242-A246 HydrophobicContact CD1-CB 4.11Å; Y242-A246 HydrophobicContact CE1-CB 3.71Å; Y242-A246 HydrophobicContact CE2-CB 4.42Å; Y242-A246 VanDerWaalsContact O-CB 3.3Å; Y242-A246 WeakPolarHBondContact O-CB 3.47Å; Y242-A246 PolarHBondContact O-N 2.99Å; A246-W250 PolarHBondContact O-NE1 3.2Å
247P90.4Very high93.9Very high110 Ų11061.1 Ų61.171%0.71432%0.319SS*.  trans-58.1144.5178.5-25.434.1000114.3G249 W250P247-G249 PolarHBondContact O-N 3.45Å; P247-W250 PolarHBondContact O-N 2.68Å
248D89.2Confident93.9Very high103 Ų10357.4 Ų57.455%0.55130%0.303SS*.THydrogen-bonded Turntrans-59.1-12.5-165.8-112.831.8000116.7W250 K251D248-W250 PolarHBondContact O-N 3.11Å; D248-W250 VanDerWaalsContact O-N 3.17Å; D248-K251 WeakPolarHBondContact O-CB 3.3Å; D248-K251 PolarHBondContact O-N 3.4Å; D248-K251 VanDerWaalsContact O-N 3.1Å; D248-K251 WeakPolarHBondContact OD1-CE 3.48Å; D248-K251 IonicContact OD1-NZ 3.36Å; D248-K251 PolarHBondContact OD1-NZ 3.46Å; D248-K251 IonicContact OD2-NZ 3.72Å; D248-K251 PolarHBondContact OD2-NZ 3.34Å
249G93.3Very high94Very high47 Ų4755.9 Ų55.949%0.48531%0.306SS..Hα-helixtrans-54.3-28.2171.500000114.2P247 K251 N252 S253P247-G249 PolarHBondContact O-N 3.45Å; G249-K251 PolarHBondContact O-N 2.89Å; G249-N252 WeakPolarHBondContact O-CA 3.34Å; G249-N252 VanDerWaalsContact O-CB 3.31Å; G249-N252 WeakPolarHBondContact O-CB 3.5Å; G249-N252 PolarHBondContact O-N 2.89Å; G249-S253 PolarHBondContact O-N 2.93Å; G249-S253 VanDerWaalsContact O-N 3.16Å; G249-S253 PolarHBondContact O-OG 2.74Å
250W95Very high94.1Very high10 Ų1060.4 Ų60.44%0.03833%0.33CS..Hα-helixtrans-60.1-33.6176.873.7-103.4000112.6Y211 Y233 M236 K237 F243 A246 P247 D248 N252 S253 V254Y211-W250 HydrophobicContact CE1-CB 4.29Å; Y233-W250 AromaticContact CD1-CH2 3.98Å; Y233-W250 HydrophobicContact CD1-CH2 3.98Å; Y233-W250 AromaticContact CD1-CZ3 3.7Å; Y233-W250 HydrophobicContact CD1-CZ3 3.7Å; Y233-W250 HydrophobicContact CE1-CZ3 4.44Å; Y233-W250 HydrophobicContact CG-CH2 4.26Å; Y233-W250 HydrophobicContact CG-CZ3 4.42Å; M236-W250 HydrophobicContact CB-CZ3 4.47Å; M236-W250 HydrophobicContact CE-CE3 3.84Å; M236-W250 HydrophobicContact CE-CZ3 3.82Å; M236-W250 HydrophobicContact SD-CZ3 4.04Å; K237-W250 HydrophobicContact CD-CZ2 4.49Å; K237-W250 HydrophobicContact CG-CH2 4.31Å; K237-W250 HydrophobicContact CG-CZ2 4.19Å; F243-W250 HydrophobicContact CB-CD2 4.44Å; F243-W250 HydrophobicContact CB-CH2 4.25Å; F243-W250 HydrophobicContact CB-CZ2 3.93Å; F243-W250 HydrophobicContact CD1-CB 4.29Å; F243-W250 AromaticContact CD1-CD2 3.78Å; F243-W250 HydrophobicContact CD1-CD2 3.78Å; F243-W250 HydrophobicContact CD1-CE3 4.03Å; F243-W250 AromaticContact CD1-CG 3.9Å; F243-W250 HydrophobicContact CD1-CG 3.9Å; F243-W250 HydrophobicContact CE1-CB 4.41Å; F243-W250 HydrophobicContact CE1-CG 4.49Å; F243-W250 HydrophobicContact CG-CD2 4.44Å; F243-W250 PolarHBondContact O-NE1 3.18Å; A246-W250 PolarHBondContact O-NE1 3.2Å; P247-W250 PolarHBondContact O-N 2.68Å; D248-W250 PolarHBondContact O-N 3.11Å; D248-W250 VanDerWaalsContact O-N 3.17Å; W250-N252 PolarHBondContact O-N 2.85Å; W250-S253 WeakPolarHBondContact O-CB 3.42Å; W250-S253 PolarHBondContact O-N 3.15Å; W250-V254 HydrophobicContact CE3-CG2 3.99Å; W250-V254 HydrophobicContact CZ3-CG2 4.25Å; W250-V254 WeakPolarHBondContact O-CG2 3.48Å; W250-V254 PolarHBondContact O-N 2.91Å
251K95.3Very high94Very high61 Ų6162.1 Ų62.127%0.26534%0.339SS..Hα-helixtrans-62.9-32.4175.1-60.5171.8-177.8165.90111.3Y233 D248 G249 R255Y233-K251 HydrophobicContact CD1-CG 4.4Å; Y233-K251 HydrophobicContact CE1-CB 3.89Å; Y233-K251 HydrophobicContact CE1-CG 4.15Å; D248-K251 WeakPolarHBondContact O-CB 3.3Å; D248-K251 PolarHBondContact O-N 3.4Å; D248-K251 VanDerWaalsContact O-N 3.1Å; D248-K251 WeakPolarHBondContact OD1-CE 3.48Å; D248-K251 IonicContact OD1-NZ 3.36Å; D248-K251 PolarHBondContact OD1-NZ 3.46Å; D248-K251 IonicContact OD2-NZ 3.72Å; D248-K251 PolarHBondContact OD2-NZ 3.34Å; G249-K251 PolarHBondContact O-N 2.89Å; K251-R255 WeakPolarHBondContact O-CG 3.49Å; K251-R255 PolarHBondContact O-N 3.49Å; K251-R255 PolarHBondContact O-NH1 3.11Å
252N96.2Very high94.1Very high95 Ų9570.2 Ų70.251%0.50837%0.373SS..Hα-helixtrans-72.9-42.1175.3-158.346.4000111.6G249 W250 V254 R255 H256G249-N252 WeakPolarHBondContact O-CA 3.34Å; G249-N252 VanDerWaalsContact O-CB 3.31Å; G249-N252 WeakPolarHBondContact O-CB 3.5Å; G249-N252 PolarHBondContact O-N 2.89Å; W250-N252 PolarHBondContact O-N 2.85Å; N252-V254 VanDerWaalsContact C-N 3.27Å; N252-V254 PolarHBondContact O-N 3.48Å; N252-R255 PolarHBondContact O-N 2.83Å; N252-R255 PolarHBondContact OD1-NH2 3.06Å; N252-H256 WeakPolarHBondContact O-CB 3.32Å; N252-H256 PolarHBondContact O-N 3.48Å
253S96.8Very high94.1Very high40 Ų4067.6 Ų67.628%0.2836%0.363SS..Hα-helixtrans-58.3-38.3174.2-50.60000112.6G249 W250 N257G249-S253 PolarHBondContact O-N 2.93Å; G249-S253 VanDerWaalsContact O-N 3.16Å; G249-S253 PolarHBondContact O-OG 2.74Å; W250-S253 WeakPolarHBondContact O-CB 3.42Å; W250-S253 PolarHBondContact O-N 3.15Å; S253-N257 WeakPolarHBondContact O-CB 3.46Å; S253-N257 PolarHBondContact O-N 3.28Å; S253-N257 PolarHBondContact O-ND2 3.3Å
254V96.8Very high94.3Very high0 Ų067.9 Ų67.90%037%0.365CS..Hα-helixtrans-64-50.8174.5169.60000111.6Y211 I215 I232 Y233 M236 W250 N252 H256 N257 L258Y211-V254 HydrophobicContact CD1-CG2 3.88Å; Y211-V254 HydrophobicContact CE1-CG2 4.3Å; I215-V254 HydrophobicContact CD1-CG1 4.17Å; I215-V254 HydrophobicContact CG1-CG1 4.22Å; I232-V254 HydrophobicContact CG2-CG1 4.07Å; Y233-V254 HydrophobicContact CD1-CG1 4.31Å; Y233-V254 HydrophobicContact CE1-CB 4.19Å; Y233-V254 HydrophobicContact CE1-CG1 3.97Å; M236-V254 HydrophobicContact CE-CG2 3.75Å; M236-V254 HydrophobicContact SD-CG2 3.63Å; W250-V254 HydrophobicContact CE3-CG2 3.99Å; W250-V254 HydrophobicContact CZ3-CG2 4.25Å; W250-V254 WeakPolarHBondContact O-CG2 3.48Å; W250-V254 PolarHBondContact O-N 2.91Å; N252-V254 VanDerWaalsContact C-N 3.27Å; N252-V254 PolarHBondContact O-N 3.48Å; V254-H256 VanDerWaalsContact C-N 3.32Å; V254-H256 PolarHBondContact O-N 3.47Å; V254-N257 PolarHBondContact O-N 2.63Å; V254-L258 HydrophobicContact CG1-CD1 4.29Å; V254-L258 WeakPolarHBondContact O-CG 3.44Å; V254-L258 PolarHBondContact O-N 3.31Å
255R96.1Very high94.4Very high113 Ų11364.7 Ų64.743%0.42635%0.352SS..Hα-helixtrans-57.9-44.6176.6-69.6-174.9-57.9-97.512.3112.1V229 Y233 K251 N252 L258 S259V229-R255 HydrophobicContact CG1-CG 4.39Å; Y233-R255 WeakPolarHBondContact OH-CG 3.29Å; Y233-R255 PolarHBondContact OH-NH1 3.39Å; Y233-R255 VanDerWaalsContact OH-NH1 3.11Å; K251-R255 WeakPolarHBondContact O-CG 3.49Å; K251-R255 PolarHBondContact O-N 3.49Å; K251-R255 PolarHBondContact O-NH1 3.11Å; N252-R255 PolarHBondContact O-N 2.83Å; N252-R255 PolarHBondContact OD1-NH2 3.06Å; R255-L258 PolarHBondContact O-N 2.92Å; R255-S259 PolarHBondContact O-N 3.36Å; R255-S259 VanDerWaalsContact O-N 3.14Å; R255-S259 PolarHBondContact O-OG 2.84Å
256H96.7Very high94.6Very high102 Ų10265.9 Ų65.947%0.47235%0.347SS..Hα-helixtrans-61.5-43.6177.217570000112.2N252 V254 L258 S259 L260N252-H256 WeakPolarHBondContact O-CB 3.32Å; N252-H256 PolarHBondContact O-N 3.48Å; V254-H256 VanDerWaalsContact C-N 3.32Å; V254-H256 PolarHBondContact O-N 3.47Å; H256-L258 PolarHBondContact O-N 2.81Å; H256-S259 WeakPolarHBondContact CA-OG 3.22Å; H256-S259 PolarHBondContact O-N 3.17Å; H256-S259 PolarHBondContact O-OG 3.1Å; H256-L260 VanDerWaalsContact O-CB 3.24Å; H256-L260 WeakPolarHBondContact O-CB 3.14Å; H256-L260 PolarHBondContact O-N 3.2Å
257N97Very high94.6Very high29 Ų2966.9 Ų66.916%0.15535%0.352CS..Hα-helixtrans-61.2-42176-91.5-109.5000112.3S212 I215 S253 V254 S259 L260 N261S212-N257 PolarHBondContact N-OD1 3.5Å; S212-N257 PolarHBondContact OG-OD1 3.07Å; I215-N257 HydrophobicContact CD1-CB 3.61Å; S253-N257 WeakPolarHBondContact O-CB 3.46Å; S253-N257 PolarHBondContact O-N 3.28Å; S253-N257 PolarHBondContact O-ND2 3.3Å; V254-N257 PolarHBondContact O-N 2.63Å; N257-S259 VanDerWaalsContact C-N 3.35Å; N257-S259 PolarHBondContact O-N 3.23Å; N257-L260 PolarHBondContact O-N 3.16Å; N257-N261 WeakPolarHBondContact O-CB 3.47Å; N257-N261 PolarHBondContact O-N 3.33Å
258L95.8Very high94.2Very high3 Ų369.9 Ų69.92%0.01636%0.356CS..Hα-helixtrans-59.6-43.2175.8-71.2168.1000111.9I215 V229 I232 V254 R255 H256 F264 W281I215-L258 HydrophobicContact CD1-CD2 4.32Å; I215-L258 HydrophobicContact CD1-CG 4.16Å; I215-L258 HydrophobicContact CG2-CD2 3.61Å; V229-L258 HydrophobicContact CG1-CD1 4.1Å; V229-L258 HydrophobicContact CG2-CD1 4.08Å; I232-L258 HydrophobicContact CD1-CD1 4.12Å; I232-L258 HydrophobicContact CD1-CD2 4.14Å; V254-L258 HydrophobicContact CG1-CD1 4.29Å; V254-L258 WeakPolarHBondContact O-CG 3.44Å; V254-L258 PolarHBondContact O-N 3.31Å; R255-L258 PolarHBondContact O-N 2.92Å; H256-L258 PolarHBondContact O-N 2.81Å; L258-F264 HydrophobicContact CD2-CB 4.22Å; L258-F264 HydrophobicContact CD2-CD2 4.29Å; L258-F264 HydrophobicContact CD2-CG 4.11Å; L258-W281 HydrophobicContact CB-CD2 4.01Å; L258-W281 HydrophobicContact CB-CE3 4.01Å; L258-W281 HydrophobicContact CB-CH2 4.01Å; L258-W281 HydrophobicContact CB-CZ2 4.01Å; L258-W281 HydrophobicContact CB-CZ3 4.02Å; L258-W281 HydrophobicContact CD1-CD2 4.29Å; L258-W281 HydrophobicContact CD1-CG 4.21Å; L258-W281 HydrophobicContact CD2-CB 4.04Å; L258-W281 HydrophobicContact CD2-CD2 3.91Å; L258-W281 HydrophobicContact CD2-CE3 4.08Å; L258-W281 HydrophobicContact CD2-CG 3.89Å; L258-W281 HydrophobicContact CG-CD2 4.3Å; L258-W281 WeakPolarHBondContact O-CZ3 3.47Å
259S94.7Very high93.6Very high88 Ų8868 Ų6862%0.61535%0.346SS*.Hα-helixtrans-76.6-31.1178.651.20000115.2R255 H256 N257R255-S259 PolarHBondContact O-N 3.36Å; R255-S259 VanDerWaalsContact O-N 3.14Å; R255-S259 PolarHBondContact O-OG 2.84Å; H256-S259 WeakPolarHBondContact CA-OG 3.22Å; H256-S259 PolarHBondContact O-N 3.17Å; H256-S259 PolarHBondContact O-OG 3.1Å; N257-S259 VanDerWaalsContact C-N 3.35Å; N257-S259 PolarHBondContact O-N 3.23Å
260L94.8Very high92.2Very high113 Ų11374.7 Ų74.759%0.59236%0.362SS*.Hα-helixtrans-88.8-38.8-173.2179.6147.9000112.6H256 N257 K262H256-L260 VanDerWaalsContact O-CB 3.24Å; H256-L260 WeakPolarHBondContact O-CB 3.14Å; H256-L260 PolarHBondContact O-N 3.2Å; N257-L260 PolarHBondContact O-N 3.16Å; L260-K262 PolarHBondContact O-N 3.03Å
261N94.2Very high90.7Very high36 Ų3678.9 Ų78.919%0.19339%0.389CS..  trans-89.6113-170.3-171.6-9.3000111.3S212 N257 C263 F264S212-N261 PolarHBondContact OG-ND2 2.82Å; N257-N261 WeakPolarHBondContact O-CB 3.47Å; N257-N261 PolarHBondContact O-N 3.33Å; N261-C263 PolarHBondContact O-N 2.95Å; N261-C263 WeakPolarHBondContact OD1-CB 3.35Å; N261-C263 PolarHBondContact OD1-N 3.23Å; N261-C263 PolarHBondContact OD1-SG 3.26Å; N261-F264 HydrophobicContact CB-CD2 3.94Å; N261-F264 HydrophobicContact CB-CE2 3.97Å; N261-F264 PolarHBondContact O-N 3.47Å
262K94.3Very high88.8Confident184 Ų18480.1 Ų80.180%0.842%0.419SS*.THydrogen-bonded Turntrans-57.8-1.8175.3-59-175.2180-176.80115.2L260 F264L260-K262 PolarHBondContact O-N 3.03Å; K262-F264 VanDerWaalsContact C-N 3.3Å
263C94.2Very high86.7Confident8 Ų879.5 Ų79.55%0.05442%0.422CS..THydrogen-bonded Turntrans-76.6-16167.3-55.80000112.9N261 L283 N284 K287 M291N261-C263 PolarHBondContact O-N 2.95Å; N261-C263 WeakPolarHBondContact OD1-CB 3.35Å; N261-C263 PolarHBondContact OD1-N 3.23Å; N261-C263 PolarHBondContact OD1-SG 3.26Å; C263-L283 WeakPolarHBondContact O-CD1 3.09Å; C263-N284 WeakPolarHBondContact O-CB 3.46Å; C263-N284 PolarHBondContact O-N 3.48Å; C263-K287 HydrophobicContact CB-CB 4.05Å; C263-M291 HydrophobicContact CB-CE 3.54Å
264F95.9Very high84.5Confident13 Ų1381 Ų816%0.05743%0.432CS..EExtended strand (participates in β ladder)trans-112.7143.7176.5-48.6-59000110.7S212 I215 A216 L219 L258 N261 K262 W281 A282 L283 M291S212-F264 WeakPolarHBondContact O-CZ 3.43Å; I215-F264 HydrophobicContact CB-CE1 4.11Å; I215-F264 HydrophobicContact CB-CE2 4.36Å; I215-F264 HydrophobicContact CB-CZ 3.82Å; I215-F264 HydrophobicContact CD1-CE2 4.29Å; I215-F264 HydrophobicContact CG2-CD1 3.82Å; I215-F264 HydrophobicContact CG2-CD2 4.4Å; I215-F264 HydrophobicContact CG2-CE1 3.44Å; I215-F264 VanDerWaalsContact CG2-CE1 3.44Å; I215-F264 HydrophobicContact CG2-CE2 4.06Å; I215-F264 HydrophobicContact CG2-CG 4.3Å; I215-F264 HydrophobicContact CG2-CZ 3.58Å; A216-F264 HydrophobicContact CB-CE1 4.24Å; L219-F264 HydrophobicContact CD1-CD1 3.7Å; L219-F264 HydrophobicContact CD1-CE1 4.03Å; L258-F264 HydrophobicContact CD2-CB 4.22Å; L258-F264 HydrophobicContact CD2-CD2 4.29Å; L258-F264 HydrophobicContact CD2-CG 4.11Å; N261-F264 HydrophobicContact CB-CD2 3.94Å; N261-F264 HydrophobicContact CB-CE2 3.97Å; N261-F264 PolarHBondContact O-N 3.47Å; K262-F264 VanDerWaalsContact C-N 3.3Å; F264-W281 HydrophobicContact CB-CE3 4.2Å; F264-A282 WeakPolarHBondContact CA-O 3.39Å; F264-L283 HydrophobicContact CD1-CD1 3.91Å; F264-L283 HydrophobicContact CE1-CD1 3.63Å; F264-M291 HydrophobicContact CZ-CE 4.1Å
265E94.9Very high82.4Confident70 Ų7087.5 Ų87.533%0.32748%0.478SS..EExtended strand (participates in β ladder)trans-131.214017859-169.3-145.200110.7V267 W281 A282 N284E265-V267 HydrophobicContact CG-CG2 4.1Å; E265-W281 CarbonylContact O-C 3.6Å; E265-W281 WeakPolarHBondContact O-CA 3.34Å; E265-A282 HydrophobicContact CG-CB 4.1Å; E265-A282 PolarHBondContact N-O 2.88Å; E265-A282 PolarHBondContact O-N 3.46Å; E265-N284 WeakPolarHBondContact OE2-CA 3.44Å; E265-N284 WeakPolarHBondContact OE2-CB 3.38Å; E265-N284 PolarHBondContact OE2-ND2 2.92Å
266K94.4Very high80.6Confident147 Ų14793.6 Ų93.664%0.63950%0.501SS*.EExtended strand (participates in β ladder)trans-79.4117.7175-178.6-166.9175.7-164.80108C279 W281K266-C279 HydrophobicContact CD-CB 4.24Å; K266-C279 HydrophobicContact CG-CB 3.83Å; K266-W281 HydrophobicContact CB-CE3 4.31Å; K266-W281 HydrophobicContact CB-CH2 4.19Å; K266-W281 HydrophobicContact CB-CZ2 4.48Å; K266-W281 HydrophobicContact CB-CZ3 4.09Å
267V90.8Very high79.2Confident33 Ų3396.5 Ų96.520%0.251%0.512CS..EExtended strand (participates in β ladder)trans-109137.5-177.8-177.40000109.9E265 L280 A282E265-V267 HydrophobicContact CG-CG2 4.1Å; V267-L280 PolarHBondContact N-O 3.04Å; V267-L280 PolarHBondContact O-N 2.95Å; V267-A282 HydrophobicContact CG2-CB 3.53Å
268E82.9Confident78.1Confident173 Ų17397.8 Ų97.881%0.80853%0.532SS*.  trans-71.2145.7177-60.1-166.6149.300111.6K270E268-K270 PolarHBondContact O-N 3.39Å
269N76.1Confident77.8Confident64 Ų64100 Ų10034%0.34255%0.547SS..  trans-74.999.4179.4-178.612.9000110.2T271 L280N269-T271 VanDerWaalsContact CG-O 3.27Å; N269-T271 PolarHBondContact ND2-O 2.89Å; N269-T271 CarbonylContact O-C 3.51Å; N269-T271 PolarHBondContact O-N 3.34Å; N269-T271 WeakPolarHBondContact OD1-CB 3.45Å; N269-T271 PolarHBondContact OD1-N 3.2Å; N269-T271 PolarHBondContact OD1-O 3.14Å; N269-L280 HydrophobicContact CB-CD1 4.49Å
270K64.3Low77.7Confident186 Ų18697.4 Ų97.481%0.80953%0.526SS*.SBendtrans-50.6-26175.6-50.9177.6-172.21770113.4E268 G272E268-K270 PolarHBondContact O-N 3.39Å; K270-G272 PolarHBondContact O-N 3.25Å
271T62.1Low77.8Confident98 Ų9893.7 Ų93.760%0.60150%0.504SS*.SBendtrans-85.994.4169.3-53.10000108.3N269 S273N269-T271 VanDerWaalsContact CG-O 3.27Å; N269-T271 PolarHBondContact ND2-O 2.89Å; N269-T271 CarbonylContact O-C 3.51Å; N269-T271 PolarHBondContact O-N 3.34Å; N269-T271 WeakPolarHBondContact OD1-CB 3.45Å; N269-T271 PolarHBondContact OD1-N 3.2Å; N269-T271 PolarHBondContact OD1-O 3.14Å; T271-S273 PolarHBondContact O-N 3.32Å
272G55.5Low77.8Confident87 Ų8792.5 Ų92.590%0.89750%0.5SS*.  trans-68.247.2-175.200000115.9K270K270-G272 PolarHBondContact O-N 3.25Å
273S52.1Low77.9Confident82 Ų8284.7 Ų84.757%0.57347%0.466SS*.  trans-120.8114.1-179.8-173.10000111.3T271T271-S273 PolarHBondContact O-N 3.32Å
274S50.1Low77.9Confident72 Ų7286.1 Ų86.150%0.50347%0.474SS..  trans65.1110.8174.674.40000117.4R276 K277S274-R276 PolarHBondContact O-N 2.88Å; S274-K277 PolarHBondContact O-N 3.22Å
275S54.1Low77.7Confident136 Ų13689.5 Ų89.595%0.95150%0.497SS*.THydrogen-bonded Turntrans-65.514.8170.1-40.50000114.9
276R58.8Low77.6Confident242 Ų24289.5 Ų89.591%0.91351%0.509SS*.THydrogen-bonded Turntrans-101.8-11.5176.6-69.3-162.9-71.5176.6-4.6113.6S274S274-R276 PolarHBondContact O-N 2.88Å
277K66.6Low77.4Confident163 Ų16386.5 Ų86.571%0.70950%0.496SS*.SBendtrans-87.4124.4166.6-78.7-178.6175.3176.60108.9S274S274-K277 PolarHBondContact O-N 3.22Å
278G74.2Confident77.5Confident55 Ų5587.4 Ų87.457%0.56750%0.499SS*.PPolyproline II helixtrans-62.4161.2-175.100000113.4
279C88.7Confident77.9Confident50 Ų5085.1 Ų85.134%0.33849%0.492SS..PPolyproline II helixtrans-58.4143.5-177.556.20000112.9K266K266-C279 HydrophobicContact CD-CB 4.24Å; K266-C279 HydrophobicContact CG-CB 3.83Å
280L93.4Very high78.7Confident33 Ų3388.4 Ų88.417%0.17350%0.503CS..EExtended strand (participates in β ladder)trans-78.8150.4170.9-56177.9000109.7P228 V267 N269P228-L280 HydrophobicContact CB-CD2 4.08Å; P228-L280 HydrophobicContact CG-CD2 4.32Å; V267-L280 PolarHBondContact N-O 3.04Å; V267-L280 PolarHBondContact O-N 2.95Å; N269-L280 HydrophobicContact CB-CD1 4.49Å
281W95.6Very high80.1Confident36 Ų3680 Ų8014%0.13647%0.467CS..EExtended strand (participates in β ladder)trans-117.4141169.9-68.687.9000108.9L219 S226 L227 L258 F264 E265 K266L219-W281 WeakPolarHBondContact CD2-O 3.16Å; S226-W281 CarbonylContact C-O 3.52Å; S226-W281 WeakPolarHBondContact CA-O 3.45Å; S226-W281 VanDerWaalsContact CB-O 3.26Å; S226-W281 WeakPolarHBondContact CB-O 3.43Å; L227-W281 PolarHBondContact N-O 3.33Å; L227-W281 PolarHBondContact O-N 3.02Å; L258-W281 HydrophobicContact CB-CD2 4.01Å; L258-W281 HydrophobicContact CB-CE3 4.01Å; L258-W281 HydrophobicContact CB-CH2 4.01Å; L258-W281 HydrophobicContact CB-CZ2 4.01Å; L258-W281 HydrophobicContact CB-CZ3 4.02Å; L258-W281 HydrophobicContact CD1-CD2 4.29Å; L258-W281 HydrophobicContact CD1-CG 4.21Å; L258-W281 HydrophobicContact CD2-CB 4.04Å; L258-W281 HydrophobicContact CD2-CD2 3.91Å; L258-W281 HydrophobicContact CD2-CE3 4.08Å; L258-W281 HydrophobicContact CD2-CG 3.89Å; L258-W281 HydrophobicContact CG-CD2 4.3Å; L258-W281 WeakPolarHBondContact O-CZ3 3.47Å; F264-W281 HydrophobicContact CB-CE3 4.2Å; E265-W281 CarbonylContact O-C 3.6Å; E265-W281 WeakPolarHBondContact O-CA 3.34Å; K266-W281 HydrophobicContact CB-CE3 4.31Å; K266-W281 HydrophobicContact CB-CH2 4.19Å; K266-W281 HydrophobicContact CB-CZ2 4.48Å; K266-W281 HydrophobicContact CB-CZ3 4.09Å
282A95.4Very high81.5Confident11 Ų1177.2 Ų77.29%0.09145%0.447CS..EExtended strand (participates in β ladder)trans-126163.1174.500000110.6F264 E265 V267F264-A282 WeakPolarHBondContact CA-O 3.39Å; E265-A282 HydrophobicContact CG-CB 4.1Å; E265-A282 PolarHBondContact N-O 2.88Å; E265-A282 PolarHBondContact O-N 3.46Å; V267-A282 HydrophobicContact CG2-CB 3.53Å
283L95.3Very high83.3Confident19 Ų1978.8 Ų78.810%0.09943%0.431CS..EExtended strand (participates in β ladder)trans-87.6121.9171.7-17070.7000108.3A216 L219 K220 C263 F264 I288 M291A216-L283 HydrophobicContact CB-CD1 4.01Å; L219-L283 HydrophobicContact CB-CB 4.36Å; L219-L283 HydrophobicContact CD1-CB 4.34Å; K220-L283 HydrophobicContact CG-CD2 4.17Å; C263-L283 WeakPolarHBondContact O-CD1 3.09Å; F264-L283 HydrophobicContact CD1-CD1 3.91Å; F264-L283 HydrophobicContact CE1-CD1 3.63Å; L283-I288 HydrophobicContact CD2-CB 4.21Å; L283-I288 HydrophobicContact CD2-CG1 3.86Å; L283-I288 HydrophobicContact CD2-CG2 4.06Å; L283-I288 HydrophobicContact CG-CG1 4.07Å; L283-M291 HydrophobicContact CD1-CG 4.3Å
284N94.3Very high85.2Confident39 Ų3977.6 Ų77.621%0.20942%0.416CS..  trans-59.9126.9-176.7178.3-76.7000110.4C263 E265 A286 K287 I288C263-N284 WeakPolarHBondContact O-CB 3.46Å; C263-N284 PolarHBondContact O-N 3.48Å; E265-N284 WeakPolarHBondContact OE2-CA 3.44Å; E265-N284 WeakPolarHBondContact OE2-CB 3.38Å; E265-N284 PolarHBondContact OE2-ND2 2.92Å; N284-A286 PolarHBondContact O-N 3.27Å; N284-A286 VanDerWaalsContact O-N 3.16Å; N284-A286 WeakPolarHBondContact OD1-CB 3.46Å; N284-A286 PolarHBondContact OD1-N 2.98Å; N284-K287 HydrophobicContact CB-CB 4.33Å; N284-K287 HydrophobicContact CB-CG 4.36Å; N284-K287 PolarHBondContact O-N 3.47Å; N284-I288 WeakPolarHBondContact O-CG1 3.12Å; N284-I288 PolarHBondContact O-N 3.47Å
285P91.6Very high87.2Confident84 Ų8474.2 Ų74.255%0.54539%0.393SS..G310 helixtrans-60.7-30.7-172.122.2-33.2000113.5K287P285-K287 PolarHBondContact O-N 3.12Å
286A93.1Very high89.1Confident70 Ų7070.3 Ų70.358%0.57936%0.36SS*.G310 helixtrans-8410.5178.300000113.6N284N284-A286 PolarHBondContact O-N 3.27Å; N284-A286 VanDerWaalsContact O-N 3.16Å; N284-A286 WeakPolarHBondContact OD1-CB 3.46Å; N284-A286 PolarHBondContact OD1-N 2.98Å
287K91.5Very high90.7Very high84 Ų8463.6 Ų63.637%0.36534%0.337SS..G310 helixtrans-134.30.8180-60.3-69.8160.2-100.90113.8C263 N284 P285 M291C263-K287 HydrophobicContact CB-CB 4.05Å; N284-K287 HydrophobicContact CB-CB 4.33Å; N284-K287 HydrophobicContact CB-CG 4.36Å; N284-K287 PolarHBondContact O-N 3.47Å; P285-K287 PolarHBondContact O-N 3.12Å; K287-M291 PolarHBondContact O-N 3.36Å
288I91.4Very high91.8Very high52 Ų5258.8 Ų58.827%0.26731%0.314SS..Hα-helixtrans-58-52.4178.8-56.7-174.3000110.5L283 N284 K290 M291 E292L283-I288 HydrophobicContact CD2-CB 4.21Å; L283-I288 HydrophobicContact CD2-CG1 3.86Å; L283-I288 HydrophobicContact CD2-CG2 4.06Å; L283-I288 HydrophobicContact CG-CG1 4.07Å; N284-I288 WeakPolarHBondContact O-CG1 3.12Å; N284-I288 PolarHBondContact O-N 3.47Å; I288-K290 PolarHBondContact O-N 3.4Å; I288-M291 PolarHBondContact O-N 2.97Å; I288-E292 PolarHBondContact O-N 3.18Å
289D91.9Very high92.6Very high125 Ų12557.7 Ų57.767%0.66829%0.294SS*.Hα-helixtrans-63.8-38.9-174-50.7-55.7000112.5M291 E292 E293D289-M291 VanDerWaalsContact C-N 3.31Å; D289-M291 PolarHBondContact O-N 3.25Å; D289-E292 PolarHBondContact O-N 3.45Å; D289-E293 WeakPolarHBondContact O-CB 3.3Å; D289-E293 PolarHBondContact O-N 3.18Å
290K92.3Very high92.7Very high132 Ų13264 Ų6457%0.57431%0.311SS*.Hα-helixtrans-60.5-40.6173.1177.2178.1178178.50112I288 E293 E294I288-K290 PolarHBondContact O-N 3.4Å; K290-E293 PolarHBondContact O-N 3.39Å; K290-E294 PolarHBondContact O-N 2.86Å; K290-E294 VanDerWaalsContact O-N 3.11Å
291M93.4Very high92.6Very high11 Ų1169.9 Ų69.95%0.05434%0.335CS..Hα-helixtrans-75.6-34.1-177.5-16960.870.800111.6A216 C263 F264 L283 K287 I288 D289 M295A216-M291 HydrophobicContact CB-CB 4.46Å; A216-M291 HydrophobicContact CB-CG 3.16Å; A216-M291 HydrophobicContact CB-SD 3.91Å; C263-M291 HydrophobicContact CB-CE 3.54Å; F264-M291 HydrophobicContact CZ-CE 4.1Å; L283-M291 HydrophobicContact CD1-CG 4.3Å; K287-M291 PolarHBondContact O-N 3.36Å; I288-M291 PolarHBondContact O-N 2.97Å; D289-M291 VanDerWaalsContact C-N 3.31Å; D289-M291 PolarHBondContact O-N 3.25Å; M291-M295 WeakPolarHBondContact O-CB 3.15Å; M291-M295 PolarHBondContact O-N 2.83Å; M291-M295 VanDerWaalsContact O-N 3.11Å
292E91.9Very high92.3Very high39 Ų3970.7 Ų70.718%0.18234%0.342CS..Hα-helixtrans-62.9-45.7168.5-176.557.3-146.900111K220 I288 D289 E294 M295 Q296 I320K220-E292 WeakPolarHBondContact CE-OE2 3.2Å; K220-E292 IonicContact NZ-OE2 2.73Å; K220-E292 PolarHBondContact NZ-OE2 3.15Å; I288-E292 PolarHBondContact O-N 3.18Å; D289-E292 PolarHBondContact O-N 3.45Å; E292-E294 PolarHBondContact O-N 3.49Å; E292-M295 WeakPolarHBondContact O-CB 3.43Å; E292-M295 PolarHBondContact O-N 3.1Å; E292-M295 VanDerWaalsContact O-N 3.1Å; E292-M295 WeakPolarHBondContact OE2-CE 3.44Å; E292-Q296 HydrophobicContact CG-CG 4.28Å; E292-Q296 WeakPolarHBondContact O-CB 3.34Å; E292-Q296 WeakPolarHBondContact O-CG 3.46Å; E292-Q296 PolarHBondContact O-N 3.07Å; E292-Q296 VanDerWaalsContact OE1-CG 3.31Å; E292-Q296 WeakPolarHBondContact OE1-CG 3.3Å; E292-Q296 PolarHBondContact OE1-NE2 3.28Å; E292-I320 VanDerWaalsContact OE1-CG2 3.31Å; E292-I320 WeakPolarHBondContact OE1-CG2 3.34Å
293E93.1Very high92.1Very high119 Ų11972.6 Ų72.656%0.55635%0.35SS*.Hα-helixtrans-58.2-46.9177.2-171-172-178.600112.2D289 K290 M295 Q296 K297D289-E293 WeakPolarHBondContact O-CB 3.3Å; D289-E293 PolarHBondContact O-N 3.18Å; K290-E293 PolarHBondContact O-N 3.39Å; E293-M295 VanDerWaalsContact C-N 3.3Å; E293-M295 PolarHBondContact O-N 3.28Å; E293-Q296 PolarHBondContact O-N 3.01Å; E293-K297 WeakPolarHBondContact O-CB 3.48Å; E293-K297 PolarHBondContact O-N 3.4Å
294E92.9Very high91.8Very high57 Ų5775.8 Ų75.827%0.26637%0.372SS..Hα-helixtrans-60.2-39.1174.7-79.9-67.5124.800112K290 E292 K297 W298K290-E294 PolarHBondContact O-N 2.86Å; K290-E294 VanDerWaalsContact O-N 3.11Å; E292-E294 PolarHBondContact O-N 3.49Å; E294-K297 PolarHBondContact O-N 3.41Å; E294-K297 WeakPolarHBondContact OE1-CD 3.31Å; E294-K297 IonicContact OE1-NZ 2.74Å; E294-K297 PolarHBondContact OE1-NZ 3.31Å; E294-K297 IonicContact OE2-NZ 3.83Å; E294-W298 VanDerWaalsContact O-CD1 3.26Å; E294-W298 PolarHBondContact O-N 2.94Å; E294-W298 VanDerWaalsContact O-N 3.11Å
295M92.8Very high91.6Very high1 Ų174.2 Ų74.21%0.00537%0.365CS..Hα-helixtrans-67.5-39.7177.8-169.9163.757.400112.3Y209 M217 K220 M291 E292 E293 K299 I320Y209-M295 HydrophobicContact CE1-CB 4.37Å; Y209-M295 HydrophobicContact CE1-CG 3.75Å; Y209-M295 WeakPolarHBondContact CE1-O 3.45Å; Y209-M295 PolarHBondContact OH-O 3.39Å; Y209-M295 VanDerWaalsContact OH-O 3.11Å; M217-M295 HydrophobicContact CB-SD 4.04Å; M217-M295 HydrophobicContact CE-CG 4.31Å; M217-M295 HydrophobicContact CE-SD 3.54Å; M217-M295 VanDerWaalsContact CE-SD 3.54Å; M217-M295 HydrophobicContact CG-SD 4.2Å; K220-M295 HydrophobicContact CD-CE 4.05Å; M291-M295 WeakPolarHBondContact O-CB 3.15Å; M291-M295 PolarHBondContact O-N 2.83Å; M291-M295 VanDerWaalsContact O-N 3.11Å; E292-M295 WeakPolarHBondContact O-CB 3.43Å; E292-M295 PolarHBondContact O-N 3.1Å; E292-M295 VanDerWaalsContact O-N 3.1Å; E292-M295 WeakPolarHBondContact OE2-CE 3.44Å; E293-M295 VanDerWaalsContact C-N 3.3Å; E293-M295 PolarHBondContact O-N 3.28Å; M295-K299 WeakPolarHBondContact O-CB 3.37Å; M295-K299 PolarHBondContact O-N 2.92Å; M295-I320 HydrophobicContact CE-CB 4.35Å; M295-I320 HydrophobicContact CE-CG1 4Å; M295-I320 HydrophobicContact CE-CG2 4.34Å; M295-I320 HydrophobicContact CG-CD1 4.02Å; M295-I320 HydrophobicContact CG-CG1 3.95Å; M295-I320 HydrophobicContact SD-CG1 3.9Å
296Q92Very high91.6Very high55 Ų5570.3 Ų70.326%0.25734%0.339SS..Hα-helixtrans-72.7-30.5175-65.5-797.900112.9E292 E293 K299 R300 I320E292-Q296 HydrophobicContact CG-CG 4.28Å; E292-Q296 WeakPolarHBondContact O-CB 3.34Å; E292-Q296 WeakPolarHBondContact O-CG 3.46Å; E292-Q296 PolarHBondContact O-N 3.07Å; E292-Q296 VanDerWaalsContact OE1-CG 3.31Å; E292-Q296 WeakPolarHBondContact OE1-CG 3.3Å; E292-Q296 PolarHBondContact OE1-NE2 3.28Å; E293-Q296 PolarHBondContact O-N 3.01Å; Q296-K299 PolarHBondContact O-N 3.04Å; Q296-R300 WeakPolarHBondContact O-CB 3.38Å; Q296-R300 WeakPolarHBondContact O-CG 3.47Å; Q296-R300 PolarHBondContact O-N 3.44Å; Q296-R300 PolarHBondContact O-NE 2.88Å; Q296-I320 HydrophobicContact CG-CG2 4.3Å
297K92.9Very high91.4Very high100 Ų10071.4 Ų71.444%0.43533%0.329SS..Hα-helixtrans-66-46.1174.1168.8-177.6168.3-173.30110.9E293 E294 R300 K301E293-K297 WeakPolarHBondContact O-CB 3.48Å; E293-K297 PolarHBondContact O-N 3.4Å; E294-K297 PolarHBondContact O-N 3.41Å; E294-K297 WeakPolarHBondContact OE1-CD 3.31Å; E294-K297 IonicContact OE1-NZ 2.74Å; E294-K297 PolarHBondContact OE1-NZ 3.31Å; E294-K297 IonicContact OE2-NZ 3.83Å; K297-R300 PolarHBondContact O-N 3.22Å; K297-K301 WeakPolarHBondContact O-CB 3.45Å; K297-K301 PolarHBondContact O-N 3.12Å
298W90.1Very high91.4Very high62 Ų6274.6 Ų74.624%0.23534%0.338CS..Hα-helixtrans-66.3-40.2171.7-77.5111.1000112.6I208 Y209 E294 R300 K301 D302 I306I208-W298 HydrophobicContact CG2-CD2 4.1Å; I208-W298 HydrophobicContact CG2-CE3 3.31Å; I208-W298 HydrophobicContact CG2-CH2 3.9Å; I208-W298 HydrophobicContact CG2-CZ3 3.18Å; Y209-W298 HydrophobicContact CD1-CB 3.91Å; Y209-W298 HydrophobicContact CD1-CG 4.25Å; Y209-W298 HydrophobicContact CE1-CB 3.53Å; Y209-W298 HydrophobicContact CE1-CG 4.32Å; E294-W298 VanDerWaalsContact O-CD1 3.26Å; E294-W298 PolarHBondContact O-N 2.94Å; E294-W298 VanDerWaalsContact O-N 3.11Å; W298-R300 VanDerWaalsContact C-N 3.3Å; W298-R300 PolarHBondContact O-N 2.97Å; W298-K301 HydrophobicContact CE3-CB 4.46Å; W298-K301 HydrophobicContact CE3-CD 3.96Å; W298-K301 HydrophobicContact CZ3-CD 3.74Å; W298-K301 PolarHBondContact O-N 3.42Å; W298-D302 PolarHBondContact O-N 3.46Å; W298-I306 HydrophobicContact CB-CD1 4.35Å; W298-I306 WeakPolarHBondContact O-CD1 3.17Å
299K90.1Very high91.4Very high32 Ų3272.2 Ų72.214%0.13933%0.326CS..Hα-helixtrans-54.9-44172.9-169.1-170.1-174179.80112M295 Q296 L303 D317 I320M295-K299 WeakPolarHBondContact O-CB 3.37Å; M295-K299 PolarHBondContact O-N 2.92Å; Q296-K299 PolarHBondContact O-N 3.04Å; K299-L303 HydrophobicContact CG-CD1 3.95Å; K299-L303 WeakPolarHBondContact O-CB 3.47Å; K299-L303 PolarHBondContact O-N 3.26Å; K299-D317 WeakPolarHBondContact CE-OD1 3.38Å; K299-D317 IonicContact NZ-OD1 3.39Å; K299-D317 PolarHBondContact NZ-OD1 3.43Å; K299-I320 HydrophobicContact CB-CD1 4.32Å; K299-I320 HydrophobicContact CD-CD1 3.86Å; K299-I320 HydrophobicContact CD-CG2 4.38Å; K299-I320 HydrophobicContact CG-CD1 4.21Å
300R91.1Very high91.5Very high184 Ų18466.4 Ų66.469%0.69430%0.295SS*.Hα-helixtrans-71.1-30.5175.4-74.6178-69.5152.8-6.5113.6Q296 K297 W298Q296-R300 WeakPolarHBondContact O-CB 3.38Å; Q296-R300 WeakPolarHBondContact O-CG 3.47Å; Q296-R300 PolarHBondContact O-N 3.44Å; Q296-R300 PolarHBondContact O-NE 2.88Å; K297-R300 PolarHBondContact O-N 3.22Å; W298-R300 VanDerWaalsContact C-N 3.3Å; W298-R300 PolarHBondContact O-N 2.97Å
301K91.7Very high91.3Very high155 Ų15561.8 Ų61.867%0.67428%0.281SS*.Hα-helixtrans-76.2-44.4-177.1-176.8172.8173.5-178.50113.2K297 W298K297-K301 WeakPolarHBondContact O-CB 3.45Å; K297-K301 PolarHBondContact O-N 3.12Å; W298-K301 HydrophobicContact CE3-CB 4.46Å; W298-K301 HydrophobicContact CE3-CD 3.96Å; W298-K301 HydrophobicContact CZ3-CD 3.74Å; W298-K301 PolarHBondContact O-N 3.42Å
302D89.9Confident91.1Very high53 Ų5365 Ų6528%0.28330%0.299SS..  trans-154.468.6-179.4-164.1-16.4000112.5I208 W298 P304 A305 I306I208-D302 HydrophobicContact CD1-CB 4.34Å; W298-D302 PolarHBondContact O-N 3.46Å; D302-P304 VanDerWaalsContact C-CD 3.46Å; D302-P304 VanDerWaalsContact C-N 3.33Å; D302-P304 WeakPolarHBondContact OD1-CD 3.44Å; D302-A305 HydrophobicContact CB-CB 4.23Å; D302-A305 PolarHBondContact O-N 2.98Å; D302-A305 WeakPolarHBondContact OD1-CB 3.24Å; D302-A305 PolarHBondContact OD1-N 3.23Å; D302-A305 WeakPolarHBondContact OD2-CB 3.34Å; D302-I306 WeakPolarHBondContact O-CD1 3.49Å; D302-I306 VanDerWaalsContact O-CG1 3.32Å; D302-I306 WeakPolarHBondContact O-CG1 3.2Å; D302-I306 PolarHBondContact O-N 3.48Å
303L89.9Confident90.8Very high51 Ų5165.2 Ų65.227%0.26730%0.304SS..Hα-helixtrans-53.2-42.3171.9-174.964.4000113K299 I306 R307 L316K299-L303 HydrophobicContact CG-CD1 3.95Å; K299-L303 WeakPolarHBondContact O-CB 3.47Å; K299-L303 PolarHBondContact O-N 3.26Å; L303-I306 PolarHBondContact O-N 2.86Å; L303-R307 HydrophobicContact CD1-CG 4.38Å; L303-R307 WeakPolarHBondContact O-CG 3.49Å; L303-R307 PolarHBondContact O-N 3.04Å; L303-L316 HydrophobicContact CD1-CD2 3.52Å
304P89.5Confident90.4Very high86 Ų8665.5 Ų65.556%0.55831%0.309SS*.Hα-helixtrans-62.7-41.2178.8-24.836000114.3D302 R308D302-P304 VanDerWaalsContact C-CD 3.46Å; D302-P304 VanDerWaalsContact C-N 3.33Å; D302-P304 WeakPolarHBondContact OD1-CD 3.44Å; P304-R308 WeakPolarHBondContact O-CG 3.31Å; P304-R308 PolarHBondContact O-N 3.46Å; P304-R308 PolarHBondContact O-NE 3.48Å
305A91.1Very high90Very high7 Ų766 Ų666%0.05831%0.311CS..Hα-helixtrans-70.9-37.8177.600000112.9I208 D302 R308 S309I208-A305 HydrophobicContact CD1-CB 3.42Å; I208-A305 VanDerWaalsContact CD1-CB 3.42Å; I208-A305 HydrophobicContact CG1-CB 4.25Å; D302-A305 HydrophobicContact CB-CB 4.23Å; D302-A305 PolarHBondContact O-N 2.98Å; D302-A305 WeakPolarHBondContact OD1-CB 3.24Å; D302-A305 PolarHBondContact OD1-N 3.23Å; D302-A305 WeakPolarHBondContact OD2-CB 3.34Å; A305-R308 VanDerWaalsContact CB-NH2 3.28Å; A305-R308 PolarHBondContact O-N 3.34Å; A305-S309 PolarHBondContact O-N 3.08Å
306I90.6Very high89.7Confident1 Ų166 Ų661%0.00531%0.311CS..Hα-helixtrans-59.3-51.1173.9-65.5162.7000109.4Y209 W298 D302 L303 R308 S309 M310 L316Y209-I306 HydrophobicContact CD2-CG1 4.5Å; Y209-I306 HydrophobicContact CD2-CG2 4.14Å; Y209-I306 HydrophobicContact CE1-CD1 4.39Å; Y209-I306 HydrophobicContact CE2-CB 4.45Å; Y209-I306 HydrophobicContact CE2-CD1 4Å; Y209-I306 HydrophobicContact CE2-CG1 4.1Å; Y209-I306 HydrophobicContact CE2-CG2 3.46Å; Y209-I306 VanDerWaalsContact CE2-CG2 3.46Å; W298-I306 HydrophobicContact CB-CD1 4.35Å; W298-I306 WeakPolarHBondContact O-CD1 3.17Å; D302-I306 WeakPolarHBondContact O-CD1 3.49Å; D302-I306 VanDerWaalsContact O-CG1 3.32Å; D302-I306 WeakPolarHBondContact O-CG1 3.2Å; D302-I306 PolarHBondContact O-N 3.48Å; L303-I306 PolarHBondContact O-N 2.86Å; I306-R308 VanDerWaalsContact C-N 3.3Å; I306-R308 PolarHBondContact O-N 2.99Å; I306-S309 PolarHBondContact O-N 3.47Å; I306-S309 PolarHBondContact O-OG 2.91Å; I306-M310 HydrophobicContact CG2-SD 4.19Å; I306-M310 PolarHBondContact O-N 3.39Å; I306-L316 HydrophobicContact CB-CD2 4.29Å; I306-L316 HydrophobicContact CG2-CD1 3.7Å; I306-L316 HydrophobicContact CG2-CD2 3.55Å; I306-L316 HydrophobicContact CG2-CG 4.28Å
307R90.1Very high89.3Confident94 Ų9465.9 Ų65.936%0.35531%0.312SS..Hα-helixtrans-58.9-37.3176.7-75.5-176172.71661.2112.9L303 S309 M310 P313 L316 D317L303-R307 HydrophobicContact CD1-CG 4.38Å; L303-R307 WeakPolarHBondContact O-CG 3.49Å; L303-R307 PolarHBondContact O-N 3.04Å; R307-S309 VanDerWaalsContact C-N 3.3Å; R307-S309 PolarHBondContact O-N 3.09Å; R307-M310 PolarHBondContact O-N 2.73Å; R307-P313 HydrophobicContact CB-CB 3.76Å; R307-P313 HydrophobicContact CG-CB 3.78Å; R307-L316 HydrophobicContact CG-CD2 3.83Å; R307-D317 IonicContact CZ-OD2 3.58Å; R307-D317 IonicContact NH2-OD2 2.63Å; R307-D317 PolarHBondContact NH2-OD2 3.09Å
308R90.8Very high89Confident151 Ų15166.9 Ų66.957%0.5732%0.317SS*.Hα-helixtrans-65.2-27.6172.9-76.2-178.4-66.3128-7114.1P205 P304 A305 I306P205-R308 WeakPolarHBondContact CD-O 3.35Å; P205-R308 HydrophobicContact CG-CB 4.2Å; P304-R308 WeakPolarHBondContact O-CG 3.31Å; P304-R308 PolarHBondContact O-N 3.46Å; P304-R308 PolarHBondContact O-NE 3.48Å; A305-R308 VanDerWaalsContact CB-NH2 3.28Å; A305-R308 PolarHBondContact O-N 3.34Å; I306-R308 VanDerWaalsContact C-N 3.3Å; I306-R308 PolarHBondContact O-N 2.99Å
309S91.6Very high88.8Confident1 Ų164.6 Ų64.61%0.00731%0.309CS..Hα-helixtrans-84.8-8.918072.50000114.6P205 A305 I306 R307P205-S309 WeakPolarHBondContact O-CB 3.38Å; A305-S309 PolarHBondContact O-N 3.08Å; I306-S309 PolarHBondContact O-N 3.47Å; I306-S309 PolarHBondContact O-OG 2.91Å; R307-S309 VanDerWaalsContact C-N 3.3Å; R307-S309 PolarHBondContact O-N 3.09Å
310M92.8Very high88.5Confident4 Ų463.1 Ų63.12%0.0230%0.303CS..  trans-101.1151.1-174.7-74179.773.700113.3F204 H239 F240 I306 R307 L316 L319F204-M310 WeakPolarHBondContact CE1-O 3.2Å; H239-M310 CarbonylContact O-C 3.48Å; H239-M310 WeakPolarHBondContact O-CA 2.94Å; F240-M310 HydrophobicContact CD1-CG 3.61Å; F240-M310 HydrophobicContact CE1-CG 3.29Å; F240-M310 HydrophobicContact CE1-SD 4Å; F240-M310 HydrophobicContact CZ-CG 3.98Å; F240-M310 HydrophobicContact CZ-SD 4.22Å; I306-M310 HydrophobicContact CG2-SD 4.19Å; I306-M310 PolarHBondContact O-N 3.39Å; R307-M310 PolarHBondContact O-N 2.73Å; M310-L316 HydrophobicContact CE-CB 4Å; M310-L316 HydrophobicContact CE-CD1 4.44Å; M310-L316 HydrophobicContact SD-CB 3.74Å; M310-L316 HydrophobicContact SD-CD1 3.71Å; M310-L316 HydrophobicContact SD-CD2 4.29Å; M310-L316 HydrophobicContact SD-CG 4.1Å; M310-L319 HydrophobicContact CE-CD1 3.83Å
311A89.8Confident87.8Confident35 Ų3558.8 Ų58.829%0.28930%0.296SS..SBendtrans-63.5-50.4168.700000111.4E238 H239 P241E238-A311 WeakPolarHBondContact O-CB 3.48Å; H239-A311 PolarHBondContact O-N 3.37Å; P241-A311 HydrophobicContact CG-CB 3.73Å
312N88.4Confident86.5Confident79 Ų7956 Ų5642%0.42229%0.289SS..  trans-120.795-174.6-59-24.3000109.2D314 E315N312-D314 PolarHBondContact O-N 3.07Å; N312-E315 HydrophobicContact CB-CB 4.25Å; N312-E315 HydrophobicContact CB-CG 3.88Å; N312-E315 WeakPolarHBondContact CB-OE2 3.43Å; N312-E315 PolarHBondContact ND2-OE2 3.12Å; N312-E315 PolarHBondContact O-N 2.96Å
313P85.3Confident84.8Confident43 Ų4361.5 Ų61.528%0.27931%0.306SS..THydrogen-bonded Turntrans-68.2-22.4-17427.3-35.2000113.8R307 E315 L316R307-P313 HydrophobicContact CB-CB 3.76Å; R307-P313 HydrophobicContact CG-CB 3.78Å; P313-E315 VanDerWaalsContact C-N 3.35Å; P313-L316 WeakPolarHBondContact O-CB 3.3Å
314D84.8Confident83Confident125 Ų12560.8 Ų60.867%0.66831%0.305SS*.THydrogen-bonded Turntrans-79.6-16.2-179.9-52.1-62.1000113.3N312N312-D314 PolarHBondContact O-N 3.07Å
315E84.7Confident80.8Confident67 Ų6761.6 Ų61.631%0.31330%0.301SS..THydrogen-bonded Turntrans-81.8-21175.8-64.6-172.9136.900112.2N312 P313 D317 K318 L319N312-E315 HydrophobicContact CB-CB 4.25Å; N312-E315 HydrophobicContact CB-CG 3.88Å; N312-E315 WeakPolarHBondContact CB-OE2 3.43Å; N312-E315 PolarHBondContact ND2-OE2 3.12Å; N312-E315 PolarHBondContact O-N 2.96Å; P313-E315 VanDerWaalsContact C-N 3.35Å; E315-D317 PolarHBondContact O-N 3.48Å; E315-K318 WeakPolarHBondContact O-CA 3.43Å; E315-K318 WeakPolarHBondContact O-CB 3.29Å; E315-K318 PolarHBondContact O-N 3.14Å; E315-L319 HydrophobicContact CB-CD1 4.27Å; E315-L319 HydrophobicContact CB-CG 4.48Å; E315-L319 VanDerWaalsContact O-CG 3.3Å; E315-L319 WeakPolarHBondContact O-CG 3.47Å; E315-L319 PolarHBondContact O-N 3.05Å
316L85.9Confident78.8Confident0 Ų067.3 Ų67.30%033%0.331CS..Hα-helixtrans-50-45.1177.4178.860.1000112.7Y209 M217 L303 I306 R307 M310 P313 K318 I320Y209-L316 HydrophobicContact CE2-CD1 4.18Å; M217-L316 HydrophobicContact CE-CD1 4.35Å; L303-L316 HydrophobicContact CD1-CD2 3.52Å; I306-L316 HydrophobicContact CB-CD2 4.29Å; I306-L316 HydrophobicContact CG2-CD1 3.7Å; I306-L316 HydrophobicContact CG2-CD2 3.55Å; I306-L316 HydrophobicContact CG2-CG 4.28Å; R307-L316 HydrophobicContact CG-CD2 3.83Å; M310-L316 HydrophobicContact CE-CB 4Å; M310-L316 HydrophobicContact CE-CD1 4.44Å; M310-L316 HydrophobicContact SD-CB 3.74Å; M310-L316 HydrophobicContact SD-CD1 3.71Å; M310-L316 HydrophobicContact SD-CD2 4.29Å; M310-L316 HydrophobicContact SD-CG 4.1Å; P313-L316 WeakPolarHBondContact O-CB 3.3Å; L316-K318 VanDerWaalsContact C-N 3.29Å; L316-K318 PolarHBondContact O-N 2.85Å; L316-I320 HydrophobicContact CD1-CD1 3.5Å; L316-I320 VanDerWaalsContact CD1-CD1 3.5Å; L316-I320 HydrophobicContact CD1-CG1 4.19Å; L316-I320 HydrophobicContact CG-CD1 4.05Å; L316-I320 WeakPolarHBondContact O-CB 3.37Å; L316-I320 VanDerWaalsContact O-CG1 3.26Å; L316-I320 WeakPolarHBondContact O-CG1 3.44Å; L316-I320 PolarHBondContact O-N 3.31Å
317D84.1Confident76.6Confident53 Ų5370.9 Ų70.928%0.28335%0.354SS..Hα-helixtrans-68.3-29.4-178.7-77.7-73.6000112.3K299 R307 E315 T321K299-D317 WeakPolarHBondContact CE-OD1 3.38Å; K299-D317 IonicContact NZ-OD1 3.39Å; K299-D317 PolarHBondContact NZ-OD1 3.43Å; R307-D317 IonicContact CZ-OD2 3.58Å; R307-D317 IonicContact NH2-OD2 2.63Å; R307-D317 PolarHBondContact NH2-OD2 3.09Å; E315-D317 PolarHBondContact O-N 3.48Å; D317-T321 WeakPolarHBondContact O-CB 3.42Å; D317-T321 PolarHBondContact O-N 3.21Å; D317-T321 PolarHBondContact O-OG1 3Å
318K86.4Confident74.2Confident122 Ų12273.8 Ų73.853%0.5337%0.365SS..Hα-helixtrans-75.3-55.2172.6-56.2177.4-172.7170.90111.3E315 L316 I320 T321 D322E315-K318 WeakPolarHBondContact O-CA 3.43Å; E315-K318 WeakPolarHBondContact O-CB 3.29Å; E315-K318 PolarHBondContact O-N 3.14Å; L316-K318 VanDerWaalsContact C-N 3.29Å; L316-K318 PolarHBondContact O-N 2.85Å; K318-I320 CarbonylContact O-C 3.38Å; K318-I320 PolarHBondContact O-N 2.93Å; K318-T321 PolarHBondContact O-N 3.33Å; K318-D322 WeakPolarHBondContact O-CB 3.39Å; K318-D322 PolarHBondContact O-N 2.86Å
319L85.9Confident71.8Confident13 Ų1377.6 Ų77.67%0.06838%0.38CS..Hα-helixtrans-53.8-27.4-178.1-63.3168.8000113.4M217 N221 F235 M310 E315M217-L319 HydrophobicContact CG-CB 4.03Å; M217-L319 HydrophobicContact SD-CB 4.08Å; M217-L319 HydrophobicContact SD-CD1 4.04Å; N221-L319 HydrophobicContact CB-CD2 4.15Å; N221-L319 VanDerWaalsContact CG-CD2 3.47Å; N221-L319 PolarHBondContact ND2-O 3.39Å; N221-L319 WeakPolarHBondContact OD1-CD2 3.43Å; F235-L319 HydrophobicContact CE2-CD2 4.2Å; F235-L319 HydrophobicContact CZ-CD2 4.07Å; M310-L319 HydrophobicContact CE-CD1 3.83Å; E315-L319 HydrophobicContact CB-CD1 4.27Å; E315-L319 HydrophobicContact CB-CG 4.48Å; E315-L319 VanDerWaalsContact O-CG 3.3Å; E315-L319 WeakPolarHBondContact O-CG 3.47Å; E315-L319 PolarHBondContact O-N 3.05Å
320I84.5Confident69.1Low2 Ų286.4 Ų86.41%0.0142%0.418CS..Hα-helixtrans-88-56.6172.6-64.8179.6000111.5Y209 M217 K220 E292 M295 Q296 K299 L316 K318Y209-I320 VanDerWaalsContact OH-CD1 3.3Å; Y209-I320 WeakPolarHBondContact OH-CD1 3.46Å; M217-I320 HydrophobicContact CE-CG1 4.28Å; K220-I320 PolarHBondContact NZ-O 2.94Å; E292-I320 VanDerWaalsContact OE1-CG2 3.31Å; E292-I320 WeakPolarHBondContact OE1-CG2 3.34Å; M295-I320 HydrophobicContact CE-CB 4.35Å; M295-I320 HydrophobicContact CE-CG1 4Å; M295-I320 HydrophobicContact CE-CG2 4.34Å; M295-I320 HydrophobicContact CG-CD1 4.02Å; M295-I320 HydrophobicContact CG-CG1 3.95Å; M295-I320 HydrophobicContact SD-CG1 3.9Å; Q296-I320 HydrophobicContact CG-CG2 4.3Å; K299-I320 HydrophobicContact CB-CD1 4.32Å; K299-I320 HydrophobicContact CD-CD1 3.86Å; K299-I320 HydrophobicContact CD-CG2 4.38Å; K299-I320 HydrophobicContact CG-CD1 4.21Å; L316-I320 HydrophobicContact CD1-CD1 3.5Å; L316-I320 VanDerWaalsContact CD1-CD1 3.5Å; L316-I320 HydrophobicContact CD1-CG1 4.19Å; L316-I320 HydrophobicContact CG-CD1 4.05Å; L316-I320 WeakPolarHBondContact O-CB 3.37Å; L316-I320 VanDerWaalsContact O-CG1 3.26Å; L316-I320 WeakPolarHBondContact O-CG1 3.44Å; L316-I320 PolarHBondContact O-N 3.31Å; K318-I320 CarbonylContact O-C 3.38Å; K318-I320 PolarHBondContact O-N 2.93Å
321T76.1Confident66.5Low92 Ų9290.4 Ų90.456%0.56445%0.445SS*.Hα-helixtrans-82.1-25.1-166.4-41.40000113.9D317 K318 R323D317-T321 WeakPolarHBondContact O-CB 3.42Å; D317-T321 PolarHBondContact O-N 3.21Å; D317-T321 PolarHBondContact O-OG1 3Å; K318-T321 PolarHBondContact O-N 3.33Å; T321-R323 VanDerWaalsContact C-N 3.34Å; T321-R323 PolarHBondContact O-N 2.88Å
322D65.3Low64.3Low98 Ų9894.8 Ų94.852%0.52447%0.47SS..  trans-68.293.6172.3-83.7-60000110K318 P324K318-D322 WeakPolarHBondContact O-CB 3.39Å; K318-D322 PolarHBondContact O-N 2.86Å; D322-P324 WeakPolarHBondContact O-CD 3.3Å
323R53.1Low61.9Low167 Ų16798.7 Ų98.763%0.6349%0.486SS*.  trans-64.2115.4157.9168.7-175.4167.3124.73.7107.3T321 E325T321-R323 VanDerWaalsContact C-N 3.34Å; T321-R323 PolarHBondContact O-N 2.88Å; R323-E325 IonicContact NE-OE1 2.68Å; R323-E325 PolarHBondContact NE-OE1 2.53Å; R323-E325 PolarHBondContact O-N 3.07Å
324P52Low60.3Low37 Ų37103 Ų10324%0.2451%0.513CS..  trans-65.6108.117527-34.9000109.5D322 N326 C327D322-P324 WeakPolarHBondContact O-CD 3.3Å; P324-N326 PolarHBondContact O-N 3.03Å; P324-C327 HydrophobicContact CG-CB 4.36Å; P324-C327 WeakPolarHBondContact O-CB 3.31Å; P324-C327 PolarHBondContact O-N 2.58Å
325E44.4Very low58.2Low102 Ų102100.2 Ų100.248%0.47752%0.515SS..G310 helixtrans-56.6-23173.3-82.8-64105.400111.7R323 C327 R328R323-E325 IonicContact NE-OE1 2.68Å; R323-E325 PolarHBondContact NE-OE1 2.53Å; R323-E325 PolarHBondContact O-N 3.07Å; E325-C327 PolarHBondContact O-N 3.06Å; E325-C327 VanDerWaalsContact O-N 3.16Å; E325-R328 VanDerWaalsContact O-CB 3.26Å; E325-R328 WeakPolarHBondContact O-CB 3.45Å; E325-R328 PolarHBondContact O-N 3.48Å; E325-R328 IonicContact OE2-NH1 2.74Å
326N48.3Very low56.3Low128 Ų128106 Ų10668%0.68454%0.543SS*.G310 helixtrans-55.6-26170.5-66.58.6000114.2K223 P324 R328K223-N326 PolarHBondContact O-ND2 2.95Å; P324-N326 PolarHBondContact O-N 3.03Å; N326-R328 VanDerWaalsContact C-N 3.31Å
327C45Very low54.3Low75 Ų75112.3 Ų112.351%0.50758%0.582SS.*G310 helixtrans-79.1-14.2175.8-73.80000113P324 E325 R329P324-C327 HydrophobicContact CG-CB 4.36Å; P324-C327 WeakPolarHBondContact O-CB 3.31Å; P324-C327 PolarHBondContact O-N 2.58Å; E325-C327 PolarHBondContact O-N 3.06Å; E325-C327 VanDerWaalsContact O-N 3.16Å; C327-R329 PolarHBondContact O-N 3.09Å; C327-R329 VanDerWaalsContact O-N 3.13Å
328R39.6Very low52.1Low155 Ų155121.5 Ų121.559%0.58561%0.613SS**SBendtrans-77.695.4169.2-166.9-179-165164.12.2108.2E325 N326 K330E325-R328 VanDerWaalsContact O-CB 3.26Å; E325-R328 WeakPolarHBondContact O-CB 3.45Å; E325-R328 PolarHBondContact O-N 3.48Å; E325-R328 IonicContact OE2-NH1 2.74Å; N326-R328 VanDerWaalsContact C-N 3.31Å; R328-K330 PolarHBondContact O-N 2.88Å
329R40Very low49.8Very low231 Ų231123.9 Ų123.987%0.87263%0.631SS**  trans-52.2115.3161.9-60.7-172-153.3133.12.4106.9C327C327-R329 PolarHBondContact O-N 3.09Å; C327-R329 VanDerWaalsContact O-N 3.13Å
330K34.2Very low47.6Very low186 Ų186128.4 Ų128.481%0.80967%0.67SS**  trans-59.6135.6167.3-69.5-173.1176.9-175.40107.5R328R328-K330 PolarHBondContact O-N 2.88Å
331P38.8Very low45.1Very low89 Ų89132.2 Ų132.258%0.57871%0.709SS**  trans-52.7142.6160.6-22.133.8000108.9E333P331-E333 VanDerWaalsContact C-N 3.34Å; P331-E333 PolarHBondContact O-N 3.47Å
332P42.6Very low43.1Very low126 Ų126133.6 Ų133.682%0.81872%0.722SS**  trans-70.194.4170.528.8-32.3000109P334P332-P334 VanDerWaalsContact O-CD 3.32Å; P332-P334 WeakPolarHBondContact O-CD 3.19Å
333E39.7Very low41.6Very low162 Ų162134.7 Ų134.776%0.75773%0.732SS**  trans-57.3117.2174-70.4-66.3134.100110.8P331 G335P331-E333 VanDerWaalsContact C-N 3.34Å; P331-E333 PolarHBondContact O-N 3.47Å; E333-G335 PolarHBondContact O-N 3.41Å; E333-G335 VanDerWaalsContact O-N 3.11Å
334P51.6Low40.7Very low133 Ų133133.3 Ų133.386%0.86474%0.742SS**  trans-84.981.117933.7-32.3000110.4P332P332-P334 VanDerWaalsContact O-CD 3.32Å; P332-P334 WeakPolarHBondContact O-CD 3.19Å
335G40.6Very low39.9Very low67 Ų67134.8 Ų134.869%0.69176%0.764SS**  trans-153.182.3-169.400000116.9E333E333-G335 PolarHBondContact O-N 3.41Å; E333-G335 VanDerWaalsContact O-N 3.11Å
336M43.9Very low39.8Very low187 Ų187138.5 Ų138.592%0.92179%0.786SS**  trans19.8116155.1-69.9-175.5164.800121
337T45Very low39.8Very low133 Ų133137.9 Ų137.982%0.81679%0.789SS**  trans-23125145.8-47.90000116.5
338R36.7Very low39.4Very low246 Ų246142.6 Ų142.693%0.92881%0.809SS**  trans-144.2160.1139.1-78.2-149.5173-117-7.6111.4
339L38.8Very low39.7Very low173 Ų173140 Ų14091%0.90681%0.812SS**  trans-89.6170.3-167.6-74.2164.8000113.7
340A38.4Very low39.6Very low108 Ų108135.5 Ų135.589%0.89381%0.81SS**  trans-71155.1-172.900000115
341G33.2Very low40.3Very low81 Ų81132.2 Ų132.284%0.83581%0.807SS**  trans-163.8144.4167.600000108.9
342C33.5Very low40.1Very low121 Ų121132.9 Ų132.982%0.81882%0.82SS**  trans-129.4176.6-173.3-162.10000111.4
343T33.3Very low39.7Very low122 Ų122135.4 Ų135.475%0.74882%0.821SS**  trans83.2147.3171.175.10000118.3
344T35.9Very low39.3Very low138 Ų138136.1 Ų136.185%0.84783%0.827SS**  trans1.6149.5158.445.60000120.8
345G34.7Very low38.5Very low67 Ų67136.6 Ų136.669%0.69182%0.817SS**  cis145.8133.91.300000112.8
346L41.4Very low38.6Very low181 Ų181139.4 Ų139.495%0.94882%0.823SS**  trans67.3147.8-178.9-61.8175.6000117.7
347P47.9Very low38Very low114 Ų114137.7 Ų137.774%0.7481%0.813SS**  trans-112.6161.6-179.241-33.2000114.9
348L37.2Very low38.3Very low175 Ų175136.2 Ų136.292%0.91681%0.805SS**  trans-143.8160.4159.3-111.6106.5000111.2
349P47.2Very low38.1Very low101 Ų101131.5 Ų131.566%0.65680%0.797SS**  trans-114.7154-16541.5-32.2000116.4
350V36.1Very low38Very low136 Ų136129.2 Ų129.282%0.82479%0.79SS**  42.8144.3126.5-178.30000119.7
351P50.5Low37.8Very low117 Ų117129.9 Ų129.976%0.7678%0.783SS**  cis-130.8176.2436.7-19.1000116.4
352A33.6Very low37.9Very low102 Ų102134.1 Ų134.184%0.84379%0.786SS**  trans-162.9146.1135.100000111.5
353Q34.8Very low38Very low180 Ų180132.8 Ų132.884%0.84178%0.778SS**  trans-104.2152.1164.9-70-171.935.100110.3
354M31.5Very low38.2Very low177 Ų177135 Ų13587%0.87279%0.785SS**  -173.3152.4129.3-104.1-68.6118.100111.6
355Q34.9Very low38.7Very low143 Ų143133.9 Ų133.967%0.66878%0.779SS**  trans-114.6154.8169.5-139.5-169.7-22.600107.6
356P41.4Very low38.6Very low125 Ų125136.1 Ų136.181%0.81278%0.783SS**  -148.4-173.881.235.5-14000115.7
357Q32.7Very low38.4Very low152 Ų152134.9 Ų134.971%0.7178%0.777SS**  trans-93.4-171.1176.2-67.4-78.8-0.600111.2
358P49.9Very low38.3Very low101 Ų101134.8 Ų134.866%0.65678%0.776SS**  cis-131-169.1-18.621.83.6000113.1
359I33Very low38.1Very low148 Ų148134.9 Ų134.976%0.75977%0.774SS**  153140125.7-82.6172.3000115.5
360V37.4Very low37.8Very low124 Ų124138.5 Ų138.575%0.75278%0.782SS**  trans22.7127.6177-63.20000121.2
361T34.5Very low37.7Very low122 Ų122140.3 Ų140.375%0.74878%0.781SS**  cis83.2110.548.9-57.10000115.1
362L35.4Very low36.9Very low170 Ų170141.5 Ų141.589%0.8978%0.776SS**  trans-154.5147.2136.5-109.1173.9000109.2
363S35Very low37.1Very low94 Ų94145.9 Ų145.966%0.65778%0.779SS**  trans-152.7145-164.7530000112.9
364L36.4Very low37.3Very low169 Ų169143.9 Ų143.989%0.88577%0.77SS**  trans-144.6159.4167.4-92.1111.2000112.7
365P46.4Very low37.7Very low113 Ų113143.7 Ų143.773%0.73477%0.771SS**  trans-94.6163.8-162.6-0.824.1000113.5
366C32.5Very low37.8Very low114 Ų114145 Ų14577%0.7778%0.777SS**  cis81.8120.135.1-153.60000112.5
367L38.4Very low37.5Very low156 Ų156142.5 Ų142.582%0.81777%0.767SS**  cis-145.9-136.90.5-129-177.1000111.6
368P46Very low37.6Very low112 Ų112143.5 Ų143.573%0.72777%0.772SS**  trans-109.4-176.8-160.645.4-34.3000115.7
369M31.5Very low37Very low176 Ų176144.4 Ų144.487%0.86777%0.771SS**  trans-134.2134.2173.4-132.5-58.1113.400111.9
370H41.1Very low37Very low177 Ų177145.3 Ų145.382%0.81977%0.771SS**  trans-163.594.3-178.4-168.4-81.6000113.2
371Q33.7Very low36.6Very low175 Ų175143.2 Ų143.282%0.81877%0.767SS**  trans-166.2125.2151.6-113.7-173.210.300114.2
372H34Very low36.7Very low142 Ų142146.4 Ų146.466%0.65777%0.773SS**  39.6119.4119.4-150.4-90.6000119.8
373H38.9Very low36.6Very low194 Ų194142.5 Ų142.590%0.89877%0.765SS**  trans-149.3154.3140.2-106.574.6000110
374Q38.3Very low36.4Very low138 Ų138149 Ų14965%0.64578%0.776SS**  trans-137.9145.5-165.9167.3-172-22.700109.3
375L39.6Very low36.2Very low172 Ų172147.5 Ų147.590%0.90177%0.768SS**  trans-143.3149.7169.3-137.580.4000113.4
376Q36.9Very low35.6Very low171 Ų171148.4 Ų148.480%0.79977%0.766SS**  trans-96.4173.2179-76.3166-90.500110.8
377A36.6Very low35.7Very low73 Ų73150.6 Ų150.660%0.60376%0.764SS**  cis-170.9176.5-24.900000109.6
378Q34Very low35.3Very low173 Ų173149.7 Ų149.781%0.80877%0.765SS**  trans9150.1145.2-67.2169-94.100120.3
379L36.5Very low34.7Very low120 Ų120151.1 Ų151.163%0.62877%0.772SS**  cis-170.3179.712.3-120.2170.8000111.6
380H33.5Very low35.7Very low167 Ų167148.8 Ų148.877%0.77377%0.77SS**  trans74.2149.7159.9-62.7148.7000119.6
381A30.1Very low35.1Very low80 Ų80146.8 Ų146.866%0.66177%0.765SS**  cis-163.1154.9-15.500000114.9
382Q36.4Very low35Very low188 Ų188144.8 Ų144.888%0.87976%0.759SS**  trans47.2112.6143-70177.8-36.700125.1
383A32.9Very low34.8Very low88 Ų88143.2 Ų143.273%0.72776%0.764SS**  89.6140.811100000125.1
384R31.1Very low34.5Very low232 Ų232142.2 Ų142.288%0.87576%0.76SS**  trans71.4152.8156.5-74.3-176.3174.5166.9-1.6119.8
385L32.2Very low34Very low136 Ų136140.9 Ų140.971%0.71277%0.766SS**  cis-171.5154.3-33-119.4-173.2000111.6
386L33.9Very low34.7Very low133 Ų133137.9 Ų137.970%0.69676%0.757SS**  trans73.8139.2156.4-62.1-178.3000124.6
387H34.4Very low34.3Very low159 Ų159136.9 Ų136.974%0.73676%0.756SS**  trans40130.3150.7-62.8-69.1000122.4
388T29Very low33.9Very low137 Ų137138.5 Ų138.584%0.8476%0.759SS**  -176.4170.780.2300000112.6
389V35.1Very low33.8Very low142 Ų142139.6 Ų139.686%0.86176%0.763SS**  trans-130.6143.2171.5-74.10000111.6
390P50.6Low33.4Very low127 Ų127142.3 Ų142.383%0.82577%0.773SS**  -151.3-178.2119.139.2-22.9000114.3
391D28.7Very low34.1Very low135 Ų135139.1 Ų139.172%0.72277%0.767SS**  cis-169.3169.7-42-169.326.2000110.7
392L33Very low34Very low133 Ų133141.1 Ų141.170%0.69678%0.776SS**  trans22.4128.7160-109.969.6000122.8
393S30Very low33.8Very low109 Ų109141.9 Ų141.976%0.76278%0.777SS**  163.2133.9106.352.10000118.7
394H31.1Very low35Very low173 Ų173142.8 Ų142.880%0.80178%0.775SS**  trans26.3118.6151.2-58.4-78.2000126.7
395S27.6Very low36Very low111 Ų111136.4 Ų136.478%0.77676%0.764SS**  13.8169.2112.5-80.80000123.5
396P55.3Low36Very low109 Ų109137 Ų13771%0.70877%0.768SS**  cis-141.3-169.2-16.535.4-13.3000115.9
397L29.2Very low35.9Very low149 Ų149136.4 Ų136.478%0.7877%0.765SS**  140.5120.3119-148.181.9000119.3
398T28.1Very low35.6Very low108 Ų108137.5 Ų137.566%0.66377%0.768SS**  trans37.3133.6150.958.90000125.5
399Q30.9Very low35.9Very low195 Ų195140.8 Ų140.891%0.91177%0.767SS**  -161.3164.5105-111.8170.987.200114.5
400Q27.7Very low35.7Very low178 Ų178138.7 Ų138.783%0.83276%0.758SS**  trans-139.4-167.8-178.8-126.3-156.620.100107.1
401P48.8Very low35.1Very low100 Ų100138.4 Ų138.465%0.64975%0.754SS**  cis-135.2175.8-7.141.8-25.8000116.1
402S27.4Very low35.1Very low121 Ų121140.5 Ų140.585%0.84676%0.759SS**  trans-162.3162.4135.6-3.70000109.1
403K33.6Very low35Very low205 Ų205138.8 Ų138.889%0.89176%0.758SS**  trans-128146.7-166.8-101.4-164.4167.5-171.80115.9
404P56.6Low35Very low106 Ų106140.2 Ų140.269%0.68876%0.758SS**  trans-85.9170.116039.3-36.3000111.5
405P53.6Low35.2Very low99 Ų99137.3 Ų137.364%0.64375%0.752SS**  -104.5177.894.236.9-41.6000112
406D31.4Very low35.6Very low149 Ų149139.4 Ų139.480%0.79775%0.754SS**  cis-147.4154.826.4-49.9-91.1000111.3
407D31.2Very low35Very low120 Ų120140.4 Ų140.464%0.64276%0.759SS**  cis-160.3-106.7-25.7-167.824.1000110.6
408F29.1Very low35.4Very low181 Ų181141.7 Ų141.779%0.79476%0.761SS**  trans-71.7135.9-176.7-86.9-93.3000114.9
409Y35Very low36Very low207 Ų207142.7 Ų142.781%0.81277%0.766SS**  cis72.3150.218.9-89.9-109000116.1
410S31.7Very low37Very low98 Ų98140.8 Ų140.869%0.68576%0.763SS**  cis-148.9163.37.2-164.50000113.6
411V37.6Very low37.9Very low120 Ų120136.7 Ų136.773%0.72776%0.759SS**  trans-81.5159.7153.3166.90000109.5
412Q27.2Very low37.9Very low179 Ų179139.9 Ų139.984%0.83677%0.77SS**  trans-122.2135156.3-170.4167.6-4.200110.3
413S32Very low38.7Very low97 Ų97139.1 Ų139.168%0.67876%0.756SS**  trans-105.7156.7178.1-46.50000109.2
414D29Very low39.4Very low140 Ų140135 Ų13575%0.74975%0.751SS**  trans-147.1147.2150.6-101.7-44.7000113.5
415T36.1Very low38.9Very low111 Ų111133.2 Ų133.268%0.68174%0.74SS**  trans-14.2134176.157.80000120.2
416N35Very low38.6Very low155 Ų155135.2 Ų135.283%0.82974%0.744SS**  -160.6146.6111.1-98.8-51.6000111.8
417T42.9Very low39.5Very low130 Ų130135.9 Ų135.980%0.79875%0.745SS**  trans-157.3162.7178.3-60.80000106.8
418E38.1Very low40Very low176 Ų176136.9 Ų136.982%0.82275%0.75SS**  trans77.5142.4-157.8-58.8-167.381.400113.2
419V41.8Very low40.6Very low129 Ų129137.6 Ų137.678%0.78275%0.753SS**  cis-135153.1-3.6-122.90000110.7
420D50.3Low41.2Very low156 Ų156131.6 Ų131.683%0.83475%0.747SS**  trans-97.7128172.2-173.15.9000110.3
421A48Very low42Very low92 Ų92136.1 Ų136.176%0.7675%0.754SS**  trans-170.463.9177.400000112.6
422L49.1Very low42.2Very low167 Ų167139.4 Ų139.487%0.87476%0.762SS**  trans-120.8131.6161.9-75.6177.7000111.9
423D42.8Very low43.4Very low104 Ų104133.7 Ų133.756%0.55675%0.751SS**  trans-55.2128.5-168.917416.2000114.2S425D423-S425 PolarHBondContact O-N 3.21Å; D423-S425 VanDerWaalsContact O-N 3.12Å; D423-S425 WeakPolarHBondContact OD1-CB 3.26Å; D423-S425 PolarHBondContact OD1-N 3.04Å; D423-S425 PolarHBondContact OD1-OG 3.29Å; D423-S425 VanDerWaalsContact OD2-CB 3.26Å; D423-S425 WeakPolarHBondContact OD2-CB 3.48Å; D423-S425 PolarHBondContact OD2-OG 3.14Å
424P48.7Very low44.3Very low120 Ų120135.4 Ų135.478%0.77975%0.752SS**G310 helixtrans-68.7-0.1176.529.5-36.3000115.2I426P424-I426 PolarHBondContact O-N 2.96Å
425S46.1Very low45.3Very low67 Ų67134.3 Ų134.347%0.46975%0.746SS.*G310 helixtrans-62.4-21.9176.4720000114.9D423 M427 D428D423-S425 PolarHBondContact O-N 3.21Å; D423-S425 VanDerWaalsContact O-N 3.12Å; D423-S425 WeakPolarHBondContact OD1-CB 3.26Å; D423-S425 PolarHBondContact OD1-N 3.04Å; D423-S425 PolarHBondContact OD1-OG 3.29Å; D423-S425 VanDerWaalsContact OD2-CB 3.26Å; D423-S425 WeakPolarHBondContact OD2-CB 3.48Å; D423-S425 PolarHBondContact OD2-OG 3.14Å; S425-M427 PolarHBondContact O-N 3.41Å; S425-M427 VanDerWaalsContact O-N 3.07Å; S425-D428 PolarHBondContact O-N 3.29Å
426I47.5Very low46Very low141 Ų141139.7 Ų139.772%0.72375%0.754SS**G310 helixtrans-74.6-0.1-167.7-153165.3000115.3P424P424-I426 PolarHBondContact O-N 2.96Å
427M50.3Low46.8Very low164 Ų164138.8 Ų138.881%0.80874%0.744SS**G310 helixtrans-93.9-10.9178.5-64.6-168.8179.800114.6S425 F429S425-M427 PolarHBondContact O-N 3.41Å; S425-M427 VanDerWaalsContact O-N 3.07Å; M427-F429 PolarHBondContact O-N 3.3Å
428D42.5Very low47.1Very low140 Ų140139.1 Ų139.175%0.74974%0.737SS**G310 helixtrans-88.2-2.4-168.7-148.524000115S425 A430S425-D428 PolarHBondContact O-N 3.29Å; D428-A430 PolarHBondContact O-N 2.87Å
429F41.4Very low47.8Very low196 Ų196138 Ų13886%0.8673%0.733SS**G310 helixtrans-78.43.4173.9-76.1-78.4000114.3M427M427-F429 PolarHBondContact O-N 3.3Å
430A46.7Very low48.3Very low82 Ų82139.2 Ų139.268%0.67873%0.728SS**G310 helixtrans-89.2-4.8-176.900000114.9D428D428-A430 PolarHBondContact O-N 2.87Å
431F48.1Very low48.1Very low193 Ų193138.2 Ų138.285%0.84672%0.723SS**SBendtrans-126.330.7-171.1-100.6-77.4000116.3
432Q42.3Very low48Very low189 Ų189141.1 Ų141.188%0.88373%0.726SS**  trans-126.285.1160.7-80.6-175.2-2.800112
433G51.8Low48.1Very low59 Ų59137.5 Ų137.561%0.60871%0.714SS**  trans-71.2176.6149.700000111.1
434N52.3Low48.2Very low133 Ų133142.6 Ų142.671%0.71173%0.732SS**  trans77.727.9167.7-44.20.2000117.8
435L49.2Very low47.6Very low116 Ų116143.9 Ų143.961%0.60773%0.732SS**SBendtrans-103.9-24.2165.6-164.466.6000113.9E437L435-E437 VanDerWaalsContact C-N 3.34Å
436W51.5Low47.4Very low225 Ų225149 Ų14985%0.85275%0.753SS**THydrogen-bonded Turntrans-78.9-16179.3-173.8-99.3000113.8
437E51.7Low47Very low135 Ų135149.4 Ų149.463%0.63176%0.757SS**THydrogen-bonded Turntrans-89.9-36176.6-72.5174.7123.900111.8L435 M439 K440L435-E437 VanDerWaalsContact C-N 3.34Å; E437-M439 PolarHBondContact O-N 3.14Å; E437-K440 VanDerWaalsContact O-CB 3.29Å; E437-K440 WeakPolarHBondContact O-CB 3.4Å; E437-K440 PolarHBondContact O-N 3.3Å; E437-K440 VanDerWaalsContact O-N 3.09Å
438E48.2Very low46.6Very low138 Ų138146 Ų14665%0.64576%0.755SS**Hα-helixtrans-63-42.3178.3-167.3168.3-143.200112.4K440E438-K440 PolarHBondContact O-N 3.12Å
439M53.8Low46.4Very low151 Ų151147.6 Ų147.674%0.74476%0.762SS**Hα-helixtrans-68.5-0.8175.3-72.6-168.4173.200115.1E437E437-M439 PolarHBondContact O-N 3.14Å
440K53Low46.3Very low156 Ų156141.7 Ų141.768%0.67876%0.757SS**Hα-helixtrans-96.4-32.1-177.3-168.6-175.5166.3-143.20113.3E437 E438E437-K440 VanDerWaalsContact O-CB 3.29Å; E437-K440 WeakPolarHBondContact O-CB 3.4Å; E437-K440 PolarHBondContact O-N 3.3Å; E437-K440 VanDerWaalsContact O-N 3.09Å; E438-K440 PolarHBondContact O-N 3.12Å
441D45.9Very low45.9Very low135 Ų135143.2 Ų143.272%0.72276%0.758SS**Hα-helixtrans-90.6-20.2-172.1-68.3-31.9000113.2S443D441-S443 PolarHBondContact O-N 3.35Å
442D45.8Very low45Very low153 Ų153144.2 Ų144.282%0.81876%0.763SS**THydrogen-bonded Turntrans-73.69178.2-105.6-6.9000115
443S50.3Low44.4Very low90 Ų90140.6 Ų140.663%0.62976%0.758SS**THydrogen-bonded Turntrans-118.722.5-170.5-138.40000116.2D441D441-S443 PolarHBondContact O-N 3.35Å
444F44.8Very low43.4Very low211 Ų211145.6 Ų145.693%0.92577%0.771SS**  trans-149.681.2160.3-84.7-64.7000112.7
445N35.6Very low42.5Very low148 Ų148144.4 Ų144.479%0.79177%0.773SS**  trans-134.1100.9169.6-146-34.8000110.4
446L41.9Very low42.1Very low173 Ų173144.5 Ų144.591%0.90678%0.781SS**  trans-108.538.5-167.2-162.769.9000112.8
447D39.5Very low41.1Very low150 Ų150140.8 Ų140.880%0.80278%0.777SS**  trans-124.922.4-177-128.4-51.2000113.3
448A42.9Very low40.2Very low92 Ų92144.4 Ų144.476%0.7679%0.785SS**SBendtrans-115.212.5-175.400000114.9
449L38.2Very low39.2Very low174 Ų174143.5 Ų143.591%0.91178%0.784SS**  trans-118.826.6174.6-69.7176.3000112.9
450G39.3Very low38.2Very low73 Ų73140.7 Ų140.775%0.75378%0.779SS**SBendtrans-82-11.7176.800000115.6
451T38.3Very low37.2Very low114 Ų114139.9 Ų139.970%0.69978%0.782SS**  trans-145.2105.3-174.2-49.60000111.8
452F28.6Very low36.8Very low214 Ų214138.9 Ų138.994%0.93978%0.784SS**  trans-175.368.1139.6-85.9-50.4000110.3
453S30.4Very low36.2Very low113 Ų113138.5 Ų138.579%0.7978%0.782SS**  trans-89.1115.6164.1-175.50000109.3
454N31.1Very low35.5Very low163 Ų163142.1 Ų142.187%0.87279%0.794SS**  trans-172.3118155.3-95.7-39.9000110.4
455S32.2Very low34.7Very low109 Ų109135.3 Ų135.376%0.76278%0.783SS**  trans-80.7169.6172.6-45.30000111.5
456P40.3Very low34.6Very low118 Ų118133.9 Ų133.977%0.76678%0.784SS**  -152.3139.487.936.8-17.4000118.5
457L30.8Very low34.2Very low147 Ų147131.7 Ų131.777%0.7778%0.778SS**  trans47.6114.5133.6-56.4174.7000122.8
458R33.1Very low33.9Very low210 Ų210130 Ų13079%0.79278%0.778SS**  177.8108.4125.8-96.5-73.1104.294.3-6.1107.1
459L27.7Very low33.6Very low119 Ų119133.6 Ų133.662%0.62378%0.783SS**  cis82.2128.745.5-147.3179.9000112.7
460S32.8Very low33.8Very low93 Ų93130.5 Ų130.565%0.6577%0.774SS**  trans87.9146.1178.1-65.90000117.7
461D32.1Very low34.7Very low139 Ų139133.1 Ų133.174%0.74378%0.778SS**  cis-167.5156.1-24.4-93.4-36.4000107.8
462C37.3Very low34.4Very low114 Ų114132.7 Ų132.777%0.7779%0.786SS**  cis-129.1-100.9-8.2-170.20000112.3
463D32.1Very low34.6Very low145 Ų145128.1 Ų128.178%0.77578%0.78SS**  cis-153.1-166-2.5-163.35.9000111.3
464L35.7Very low34.7Very low166 Ų166128.7 Ų128.787%0.86978%0.784SS**  trans-83.9148.9-153.7-117.568.6000119.9
465G29.5Very low34.7Very low68 Ų68125 Ų12570%0.70178%0.784SS**  trans149.580.5156.500000115.1
466S33Very low34.6Very low117 Ų117123.1 Ų123.182%0.81878%0.782SS**  66.4126.387.8-175.50000114.8
467V32.6Very low34.3Very low127 Ų127123.4 Ų123.477%0.7779%0.787SS**  cis-158.2155.50.21220000109.8
468S33.9Very low34.6Very low114 Ų114123.1 Ų123.180%0.79779%0.791SS**  trans-105.4151174.8-46.80000112.4
469L36.4Very low35.4Very low168 Ų168118.3 Ų118.388%0.8879%0.787SS**  trans-166.7173159.5-101.6178.1000110.3
470P43.5Very low35.5Very low109 Ų109120.3 Ų120.371%0.70880%0.798SS**  trans-130.9-172.4-132.744.9-26000115.2
471P57.4Low35.5Very low129 Ų129120.9 Ų120.984%0.83880%0.802SS**  trans-101.6161.5-172.738.4-33.5000115.5
472A31.9Very low35.4Very low105 Ų105122 Ų12287%0.86881%0.808SS**  trans-154.5160.1163.300000111.4
473S32.4Very low35.5Very low118 Ų118122.9 Ų122.983%0.82581%0.809SS**  trans-118152.4-167.8-46.90000113.6
474S33.6Very low35.6Very low125 Ų125124.2 Ų124.287%0.87481%0.811SS**  167.1146.9124.348.50000115.1
475G30.5Very low35.6Very low84 Ų84123.5 Ų123.587%0.86681%0.813SS**  trans90.7109139.400000120.7
476G30.6Very low35.9Very low70 Ų70126.1 Ų126.172%0.72282%0.815SS**  trans125.5113.2133.200000119.6
477S33.3Very low35.9Very low125 Ų125123.9 Ų123.987%0.87481%0.811SS**  trans69.7139.5156.665.10000121
478V37.9Very low36.2Very low140 Ų140125 Ų12585%0.84881%0.812SS**  trans-139.3146.1-179.6-174.30000102.9
479P48.4Very low36.1Very low110 Ų110130.5 Ų130.571%0.71482%0.817SS**  cis-137.9173.542.644.1-25.2000115
480L29.8Very low36.1Very low160 Ų160126.1 Ų126.184%0.83881%0.805SS**  -164.7171.957.4-161.364.1000112.6
481S33.6Very low35.8Very low106 Ų106125.5 Ų125.574%0.74180%0.803SS**  trans-45.9144.7-174.7-42.10000118
482D30.8Very low34.7Very low163 Ų163129.8 Ų129.887%0.87280%0.804SS**  trans-138.9158.9144.8-148.4-25.5000109.8
483V37.7Very low34.9Very low131 Ų131130.1 Ų130.179%0.79480%0.796SS**  trans-115.8141-165.5170.80000112.6
484Q35.4Very low35.1Very low174 Ų174129.4 Ų129.481%0.81379%0.791SS**  trans-74.3139.7-173-56.9169.6-0.900113.6
485V35.4Very low35.1Very low150 Ų150132.9 Ų132.991%0.90979%0.793SS**  trans-138.4120.6135.3-1800000108.6
486T36.1Very low35.2Very low123 Ų123135.1 Ų135.176%0.75579%0.785SS**  trans-113.9137.8172.5-55.70000108.9
487G33Very low36Very low70 Ų70137.4 Ų137.472%0.72279%0.787SS**  trans-136.6109.3176.100000112.3
488L39.5Very low36.3Very low151 Ų151138.4 Ų138.479%0.79178%0.782SS**  trans-145.2117.7175.5-76.6178.3000112.6
489Y31.5Very low36.1Very low229 Ų229138.3 Ų138.390%0.89878%0.782SS**  trans63.3160.6136.4-109.5-98.4000124.3
490A35.8Very low35.5Very low77 Ų77138 Ų13864%0.63678%0.783SS**  trans92.492.4157.300000121
491S37Very low35.7Very low96 Ų96138.4 Ų138.467%0.67178%0.78SS**  trans5.7149.4130.255.50000121.9
492Y34.3Very low35.5Very low218 Ų218142.1 Ų142.186%0.85578%0.779SS**  -169.9171123.8-98-62.5000113.7
493T37.1Very low35.7Very low113 Ų113141.3 Ų141.369%0.69377%0.772SS**  trans-99.6157.5-149.147.80000118.7
494S36.1Very low35.4Very low103 Ų103139.3 Ų139.372%0.7277%0.769SS**  trans81.5128.4135.3-680000125.5
495Q33.4Very low35.4Very low197 Ų197136.9 Ų136.992%0.92177%0.771SS**  trans93.6154.2131-84.3-179.3-35.900124.7
496D33Very low35.6Very low132 Ų132138 Ų13871%0.70677%0.767SS**  trans-91.2167-168.2-139.6-59.4000111.8L498D496-L498 PolarHBondContact OD1-N 3.07Å
497P47.8Very low36.2Very low118 Ų118137.9 Ų137.977%0.76677%0.768SS**  -151.7165.889.739.8-21.6000117.9
498L39.6Very low36.3Very low146 Ų146138.4 Ų138.476%0.76477%0.765SS**  trans-65.2159.2171.7-60.988.8000114.6D496D496-L498 PolarHBondContact OD1-N 3.07Å
499T32.2Very low36.1Very low138 Ų138137.1 Ų137.185%0.84777%0.769SS**  -164.3162.5127.3-76.10000109.9
500S35.7Very low36.9Very low104 Ų104135.7 Ų135.773%0.72777%0.768SS**  trans-137.7163.7-178.2-71.10000113.4
501Q33.7Very low37.7Very low168 Ų168138.1 Ų138.179%0.78578%0.777SS**  trans111.1132.7152.4-61.6-158.820.400121.1
502Y30.4Very low37.9Very low184 Ų184141.6 Ų141.672%0.72279%0.786SS**  trans91.4106.2135.9-95.9-125000124.1
503M34.6Very low38.6Very low145 Ų145135.7 Ų135.771%0.71478%0.783SS**  86.2135.7129.6-71.8-65.2171.900124.1
504A32.6Very low38.9Very low90 Ų90138.3 Ų138.374%0.74479%0.791SS**  trans52118.1156.300000118.5
505S35.1Very low39.4Very low122 Ų122145.2 Ų145.285%0.85382%0.819SS**  -170.817060.540.20000113.1
506Q38.6Very low39.7Very low175 Ų175142.6 Ų142.682%0.81881%0.814SS**  trans-102.9168.3174.2-96.8-151.151.300110.3
507P48.9Very low40Very low119 Ų119143.2 Ų143.277%0.77382%0.819SS**  cis-143.4-178.333.143.1-22.9000118.9
508A34.8Very low39.6Very low81 Ų81144.6 Ų144.667%0.66982%0.822SS**  trans-47.1154.8-178.500000120.1
509S36.4Very low39.6Very low125 Ų125144.5 Ų144.587%0.87483%0.826SS**  trans-151.3149.5136.1-81.40000110.3
510K47.5Very low40Very low199 Ų199144.9 Ų144.987%0.86582%0.824SS**PPolyproline II helixtrans-97155.8-178.5-79.5-177178.5178.90111.5
511P52.7Low40.3Very low127 Ų127147.6 Ų147.683%0.82583%0.831SS**PPolyproline II helixtrans-72157.7-174.329.5-36.5000114
512I42.3Very low40.8Very low170 Ų170146.1 Ų146.187%0.87283%0.834SS**PPolyproline II helixtrans-79.9144.7173.9-65.2165000110
513A48.6Very low41.6Very low94 Ų94143.2 Ų143.278%0.77784%0.843SS**  trans-144.7119.2160.200000109.4
514L43.9Very low42.2Very low168 Ų168143.1 Ų143.188%0.8885%0.854SS**  trans-176.383157.6-109.5174.2000111.2
515L44.8Very low43.1Very low247 Ų247147.9 Ų147.9100%1.29386%0.864SS**  trans-173.60139.8-106.5159000109.6

Retrieved 515 of 515 residues in 587.5 ms (Link to these results)