A0A087YGS7_POEFO Loading...

Draxin

Chemorepulsive axon guidance protein required for the development of spinal cord and forebrain commissures. Acts as a chemorepulsive guidance protein for commissural axons during development. Able to inhibit or repel neurite outgrowth from dorsal spinal cord.

AlphaFold DB , UniProt , Accession A0A087YGS7, Species POEFO (Poecilia formosa, Amazon molly), Gene DRAXIN, Length 380 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
1K59.8Low83.6Confident225 Ų225130.5 Ų130.598%0.97864%0.64SS**  0-65.80-71-178.5178.4177.90111.5A3 F4K1-A3 VanDerWaalsContact C-N 3.35Å; K1-A3 PolarHBondContact O-N 3.31Å; K1-F4 PolarHBondContact O-N 2.97Å
2M71.4Confident84.3Confident152 Ų152130.7 Ų130.775%0.74964%0.635SS**Hα-helixtrans-48-46-179.9-66.3-54.3-14800115.4F4 Y5 W6M2-F4 VanDerWaalsContact C-N 3.27Å; M2-F4 PolarHBondContact O-N 2.71Å; M2-Y5 WeakPolarHBondContact O-CB 3.47Å; M2-Y5 PolarHBondContact O-N 3.19Å; M2-W6 PolarHBondContact O-N 3.17Å
3A75.1Confident84.8Confident75 Ų75127.8 Ų127.862%0.6262%0.624SS**Hα-helixtrans-59.1-32.1-179.500000114.4K1 W6 S7K1-A3 VanDerWaalsContact C-N 3.35Å; K1-A3 PolarHBondContact O-N 3.31Å; A3-W6 PolarHBondContact O-N 3.19Å; A3-S7 WeakPolarHBondContact O-CB 3.14Å; A3-S7 PolarHBondContact O-N 3.32Å
4F82.7Confident84.9Confident158 Ų158129.1 Ų129.169%0.69363%0.625SS**Hα-helixtrans-71.2-35.8175-74.1-83.6000111.8K1 M2 S7 L8K1-F4 PolarHBondContact O-N 2.97Å; M2-F4 VanDerWaalsContact C-N 3.27Å; M2-F4 PolarHBondContact O-N 2.71Å; F4-S7 PolarHBondContact O-N 3.3Å; F4-L8 WeakPolarHBondContact O-CB 3.43Å; F4-L8 VanDerWaalsContact O-CG 3.29Å; F4-L8 WeakPolarHBondContact O-CG 3.46Å; F4-L8 PolarHBondContact O-N 3.49Å
5Y88Confident84.9Confident179 Ų179125.3 Ų125.370%0.70261%0.613SS**Hα-helixtrans-64.3-42.5173.4-108.3-93.8000111.8M2 L8 L9M2-Y5 WeakPolarHBondContact O-CB 3.47Å; M2-Y5 PolarHBondContact O-N 3.19Å; Y5-L8 PolarHBondContact O-N 2.94Å; Y5-L9 VanDerWaalsContact O-CB 3.3Å; Y5-L9 WeakPolarHBondContact O-CB 3.39Å; Y5-L9 PolarHBondContact O-N 3.36Å
6W86.2Confident84.8Confident189 Ų189122.9 Ų122.972%0.71660%0.603SS**Hα-helixtrans-63.5-43.3174.3-86.569.3000112.4M2 A3 L9 L10M2-W6 PolarHBondContact O-N 3.17Å; A3-W6 PolarHBondContact O-N 3.19Å; W6-L9 PolarHBondContact O-N 3.19Å; W6-L10 WeakPolarHBondContact O-CG 3.47Å; W6-L10 PolarHBondContact O-N 2.96Å
7S89.2Confident84.6Confident67 Ų67120.8 Ų120.847%0.46959%0.594SS.*Hα-helixtrans-60.9-47.4175.8-173.60000112.1A3 F4 L9 L10 V11A3-S7 WeakPolarHBondContact O-CB 3.14Å; A3-S7 PolarHBondContact O-N 3.32Å; F4-S7 PolarHBondContact O-N 3.3Å; S7-L9 VanDerWaalsContact C-N 3.35Å; S7-L9 PolarHBondContact O-N 3.37Å; S7-L10 PolarHBondContact O-N 3.3Å; S7-V11 WeakPolarHBondContact O-CG2 3.33Å; S7-V11 PolarHBondContact O-N 3.29Å
8L92.2Very high84Confident117 Ų117117.7 Ų117.761%0.61359%0.591SS**Hα-helixtrans-61.3-40.7176.4-72.9167.6000112.5F4 Y5 V11 F12F4-L8 WeakPolarHBondContact O-CB 3.43Å; F4-L8 VanDerWaalsContact O-CG 3.29Å; F4-L8 WeakPolarHBondContact O-CG 3.46Å; F4-L8 PolarHBondContact O-N 3.49Å; Y5-L8 PolarHBondContact O-N 2.94Å; L8-V11 PolarHBondContact O-N 3.24Å; L8-F12 WeakPolarHBondContact O-CB 3.47Å; L8-F12 PolarHBondContact O-N 3.15Å
9L91.6Very high83.4Confident102 Ų102117.6 Ų117.653%0.53460%0.597SS.*Hα-helixtrans-67.5-39.6178.7-167.9152.2000111.6Y5 W6 S7 F12 L13Y5-L9 VanDerWaalsContact O-CB 3.3Å; Y5-L9 WeakPolarHBondContact O-CB 3.39Å; Y5-L9 PolarHBondContact O-N 3.36Å; W6-L9 PolarHBondContact O-N 3.19Å; S7-L9 VanDerWaalsContact C-N 3.35Å; S7-L9 PolarHBondContact O-N 3.37Å; L9-F12 PolarHBondContact O-N 3.29Å; L9-L13 HydrophobicContact CD2-CD1 3.68Å; L9-L13 HydrophobicContact CD2-CG 4.23Å; L9-L13 WeakPolarHBondContact O-CG 3.41Å; L9-L13 PolarHBondContact O-N 3.03Å
10L91.8Very high82.7Confident86 Ų86115.5 Ų115.545%0.4559%0.593SS.*Hα-helixtrans-63.9-46.1173.1-72.5169.4000111.9W6 S7 F12 L13 F14W6-L10 WeakPolarHBondContact O-CG 3.47Å; W6-L10 PolarHBondContact O-N 2.96Å; S7-L10 PolarHBondContact O-N 3.3Å; L10-F12 VanDerWaalsContact C-N 3.3Å; L10-F12 PolarHBondContact O-N 3Å; L10-L13 PolarHBondContact O-N 3.28Å; L10-F14 VanDerWaalsContact O-CD2 3.26Å; L10-F14 WeakPolarHBondContact O-CD2 3.24Å; L10-F14 PolarHBondContact O-N 3.01Å
11V92Very high81.7Confident86 Ų86117 Ų11752%0.52160%0.598SS.*Hα-helixtrans-58.4-43.1175.2170.90000111S7 L8 F14 T15S7-V11 WeakPolarHBondContact O-CG2 3.33Å; S7-V11 PolarHBondContact O-N 3.29Å; L8-V11 PolarHBondContact O-N 3.24Å; V11-F14 PolarHBondContact O-N 3.26Å; V11-T15 WeakPolarHBondContact O-CG2 3.5Å; V11-T15 PolarHBondContact O-N 2.77Å; V11-T15 PolarHBondContact O-OG1 3.07Å
12F91.4Very high81.3Confident132 Ų132109.5 Ų109.558%0.57959%0.585SS**Hα-helixtrans-61.5-46.4177.5-169.9-113.6000112.1L8 L9 L10 F14 T15 I16L8-F12 WeakPolarHBondContact O-CB 3.47Å; L8-F12 PolarHBondContact O-N 3.15Å; L9-F12 PolarHBondContact O-N 3.29Å; L10-F12 VanDerWaalsContact C-N 3.3Å; L10-F12 PolarHBondContact O-N 3Å; F12-F14 PolarHBondContact O-N 3.45Å; F12-T15 PolarHBondContact O-N 2.79Å; F12-T15 PolarHBondContact O-OG1 2.83Å; F12-I16 HydrophobicContact CD1-CD1 3.86Å; F12-I16 HydrophobicContact CE1-CD1 3.58Å; F12-I16 HydrophobicContact CZ-CD1 4.02Å; F12-I16 WeakPolarHBondContact O-CG1 3.44Å; F12-I16 PolarHBondContact O-N 3.24Å
13L91.5Very high80.1Confident94 Ų94106.2 Ų106.249%0.49258%0.582SS.*Hα-helixtrans-59.4-42.6174.4-70.9173.1000112.4L9 L10 I16 L17L9-L13 HydrophobicContact CD2-CD1 3.68Å; L9-L13 HydrophobicContact CD2-CG 4.23Å; L9-L13 WeakPolarHBondContact O-CG 3.41Å; L9-L13 PolarHBondContact O-N 3.03Å; L10-L13 PolarHBondContact O-N 3.28Å; L13-I16 PolarHBondContact O-N 3.21Å; L13-L17 WeakPolarHBondContact O-CB 3.12Å; L13-L17 PolarHBondContact O-N 3.13Å
14F86.4Confident78.7Confident145 Ų145109.8 Ų109.864%0.63659%0.59SS**Hα-helixtrans-64.3-37.8175.3-84-67.1000112.7L10 V11 F12 L17 A18L10-F14 VanDerWaalsContact O-CD2 3.26Å; L10-F14 WeakPolarHBondContact O-CD2 3.24Å; L10-F14 PolarHBondContact O-N 3.01Å; V11-F14 PolarHBondContact O-N 3.26Å; F12-F14 PolarHBondContact O-N 3.45Å; F14-L17 PolarHBondContact O-N 3.02Å; F14-A18 WeakPolarHBondContact O-CB 3.04Å; F14-A18 PolarHBondContact O-N 2.89Å
15T83.6Confident77Confident73 Ų73108 Ų10845%0.44859%0.594SS.*Hα-helixtrans-66-39.3175.256.40000112.8V11 F12 A18 V19V11-T15 WeakPolarHBondContact O-CG2 3.5Å; V11-T15 PolarHBondContact O-N 2.77Å; V11-T15 PolarHBondContact O-OG1 3.07Å; F12-T15 PolarHBondContact O-N 2.79Å; F12-T15 PolarHBondContact O-OG1 2.83Å; T15-A18 PolarHBondContact O-N 2.83Å; T15-V19 WeakPolarHBondContact O-CG2 3.45Å; T15-V19 PolarHBondContact O-N 3.37Å
16I83.3Confident74.6Confident87 Ų87104 Ų10445%0.44660%0.599SS.*Hα-helixtrans-63.2-45.3174.4-67.6168.6000110.3F12 L13 A18 V19 S20F12-I16 HydrophobicContact CD1-CD1 3.86Å; F12-I16 HydrophobicContact CE1-CD1 3.58Å; F12-I16 HydrophobicContact CZ-CD1 4.02Å; F12-I16 WeakPolarHBondContact O-CG1 3.44Å; F12-I16 PolarHBondContact O-N 3.24Å; L13-I16 PolarHBondContact O-N 3.21Å; I16-A18 PolarHBondContact O-N 3.22Å; I16-V19 PolarHBondContact O-N 3.32Å; I16-S20 PolarHBondContact O-N 3.4Å; I16-S20 PolarHBondContact O-OG 2.79Å
17L82Confident72.5Confident86 Ų8699.1 Ų99.145%0.4560%0.598SS.*Hα-helixtrans-62.2-44.2-180-166.566.9000111.4L13 F14 V19 S20 Q21L13-L17 WeakPolarHBondContact O-CB 3.12Å; L13-L17 PolarHBondContact O-N 3.13Å; F14-L17 PolarHBondContact O-N 3.02Å; L17-V19 PolarHBondContact O-N 2.93Å; L17-S20 WeakPolarHBondContact CA-OG 3.42Å; L17-S20 PolarHBondContact O-N 3.48Å; L17-S20 PolarHBondContact O-OG 2.96Å; L17-Q21 WeakPolarHBondContact O-CG 3.27Å; L17-Q21 PolarHBondContact O-N 3.31Å; L17-Q21 VanDerWaalsContact O-N 3.11Å
18A73.4Confident70.5Confident66 Ų66102 Ų10255%0.54562%0.616SS.*Hα-helixtrans-61.6-42.5176.300000112.8F14 T15 I16 Q21 G22F14-A18 WeakPolarHBondContact O-CB 3.04Å; F14-A18 PolarHBondContact O-N 2.89Å; T15-A18 PolarHBondContact O-N 2.83Å; I16-A18 PolarHBondContact O-N 3.22Å; A18-Q21 PolarHBondContact O-N 3.04Å; A18-G22 PolarHBondContact O-N 3.17Å
19V73.8Confident67.9Low115 Ų115105.4 Ų105.470%0.69763%0.628SS**Hα-helixtrans-64.5-40175.2172.10000111.3T15 I16 L17 Q21 G22T15-V19 WeakPolarHBondContact O-CG2 3.45Å; T15-V19 PolarHBondContact O-N 3.37Å; I16-V19 PolarHBondContact O-N 3.32Å; L17-V19 PolarHBondContact O-N 2.93Å; V19-Q21 VanDerWaalsContact C-N 3.29Å; V19-Q21 PolarHBondContact O-N 2.71Å; V19-G22 PolarHBondContact O-N 3.22Å
20S69Low65.2Low75 Ų75104.2 Ų104.252%0.52464%0.64SS.*Hα-helixtrans-69-23.4179.469.30000114.4I16 L17I16-S20 PolarHBondContact O-N 3.4Å; I16-S20 PolarHBondContact O-OG 2.79Å; L17-S20 WeakPolarHBondContact CA-OG 3.42Å; L17-S20 PolarHBondContact O-N 3.48Å; L17-S20 PolarHBondContact O-OG 2.96Å
21Q62Low62.9Low148 Ų148110.2 Ų110.269%0.69266%0.662SS**Hα-helixtrans-89.8-11.4176.1-68.2-179.512.100113.5L17 A18 V19 A23L17-Q21 WeakPolarHBondContact O-CG 3.27Å; L17-Q21 PolarHBondContact O-N 3.31Å; L17-Q21 VanDerWaalsContact O-N 3.11Å; A18-Q21 PolarHBondContact O-N 3.04Å; V19-Q21 VanDerWaalsContact C-N 3.29Å; V19-Q21 PolarHBondContact O-N 2.71Å; Q21-A23 VanDerWaalsContact C-N 3.32Å; Q21-A23 PolarHBondContact O-N 3.06Å
22G49.9Very low60.2Low68 Ų68118 Ų11870%0.70168%0.682SS**SBendtrans-83.64.3-179.200000115.7A18 V19 D24A18-G22 PolarHBondContact O-N 3.17Å; V19-G22 PolarHBondContact O-N 3.22Å; G22-D24 PolarHBondContact O-N 3.26Å
23A47.4Very low57.7Low83 Ų83123.1 Ų123.169%0.68670%0.698SS**  trans-102.451.7-166.300000114Q21 P25Q21-A23 VanDerWaalsContact C-N 3.32Å; Q21-A23 PolarHBondContact O-N 3.06Å; A23-P25 WeakPolarHBondContact O-CD 3.25Å
24D44.3Very low55.1Low149 Ų149127.3 Ų127.380%0.79771%0.712SS**  trans-101.9103.5179.8-152.2-3.8000111.1G22 A26G22-D24 PolarHBondContact O-N 3.26Å; D24-A26 PolarHBondContact O-N 3.32Å
25P48.7Very low52.6Low120 Ų120125.2 Ų125.278%0.77972%0.722SS**  trans-81.278.3-169.633-36.1000112.5A23 A27A23-P25 WeakPolarHBondContact O-CD 3.25Å; P25-A27 PolarHBondContact O-N 3.21Å
26A37.3Very low50.4Low96 Ų96129.5 Ų129.579%0.79374%0.736SS**PPolyproline II helixtrans-56.3118.3175.600000112.5D24D24-A26 PolarHBondContact O-N 3.32Å
27A41.4Very low47.9Very low86 Ų86133.9 Ų133.971%0.71176%0.759SS**PPolyproline II helixtrans-71.9131.4-174.800000112.9P25 H29P25-A27 PolarHBondContact O-N 3.21Å; A27-H29 PolarHBondContact O-N 2.02Å
28P48Very low45.6Very low128 Ų128135 Ų13583%0.83177%0.774SS**PPolyproline II helixtrans-75.6117.6-177.328.3-34000112.8G30P28-G30 PolarHBondContact O-N 2.92Å
29H36.8Very low43.8Very low189 Ų189136.7 Ų136.788%0.87579%0.788SS**  trans-64.698177.3-90.5-75.5000113.5A27 K31A27-H29 PolarHBondContact O-N 2.02Å; H29-K31 PolarHBondContact O-N 3.23Å; H29-K31 VanDerWaalsContact O-N 3.17Å
30G35.4Very low41.7Very low76 Ų76134.8 Ų134.878%0.78479%0.791SS**  trans-72.698.3170.600000113.3P28 R32P28-G30 PolarHBondContact O-N 2.92Å; G30-R32 PolarHBondContact O-N 3.31Å
31K44.2Very low39.9Very low212 Ų212136.6 Ų136.692%0.92280%0.804SS**  trans-65.1111.7174.7-66.1174.5-178.8173.40111.4H29H29-K31 PolarHBondContact O-N 3.23Å; H29-K31 VanDerWaalsContact O-N 3.17Å
32R34.2Very low38.6Very low249 Ų249133.9 Ų133.994%0.9480%0.802SS**  trans-128.4156.8165.3-151.2168.4-175.4-177.20.6111.8G30G30-R32 PolarHBondContact O-N 3.31Å
33R39.5Very low38Very low240 Ų240138 Ų13891%0.90681%0.808SS**  trans-80.2148.8-153.8-66.7-179178.3173.4-1.7114.9
34K37.4Very low37.2Very low182 Ų182138.2 Ų138.279%0.79181%0.809SS**  trans-57128.2171.3-173.4179.5-174.5179.90112.1
35A33.2Very low36.7Very low101 Ų101138.8 Ų138.884%0.83581%0.811SS**  trans-148.3120.2161.200000108.4
36Q37Very low35.9Very low163 Ų163142 Ų14276%0.76282%0.816SS**  trans-104.1128.7176.6-67.7167.1-104.700109.2
37I31.4Very low35.6Very low180 Ų180147.8 Ų147.892%0.92382%0.819SS**  trans-138.3145.9150.6-54.7-177.9000106.2
38S33.6Very low35.6Very low108 Ų108149.6 Ų149.676%0.75582%0.824SS**  trans-126.4147.5-172.9-1710000112
39A35.3Very low34.9Very low103 Ų103146.2 Ų146.285%0.85181%0.812SS**  trans58.4150.1155.600000121.3
40G29.7Very low34.7Very low74 Ų74146.3 Ų146.376%0.76381%0.813SS**  trans135.5132.3148.700000116.9
41S31.3Very low34.5Very low114 Ų114147.8 Ų147.880%0.79781%0.806SS**  trans38.9131.4164.3-660000121
42S35.1Very low33.8Very low91 Ų91144.7 Ų144.764%0.63680%0.799SS**  cis90.7123.22788.90000117.4
43N36.1Very low33.8Very low155 Ų155140.4 Ų140.483%0.82979%0.79SS**  trans79.4135.7148-61.3-12.5000123.9
44A31.1Very low33.3Very low87 Ų87134.1 Ų134.172%0.71978%0.783SS**  trans86111.6138.600000122.6
45L33.2Very low32.9Very low160 Ų160134 Ų13484%0.83879%0.785SS**  43.2123.3125.4-59.5170.9000120.6
46Q32.1Very low32.9Very low189 Ų189134 Ų13488%0.88378%0.779SS**  -166.2137.797-101.6171.528.600113.5
47Y31.2Very low32.8Very low217 Ų217137 Ų13785%0.85179%0.785SS**  trans-93.5159.2155-113.5-90.2000107.6
48P41.8Very low32.9Very low124 Ų124131.7 Ų131.781%0.80577%0.774SS**  -136.6162.8109.137.9-29.2000114
49G32.8Very low32.9Very low57 Ų57138.7 Ų138.759%0.58878%0.784SS**  trans-136.3-15616600000109.9
50Q34.2Very low33Very low191 Ų191141.2 Ų141.289%0.89378%0.783SS**  trans81.8147.3-176.3-51.5-16718.600114.3
51V29.6Very low33.4Very low107 Ų107149.5 Ų149.565%0.64879%0.792SS**  cis-163.8154.2-8.4116.80000111.4
52L31.2Very low33.6Very low146 Ų146154.3 Ų154.376%0.76479%0.792SS**  trans57.3175.8164.7-93.339.5000118.8
53Q32.8Very low33.4Very low159 Ų159153 Ų15374%0.74379%0.794SS**  -173.1137.6-55.5-179.4175.340.200110.3
54S29.7Very low33.7Very low109 Ų109153.5 Ų153.576%0.76279%0.79SS**  trans65.3155.3176.279.70000115
55Q29.7Very low33.7Very low180 Ų180153 Ų15384%0.84179%0.794SS**  cis-135.4-16929.2-63.9-176.8-6.100113.9
56S32.9Very low33.8Very low100 Ų100151.4 Ų151.470%0.69980%0.796SS**  trans-115.5130.2-166.81780000114.4
57Y35.1Very low34.2Very low226 Ų226151.4 Ų151.489%0.88680%0.796SS**  trans-153.4147.5150.7-66.3-75000108
58G32.6Very low34.3Very low69 Ų69153.3 Ų153.371%0.71180%0.802SS**  cis135.373.6-4.600000113.8
59R34.3Very low34.2Very low255 Ų255152.4 Ų152.496%0.96280%0.798SS**  trans-161124.1167.5-124177-165.5-175.36.2116.2
60D36.5Very low34.7Very low155 Ų155160.6 Ų160.683%0.82981%0.812SS**  trans-94143170.2-78.4-76000114
61R37.9Very low34.8Very low249 Ų249162.1 Ų162.194%0.9481%0.811SS**  trans-152.3106.2142.4-73.6-166.5172.4173.5-4.4106.9
62R36.2Very low35.3Very low214 Ų214161.1 Ų161.181%0.80881%0.814SS**  76.6117.356-172.2-174.4-83.4-109.911.5113.9H64R62-H64 PolarHBondContact NH1-NE2 2.92Å
63G31.5Very low35.9Very low65 Ų65162.6 Ų162.667%0.6781%0.814SS**  trans155.782.1173.700000109.9
64H41Very low35.9Very low164 Ų164158.2 Ų158.276%0.75981%0.812SS**  49.8124.685.8-63.9-77.6000113.7R62R62-H64 PolarHBondContact NH1-NE2 2.92Å
65G31.8Very low36Very low77 Ų77160 Ų16079%0.79481%0.808SS**  cis155.7163.5-6.900000112.6
66S35.4Very low36.2Very low127 Ų127156.7 Ų156.789%0.88881%0.811SS**  trans-158.2112164-173.40000110.9
67Q40.3Very low36.2Very low188 Ų188155.1 Ų155.188%0.87981%0.811SS**  trans-108.3143.1166.5-80.5-177.5-28.800109.2
68R33.3Very low36.2Very low258 Ų258152 Ų15297%0.97481%0.808SS**  trans-145.4118149.6-112.3-176.8-176.9-164.91.2110.4
69S39.5Very low36.4Very low104 Ų104156.5 Ų156.573%0.72782%0.815SS**  trans-130.5151167.760.70000109.6
70R43.9Very low36.2Very low229 Ų229149.5 Ų149.586%0.86481%0.805SS**  trans-166.2118.2155.9-102174.3-127.5-159.50.8105.7
71Y35.7Very low36.1Very low224 Ų224150.4 Ų150.488%0.87880%0.804SS**  67.4140.391.9-91.1-89.3000114.1
72A40.6Very low35.7Very low86 Ų86149.4 Ų149.471%0.71180%0.8SS**  168135-51.100000110.2
73K43.7Very low35.4Very low176 Ų176142.8 Ų142.877%0.76580%0.799SS**  trans-177162149.2-117.6-165.3176.5-132.30114E75K73-E75 WeakPolarHBondContact CE-OE2 3.24Å; K73-E75 WeakPolarHBondContact CG-OE2 3.5Å; K73-E75 IonicContact NZ-OE1 3.84Å; K73-E75 PolarHBondContact NZ-OE1 2.04Å; K73-E75 IonicContact NZ-OE2 2.65Å; K73-E75 PolarHBondContact NZ-OE2 3.06Å
74G32.1Very low35.6Very low68 Ų68147.3 Ų147.370%0.70181%0.807SS**  trans98.978.917700000114.5
75E31.3Very low35.4Very low147 Ų147147.9 Ų147.969%0.68781%0.809SS**  cis76.194.124.9-157.9177.2106.100110.8K73K73-E75 WeakPolarHBondContact CE-OE2 3.24Å; K73-E75 WeakPolarHBondContact CG-OE2 3.5Å; K73-E75 IonicContact NZ-OE1 3.84Å; K73-E75 PolarHBondContact NZ-OE1 2.04Å; K73-E75 IonicContact NZ-OE2 2.65Å; K73-E75 PolarHBondContact NZ-OE2 3.06Å
76A33.8Very low36Very low109 Ų109149.9 Ų149.990%0.90181%0.808SS**  cis-148.1-163.91.600000109.9
77G33.3Very low36.2Very low67 Ų67151.1 Ų151.169%0.69180%0.804SS**  cis171.1-160.26.800000112.8
78I34.6Very low36.1Very low161 Ų161148 Ų14883%0.82680%0.8SS**  trans77.9104166.2-50.1-179.7000120.2
79L36.8Very low36.6Very low163 Ų163146.3 Ų146.385%0.85379%0.794SS**  trans59.9153.8149.7-59.8174.4000120
80S31.9Very low36.6Very low109 Ų109149.3 Ų149.376%0.76280%0.801SS**  cis-144.4-174.6-5.4-156.50000112
81H32.8Very low36.2Very low174 Ų174143.9 Ų143.981%0.80679%0.789SS**  trans-92.9144.9-166.7-75.1-86.4000117.4
82R29.7Very low36.1Very low228 Ų228140.6 Ų140.686%0.8679%0.786SS**  59120128-169.9-174.7-166.9164.32.6120.2
83G30.9Very low35.9Very low75 Ų75144.5 Ų144.577%0.77379%0.79SS**  trans-152.5134154.600000110.6
84L34.3Very low35.2Very low160 Ų160144 Ų14484%0.83879%0.79SS**  trans-119.7157.6178.3-77.1169.1000110.3
85H37.7Very low35.8Very low175 Ų175146.8 Ų146.881%0.8179%0.794SS**  trans-53.7153.6171.9-84.3-82.6000112.8
86P44Very low36Very low120 Ų120143.2 Ų143.278%0.77980%0.797SS**  -134.3167101.138-28.9000114.8
87L40.3Very low36.8Very low153 Ų153146.8 Ų146.880%0.80180%0.8SS**  trans-94.1159.5162.7-73.9165.9000109.8
88P38.7Very low37.3Very low123 Ų123152.9 Ų152.980%0.79981%0.81SS**  -129.5168.612837.2-29.6000113
89R43.8Very low37.5Very low221 Ų221148.4 Ų148.483%0.83480%0.803SS**  trans-104.1153.4166.2-57.3171.291.5107.4-3.4109.1
90L38Very low37.8Very low168 Ų168149 Ų14988%0.8881%0.807SS**  trans-154.6153.2138.2-130.1141.1000108.1
91D36.1Very low38.2Very low115 Ų115151 Ų15162%0.61581%0.809SS**  trans-94.5152.4-172.3-53.6-93.6000111.2
92D34.7Very low39.1Very low154 Ų154148 Ų14882%0.82481%0.805SS**  166.8154.7127.4-86.4-30.7000113.9
93E35Very low39.6Very low168 Ų168143.5 Ų143.579%0.78580%0.802SS**  trans53.6120.8158.2-67-87.262.300123.4
94E30.3Very low40Very low165 Ų165151.5 Ų151.577%0.77181%0.809SS**  trans67.8122.4130.5-156.4162.9-138.100124.9
95T43.6Very low40.4Very low128 Ų128150.2 Ų150.279%0.78581%0.808SS**  trans24112.8146.4-47.90000121.4
96G34.8Very low40.9Very low72 Ų72151 Ų15174%0.74281%0.812SS**  trans-151.9124.2160.300000113.4E98G96-E98 PolarHBondContact O-N 3.17Å
97L51.1Low40.8Very low184 Ų184153.7 Ų153.796%0.96382%0.816SS**  trans-87.590176.4-75.5171.6000110.9
98E43.3Very low40.8Very low195 Ų195149.2 Ų149.291%0.91181%0.807SS**  trans-98.5128-175.8-168.2165.3-162.500114.7G96G96-E98 PolarHBondContact O-N 3.17Å
99G40.1Very low41.2Very low66 Ų66149.3 Ų149.368%0.6881%0.808SS**  trans84.359.9141.800000118.8N101G99-N101 PolarHBondContact O-N 3.24Å
100L42Very low40.7Very low177 Ų177143.5 Ų143.593%0.92780%0.801SS**  trans-59.5119.4157.5-74.3176000109.9P102L100-P102 WeakPolarHBondContact O-CD 3.29Å
101N41.2Very low41Very low150 Ų150146.8 Ų146.880%0.80280%0.802SS**  trans-74.9112.7-172.2-171-3.1000111.4G99G99-N101 PolarHBondContact O-N 3.24Å
102P52.1Low40.9Very low111 Ų111148.5 Ų148.572%0.72181%0.811SS**  trans-75.2133.3-171.829.6-34.3000112.5L100 R104L100-P102 WeakPolarHBondContact O-CD 3.29Å; P102-R104 PolarHBondContact O-N 3.25Å
103V38.9Very low41.3Very low134 Ų134153.2 Ų153.281%0.81282%0.817SS**  trans-64.5125.4178.1174.60000110.7V105V103-V105 PolarHBondContact O-N 3.13Å
104R40.3Very low41.4Very low243 Ų243149.9 Ų149.992%0.91782%0.818SS**  trans-69.8115.4171.1-118-179.1178.6135.4-0.2109.9P102P102-R104 PolarHBondContact O-N 3.25Å
105V43.2Very low41.7Very low133 Ų133152.8 Ų152.881%0.80682%0.822SS**PPolyproline II helixtrans-86123.9169.5-172.60000108.5V103V103-V105 PolarHBondContact O-N 3.13Å
106E47.8Very low41.3Very low191 Ų191155.4 Ų155.489%0.89383%0.826SS**PPolyproline II helixtrans-86.9120.4-178.5-168.8172.3-176.900111
107M42.1Very low41Very low176 Ų176156 Ų15687%0.86783%0.831SS**PPolyproline II helixtrans-85.5120.2-175.1-163.569.5174.800111.1
108G40.8Very low40.3Very low59 Ų59152.1 Ų152.161%0.60883%0.826SS**PPolyproline II helixtrans-66.8143.3-179.700000113.6S110G108-S110 PolarHBondContact O-N 2.79Å
109P46.4Very low39.9Very low126 Ų126153 Ų15382%0.81883%0.826SS**  trans-78.6112.1-175.730-34.3000112.8
110S33.3Very low39.7Very low99 Ų99155.4 Ų155.469%0.69283%0.833SS**  trans-64.8142.2167.4179.80000111.8G108G108-S110 PolarHBondContact O-N 2.79Å
111R44.7Very low39.2Very low237 Ų237151.6 Ų151.689%0.89482%0.821SS**  trans-147.486.5168-76-163.5170.6-178.8-1.7112.2
112D34.3Very low38.8Very low151 Ų151149.3 Ų149.381%0.80782%0.817SS**  trans-66.7132.1162.4-75.4-65.4000111.9
113R42.4Very low38Very low252 Ų252152.8 Ų152.895%0.95182%0.823SS**  trans-162.4101.6150.9-112.9172.4-165.1174.85.6110.5
114A37.1Very low37.5Very low98 Ų98153.4 Ų153.481%0.8182%0.822SS**  trans-83.9141.1175.700000112
115R36.6Very low37.3Very low226 Ų226150.2 Ų150.285%0.85382%0.818SS**  trans-166.7112.4133.5-107.4168.5-161.6-108.52.9112.3
116Q35.2Very low36.7Very low184 Ų184152.5 Ų152.586%0.8682%0.82SS**  trans33.2117.2135.4-62.6171-10.300118.6
117G28.9Very low35.8Very low83 Ų83148.8 Ų148.886%0.85682%0.815SS**  trans-163.136.2174.100000114.2
118A36.4Very low35.3Very low103 Ų103149.9 Ų149.985%0.85182%0.815SS**  trans-78.1124.4-177.900000112.1
119K35.2Very low34.9Very low213 Ų213154.7 Ų154.793%0.92683%0.826SS**  trans-152144.9160.3-110.5170.1178.8176.90110.2
120S34.1Very low34.2Very low117 Ų117157 Ų15782%0.81883%0.826SS**  trans-115.3-170.1-172.253.10000111.6
121S31.7Very low33.9Very low97 Ų97159.5 Ų159.568%0.67883%0.827SS**  trans80.8125.5-166.9-1540000112.7
122S33.4Very low33.4Very low102 Ų102155.2 Ų155.271%0.71382%0.822SS**  cis86.3154.523.61000000115.7
123Q36.3Very low33.3Very low184 Ų184156.1 Ų156.186%0.8682%0.821SS**  trans77.8127.5-161.2-54.2179.5-9.300113.1
124N28.5Very low32.8Very low148 Ų148150.7 Ų150.779%0.79181%0.81SS**  cis105.6154.713.4-159.723.7000114.3
125Q34.2Very low32.6Very low176 Ų176152.2 Ų152.282%0.82281%0.809SS**  trans75.8129.9-164.1-54.6176-5.800113.3
126E31.1Very low32.6Very low181 Ų181144.7 Ų144.785%0.84680%0.802SS**  cis88.6103.812-159.6-174164.300117.7
127S29.9Very low32.5Very low112 Ų112142.7 Ų142.778%0.78380%0.803SS**  trans-165.2112.5147.663.60000115.2
128K31.7Very low32.8Very low200 Ų200150.2 Ų150.287%0.8781%0.805SS**  trans42.9120.8141.1-63.5-177.4178.5177.30123.9
129N31.3Very low32.8Very low159 Ų159155.1 Ų155.185%0.8581%0.807SS**  trans-15.4133.7136.7-57.7-25.7000119.8
130Q31.6Very low32.7Very low174 Ų174148.4 Ų148.481%0.81380%0.799SS**  trans-175.5152.1139.4-104.7179-52.700107.5
131E28.1Very low32.7Very low152 Ų152155 Ų15571%0.7181%0.806SS**  cis-151.6177.3-14.9-155.2168.3122.500108.5
132N33.9Very low32.8Very low148 Ų148153.3 Ų153.379%0.79180%0.803SS**  trans-89.2174.5177.5-75.5-58.8000112.9
133Q31.8Very low33Very low169 Ų169158.3 Ų158.379%0.7982%0.815SS**  trans86.9152.3174.6-57.6-173.88100116.1
134L32.3Very low32.9Very low138 Ų138152.8 Ų152.872%0.72381%0.807SS**  cis-164.9167.3-28.4-116173.3000108.3
135V31.7Very low33.2Very low130 Ų130152 Ų15279%0.78881%0.813SS**  trans58.6131163.7177.30000117.5
136G37.9Very low33Very low69 Ų69146.8 Ų146.871%0.71181%0.806SS**  trans-115.7154174.100000114.1
137T32.8Very low33.2Very low141 Ų141146.5 Ų146.587%0.86581%0.805SS**  trans-141.3124.2172.2340000114.7
138R34.3Very low33.3Very low241 Ų241152.8 Ų152.891%0.90981%0.811SS**  trans9.3126.6150.2-79.5178.8170.4-179.1-2.1122.2
139K37.3Very low33.6Very low206 Ų206150.1 Ų150.190%0.89680%0.802SS**  102.4128.3112.3-175.1-174.9-179.9-172.90120.6
140G32Very low34Very low72 Ų72149.6 Ų149.674%0.74280%0.798SS**  trans106.4140.2164.500000112.6
141R35.6Very low34.3Very low257 Ų257150 Ų15097%0.9780%0.797SS**  cis-137.3166.7-6.8-58173.6-179.8178.5-1.6106.2
142G32.7Very low34.7Very low60 Ų60150.2 Ų150.262%0.61980%0.799SS**  cis152.2133.8-0.300000109.6
143H37.7Very low34.8Very low208 Ų208150.4 Ų150.496%0.96380%0.8SS**  trans66.6144.9-179.4-53.9-93.5000116.7
144G35.1Very low35.2Very low67 Ų67150.9 Ų150.969%0.69180%0.799SS**  cis-178.6156.7-7.900000113.3
145S33.6Very low35.8Very low131 Ų131153.8 Ų153.892%0.91681%0.806SS**  trans45.2133.3172.7-66.10000120
146G29.8Very low36.3Very low67 Ų67156.9 Ų156.969%0.69181%0.812SS**  cis110.3110.4-5.600000114.8
147H36.1Very low36.3Very low175 Ų175157.4 Ų157.481%0.8182%0.817SS**  trans-151.6101.4148.4-104.5-72.9000108.7H149H147-H149 AromaticContact ND1-CD2 3.85Å; H147-H149 AromaticContact ND1-NE2 3.71Å
148R32.3Very low36.5Very low244 Ų244156.4 Ų156.492%0.92182%0.816SS**  trans-124.188.9173.6-163.1-175.7-158.5-150.46.9107.9L150R148-L150 PolarHBondContact O-N 2.68Å
149H38.8Very low37.2Very low145 Ų145156.7 Ų156.767%0.67182%0.817SS**  trans-71.796.6178.5-94.2-74.6000110.7H147 F151H147-H149 AromaticContact ND1-CD2 3.85Å; H147-H149 AromaticContact ND1-NE2 3.71Å; H149-F151 AromaticContact ND1-CD2 3.83Å; H149-F151 AromaticContact ND1-CE2 3.99Å
150L39Very low37.8Very low148 Ų148158 Ų15878%0.77582%0.816SS**  trans-77.4111.7154.8-177.970.1000107.5R148R148-L150 PolarHBondContact O-N 2.68Å
151F37.4Very low38Very low181 Ų181161.2 Ų161.279%0.79482%0.816SS**  trans-132.2101.8159.9-102.2-68.8000108.3H149 N153H149-F151 AromaticContact ND1-CD2 3.83Å; H149-F151 AromaticContact ND1-CE2 3.99Å; F151-N153 PolarHBondContact O-N 2.99Å
152E36.4Very low38.6Very low157 Ų157158.9 Ų158.973%0.73481%0.813SS**  trans-65.6128.2159.3-59.7179.1114.900108
153N35.9Very low38.9Very low152 Ų152161.1 Ų161.181%0.81381%0.814SS**  trans-179.1143.5131.5-107.9-76.8000114.5F151F151-N153 PolarHBondContact O-N 2.99Å
154K39.7Very low39.1Very low179 Ų179162.2 Ų162.278%0.77881%0.81SS**  trans65.470.6136.3-161.3176-174.9173.50119.5
155K46.5Very low39.2Very low199 Ų199166.7 Ų166.787%0.86581%0.813SS**  172.1107.1112.4-96.3175.3175.5-179.80113
156Q41.4Very low39.4Very low196 Ų196170 Ų17092%0.91681%0.811SS**  trans-133.3138.1145-73.6-167-5.300108.6S158Q156-S158 PolarHBondContact O-N 3.23Å; Q156-S158 VanDerWaalsContact O-N 3.17Å
157G37.4Very low39.8Very low79 Ų79176.7 Ų176.781%0.81482%0.821SS**  trans-84.786.7-170.400000112.8R159G157-R159 PolarHBondContact O-N 2.85Å
158S37.5Very low39.6Very low120 Ų120171.9 Ų171.984%0.83982%0.818SS**  trans-63.1116.5164.2-175.70000109.2Q156Q156-S158 PolarHBondContact O-N 3.23Å; Q156-S158 VanDerWaalsContact O-N 3.17Å
159R49.4Very low39.5Very low248 Ų248170.3 Ų170.394%0.93682%0.819SS**  trans-124.661.4178.8-159.2-173.3-172.5-160.83111.9G157G157-R159 PolarHBondContact O-N 2.85Å
160R49.8Very low40Very low233 Ų233168.4 Ų168.488%0.87982%0.819SS**  trans-130.4102.8156.9-74.3-174.1177.2-177.6-0.5108.6
161D35.7Very low39.7Very low139 Ų139166.8 Ų166.874%0.74382%0.82SS**  -164.3144.9113.1-140.7-45.3000111.6V163D161-V163 PolarHBondContact OD1-N 3.21Å
162K48.5Very low39.4Very low208 Ų208161.4 Ų161.490%0.90482%0.816SS**  trans-162.645155.7-143.2178.3-175-176.70112.6R164K162-R164 PolarHBondContact O-N 3.17Å
163V39.3Very low39.6Very low107 Ų107159.4 Ų159.465%0.64882%0.816SS**  trans-65.2119.4167.5174.60000110.4D161D161-V163 PolarHBondContact OD1-N 3.21Å
164R40.6Very low39.4Very low232 Ų232161 Ų16188%0.87582%0.819SS**  trans-147.396.2149.3-79.1-152.2175.1-156.6-2.6112.4K162K162-R164 PolarHBondContact O-N 3.17Å
165H38.4Very low39Very low160 Ų160157.2 Ų157.274%0.74182%0.821SS**  trans27.4123146.9-45.2-79.4000121.4
166K36.5Very low38.4Very low201 Ų201153.6 Ų153.687%0.87482%0.821SS**  -158.9119.9101.7-95164.6-175-178.30107
167K38.8Very low38Very low207 Ų207149.1 Ų149.190%0.981%0.812SS**  71.4110.283.6-167.9178.3-176.1-179.10111.1
168G32.8Very low37.8Very low74 Ų74149.7 Ų149.776%0.76381%0.809SS**  cis-164.2-165.44.600000115.3
169F30.6Very low37.6Very low211 Ų211153.4 Ų153.493%0.92581%0.81SS**  trans-94.4178.8-176.2-78.5-81.4000112.9
170P49.1Very low36.8Very low106 Ų106150.4 Ų150.469%0.68880%0.804SS**  cis-134.9-174.3-12.124.8-0.2000115.5
171S32.5Very low36Very low113 Ų113146.1 Ų146.179%0.7980%0.798SS**  trans67.5140.3143.749.30000122.8
172G30.2Very low35.9Very low69 Ų69149.7 Ų149.771%0.71180%0.801SS**  trans-92.1-154.3158.900000111.9
173P41.2Very low35.2Very low114 Ų114145.9 Ų145.974%0.7479%0.791SS**  cis-126.7-160.520.244.4-29.4000114.5
174E31.4Very low34.9Very low185 Ų185149.1 Ų149.186%0.86480%0.799SS**  trans13.4124.8156.3-64168.1115.800121.1
175A32.1Very low34.3Very low100 Ų100146.9 Ų146.983%0.82680%0.796SS**  trans-169134.413100000111.6
176S33.6Very low34Very low123 Ų123147.1 Ų147.186%0.8680%0.797SS**  trans-101.7117.1171.454.80000111.4
177S32.6Very low33.9Very low103 Ų103144.6 Ų144.672%0.7279%0.793SS**  trans-159.7117.8163.955.60000114.1
178A32.5Very low34.4Very low91 Ų91139.7 Ų139.775%0.75278%0.783SS**  trans-167.786.5159.300000106.8
179F33Very low35.1Very low197 Ų197141.3 Ų141.386%0.86478%0.78SS**  40.3100.892.2-63.4-68.5000113.1
180K33.5Very low35.9Very low186 Ų186136.7 Ų136.781%0.80977%0.771SS**  -175120.888.4-171.8166.3-173.9172.60111.7
181D32.2Very low35.1Very low142 Ų142137.4 Ų137.476%0.75978%0.779SS**  trans-87149.6169-167.48.2000110.8
182R33.7Very low35Very low215 Ų215137 Ų13781%0.81178%0.776SS**  trans-174.1112.9170.5-174.174.8100.214612.1111
183D35Very low35.1Very low127 Ų127139.1 Ų139.168%0.67978%0.78SS**  trans-63.6165.8167.9-43-100.6000113.4
184Q32Very low34.7Very low175 Ų175138.9 Ų138.982%0.81878%0.78SS**  160.7132.696.6-165.7142.571.100115
185F29.5Very low35.1Very low186 Ų186136.5 Ų136.582%0.81678%0.781SS**  trans82.6159.9155.7-114.3-100.6000122.5
186E32.2Very low35.1Very low164 Ų164136.6 Ų136.677%0.76678%0.776SS**  trans-110.9149-160.9-55.5175.496.200114.5
187D32.9Very low35Very low148 Ų148137.9 Ų137.979%0.79178%0.779SS**  trans45.2171.6143.3-112.118.7000122.4
188P49Very low35.1Very low105 Ų105137.8 Ų137.868%0.68278%0.778SS**  cis-128.6173.9-9.540.8-26000115
189P48Very low35.5Very low108 Ų108139.7 Ų139.770%0.70178%0.783SS**  trans-86.6151.1168.334.6-34.5000113.6
190P48.1Very low35.5Very low114 Ų114138.9 Ų138.974%0.7478%0.779SS**  trans-102.6147.9-178.836.8-33.4000115.6
191S31.4Very low35.6Very low121 Ų121138 Ų13885%0.84678%0.783SS**  trans77.1139.3165.6-41.60000116.7
192S30.8Very low35.2Very low105 Ų105134.6 Ų134.673%0.73478%0.781SS**  cis-153.5128.7-052.10000113.9
193S32.1Very low35.1Very low113 Ų113131.3 Ų131.379%0.7978%0.784SS**  trans33.8125.2145.558.80000122.4
194S33.3Very low34.9Very low108 Ų108131.1 Ų131.176%0.75579%0.788SS**  trans-61.7175.6164.3-360000114.5
195P40.1Very low36.1Very low135 Ų135128.1 Ų128.188%0.87778%0.784SS**  -134.6169.894.739.9-31.9000114.4
196S31.4Very low37.4Very low103 Ų103124.8 Ų124.872%0.7278%0.781SS**  trans-142.9121.1179.159.10000112.1
197T31.1Very low37.3Very low150 Ų150123 Ų12392%0.9279%0.786SS**  trans-164.8137.7152.112.70000110.7
198S35.2Very low37.3Very low101 Ų101124.4 Ų124.471%0.70679%0.788SS**  trans-86.3178.4169.2-47.10000110.9
199P41.6Very low38.2Very low131 Ų131124.1 Ų124.185%0.85179%0.786SS**  -138.9179.5102.338-25.9000114.8
200F31.8Very low38.6Very low180 Ų180124.7 Ų124.779%0.78979%0.79SS**  trans-109.3151.2-176.6-110.2-127000111.6
201L35.3Very low38.1Very low168 Ų168124 Ų12488%0.8879%0.787SS**  trans62.7136.3153.9-61.5165.9000120.4
202G25.9Very low39.3Very low70 Ų70123.6 Ų123.672%0.72278%0.782SS**  trans161.388.2158.600000119
203V31.3Very low39.4Very low146 Ų146125.2 Ų125.289%0.88578%0.781SS**  trans45.9151.8136.1-166.20000122.4
204T30.1Very low39.3Very low122 Ų122127.1 Ų127.175%0.74878%0.782SS**  trans-89.6-166.5179.349.50000113.7
205P57.3Low39.3Very low113 Ų113127.5 Ų127.573%0.73479%0.785SS**  cis-121.9-122.4-49.334-14000110.4
206P56.9Low39.2Very low116 Ų116127.6 Ų127.675%0.75378%0.777SS**  -115.1173.2-69.237-23.3000114.8
207S29.9Very low39.3Very low126 Ų126131 Ų13188%0.88178%0.779SS**  trans-158.7154.7146.855.20000113.5
208E33.8Very low39.2Very low177 Ų177131 Ų13183%0.82777%0.774SS**  trans-153.7-177.2-168.2-125.3-163.4127.100108
209P67.4Low39.5Very low99 Ų99131.1 Ų131.164%0.64378%0.775SS**  cis-121.7-132.6-23.734.7-12000109.2
210P55.5Low39.4Very low120 Ų120132.6 Ų132.678%0.77978%0.776SS**  cis-127.3157.630.238.9-20.7000117.6
211S38.2Very low39.7Very low99 Ų99129.3 Ų129.369%0.69278%0.775SS**  trans-85.2-177.3169.7-25.30000111.6
212P55.6Low39.9Very low114 Ų114125.8 Ų125.874%0.7476%0.764SS**  cis-133.2-161.84430.2-3.8000112.6
213I34Very low40.5Very low138 Ų138130.5 Ų130.571%0.70877%0.769SS**  cis-149.2164.111.7-6.1178.4000111.6
214D29.4Very low40.4Very low153 Ų153129.9 Ų129.982%0.81877%0.766SS**  trans60.1143.1151-62.2-26.9000123.3
215S34.6Very low40.6Very low116 Ų116129 Ų12981%0.81176%0.76SS**  trans-165.1165.9-18062.80000110.3
216L36.1Very low39.5Very low137 Ų137130 Ų13072%0.71777%0.765SS**  trans104.1142.9169.2-16064000116.6
217F35.1Very low38.3Very low174 Ų174127.9 Ų127.976%0.76376%0.757SS**  trans69.1139.1-174.6-49.5-72.8000114.4
218D29Very low38.3Very low152 Ų152128.6 Ų128.681%0.81376%0.756SS**  cis-133.4167.57-98.2-43000113.2
219S40.9Very low38.1Very low103 Ų103126.7 Ų126.772%0.7275%0.752SS**  trans-101.6160.1169.9-66.70000112.5
220D38.6Very low36.3Very low162 Ų162130 Ų13087%0.86676%0.759SS**  trans51.7115.1156.5-61.3-36000120.5
221S39.8Very low35.8Very low110 Ų110132.6 Ų132.677%0.76976%0.76SS**  trans-167116.3133.7-158.60000114.6
222S38.3Very low36.7Very low94 Ų94132.6 Ų132.666%0.65776%0.757SS**  trans61.7157.6143-122.90000119.7
223M38.1Very low36.3Very low169 Ų169132.5 Ų132.583%0.83376%0.757SS**  cis-128.4157.520.4-54.6-78.5164.100113.5
224V30.8Very low36.2Very low133 Ų133131.5 Ų131.581%0.80676%0.757SS**  trans-141137.2-174.2161.70000107.7
225T34.2Very low37Very low104 Ų104132.6 Ų132.664%0.63876%0.762SS**  cis-166.8178.6-9-93.40000106.8
226T32.5Very low37.4Very low135 Ų135132 Ų13283%0.82876%0.756SS**  trans67.4158.6171.142.70000116.6
227A31.9Very low37.8Very low70 Ų70131.8 Ų131.858%0.57976%0.762SS**  cis-169.3171-22.500000110.8
228T30.4Very low37.5Very low141 Ų141127 Ų12787%0.86576%0.763SS**  trans65.1152.5150.245.20000121.8
229N28.6Very low37.8Very low138 Ų138125.7 Ų125.774%0.73877%0.765SS**  trans97.397.5150-148.1-101.2000118.6
230E30.9Very low37.5Very low169 Ų169127.1 Ų127.179%0.7977%0.769SS**  trans62.8164.7142.7-55.2-47.2120.900121.2
231H43.9Very low37.4Very low174 Ų174128.5 Ų128.581%0.80677%0.768SS**  trans-120.7-162.4-151.4-153.71.1000112.5
232P57.9Low37.6Very low98 Ų98128.3 Ų128.364%0.63676%0.763SS**  trans-81.6169.3-14342.2-28.8000112.7
233P47.3Very low37.6Very low113 Ų113133 Ų13373%0.73478%0.775SS**  -154.317510139.9-23.5000115.1
234T30.9Very low37.5Very low116 Ų116134.2 Ų134.271%0.71278%0.776SS**  -169.497.2116.1-730000110.7P236T234-P236 HydrophobicContact CG2-CB 4.24Å; T234-P236 HydrophobicContact CG2-CG 3.78Å
235L47.1Very low37.6Very low176 Ų176133.8 Ų133.892%0.92178%0.779SS**  trans-91.9137140.9-72.5171.7000107
236P43.7Very low37.9Very low104 Ų104132 Ų13268%0.67578%0.781SS**  trans-136154.6167.638.1-24.2000114.3T234T234-P236 HydrophobicContact CG2-CB 4.24Å; T234-P236 HydrophobicContact CG2-CG 3.78Å
237P44Very low38.3Very low132 Ų132135.1 Ų135.186%0.85779%0.786SS**  cis-104.1169.5-38.436.4-24.5000110.1
238G28.6Very low38.8Very low75 Ų75135 Ų13577%0.77379%0.792SS**  cis11193.716.500000110.4
239S35Very low39.5Very low124 Ų124137.2 Ų137.287%0.86779%0.792SS**  trans-151.5162169.5-164.60000111.8
240V34.3Very low40.4Very low133 Ų133134 Ų13481%0.80679%0.791SS**  trans-98.9138.6-150.8-72.50000116.5
241K37.1Very low41.3Very low191 Ų191135.1 Ų135.183%0.8380%0.797SS**  2.1145.9127.1-175.6-176.9-176.1177.30116.9
242P45.3Very low42Very low105 Ų105133 Ų13368%0.68280%0.796SS**  cis-135.2168.8-15.137.9-21.7000115.8
243Q37.2Very low41.6Very low193 Ų193135.5 Ų135.590%0.90280%0.801SS**  -167.8106128.5-110.2174.511.900116.3
244K35.3Very low42.2Very low194 Ų194135.5 Ų135.584%0.84380%0.801SS**  trans40.9134.8131.6-149.4171.2-173.9178.60122.7
245S34.1Very low43.3Very low125 Ų125136 Ų13687%0.87480%0.804SS**  trans79.7141.2165.474.50000117
246G39.5Very low43.9Very low67 Ų67135.2 Ų135.269%0.69180%0.8SS**  cis-131.2-178.82.900000114.4
247Q41.2Very low44.5Very low199 Ų199134.8 Ų134.893%0.9379%0.792SS**  trans-63.5157.5171.5-64121.8-86.300111.3
248G41.8Very low45.3Very low67 Ų67136.4 Ų136.469%0.69179%0.79SS**  cis149.777.5400000110
249Q45.7Very low46.7Very low188 Ų188137.1 Ų137.188%0.87978%0.779SS**  trans-122112.8175.7-70.3-85.1-97.900106.8
250G46.9Very low47.8Very low70 Ų70138.5 Ų138.572%0.72278%0.776SS**  trans-80.1121.217300000109.3V252G250-V252 PolarHBondContact O-N 3.21Å
251E50.4Low48.7Very low193 Ų193141.4 Ų141.490%0.90278%0.778SS**  trans-70.979.1170.3-68.1-176.612900109.5M253E251-M253 VanDerWaalsContact C-N 3.31Å; E251-M253 PolarHBondContact O-N 3.37Å
252V58.7Low50.1Low131 Ų131137.2 Ų137.279%0.79477%0.765SS**  trans-68.595.1168.1-178.70000107G250 P254G250-V252 PolarHBondContact O-N 3.21Å; V252-P254 WeakPolarHBondContact O-CD 2.97Å
253M48.7Very low50.8Low149 Ų149142.1 Ų142.173%0.73477%0.77SS**  trans-50.2124.4162.1-72.3-96.572.500107.6E251 T255E251-M253 VanDerWaalsContact C-N 3.31Å; E251-M253 PolarHBondContact O-N 3.37Å; M253-T255 PolarHBondContact O-N 3.17Å
254P59.7Low51.7Low114 Ų114136.9 Ų136.974%0.7475%0.752SS**  trans-72.784.6175.529.7-33.2000108.5V252 L256V252-P254 WeakPolarHBondContact O-CD 2.97Å; P254-L256 PolarHBondContact O-N 3.47Å
255T54.3Low52.9Low126 Ų126132.6 Ų132.677%0.77374%0.738SS**  trans-52.2112.1159.6-590000106.3M253 D257M253-T255 PolarHBondContact O-N 3.17Å; T255-D257 PolarHBondContact O-N 3.46Å
256L59.6Low54Low159 Ų159135.9 Ų135.983%0.83273%0.733SS**  trans-73.381.9-178.2-166.391.6000108.3P254 M258P254-L256 PolarHBondContact O-N 3.47Å; L256-M258 PolarHBondContact O-N 2.86Å
257D56.7Low54.9Low96 Ų96140.7 Ų140.751%0.51374%0.737SS.*  trans-64.5108-178.3-162.5-31.5000109.1T255 T259 L260T255-D257 PolarHBondContact O-N 3.46Å; D257-T259 PolarHBondContact O-N 3.39Å; D257-T259 WeakPolarHBondContact OD1-CB 3.43Å; D257-T259 WeakPolarHBondContact OD1-CG2 3.33Å; D257-T259 PolarHBondContact OD1-N 3.31Å; D257-T259 VanDerWaalsContact OD1-N 3.11Å; D257-T259 PolarHBondContact OD1-OG1 2.89Å; D257-L260 PolarHBondContact O-N 2.77Å
258M60.5Low55.7Low166 Ų166138.2 Ų138.282%0.81873%0.73SS**G310 helixtrans-65.1-10.4-176.2-74.9178.256.300112.9L256 L260L256-M258 PolarHBondContact O-N 2.86Å; M258-L260 VanDerWaalsContact C-N 3.29Å
259T58Low56.4Low89 Ų89140.8 Ų140.855%0.54673%0.726SS.*G310 helixtrans-73.4-16.3172.363.50000113.7D257 F261 D262D257-T259 PolarHBondContact O-N 3.39Å; D257-T259 WeakPolarHBondContact OD1-CB 3.43Å; D257-T259 WeakPolarHBondContact OD1-CG2 3.33Å; D257-T259 PolarHBondContact OD1-N 3.31Å; D257-T259 VanDerWaalsContact OD1-N 3.11Å; D257-T259 PolarHBondContact OD1-OG1 2.89Å; T259-F261 PolarHBondContact O-N 3.42Å; T259-D262 PolarHBondContact O-N 2.86Å
260L57.7Low56.9Low153 Ų153139.8 Ų139.880%0.80172%0.718SS**G310 helixtrans-73.3-8.6177.9-160.467000113.5D257 M258D257-L260 PolarHBondContact O-N 2.77Å; M258-L260 VanDerWaalsContact C-N 3.29Å
261F54.4Low57.1Low194 Ų194141.5 Ų141.585%0.85172%0.717SS**G310 helixtrans-112.752.2170.6-85.6-85.7000111.1T259 W263T259-F261 PolarHBondContact O-N 3.42Å; F261-W263 PolarHBondContact O-N 3.14Å; F261-W263 VanDerWaalsContact O-N 3.08Å
262D65.5Low57.2Low103 Ų103138.4 Ų138.455%0.55171%0.711SS**  trans-58.8110.2167.5-95.2-17.8000110.2T259 T264 D265T259-D262 PolarHBondContact O-N 2.86Å; D262-T264 PolarHBondContact O-N 2.03Å; D262-D265 PolarHBondContact O-N 3.31Å; D262-D265 VanDerWaalsContact O-N 3.14Å
263W60.5Low57.1Low209 Ų209140.3 Ų140.379%0.79272%0.717SS**THydrogen-bonded Turntrans-60.7-11.9-174.958.6-84.5000114.5F261 D265 Y266F261-W263 PolarHBondContact O-N 3.14Å; F261-W263 VanDerWaalsContact O-N 3.08Å; W263-D265 VanDerWaalsContact C-N 3.33Å; W263-Y266 WeakPolarHBondContact O-CB 2.96Å; W263-Y266 PolarHBondContact O-N 2.7Å
264T56.8Low57.2Low83 Ų83137.4 Ų137.451%0.50971%0.711SS.*THydrogen-bonded Turntrans-69.2-23.6174.339.10000113.8D262 Y266 E267D262-T264 PolarHBondContact O-N 2.03Å; T264-Y266 PolarHBondContact O-N 2.65Å; T264-E267 PolarHBondContact O-N 3.14Å
265D59.3Low56.4Low103 Ų103143.8 Ų143.855%0.55172%0.72SS**Hα-helixtrans-66.4-20.3174.6-167.758.9000112.4D262 W263 E267 D268D262-D265 PolarHBondContact O-N 3.31Å; D262-D265 VanDerWaalsContact O-N 3.14Å; W263-D265 VanDerWaalsContact C-N 3.33Å; D265-E267 VanDerWaalsContact C-N 3.3Å; D265-E267 PolarHBondContact O-N 3.49Å; D265-D268 PolarHBondContact O-N 2.04Å
266Y57.1Low55.8Low195 Ų195143.3 Ų143.377%0.76572%0.719SS**Hα-helixtrans-76.4-11.7-177.2-143.2-91.1000114.4W263 T264 M269W263-Y266 WeakPolarHBondContact O-CB 2.96Å; W263-Y266 PolarHBondContact O-N 2.7Å; T264-Y266 PolarHBondContact O-N 2.65Å; Y266-M269 HydrophobicContact CD2-CE 4.3Å
267E59.8Low54.9Low168 Ų168140.3 Ų140.379%0.78571%0.711SS**Hα-helixtrans-78.4-36.7171-74.1-100.7117.100111.8T264 D265 K270T264-E267 PolarHBondContact O-N 3.14Å; D265-E267 VanDerWaalsContact C-N 3.3Å; D265-E267 PolarHBondContact O-N 3.49Å; E267-K270 WeakPolarHBondContact O-CB 3.3Å; E267-K270 PolarHBondContact O-N 2.72Å
268D58.3Low54.5Low147 Ų147141.6 Ų141.679%0.78673%0.728SS**Hα-helixtrans-80.5-24.9-173.4-154.146000112.7D265 K270D265-D268 PolarHBondContact O-N 2.04Å; D268-K270 PolarHBondContact O-N 3.18Å; D268-K270 VanDerWaalsContact O-N 3.14Å
269M55.9Low53.9Low121 Ų121143.4 Ų143.460%0.59673%0.726SS**THydrogen-bonded Turntrans-72.46.2170.9-79.4-164.9-78.300114.8Y266 P271Y266-M269 HydrophobicContact CD2-CE 4.3Å; M269-P271 VanDerWaalsContact O-CD 3.3Å; M269-P271 WeakPolarHBondContact O-CD 3.31Å
270K55.9Low53.7Low167 Ų167149 Ų14973%0.72674%0.742SS**  trans-65.3116174.7-177.6-176.8177.7-176.80110.6E267 D268 V272E267-K270 WeakPolarHBondContact O-CB 3.3Å; E267-K270 PolarHBondContact O-N 2.72Å; D268-K270 PolarHBondContact O-N 3.18Å; D268-K270 VanDerWaalsContact O-N 3.14Å; K270-V272 PolarHBondContact O-N 2.97Å; K270-V272 VanDerWaalsContact O-N 3.07Å
271P51Low53.4Low106 Ų106151.6 Ų151.669%0.68875%0.747SS**  trans-68113.2-176.326.8-34000111.5M269M269-P271 VanDerWaalsContact O-CD 3.3Å; M269-P271 WeakPolarHBondContact O-CD 3.31Å
272V52.3Low53.2Low127 Ų127146 Ų14677%0.7774%0.737SS**  trans-62.4142.1171174.90000110.2K270 S274K270-V272 PolarHBondContact O-N 2.97Å; K270-V272 VanDerWaalsContact O-N 3.07Å; V272-S274 WeakPolarHBondContact O-CB 3.43Å; V272-S274 PolarHBondContact O-N 3.45Å; V272-S274 PolarHBondContact O-OG 3.35Å
273D56.8Low52.5Low172 Ų172147.6 Ų147.692%0.9275%0.745SS**SBendtrans-32.195.2-171.4-76.7-63.3000116.1
274S50.7Low52.3Low87 Ų87147 Ų14761%0.60875%0.748SS**  trans-139.816.5-175.9460000114.9V272 P276V272-S274 WeakPolarHBondContact O-CB 3.43Å; V272-S274 PolarHBondContact O-N 3.45Å; V272-S274 PolarHBondContact O-OG 3.35Å; S274-P276 WeakPolarHBondContact O-CD 3.04Å
275W43Very low52.3Low248 Ų248154.7 Ų154.794%0.93977%0.768SS**  trans-89102.9166.4-79.4103.9000111.5S277W275-S277 PolarHBondContact O-N 3.11Å
276P41.8Very low52.2Low117 Ų117161.4 Ų161.476%0.7679%0.786SS**  trans-67.7106.1173.828.1-34.5000109.8S274 S278S274-P276 WeakPolarHBondContact O-CD 3.04Å; P276-S278 PolarHBondContact O-N 3.48Å
277S41.8Very low52Low95 Ų95156.8 Ų156.866%0.66478%0.782SS**  trans-59.2124.2-172.467.10000112.7W275 R279W275-S277 PolarHBondContact O-N 3.11Å; S277-R279 PolarHBondContact O-N 3.4Å
278S46.7Very low51.9Low123 Ų123157.7 Ų157.786%0.8678%0.784SS**SBendtrans-70.910.217856.60000113.8P276 K280P276-S278 PolarHBondContact O-N 3.48Å; S278-K280 VanDerWaalsContact C-N 3.27Å; S278-K280 PolarHBondContact O-N 3Å; S278-K280 VanDerWaalsContact O-N 3.17Å
279R49.6Very low51.6Low205 Ų205157.5 Ų157.577%0.77478%0.783SS**  trans-84.229.4-176.8-68.8-160.9176.8-151.23114.9S277 K281S277-R279 PolarHBondContact O-N 3.4Å; R279-K281 VanDerWaalsContact C-N 3.31Å; R279-K281 PolarHBondContact O-N 2.93Å
280K52.7Low51.2Low205 Ų205160.4 Ų160.489%0.89180%0.799SS**SBendtrans-90.635169-76.1-169.9175.1177.10114.6S278S278-K280 VanDerWaalsContact C-N 3.27Å; S278-K280 PolarHBondContact O-N 3Å; S278-K280 VanDerWaalsContact O-N 3.17Å
281K50.9Low50.9Low208 Ų208157.6 Ų157.690%0.90480%0.801SS**SBendtrans-152.87.2163.9-126.8175.8-173.3178.10117.5R279R279-K281 VanDerWaalsContact C-N 3.31Å; R279-K281 PolarHBondContact O-N 2.93Å
282A51Low51Low78 Ų78158.3 Ų158.365%0.64581%0.808SS**SBendtrans-96-15.2179.700000114K284A282-K284 PolarHBondContact O-N 2.93Å
283D51.3Low50.5Low135 Ų135155 Ų15572%0.72280%0.8SS**THydrogen-bonded Turntrans-105.580.1-164.2-160.62.4000113.8
284K56.5Low50.1Low196 Ų196154.9 Ų154.985%0.85280%0.799SS**THydrogen-bonded Turntrans-151.43161.7-157.7159.1-177.9172.60115A282A282-K284 PolarHBondContact O-N 2.93Å
285R56.7Low49.7Very low246 Ų246157.9 Ų157.993%0.92881%0.808SS**SBendtrans-14514.9-174.5-82.1-158.3173.4-152.4-1.6117.2
286R56.4Low49.6Very low243 Ų243152.5 Ų152.592%0.91780%0.802SS**  trans-139.730.9172.4-147.4170.8-178.7167.9-1115.7K288R286-K288 PolarHBondContact O-N 3.3Å
287S53.5Low49.8Very low98 Ų98151.4 Ų151.469%0.68580%0.803SS**  trans-89.294.616742.70000111.2
288K56.5Low49.7Very low188 Ų188152.5 Ų152.582%0.81780%0.801SS**  trans-159.9102.8150.2-114.1171.8-173.1-176.90111.1R286R286-K288 PolarHBondContact O-N 3.3Å
289N52.5Low50.1Low143 Ų143153.9 Ų153.977%0.76580%0.804SS**  trans58.895.2150.7-500.2000117.9
290L48.5Very low50.2Low182 Ų182149.8 Ų149.895%0.95380%0.798SS**  -125.9109.5118.3-74.7-179.5000107.3
291S47.8Very low50.5Low108 Ų108143.6 Ų143.676%0.75579%0.785SS**  trans-82147.1170-176.90000108.5G293S291-G293 PolarHBondContact O-N 3.11Å
292S53.9Low51.3Low121 Ų121138 Ų13885%0.84676%0.764SS**  trans-55.8121.5166.452.10000109.8
293G42.2Very low52.4Low57 Ų57141.2 Ų141.259%0.58877%0.765SS**  trans-160.3123.4176.900000108.8S291 L295S291-G293 PolarHBondContact O-N 3.11Å; G293-L295 PolarHBondContact O-N 3.5Å
294N47.1Very low54.2Low170 Ų170139.8 Ų139.891%0.90976%0.764SS**  trans-69.299.5177.6-177.113.8000108.8
295L43.4Very low56Low150 Ų150130.5 Ų130.579%0.78572%0.724SS**  trans-122.6139.3175.6-72.7171.8000108.3G293 A297G293-L295 PolarHBondContact O-N 3.5Å; L295-A297 PolarHBondContact O-N 3.34Å
296T40.2Very low57.8Low134 Ų134124 Ų12482%0.82271%0.707SS**  trans-42.1128176.545.40000111.3D298T296-D298 PolarHBondContact O-N 2.99Å
297A46.8Very low59.5Low94 Ų94118.1 Ų118.178%0.77769%0.69SS**  trans-52.1117.1175.400000109.6L295 V299L295-A297 PolarHBondContact O-N 3.34Å; A297-V299 PolarHBondContact O-N 2.96Å
298D39.9Very low61.3Low118 Ų118114.7 Ų114.763%0.63166%0.663SS**  trans-64.6124.5171.2-169.4-7.4000107.4T296 D300 A301T296-D298 PolarHBondContact O-N 2.99Å; D298-D300 PolarHBondContact O-N 3.01Å; D298-D300 PolarHBondContact OD1-N 3.46Å; D298-A301 HydrophobicContact CB-CB 4.32Å; D298-A301 WeakPolarHBondContact O-CB 3.49Å; D298-A301 PolarHBondContact O-N 3.26Å
299V54.6Low62.9Low152 Ų152113.1 Ų113.192%0.92166%0.663SS**THydrogen-bonded Turntrans-69.8-14.2-175.5178.50000110.9A297A297-V299 PolarHBondContact O-N 2.96Å
300D52.7Low64.8Low120 Ų120110 Ų11064%0.64265%0.646SS**THydrogen-bonded Turntrans-103.920.6173.2-146.721.3000112.7D298 I302D298-D300 PolarHBondContact O-N 3.01Å; D298-D300 PolarHBondContact OD1-N 3.46Å; D300-I302 PolarHBondContact O-N 3.39Å
301A58.3Low66.9Low75 Ų75102 Ų10262%0.6261%0.605SS**  trans-73.466.7166.800000110.7D298 E303D298-A301 HydrophobicContact CB-CB 4.32Å; D298-A301 WeakPolarHBondContact O-CB 3.49Å; D298-A301 PolarHBondContact O-N 3.26Å; A301-E303 PolarHBondContact O-N 3Å
302I68.4Low68.9Low91 Ų91103.3 Ų103.347%0.46760%0.603SS.*PPolyproline II helixtrans-50120.2-174.8-60.6155.2000110.5D300 P304 E323D300-I302 PolarHBondContact O-N 3.39Å; I302-P304 WeakPolarHBondContact O-CD 3.38Å; I302-E323 HydrophobicContact CG2-CB 4.02Å; I302-E323 HydrophobicContact CG2-CG 4Å
303E72.6Confident70.5Confident144 Ų144103.8 Ų103.867%0.67360%0.603SS**PPolyproline II helixtrans-63.8122.1-179.6-173.8164.4-155.700110.4A301A301-E303 PolarHBondContact O-N 3Å
304P90.6Very high72.5Confident106 Ų106103.1 Ų103.169%0.68860%0.596SS**BIsolated β-bridgetrans-77.5126.3-176.129.9-33.4000110.9I302 H322I302-P304 WeakPolarHBondContact O-CD 3.38Å; P304-H322 VanDerWaalsContact CA-O 3.25Å; P304-H322 WeakPolarHBondContact CA-O 3.26Å
305C93.6Very high74.6Confident1 Ų196 Ų961%0.00756%0.56CS.*  trans-111.3136.4-178.962.50000112.2D310 C317 H322 E323 C324C305-D310 HydrophobicContact CB-CB 3.99Å; C305-C317 HydrophobicContact CB-CB 3.76Å; C305-C317 WeakPolarHBondContact CB-SG 2.98Å; C305-C317 PolarHBondContact O-SG 2.04Å; C305-C317 WeakPolarHBondContact SG-CA 3.28Å; C305-C317 WeakPolarHBondContact SG-CB 3.05Å; C305-C317 CovalentContact SG-SG 2.03Å; C305-C317 PolarHBondContact SG-SG 3.47Å; C305-H322 PolarHBondContact N-O 3.39Å; C305-H322 VanDerWaalsContact O-CA 3.28Å; C305-H322 WeakPolarHBondContact O-CA 3.45Å; C305-H322 WeakPolarHBondContact O-CB 3.04Å; C305-H322 PolarHBondContact O-CD2 3.35Å; C305-H322 VanDerWaalsContact SG-C 3.5Å; C305-E323 PolarHBondContact SG-N 3.07Å; C305-E323 VanDerWaalsContact SG-N 3.42Å; C305-C324 PolarHBondContact SG-N 3.48Å
306D93.4Very high77Confident109 Ų10988.9 Ų88.958%0.58352%0.523SS*.SBendtrans-98.8-24.7171.6-81.9-18.3000111.4D310 L319 H322D306-D310 PolarHBondContact N-OD2 2.89Å; D306-L319 WeakPolarHBondContact O-CD2 3.07Å; D306-H322 IonicContact OD1-CD2 3.19Å; D306-H322 PolarHBondContact OD1-CD2 3.36Å
307H92.3Very high79.6Confident119 Ų11982.7 Ų82.755%0.55149%0.485SS*.SBendtrans-134.8159.7-176.2-56.186.6000112.3L309 D310 C317H307-L309 PolarHBondContact O-N 2.94Å; H307-D310 PolarHBondContact N-OD2 3.45Å; H307-D310 IonicContact ND1-OD2 3.26Å; H307-D310 WeakPolarHBondContact O-CB 3.42Å; H307-D310 PolarHBondContact O-N 2.83Å; H307-C317 WeakPolarHBondContact O-CB 3.19Å
308H91.7Very high81.8Confident26 Ų2680 Ų8012%0.1246%0.457CS..G310 helixtrans-63.3-26.8176.5-68.5-36.4000113.8D310 C317 D337 M340H308-D310 VanDerWaalsContact C-N 3.33Å; H308-C317 PolarHBondContact CE1-O 2.94Å; H308-C317 PolarHBondContact ND1-N 3.2Å; H308-C317 PolarHBondContact ND1-O 2.86Å; H308-C317 VanDerWaalsContact ND1-O 3.14Å; H308-D337 HydrophobicContact CB-CB 4.31Å; H308-D337 VanDerWaalsContact CB-OD2 3.26Å; H308-D337 WeakPolarHBondContact CB-OD2 3.08Å; H308-D337 IonicContact CD2-OD2 2.71Å; H308-D337 PolarHBondContact CD2-OD2 2.7Å; H308-D337 VanDerWaalsContact CD2-OD2 3.26Å; H308-D337 IonicContact CG-OD2 3.46Å; H308-M340 WeakPolarHBondContact CE1-CE 3.08Å; H308-M340 WeakPolarHBondContact NE2-CE 3.49Å
309L90.8Very high84.3Confident155 Ų15578.5 Ų78.581%0.81245%0.449SS*.G310 helixtrans-77.4-15.9179-59.3177.5000113.9H307 C311H307-L309 PolarHBondContact O-N 2.94Å; L309-C311 PolarHBondContact O-N 3.19Å
310D92.7Very high86Confident77 Ų7781.5 Ų81.541%0.41244%0.443SS..G310 helixtrans-74.6-14.5178.7-48.2-16.5000111.2C305 D306 H307 H308C305-D310 HydrophobicContact CB-CB 3.99Å; D306-D310 PolarHBondContact N-OD2 2.89Å; H307-D310 PolarHBondContact N-OD2 3.45Å; H307-D310 IonicContact ND1-OD2 3.26Å; H307-D310 WeakPolarHBondContact O-CB 3.42Å; H307-D310 PolarHBondContact O-N 2.83Å; H308-D310 VanDerWaalsContact C-N 3.33Å
311C92.4Very high88Confident15 Ų1580.3 Ų80.310%0.10143%0.434CS..SBendtrans-96.7143.5-175.2-63.20000112.8L309 C317 C324L309-C311 PolarHBondContact O-N 3.19Å; C311-C317 VanDerWaalsContact SG-CA 3.52Å; C311-C317 PolarHBondContact SG-N 3.49Å; C311-C324 WeakPolarHBondContact CA-SG 3.26Å; C311-C324 HydrophobicContact CB-CB 3.83Å; C311-C324 WeakPolarHBondContact CB-SG 3.42Å; C311-C324 VanDerWaalsContact SG-CA 3.51Å; C311-C324 WeakPolarHBondContact SG-CB 3.42Å; C311-C324 CovalentContact SG-SG 2.04Å; C311-C324 PolarHBondContact SG-SG 3.26Å
312L89.5Confident89.7Confident136 Ų13680.6 Ų80.671%0.71242%0.423SS*.PPolyproline II helixtrans-62.4147.1175.3-63.9177.2000112S315L312-S315 PolarHBondContact N-OG 2.94Å; L312-S315 WeakPolarHBondContact O-CA 3.37Å; L312-S315 WeakPolarHBondContact O-CB 2.97Å; L312-S315 PolarHBondContact O-N 3.01Å; L312-S315 PolarHBondContact O-OG 2.8Å
313P86.8Confident90.9Very high130 Ų13079.3 Ų79.384%0.84442%0.415SS*.THydrogen-bonded Turntrans-49139.2176.4-2935.7000113.5
314G84.4Confident91.9Very high43 Ų4374.3 Ų74.344%0.44340%0.395SS..THydrogen-bonded Turntrans85-11.2-170.500000114.2P326G314-P326 WeakPolarHBondContact O-CA 3.3Å
315S92.1Very high92Very high22 Ų2271.9 Ų71.915%0.15437%0.373CS..EExtended strand (participates in β ladder)trans-121159.7169.876.40000111.6L312 K325 C339L312-S315 PolarHBondContact N-OG 2.94Å; L312-S315 WeakPolarHBondContact O-CA 3.37Å; L312-S315 WeakPolarHBondContact O-CB 2.97Å; L312-S315 PolarHBondContact O-N 3.01Å; L312-S315 PolarHBondContact O-OG 2.8Å; S315-K325 CarbonylContact C-O 3.56Å; S315-K325 WeakPolarHBondContact CA-O 3.31Å; S315-C339 WeakPolarHBondContact O-CB 3.47Å
316C94.1Very high92Very high0 Ų076.7 Ų76.70%041%0.405CS..EExtended strand (participates in β ladder)trans-151139.1-173.3-1570000109D318 K325 H327 C339 M340C316-D318 PolarHBondContact O-N 2.81Å; C316-K325 PolarHBondContact N-O 3.2Å; C316-K325 PolarHBondContact O-N 2.8Å; C316-K325 VanDerWaalsContact O-N 3.11Å; C316-H327 HydrophobicContact CB-CB 4.17Å; C316-C339 VanDerWaalsContact CA-SG 3.58Å; C316-C339 HydrophobicContact CB-CB 3.54Å; C316-C339 VanDerWaalsContact CB-O 3.25Å; C316-C339 WeakPolarHBondContact CB-O 3.12Å; C316-C339 WeakPolarHBondContact CB-SG 3.44Å; C316-C339 WeakPolarHBondContact SG-CB 3.19Å; C316-C339 CovalentContact SG-SG 2.04Å; C316-C339 PolarHBondContact SG-SG 2.98Å; C316-M340 VanDerWaalsContact SG-CG 3.58Å; C316-M340 PolarHBondContact SG-N 2.97Å
317C94.9Very high91.8Very high3 Ų373.8 Ų73.82%0.0239%0.387CS..EExtended strand (participates in β ladder)trans-66.7126.5-171.3-171.60000113.2C305 H307 H308 C311 L319C305-C317 HydrophobicContact CB-CB 3.76Å; C305-C317 WeakPolarHBondContact CB-SG 2.98Å; C305-C317 PolarHBondContact O-SG 2.04Å; C305-C317 WeakPolarHBondContact SG-CA 3.28Å; C305-C317 WeakPolarHBondContact SG-CB 3.05Å; C305-C317 CovalentContact SG-SG 2.03Å; C305-C317 PolarHBondContact SG-SG 3.47Å; H307-C317 WeakPolarHBondContact O-CB 3.19Å; H308-C317 PolarHBondContact CE1-O 2.94Å; H308-C317 PolarHBondContact ND1-N 3.2Å; H308-C317 PolarHBondContact ND1-O 2.86Å; H308-C317 VanDerWaalsContact ND1-O 3.14Å; C311-C317 VanDerWaalsContact SG-CA 3.52Å; C311-C317 PolarHBondContact SG-N 3.49Å; C317-L319 HydrophobicContact CB-CD2 4.23Å; C317-L319 PolarHBondContact O-N 3.07Å
318D92.9Very high91.7Very high37 Ų3773.5 Ų73.520%0.19839%0.39CS..EExtended strand (participates in β ladder)trans-84.185.7168.7-169.9-1.5000109.6C316 R320 Q321 H322 E323 K325C316-D318 PolarHBondContact O-N 2.81Å; D318-R320 PolarHBondContact O-N 3.06Å; D318-Q321 PolarHBondContact O-N 3.02Å; D318-Q321 PolarHBondContact OD2-NE2 3.14Å; D318-H322 PolarHBondContact O-N 3.28Å; D318-E323 WeakPolarHBondContact CB-O 3.31Å; D318-E323 PolarHBondContact N-O 3.43Å; D318-K325 HydrophobicContact CB-CD 4.41Å; D318-K325 IonicContact OD2-NZ 3.59Å; D318-K325 PolarHBondContact OD2-NZ 3.06Å
319L90.8Very high91.7Very high87 Ų8775.3 Ų75.346%0.45540%0.396SS..THydrogen-bonded Turntrans-54.48.4-177.3-56.2174.2000116.4D306 C317D306-L319 WeakPolarHBondContact O-CD2 3.07Å; C317-L319 HydrophobicContact CB-CD2 4.23Å; C317-L319 PolarHBondContact O-N 3.07Å
320R91.8Very high91.8Very high215 Ų21568.5 Ų68.581%0.81136%0.364SS*.THydrogen-bonded Turntrans-105.5-36.1172.6-72.4172.4163.6-155.5-6.2112.5D318D318-R320 PolarHBondContact O-N 3.06Å
321Q93.6Very high91.7Very high95 Ų9569.4 Ų69.444%0.44437%0.368SS..THydrogen-bonded Turntrans-102.8-16.9175.6-68.194.3-96.700112.6D318 E323D318-Q321 PolarHBondContact O-N 3.02Å; D318-Q321 PolarHBondContact OD2-NE2 3.14Å; Q321-E323 HydrophobicContact CB-CB 4.36Å; Q321-E323 VanDerWaalsContact CB-CD 3.48Å; Q321-E323 HydrophobicContact CB-CG 3.9Å; Q321-E323 VanDerWaalsContact CB-OE2 3.31Å; Q321-E323 WeakPolarHBondContact CB-OE2 3.19Å
322H94.1Very high91.5Very high82 Ų8273.2 Ų73.238%0.3839%0.387SS..THydrogen-bonded Turntrans63.742.2-174.1-5475.2000111.3P304 C305 D306 D318P304-H322 VanDerWaalsContact CA-O 3.25Å; P304-H322 WeakPolarHBondContact CA-O 3.26Å; C305-H322 PolarHBondContact N-O 3.39Å; C305-H322 VanDerWaalsContact O-CA 3.28Å; C305-H322 WeakPolarHBondContact O-CA 3.45Å; C305-H322 WeakPolarHBondContact O-CB 3.04Å; C305-H322 PolarHBondContact O-CD2 3.35Å; C305-H322 VanDerWaalsContact SG-C 3.5Å; D306-H322 IonicContact OD1-CD2 3.19Å; D306-H322 PolarHBondContact OD1-CD2 3.36Å; D318-H322 PolarHBondContact O-N 3.28Å
323E94.4Very high91.7Very high64 Ų6470.9 Ų70.930%0.29938%0.375SS..EExtended strand (participates in β ladder)trans-128.3130.2-177.4-63.3163172.400109.2I302 C305 D318 Q321 K325I302-E323 HydrophobicContact CG2-CB 4.02Å; I302-E323 HydrophobicContact CG2-CG 4Å; C305-E323 PolarHBondContact SG-N 3.07Å; C305-E323 VanDerWaalsContact SG-N 3.42Å; D318-E323 WeakPolarHBondContact CB-O 3.31Å; D318-E323 PolarHBondContact N-O 3.43Å; Q321-E323 HydrophobicContact CB-CB 4.36Å; Q321-E323 VanDerWaalsContact CB-CD 3.48Å; Q321-E323 HydrophobicContact CB-CG 3.9Å; Q321-E323 VanDerWaalsContact CB-OE2 3.31Å; Q321-E323 WeakPolarHBondContact CB-OE2 3.19Å; E323-K325 PolarHBondContact O-N 3.03Å; E323-K325 VanDerWaalsContact OE2-CE 3.3Å; E323-K325 WeakPolarHBondContact OE2-CE 3.48Å; E323-K325 IonicContact OE2-NZ 3.88Å; E323-K325 PolarHBondContact OE2-NZ 3.11Å
324C94.1Very high91.9Very high38 Ų3869.7 Ų69.726%0.25736%0.357SS..EExtended strand (participates in β ladder)trans-67.3127.3172.7-660000110.9C305 C311C305-C324 PolarHBondContact SG-N 3.48Å; C311-C324 WeakPolarHBondContact CA-SG 3.26Å; C311-C324 HydrophobicContact CB-CB 3.83Å; C311-C324 WeakPolarHBondContact CB-SG 3.42Å; C311-C324 VanDerWaalsContact SG-CA 3.51Å; C311-C324 WeakPolarHBondContact SG-CB 3.42Å; C311-C324 CovalentContact SG-SG 2.04Å; C311-C324 PolarHBondContact SG-SG 3.26Å
325K92.6Very high92.1Very high55 Ų5567.7 Ų67.724%0.23934%0.336CS..EExtended strand (participates in β ladder)trans-130.5145.3178-66.6-168.4-17471.90112.4S315 C316 D318 E323 H327S315-K325 CarbonylContact C-O 3.56Å; S315-K325 WeakPolarHBondContact CA-O 3.31Å; C316-K325 PolarHBondContact N-O 3.2Å; C316-K325 PolarHBondContact O-N 2.8Å; C316-K325 VanDerWaalsContact O-N 3.11Å; D318-K325 HydrophobicContact CB-CD 4.41Å; D318-K325 IonicContact OD2-NZ 3.59Å; D318-K325 PolarHBondContact OD2-NZ 3.06Å; E323-K325 PolarHBondContact O-N 3.03Å; E323-K325 VanDerWaalsContact OE2-CE 3.3Å; E323-K325 WeakPolarHBondContact OE2-CE 3.48Å; E323-K325 IonicContact OE2-NZ 3.88Å; E323-K325 PolarHBondContact OE2-NZ 3.11Å; K325-H327 PolarHBondContact O-CD2 3.38Å; K325-H327 PolarHBondContact O-N 3.33Å
326P92.4Very high92Very high102 Ų10272.2 Ų72.266%0.66235%0.351SS*.EExtended strand (participates in β ladder)trans-64.4130.7173.827-33.9000110.7G314G314-P326 WeakPolarHBondContact O-CA 3.3Å
327H88.8Confident91.8Very high48 Ų4874.5 Ų74.522%0.22236%0.363CS..  trans-135.583-170.7-89.9-50.8000113.5C316 K325 R329 M340C316-H327 HydrophobicContact CB-CB 4.17Å; K325-H327 PolarHBondContact O-CD2 3.38Å; K325-H327 PolarHBondContact O-N 3.33Å; H327-R329 PolarHBondContact O-N 3.38Å; H327-M340 CarbonylContact O-C 3.58Å; H327-M340 VanDerWaalsContact O-O 3.06Å
328N91.3Very high91.6Very high113 Ų11377.7 Ų77.760%0.60438%0.38SS*.  trans-91.683.8178.4-61.4-35.6000111.7E342N328-E342 HydrophobicContact CB-CB 4.26Å
329R92.1Very high91.6Very high64 Ų6477.4 Ų77.424%0.24238%0.38CS..BIsolated β-bridgetrans-93.7102.6168.2-57.9177.4-166.8159.820.7109.9H327 N333 K334 M340 C341 E342 C364H327-R329 PolarHBondContact O-N 3.38Å; R329-N333 HydrophobicContact CB-CB 3.96Å; R329-K334 WeakPolarHBondContact CD-O 3.33Å; R329-K334 PolarHBondContact NH1-O 3.43Å; R329-M340 WeakPolarHBondContact CB-O 3.45Å; R329-M340 WeakPolarHBondContact CD-O 3.17Å; R329-M340 WeakPolarHBondContact CG-O 3.38Å; R329-M340 VanDerWaalsContact CZ-SD 3.54Å; R329-M340 PolarHBondContact N-O 3.19Å; R329-M340 PolarHBondContact NH1-SD 3Å; R329-M340 PolarHBondContact NH2-SD 3.35Å; R329-C341 WeakPolarHBondContact O-CA 3.5Å; R329-E342 PolarHBondContact O-N 3.29Å; R329-E342 VanDerWaalsContact O-N 3.13Å; R329-C364 PolarHBondContact O-SG 3.35Å
330G91.3Very high91.7Very high13 Ų1373.8 Ų73.813%0.13436%0.361CS..  trans-64.2176.3175.300000114.8N333 E342G330-N333 VanDerWaalsContact O-CB 3.27Å; G330-N333 WeakPolarHBondContact O-CB 3.46Å; G330-N333 PolarHBondContact O-N 3.31Å; G330-N333 PolarHBondContact O-ND2 3.39Å; G330-E342 WeakPolarHBondContact CA-OE2 3.25Å
331L91.8Very high91.7Very high95 Ų9564.2 Ų64.250%0.49733%0.327SS..THydrogen-bonded Turntrans-39137.5-172.3-17458.1000115.5N333 F345 V366L331-N333 PolarHBondContact O-N 2.64Å; L331-F345 HydrophobicContact CB-CD1 4.29Å; L331-F345 HydrophobicContact CB-CE1 3.7Å; L331-F345 HydrophobicContact CB-CE2 4.49Å; L331-F345 HydrophobicContact CB-CZ 3.82Å; L331-F345 HydrophobicContact CD1-CD1 3.97Å; L331-F345 HydrophobicContact CD1-CE1 3.87Å; L331-F345 HydrophobicContact CD2-CE1 4.49Å; L331-F345 HydrophobicContact CG-CE1 4.21Å; L331-V366 HydrophobicContact CD1-CG2 4.35Å
332N88.9Confident91.7Very high95 Ų9563.8 Ų63.851%0.50833%0.325SS..THydrogen-bonded Turntrans65.2-0.7174.6-160.413000115.4R363 C364N332-R363 WeakPolarHBondContact O-CD 3.49Å; N332-R363 PolarHBondContact O-NH1 2.95Å; N332-R363 VanDerWaalsContact OD1-CD 3.25Å; N332-R363 WeakPolarHBondContact OD1-CD 3.3Å; N332-R363 PolarHBondContact OD1-NH1 3.32Å; N332-C364 WeakPolarHBondContact CA-O 3.34Å; N332-C364 PolarHBondContact N-O 3.39Å
333N91.9Very high91.5Very high88 Ų8868 Ų6847%0.47135%0.345SS..  trans-67161.1168.9-77.2-63.5000112.1R329 G330 L331 R363 C364R329-N333 HydrophobicContact CB-CB 3.96Å; G330-N333 VanDerWaalsContact O-CB 3.27Å; G330-N333 WeakPolarHBondContact O-CB 3.46Å; G330-N333 PolarHBondContact O-N 3.31Å; G330-N333 PolarHBondContact O-ND2 3.39Å; L331-N333 PolarHBondContact O-N 2.64Å; N333-R363 CarbonylContact O-C 3.56Å; N333-R363 WeakPolarHBondContact O-CA 3.4Å; N333-R363 WeakPolarHBondContact O-CB 3.42Å; N333-C364 PolarHBondContact O-N 3.24Å
334K90.9Very high91.2Very high105 Ų10567.9 Ų67.946%0.45736%0.361SS..EExtended strand (participates in β ladder)trans-87.1130.1-179.4-58.4175.2-175.3171.80111.5R329 R361 G362R329-K334 WeakPolarHBondContact CD-O 3.33Å; R329-K334 PolarHBondContact NH1-O 3.43Å; K334-R361 HydrophobicContact CB-CG 4.28Å; K334-G362 WeakPolarHBondContact CA-O 3.37Å
335C90.5Very high91.1Very high0 Ų068.1 Ų68.10%036%0.357CS..EExtended strand (participates in β ladder)trans-124.5177.8-179.958.10000110.9M340 C347 R361 G362 R363C335-M340 HydrophobicContact CB-CB 4.14Å; C335-C347 HydrophobicContact CB-CB 3.81Å; C335-C347 WeakPolarHBondContact CB-SG 3.41Å; C335-C347 WeakPolarHBondContact SG-CA 3.13Å; C335-C347 WeakPolarHBondContact SG-CB 3.11Å; C335-C347 CovalentContact SG-SG 2.02Å; C335-C347 PolarHBondContact SG-SG 2.95Å; C335-R361 VanDerWaalsContact O-CG 3.24Å; C335-R361 WeakPolarHBondContact O-CG 3.47Å; C335-G362 PolarHBondContact N-O 3.36Å; C335-G362 VanDerWaalsContact N-O 3.13Å; C335-G362 PolarHBondContact O-N 3.43Å; C335-R363 VanDerWaalsContact SG-CA 3.53Å; C335-R363 PolarHBondContact SG-N 2.74Å; C335-R363 VanDerWaalsContact SG-N 3.37Å
336Y89.3Confident91Very high118 Ų11871.9 Ų71.946%0.46337%0.37SS..SBendtrans-130.3-24.9168.3-65.4-72.7000112.2M340 R361Y336-M340 HydrophobicContact CD2-CE 4.09Å; Y336-M340 HydrophobicContact CD2-SD 3.89Å; Y336-M340 HydrophobicContact CG-SD 4.43Å; Y336-R361 HydrophobicContact CD1-CB 4.04Å; Y336-R361 HydrophobicContact CD1-CG 3.88Å; Y336-R361 HydrophobicContact CE1-CB 3.6Å; Y336-R361 HydrophobicContact CE1-CG 3.43Å; Y336-R361 VanDerWaalsContact CE1-CG 3.43Å; Y336-R361 WeakPolarHBondContact OH-CD 3.48Å
337D90.6Very high90.9Very high48 Ų4867.2 Ų67.226%0.25734%0.339SS..SBendtrans-141.4160.1-178.1-155.3-55.9000108.1H308 M340 C347H308-D337 HydrophobicContact CB-CB 4.31Å; H308-D337 VanDerWaalsContact CB-OD2 3.26Å; H308-D337 WeakPolarHBondContact CB-OD2 3.08Å; H308-D337 IonicContact CD2-OD2 2.71Å; H308-D337 PolarHBondContact CD2-OD2 2.7Å; H308-D337 VanDerWaalsContact CD2-OD2 3.26Å; H308-D337 IonicContact CG-OD2 3.46Å; D337-M340 HydrophobicContact CB-CG 4.45Å; D337-M340 WeakPolarHBondContact O-CB 3.37Å; D337-M340 PolarHBondContact O-N 3.11Å; D337-C347 VanDerWaalsContact C-CB 3.48Å; D337-C347 WeakPolarHBondContact O-CB 3.49Å
338D90.8Very high90.8Very high70 Ų7066 Ų6637%0.37433%0.333SS..G310 helixtrans-64.9-37.6-179.8-89.117.4000111.3M340 C341 R346 C347D338-M340 PolarHBondContact O-N 3.08Å; D338-C341 WeakPolarHBondContact O-CB 3.25Å; D338-C341 PolarHBondContact O-N 3.14Å; D338-R346 WeakPolarHBondContact OD2-CB 3.04Å; D338-R346 VanDerWaalsContact OD2-CD 3.31Å; D338-R346 WeakPolarHBondContact OD2-CD 3.49Å; D338-R346 WeakPolarHBondContact OD2-CG 3.35Å; D338-R346 IonicContact OD2-NE 3.18Å; D338-C347 WeakPolarHBondContact OD1-CA 3.05Å; D338-C347 VanDerWaalsContact OD1-CB 3.26Å; D338-C347 WeakPolarHBondContact OD1-CB 3.43Å; D338-C347 PolarHBondContact OD1-N 3.47Å
339C91.9Very high90.5Very high30 Ų3060.8 Ų60.820%0.20331%0.306CS..G310 helixtrans-65.3-7.517762.30000114.6S315 C316 C341S315-C339 WeakPolarHBondContact O-CB 3.47Å; C316-C339 VanDerWaalsContact CA-SG 3.58Å; C316-C339 HydrophobicContact CB-CB 3.54Å; C316-C339 VanDerWaalsContact CB-O 3.25Å; C316-C339 WeakPolarHBondContact CB-O 3.12Å; C316-C339 WeakPolarHBondContact CB-SG 3.44Å; C316-C339 WeakPolarHBondContact SG-CB 3.19Å; C316-C339 CovalentContact SG-SG 2.04Å; C316-C339 PolarHBondContact SG-SG 2.98Å; C339-C341 VanDerWaalsContact C-N 3.31Å
340M92.4Very high89.7Confident12 Ų1262.5 Ų62.56%0.05932%0.315CS..G310 helixtrans-82.8-8.9171-61.4-165.6-17900113.5H308 C316 H327 R329 C335 Y336 D337 D338H308-M340 WeakPolarHBondContact CE1-CE 3.08Å; H308-M340 WeakPolarHBondContact NE2-CE 3.49Å; C316-M340 VanDerWaalsContact SG-CG 3.58Å; C316-M340 PolarHBondContact SG-N 2.97Å; H327-M340 CarbonylContact O-C 3.58Å; H327-M340 VanDerWaalsContact O-O 3.06Å; R329-M340 WeakPolarHBondContact CB-O 3.45Å; R329-M340 WeakPolarHBondContact CD-O 3.17Å; R329-M340 WeakPolarHBondContact CG-O 3.38Å; R329-M340 VanDerWaalsContact CZ-SD 3.54Å; R329-M340 PolarHBondContact N-O 3.19Å; R329-M340 PolarHBondContact NH1-SD 3Å; R329-M340 PolarHBondContact NH2-SD 3.35Å; C335-M340 HydrophobicContact CB-CB 4.14Å; Y336-M340 HydrophobicContact CD2-CE 4.09Å; Y336-M340 HydrophobicContact CD2-SD 3.89Å; Y336-M340 HydrophobicContact CG-SD 4.43Å; D337-M340 HydrophobicContact CB-CG 4.45Å; D337-M340 WeakPolarHBondContact O-CB 3.37Å; D337-M340 PolarHBondContact O-N 3.11Å; D338-M340 PolarHBondContact O-N 3.08Å
341C92.7Very high88.6Confident13 Ų1365.3 Ų65.39%0.08832%0.324CS..BIsolated β-bridgetrans-100.4149.7-176.1-63.70000111.4R329 D338 C339 F345 C364R329-C341 WeakPolarHBondContact O-CA 3.5Å; D338-C341 WeakPolarHBondContact O-CB 3.25Å; D338-C341 PolarHBondContact O-N 3.14Å; C339-C341 VanDerWaalsContact C-N 3.31Å; C341-F345 HydrophobicContact CB-CB 4.18Å; C341-C364 VanDerWaalsContact CA-SG 3.51Å; C341-C364 HydrophobicContact CB-CB 3.8Å; C341-C364 WeakPolarHBondContact CB-SG 3.26Å; C341-C364 WeakPolarHBondContact SG-CA 3.3Å; C341-C364 WeakPolarHBondContact SG-CB 3.47Å; C341-C364 CovalentContact SG-SG 2.04Å; C341-C364 PolarHBondContact SG-SG 3.39Å
342E92.8Very high87.3Confident86 Ų8666 Ų6640%0.40232%0.324SS..PPolyproline II helixtrans-65.8153.5169.8172.2176.9-141.400110.8N328 R329 G330 F345N328-E342 HydrophobicContact CB-CB 4.26Å; R329-E342 PolarHBondContact O-N 3.29Å; R329-E342 VanDerWaalsContact O-N 3.13Å; G330-E342 WeakPolarHBondContact CA-OE2 3.25Å; E342-F345 HydrophobicContact CB-CD2 3.87Å; E342-F345 HydrophobicContact CB-CE2 4.08Å; E342-F345 HydrophobicContact CG-CD2 4.25Å; E342-F345 HydrophobicContact CG-CE2 4.04Å; E342-F345 WeakPolarHBondContact O-CD2 3.35Å; E342-F345 PolarHBondContact O-N 2.75Å; E342-F345 VanDerWaalsContact O-N 3.11Å
343E90.4Very high86.4Confident172 Ų17273.5 Ų73.580%0.80435%0.345SS*.THydrogen-bonded Turntrans-53.7138.9-176-64.9178.9-176.700112.4F345E343-F345 VanDerWaalsContact C-N 3.32Å; E343-F345 PolarHBondContact O-N 2.98Å
344G88.6Confident85Confident61 Ų6177.7 Ų77.763%0.62936%0.359SS*.THydrogen-bonded Turntrans83.1-5.1-174.400000115.4P367G344-P367 WeakPolarHBondContact O-CD 3.36Å
345F91.1Very high83.6Confident42 Ų4283.4 Ų83.418%0.18438%0.378CS..  trans-112.3147.6170.6-48.1-67.8000112L331 C341 E342 E343 C364 V365 V366L331-F345 HydrophobicContact CB-CD1 4.29Å; L331-F345 HydrophobicContact CB-CE1 3.7Å; L331-F345 HydrophobicContact CB-CE2 4.49Å; L331-F345 HydrophobicContact CB-CZ 3.82Å; L331-F345 HydrophobicContact CD1-CD1 3.97Å; L331-F345 HydrophobicContact CD1-CE1 3.87Å; L331-F345 HydrophobicContact CD2-CE1 4.49Å; L331-F345 HydrophobicContact CG-CE1 4.21Å; C341-F345 HydrophobicContact CB-CB 4.18Å; E342-F345 HydrophobicContact CB-CD2 3.87Å; E342-F345 HydrophobicContact CB-CE2 4.08Å; E342-F345 HydrophobicContact CG-CD2 4.25Å; E342-F345 HydrophobicContact CG-CE2 4.04Å; E342-F345 WeakPolarHBondContact O-CD2 3.35Å; E342-F345 PolarHBondContact O-N 2.75Å; E342-F345 VanDerWaalsContact O-N 3.11Å; E343-F345 VanDerWaalsContact C-N 3.32Å; E343-F345 PolarHBondContact O-N 2.98Å; F345-C364 HydrophobicContact CB-CB 3.99Å; F345-V365 WeakPolarHBondContact CA-O 3.44Å; F345-V366 HydrophobicContact CD1-CB 4.49Å; F345-V366 HydrophobicContact CD1-CG2 3.65Å; F345-V366 HydrophobicContact CE1-CG2 3.5Å; F345-V366 VanDerWaalsContact CE1-CG2 3.5Å
346R90.6Very high82.4Confident135 Ų13594.7 Ų94.751%0.50942%0.421SS..EExtended strand (participates in β ladder)trans-121.4158.4171.2-68.6-172177.6147.1-0.4112.5D338 Y348 C364 V365 P367D338-R346 WeakPolarHBondContact OD2-CB 3.04Å; D338-R346 VanDerWaalsContact OD2-CD 3.31Å; D338-R346 WeakPolarHBondContact OD2-CD 3.49Å; D338-R346 WeakPolarHBondContact OD2-CG 3.35Å; D338-R346 IonicContact OD2-NE 3.18Å; R346-Y348 HydrophobicContact CB-CD2 4.23Å; R346-Y348 HydrophobicContact CB-CE2 3.7Å; R346-Y348 WeakPolarHBondContact O-CD2 3.48Å; R346-Y348 PolarHBondContact O-N 3.47Å; R346-C364 CarbonylContact O-C 3.36Å; R346-C364 VanDerWaalsContact O-CA 3.31Å; R346-C364 WeakPolarHBondContact O-CA 3.21Å; R346-V365 PolarHBondContact N-O 3.38Å; R346-V365 PolarHBondContact O-N 3.31Å; R346-P367 HydrophobicContact CB-CG 4.27Å; R346-P367 HydrophobicContact CG-CG 3.88Å
347C89.9Confident81Confident3 Ų392 Ų922%0.0242%0.416CS..EExtended strand (participates in β ladder)trans-90.182.2-172.8-172.70000113.4C335 D337 D338 R363C335-C347 HydrophobicContact CB-CB 3.81Å; C335-C347 WeakPolarHBondContact CB-SG 3.41Å; C335-C347 WeakPolarHBondContact SG-CA 3.13Å; C335-C347 WeakPolarHBondContact SG-CB 3.11Å; C335-C347 CovalentContact SG-SG 2.02Å; C335-C347 PolarHBondContact SG-SG 2.95Å; D337-C347 VanDerWaalsContact C-CB 3.48Å; D337-C347 WeakPolarHBondContact O-CB 3.49Å; D338-C347 WeakPolarHBondContact OD1-CA 3.05Å; D338-C347 VanDerWaalsContact OD1-CB 3.26Å; D338-C347 WeakPolarHBondContact OD1-CB 3.43Å; D338-C347 PolarHBondContact OD1-N 3.47Å; C347-R363 WeakPolarHBondContact CA-O 3.37Å
348Y87Confident79.4Confident22 Ų2296.8 Ų96.89%0.08645%0.448CS..EExtended strand (participates in β ladder)trans-82.5129.9-179.5-69.3-89.5000113.3R346 K350 G362 R363 V365 V370 F377 T379R346-Y348 HydrophobicContact CB-CD2 4.23Å; R346-Y348 HydrophobicContact CB-CE2 3.7Å; R346-Y348 WeakPolarHBondContact O-CD2 3.48Å; R346-Y348 PolarHBondContact O-N 3.47Å; Y348-K350 PolarHBondContact O-N 3.24Å; Y348-G362 CarbonylContact O-C 3.2Å; Y348-G362 WeakPolarHBondContact O-CA 3.49Å; Y348-R363 PolarHBondContact N-O 3.19Å; Y348-R363 PolarHBondContact O-N 3.47Å; Y348-V365 HydrophobicContact CD2-CB 4.02Å; Y348-V365 HydrophobicContact CD2-CG2 4.13Å; Y348-V370 HydrophobicContact CD1-CG1 4.19Å; Y348-V370 HydrophobicContact CD2-CG2 3.98Å; Y348-V370 HydrophobicContact CE1-CB 4.45Å; Y348-V370 HydrophobicContact CE1-CG1 4.05Å; Y348-V370 HydrophobicContact CE1-CG2 4.32Å; Y348-V370 HydrophobicContact CE2-CG2 3.7Å; Y348-V370 HydrophobicContact CG-CG2 4.4Å; Y348-F377 VanDerWaalsContact CB-CD1 3.47Å; Y348-F377 HydrophobicContact CD1-CB 4.24Å; Y348-F377 HydrophobicContact CG-CB 4.27Å; Y348-T379 HydrophobicContact CD1-CG2 4.24Å; Y348-T379 HydrophobicContact CE1-CG2 3.67Å
349A85.3Confident78.1Confident4 Ų4104.6 Ų104.63%0.03347%0.472CS..EExtended strand (participates in β ladder)trans-67.5109.4177.200000111.9F351 R360 F377 I378 I380A349-F351 PolarHBondContact O-N 3.05Å; A349-F351 VanDerWaalsContact O-N 3.15Å; A349-R360 HydrophobicContact CB-CB 3.77Å; A349-F377 WeakPolarHBondContact O-CA 3.48Å; A349-I378 PolarHBondContact N-O 3.49Å; A349-I378 PolarHBondContact O-N 3.06Å; A349-I380 HydrophobicContact CB-CD1 4.15Å; A349-I380 HydrophobicContact CB-CG1 3.77Å
350K75.5Confident76.9Confident100 Ų100105.6 Ų105.644%0.43547%0.471SS..EExtended strand (participates in β ladder)trans-60.5121179.7-177.6167.7-176.6165.40111.5Y348 H352 G376 F377Y348-K350 PolarHBondContact O-N 3.24Å; K350-H352 PolarHBondContact O-N 3.48Å; K350-G376 CarbonylContact C-O 3.43Å; K350-G376 WeakPolarHBondContact CA-O 3.43Å; K350-F377 HydrophobicContact CB-CE1 4.2Å
351F67.4Low76.4Confident73 Ų73110.5 Ų110.532%0.3249%0.489SS..PPolyproline II helixtrans-72.4116.7177.8-156.7-80.5000111A349 R355 G375 G376 I378A349-F351 PolarHBondContact O-N 3.05Å; A349-F351 VanDerWaalsContact O-N 3.15Å; F351-R355 HydrophobicContact CZ-CG 4.46Å; F351-G375 WeakPolarHBondContact CB-O 3.5Å; F351-G376 PolarHBondContact N-O 3.04Å; F351-I378 HydrophobicContact CD2-CD1 3.85Å; F351-I378 HydrophobicContact CD2-CG1 4.06Å; F351-I378 HydrophobicContact CE2-CD1 4.04Å
352H65.6Low76.2Confident109 Ų109109.9 Ų109.951%0.50549%0.485SS..PPolyproline II helixtrans-91.8135.5167.7-82.9-104000109.7K350 K354 V357K350-H352 PolarHBondContact O-N 3.48Å; H352-K354 CarbonylContact O-C 3.53Å; H352-K354 PolarHBondContact O-N 2.94Å; H352-V357 HydrophobicContact CB-CG2 4.14Å
353R69.5Low76.1Confident252 Ų252109.3 Ų109.395%0.95148%0.479SS*.SBendtrans-54.4-20.8-178.8-66.7-177.6178.3172.9-1.7114.3
354K61.6Low76.2Confident177 Ų177101.1 Ų101.177%0.7744%0.441SS*.SBendtrans-92.5115.4167.5-64.8-175.5178.3-1760108.5H352 R356H352-K354 CarbonylContact O-C 3.53Å; H352-K354 PolarHBondContact O-N 2.94Å; K354-R356 PolarHBondContact O-N 3Å
355R62.3Low76.3Confident225 Ų22599.1 Ų99.185%0.84942%0.417SS*.SBendtrans-56.7-18.2-174.9-67.4-173.9178.1-169.5-0.9114.8F351 V357F351-R355 HydrophobicContact CZ-CG 4.46Å; R355-V357 PolarHBondContact O-N 3.28Å
356R64.7Low76.3Confident237 Ų23799.4 Ų99.489%0.89442%0.421SS*.  trans-81.194.2178.7-62.7-176-178.8-170.2-0.3112.8K354K354-R356 PolarHBondContact O-N 3Å
357V59.4Low76Confident61 Ų6194.8 Ų94.837%0.3741%0.409SS..  trans-144.1115.1160.5-175.70000108.2H352 R355 R360H352-V357 HydrophobicContact CB-CG2 4.14Å; R355-V357 PolarHBondContact O-N 3.28Å; V357-R360 HydrophobicContact CB-CG 3.77Å; V357-R360 HydrophobicContact CG1-CG 3.64Å
358T58.4Low75.4Confident149 Ų149103.6 Ų103.691%0.91445%0.45SS*.SBendtrans-92.7-11.1-169.445.40000115.5
359R61.9Low74.4Confident234 Ų234106 Ų10688%0.88347%0.47SS*.SBendtrans-139.398.2163.2-73.7-167.8174.5-157.2-2.8108.3R361R359-R361 PolarHBondContact O-N 3.28Å
360R67.3Low73.2Confident50 Ų50107.3 Ų107.319%0.18948%0.477CS..  trans-84.994.3-174.5-74-173.3176.5-155.7-2.3111.2A349 V357 G362A349-R360 HydrophobicContact CB-CB 3.77Å; V357-R360 HydrophobicContact CB-CG 3.77Å; V357-R360 HydrophobicContact CG1-CG 3.64Å; R360-G362 PolarHBondContact O-N 2.96Å; R360-G362 VanDerWaalsContact O-N 3.07Å
361R82.4Confident72.3Confident115 Ų115104.9 Ų104.943%0.43447%0.473SS..  trans-56.4112.2166.9-170.1172.4-172.5176.5-2.2109.9K334 C335 Y336 R359K334-R361 HydrophobicContact CB-CG 4.28Å; C335-R361 VanDerWaalsContact O-CG 3.24Å; C335-R361 WeakPolarHBondContact O-CG 3.47Å; Y336-R361 HydrophobicContact CD1-CB 4.04Å; Y336-R361 HydrophobicContact CD1-CG 3.88Å; Y336-R361 HydrophobicContact CE1-CB 3.6Å; Y336-R361 HydrophobicContact CE1-CG 3.43Å; Y336-R361 VanDerWaalsContact CE1-CG 3.43Å; Y336-R361 WeakPolarHBondContact OH-CD 3.48Å; R359-R361 PolarHBondContact O-N 3.28Å
362G88.6Confident71.8Confident0 Ų0107.9 Ų107.90%049%0.492CS..EExtended strand (participates in β ladder)trans-81.3-170.8-175.900000114.1K334 C335 Y348 R360K334-G362 WeakPolarHBondContact CA-O 3.37Å; C335-G362 PolarHBondContact N-O 3.36Å; C335-G362 VanDerWaalsContact N-O 3.13Å; C335-G362 PolarHBondContact O-N 3.43Å; Y348-G362 CarbonylContact O-C 3.2Å; Y348-G362 WeakPolarHBondContact O-CA 3.49Å; R360-G362 PolarHBondContact O-N 2.96Å; R360-G362 VanDerWaalsContact O-N 3.07Å
363R90.7Very high71.1Confident74 Ų74109.8 Ų109.828%0.27951%0.506SS..EExtended strand (participates in β ladder)trans-131.1148.8163.4-66.8-169.5178.2-127.73.7111.2N332 N333 C335 C347 Y348 V365 F377N332-R363 WeakPolarHBondContact O-CD 3.49Å; N332-R363 PolarHBondContact O-NH1 2.95Å; N332-R363 VanDerWaalsContact OD1-CD 3.25Å; N332-R363 WeakPolarHBondContact OD1-CD 3.3Å; N332-R363 PolarHBondContact OD1-NH1 3.32Å; N333-R363 CarbonylContact O-C 3.56Å; N333-R363 WeakPolarHBondContact O-CA 3.4Å; N333-R363 WeakPolarHBondContact O-CB 3.42Å; C335-R363 VanDerWaalsContact SG-CA 3.53Å; C335-R363 PolarHBondContact SG-N 2.74Å; C335-R363 VanDerWaalsContact SG-N 3.37Å; C347-R363 WeakPolarHBondContact CA-O 3.37Å; Y348-R363 PolarHBondContact N-O 3.19Å; Y348-R363 PolarHBondContact O-N 3.47Å; R363-V365 HydrophobicContact CB-CG2 4.36Å; R363-V365 WeakPolarHBondContact O-CG2 3.39Å; R363-V365 PolarHBondContact O-N 2.93Å; R363-F377 HydrophobicContact CB-CE1 4.47Å
364C92.3Very high70.2Confident0 Ų0105.8 Ų105.80%050%0.498CS..EExtended strand (participates in β ladder)trans-70.8123169.8-56.90000109R329 N332 N333 C341 F345 R346R329-C364 PolarHBondContact O-SG 3.35Å; N332-C364 WeakPolarHBondContact CA-O 3.34Å; N332-C364 PolarHBondContact N-O 3.39Å; N333-C364 PolarHBondContact O-N 3.24Å; C341-C364 VanDerWaalsContact CA-SG 3.51Å; C341-C364 HydrophobicContact CB-CB 3.8Å; C341-C364 WeakPolarHBondContact CB-SG 3.26Å; C341-C364 WeakPolarHBondContact SG-CA 3.3Å; C341-C364 WeakPolarHBondContact SG-CB 3.47Å; C341-C364 CovalentContact SG-SG 2.04Å; C341-C364 PolarHBondContact SG-SG 3.39Å; F345-C364 HydrophobicContact CB-CB 3.99Å; R346-C364 CarbonylContact O-C 3.36Å; R346-C364 VanDerWaalsContact O-CA 3.31Å; R346-C364 WeakPolarHBondContact O-CA 3.21Å
365V91Very high69.7Low20 Ų2099.8 Ų99.812%0.12149%0.486CS..EExtended strand (participates in β ladder)trans-139.1147.6-178.9-155.70000109.4F345 R346 Y348 R363 P367 V370 F377F345-V365 WeakPolarHBondContact CA-O 3.44Å; R346-V365 PolarHBondContact N-O 3.38Å; R346-V365 PolarHBondContact O-N 3.31Å; Y348-V365 HydrophobicContact CD2-CB 4.02Å; Y348-V365 HydrophobicContact CD2-CG2 4.13Å; R363-V365 HydrophobicContact CB-CG2 4.36Å; R363-V365 WeakPolarHBondContact O-CG2 3.39Å; R363-V365 PolarHBondContact O-N 2.93Å; V365-P367 WeakPolarHBondContact O-CD 3.38Å; V365-V370 HydrophobicContact CB-CG2 4.23Å; V365-V370 HydrophobicContact CG1-CG2 4.08Å; V365-F377 HydrophobicContact CG2-CE1 4.2Å; V365-F377 HydrophobicContact CG2-CZ 4.19Å
366V90.6Very high69.4Low47 Ų4790.1 Ų90.129%0.28546%0.457SS..  trans-64.7121.9172.2-178.90000108.2L331 F345 E368 S369L331-V366 HydrophobicContact CD1-CG2 4.35Å; F345-V366 HydrophobicContact CD1-CB 4.49Å; F345-V366 HydrophobicContact CD1-CG2 3.65Å; F345-V366 HydrophobicContact CE1-CG2 3.5Å; F345-V366 VanDerWaalsContact CE1-CG2 3.5Å; V366-E368 VanDerWaalsContact C-N 3.28Å; V366-E368 HydrophobicContact CG1-CB 4.2Å; V366-E368 PolarHBondContact O-N 3.43Å; V366-S369 PolarHBondContact O-N 3.4Å; V366-S369 PolarHBondContact O-OG 2.93Å
367P85.1Confident69.1Low39 Ų3981.9 Ų81.925%0.25343%0.427SS..G310 helixtrans-53.8-41.8-176.9-29.637000113.7G344 R346 V365 S369 V370G344-P367 WeakPolarHBondContact O-CD 3.36Å; R346-P367 HydrophobicContact CB-CG 4.27Å; R346-P367 HydrophobicContact CG-CG 3.88Å; V365-P367 WeakPolarHBondContact O-CD 3.38Å; P367-S369 PolarHBondContact O-N 2.96Å; P367-S369 VanDerWaalsContact O-N 3.17Å; P367-V370 PolarHBondContact O-N 3.43Å
368E76.7Confident69Low188 Ų18882.6 Ų82.688%0.87943%0.428SS*.G310 helixtrans-62.1-22179-57.7178.9168.200113.9V366V366-E368 VanDerWaalsContact C-N 3.28Å; V366-E368 HydrophobicContact CG1-CB 4.2Å; V366-E368 PolarHBondContact O-N 3.43Å
369S65.4Low69Low72 Ų7280.3 Ų80.350%0.50341%0.414SS..G310 helixtrans-85.5-5.4177.472.20000114.1V366 P367 S371V366-S369 PolarHBondContact O-N 3.4Å; V366-S369 PolarHBondContact O-OG 2.93Å; P367-S369 PolarHBondContact O-N 2.96Å; P367-S369 VanDerWaalsContact O-N 3.17Å; S369-S371 PolarHBondContact O-N 2.96Å
370V60.8Low68.7Low32 Ų3276.4 Ų76.419%0.19441%0.41CS..  trans-91.581.5-173.2-171.50000111.4Y348 V365 P367 N372 F377Y348-V370 HydrophobicContact CD1-CG1 4.19Å; Y348-V370 HydrophobicContact CD2-CG2 3.98Å; Y348-V370 HydrophobicContact CE1-CB 4.45Å; Y348-V370 HydrophobicContact CE1-CG1 4.05Å; Y348-V370 HydrophobicContact CE1-CG2 4.32Å; Y348-V370 HydrophobicContact CE2-CG2 3.7Å; Y348-V370 HydrophobicContact CG-CG2 4.4Å; V365-V370 HydrophobicContact CB-CG2 4.23Å; V365-V370 HydrophobicContact CG1-CG2 4.08Å; P367-V370 PolarHBondContact O-N 3.43Å; V370-N372 PolarHBondContact O-N 3.07Å; V370-F377 HydrophobicContact CG1-CB 4.03Å
371S55.4Low68.8Low48 Ų4877.8 Ų77.834%0.33642%0.421SS..  trans-64.6123.9160.3156.60000109.8S369 D373 Q374S369-S371 PolarHBondContact O-N 2.96Å; S371-D373 PolarHBondContact O-N 3.23Å; S371-D373 WeakPolarHBondContact OG-CB 3.29Å; S371-D373 PolarHBondContact OG-N 3.02Å; S371-D373 PolarHBondContact OG-OD2 2.99Å; S371-Q374 PolarHBondContact O-N 3.42Å
372N57Low68.1Low136 Ų13675.8 Ų75.873%0.72742%0.42SS*.G310 helixtrans-57.4-35171.8-94.5-41.7000111.6V370 Q374 G375V370-N372 PolarHBondContact O-N 3.07Å; N372-Q374 VanDerWaalsContact C-N 3.26Å; N372-Q374 PolarHBondContact O-N 3.49Å; N372-G375 PolarHBondContact O-N 3.48Å
373D51.9Low66.9Low150 Ų15080 Ų8080%0.80244%0.443SS*.G310 helixtrans-68.3-23.6-172-36-77.8000112.8S371 G375S371-D373 PolarHBondContact O-N 3.23Å; S371-D373 WeakPolarHBondContact OG-CB 3.29Å; S371-D373 PolarHBondContact OG-N 3.02Å; S371-D373 PolarHBondContact OG-OD2 2.99Å; D373-G375 PolarHBondContact O-N 2.95Å
374Q50.7Low65.5Low168 Ų16880.4 Ų80.479%0.78545%0.453SS*.G310 helixtrans-760.7173.9-62.5-167.929.200113.3S371 N372 G376S371-Q374 PolarHBondContact O-N 3.42Å; N372-Q374 VanDerWaalsContact C-N 3.26Å; N372-Q374 PolarHBondContact O-N 3.49Å; Q374-G376 PolarHBondContact O-N 3.18Å
375G50.3Low63.8Low50 Ų5085.4 Ų85.452%0.51548%0.481SS..  trans6122.2162.900000115.1F351 N372 D373F351-G375 WeakPolarHBondContact CB-O 3.5Å; N372-G375 PolarHBondContact O-N 3.48Å; D373-G375 PolarHBondContact O-N 2.95Å
376G56.9Low62Low22 Ų2289.7 Ų89.723%0.22751%0.505CS..  trans-105.1-18.4-166.800000115.4K350 F351 Q374K350-G376 CarbonylContact C-O 3.43Å; K350-G376 WeakPolarHBondContact CA-O 3.43Å; F351-G376 PolarHBondContact N-O 3.04Å; Q374-G376 PolarHBondContact O-N 3.18Å
377F58Low60Low64 Ų6492.8 Ų92.828%0.28152%0.521SS..EExtended strand (participates in β ladder)trans-152.2139.1-159-73.1-61.3000111.7Y348 A349 K350 R363 V365 V370Y348-F377 VanDerWaalsContact CB-CD1 3.47Å; Y348-F377 HydrophobicContact CD1-CB 4.24Å; Y348-F377 HydrophobicContact CG-CB 4.27Å; A349-F377 WeakPolarHBondContact O-CA 3.48Å; K350-F377 HydrophobicContact CB-CE1 4.2Å; R363-F377 HydrophobicContact CB-CE1 4.47Å; V365-F377 HydrophobicContact CG2-CE1 4.2Å; V365-F377 HydrophobicContact CG2-CZ 4.19Å; V370-F377 HydrophobicContact CG1-CB 4.03Å
378I58.4Low58.1Low76 Ų7696.9 Ų96.939%0.3954%0.542SS..EExtended strand (participates in β ladder)trans-126.3144.6168.6-38.9178.9000106.9A349 F351A349-I378 PolarHBondContact N-O 3.49Å; A349-I378 PolarHBondContact O-N 3.06Å; F351-I378 HydrophobicContact CD2-CD1 3.85Å; F351-I378 HydrophobicContact CD2-CG1 4.06Å; F351-I378 HydrophobicContact CE2-CD1 4.04Å
379T57.9Low56.5Low101 Ų10189.3 Ų89.362%0.6251%0.514SS*.  trans-57.8144.7159.4470000109.7Y348Y348-T379 HydrophobicContact CD1-CG2 4.24Å; Y348-T379 HydrophobicContact CE1-CG2 3.67Å
380I55.3Low55.7Low153 Ų15390.9 Ų90.979%0.78552%0.515SS*.  trans-86.70175.2-65.3178.6000108.9A349A349-I380 HydrophobicContact CB-CD1 4.15Å; A349-I380 HydrophobicContact CB-CG1 3.77Å

Retrieved 380 of 380 residues in 197.9 ms (Link to these results)

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