A0A077ZHV7_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZHV7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 326 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
1M42.1Very low31.9Very low222 Ų222140.3 Ų140.3100%1.09465%0.648SS**  0-30.10-75.7-144.3-97.200113.6D3M1-D3 PolarHBondContact O-N 3.29Å
2H29.1Very low32.2Very low141 Ų141136.2 Ų136.265%0.65364%0.64SS**Hα-helixtrans-62.4-37.4179.7-149.646.8000114.2K4 W5 L6H2-K4 PolarHBondContact O-N 3.49Å; H2-W5 PolarHBondContact O-N 3.36Å; H2-L6 PolarHBondContact O-N 3.46Å
3D31.9Very low32.5Very low120 Ų120135.2 Ų135.264%0.64264%0.635SS**Hα-helixtrans-68.9-30.9-179-71-27.9000115.1M1 R7M1-D3 PolarHBondContact O-N 3.29Å; D3-R7 PolarHBondContact O-N 3.44Å
4K31.9Very low32.4Very low176 Ų176127.9 Ų127.977%0.76561%0.613SS**Hα-helixtrans-70.4-35.4177.5-75-172.5178-178.30111.1H2 R7 V8H2-K4 PolarHBondContact O-N 3.49Å; K4-R7 PolarHBondContact O-N 3.45Å; K4-V8 WeakPolarHBondContact O-CG2 3.34Å; K4-V8 PolarHBondContact O-N 3.13Å
5W30.6Very low32.5Very low172 Ų172123.7 Ų123.765%0.65261%0.609SS**Hα-helixtrans-69.4-41.5177.1-168.182.8000111.9H2 R7 V8 S9H2-W5 PolarHBondContact O-N 3.36Å; W5-R7 VanDerWaalsContact C-N 3.32Å; W5-R7 PolarHBondContact O-N 2.87Å; W5-V8 PolarHBondContact O-N 3.37Å; W5-S9 PolarHBondContact O-N 3.08Å; W5-S9 VanDerWaalsContact O-N 3.11Å
6L28.8Very low32.7Very low71 Ų71125.6 Ų125.637%0.37261%0.607SS.*Hα-helixtrans-62-33.2175.3-83.5160.2000113.5H2 R10H2-L6 PolarHBondContact O-N 3.46Å; L6-R10 WeakPolarHBondContact O-CG 3.48Å; L6-R10 PolarHBondContact O-N 3.27Å
7R30Very low32.9Very low190 Ų190127.1 Ų127.172%0.71762%0.618SS**Hα-helixtrans-68.8-39.5173.7-78.3-172.9-160.5-178.34.5112.9D3 K4 W5 R10 L11D3-R7 PolarHBondContact O-N 3.44Å; K4-R7 PolarHBondContact O-N 3.45Å; W5-R7 VanDerWaalsContact C-N 3.32Å; W5-R7 PolarHBondContact O-N 2.87Å; R7-R10 PolarHBondContact O-N 3.01Å; R7-L11 PolarHBondContact O-N 3.04Å; R7-L11 VanDerWaalsContact O-N 3.08Å
8V33.2Very low33.4Very low89 Ų89126.3 Ų126.354%0.53962%0.622SS.*Hα-helixtrans-68.8-41.9-179.9176.70000111K4 W5 R10 L11 V12K4-V8 WeakPolarHBondContact O-CG2 3.34Å; K4-V8 PolarHBondContact O-N 3.13Å; W5-V8 PolarHBondContact O-N 3.37Å; V8-R10 PolarHBondContact O-N 3.21Å; V8-L11 PolarHBondContact O-N 3.3Å; V8-V12 WeakPolarHBondContact O-CG2 3.42Å; V8-V12 PolarHBondContact O-N 3.37Å; V8-V12 VanDerWaalsContact O-N 3.08Å
9S30.7Very low33.5Very low43 Ų43122.9 Ų122.930%0.30162%0.623SS.*Hα-helixtrans-62.6-39.6175.1-63.60000112.8W5 V12 E13W5-S9 PolarHBondContact O-N 3.08Å; W5-S9 VanDerWaalsContact O-N 3.11Å; S9-V12 PolarHBondContact O-N 3.19Å; S9-E13 PolarHBondContact O-N 3.48Å
10R30.9Very low33.6Very low191 Ų191122.4 Ų122.472%0.72163%0.631SS**Hα-helixtrans-67.5-33.5175.7-74.8-177.6-178.1-178.22.2113.3L6 R7 V8 G14L6-R10 WeakPolarHBondContact O-CG 3.48Å; L6-R10 PolarHBondContact O-N 3.27Å; R7-R10 PolarHBondContact O-N 3.01Å; V8-R10 PolarHBondContact O-N 3.21Å; R10-G14 PolarHBondContact O-N 3.26Å
11L32Very low33.5Very low128 Ų128128.6 Ų128.667%0.6765%0.646SS**Hα-helixtrans-68.9-38174.6-81.7161.6000112R7 V8 A15R7-L11 PolarHBondContact O-N 3.04Å; R7-L11 VanDerWaalsContact O-N 3.08Å; V8-L11 PolarHBondContact O-N 3.3Å; L11-A15 WeakPolarHBondContact O-CB 3.46Å; L11-A15 PolarHBondContact O-N 2.87Å
12V35.3Very low32.9Very low91 Ų91121.4 Ų121.455%0.55263%0.629SS**Hα-helixtrans-72.3-38.8177.3175.90000111.8V8 S9 R16V8-V12 WeakPolarHBondContact O-CG2 3.42Å; V8-V12 PolarHBondContact O-N 3.37Å; V8-V12 VanDerWaalsContact O-N 3.08Å; S9-V12 PolarHBondContact O-N 3.19Å; V12-R16 PolarHBondContact O-N 3.18Å; V12-R16 VanDerWaalsContact O-N 3.15Å
13E36.3Very low33Very low124 Ų124121.8 Ų121.858%0.57964%0.641SS**Hα-helixtrans-69.5-37.2171.8-93.6171.2148.300112.6S9 R16 L17S9-E13 PolarHBondContact O-N 3.48Å; E13-R16 PolarHBondContact O-N 2.95Å; E13-L17 WeakPolarHBondContact O-CG 3.47Å; E13-L17 PolarHBondContact O-N 3.44Å
14G31.3Very low32.9Very low32 Ų32127.5 Ų127.533%0.3365%0.654SS.*Hα-helixtrans-61.6-46.3173.400000112.5R10 R16 L17 T18R10-G14 PolarHBondContact O-N 3.26Å; G14-R16 VanDerWaalsContact C-N 3.27Å; G14-R16 PolarHBondContact O-N 2.76Å; G14-L17 PolarHBondContact O-N 3.47Å; G14-T18 WeakPolarHBondContact O-CG2 3.47Å; G14-T18 PolarHBondContact O-N 3.39Å; G14-T18 VanDerWaalsContact O-N 3.13Å; G14-T18 PolarHBondContact O-OG1 3.2Å
15A33.5Very low33Very low66 Ų66130.9 Ų130.955%0.54566%0.662SS.*Hα-helixtrans-65.9-28.4176.700000113.2L11 G19L11-A15 WeakPolarHBondContact O-CB 3.46Å; L11-A15 PolarHBondContact O-N 2.87Å; A15-G19 PolarHBondContact O-N 3.34Å
16R36.2Very low33.1Very low153 Ų153128.8 Ų128.858%0.57767%0.668SS**Hα-helixtrans-73.7-33.9173.7-120.4-174.6-166.1168.318.2113.3V12 E13 G14 H86V12-R16 PolarHBondContact O-N 3.18Å; V12-R16 VanDerWaalsContact O-N 3.15Å; E13-R16 PolarHBondContact O-N 2.95Å; G14-R16 VanDerWaalsContact C-N 3.27Å; G14-R16 PolarHBondContact O-N 2.76Å; R16-H86 PolarHBondContact NH2-CE1 3.44Å; R16-H86 PolarHBondContact NH2-NE2 3.37Å
17L36.3Very low33.3Very low152 Ų152133.9 Ų133.980%0.79669%0.69SS**Hα-helixtrans-83.8-17.2-178.3-71.3167.3000112.9E13 G14E13-L17 WeakPolarHBondContact O-CG 3.47Å; E13-L17 PolarHBondContact O-N 3.44Å; G14-L17 PolarHBondContact O-N 3.47Å
18T40.5Very low33.5Very low112 Ų112133.2 Ų133.269%0.68769%0.692SS**Hα-helixtrans-99.4-9.3177.9550000114.4G14 S20G14-T18 WeakPolarHBondContact O-CG2 3.47Å; G14-T18 PolarHBondContact O-N 3.39Å; G14-T18 VanDerWaalsContact O-N 3.13Å; G14-T18 PolarHBondContact O-OG1 3.2Å; T18-S20 PolarHBondContact O-N 3.45Å
19G35.5Very low33.5Very low62 Ų62135.6 Ų135.664%0.63970%0.702SS**THydrogen-bonded Turntrans-84.612.3-174.600000117.2A15A15-G19 PolarHBondContact O-N 3.34Å
20S36Very low33.7Very low112 Ų112142.8 Ų142.878%0.78373%0.733SS**THydrogen-bonded Turntrans-137.615-172.6-46.10000116T18T18-S20 PolarHBondContact O-N 3.45Å
21R32.2Very low33.8Very low253 Ų253142.2 Ų142.296%0.95574%0.741SS**SBendtrans-111.799.3172.4-84.1-176.1173.5177.9-1.6110.5
22G29.3Very low34.3Very low72 Ų72143 Ų14374%0.74274%0.744SS**  trans136.572.8158.400000115.1
23V31.8Very low34.4Very low148 Ų148146.1 Ų146.190%0.89775%0.753SS**  trans-147.1106.6143.8-174.40000107.7
24R29.6Very low34.4Very low241 Ų241148.9 Ų148.991%0.90977%0.765SS**  trans-63.9138.5168.7-74.6175.7171-176.8-3.7109.4
25R34Very low34.6Very low247 Ų247151.4 Ų151.493%0.93279%0.791SS**  trans-146.7116.3142.5-107.1177.8-174.7-174.90.1110.2
26T30.9Very low34.5Very low127 Ų127151.9 Ų151.978%0.77980%0.803SS**  trans-45.7135.7163.337.60000113.3
27E32.9Very low34.6Very low179 Ų179149.7 Ų149.784%0.83682%0.818SS**  -179.6143.8127-103.9176.9-166.500112.3
28K34.5Very low34.6Very low175 Ų175151.4 Ų151.476%0.76182%0.822SS**  trans85.5115.1159.7-79.3178.7175.6172.50121.1
29N32.9Very low34.6Very low139 Ų139153 Ų15374%0.74383%0.831SS**  trans83.299.4138.3-62-3.5000117.2
30M35Very low34.8Very low194 Ų194156.6 Ų156.696%0.95684%0.841SS**  -156.5127.5120.5-103.1-179.8-74.900108.7
31M34.4Very low34.8Very low179 Ų179154.9 Ų154.988%0.88284%0.841SS**  trans-69168.7172.5-68.6-175.1-174.600110.8
32I41.2Very low35Very low144 Ų144152.1 Ų152.174%0.73884%0.839SS**  trans112.3103.2152.2-55.1175.1000114.9
33E37.7Very low35.7Very low158 Ų158154.1 Ų154.174%0.73884%0.838SS**  trans80.5111.9139.2-67.3171.3-178.700123.6
34Q37.2Very low36.3Very low181 Ų181153 Ų15385%0.84683%0.834SS**  64122.7121.4-63-1735.500122.1
35G34.2Very low36.6Very low85 Ų85145.9 Ų145.988%0.87683%0.827SS**  trans78.1128.1151.400000114.4
36G32.6Very low36.7Very low76 Ų76143 Ų14378%0.78482%0.824SS**  cis138144.327.800000106.6
37A37.3Very low37Very low108 Ų108147.4 Ų147.489%0.89383%0.826SS**  trans86.1106.9173.700000118.8
38Q36.8Very low37.1Very low188 Ų188147.2 Ų147.288%0.87983%0.831SS**  trans-65.6140158.2-65.8168.1-42.100110.9
39V40.2Very low37.1Very low144 Ų144149.4 Ų149.487%0.87384%0.835SS**  trans-140.9124.7145.3-178.50000108.7
40T39.6Very low37Very low139 Ų139150.6 Ų150.685%0.85384%0.84SS**  trans-77.5149.8177.738.40000111.9
41G36.2Very low36.9Very low76 Ų76145.9 Ų145.978%0.78483%0.826SS**  trans174.89716900000112.4
42Q35.8Very low36.6Very low195 Ų195143 Ų14391%0.91182%0.824SS**  trans-68.2151.9171.1-89172.2-49.400112.2
43P44.2Very low35.9Very low113 Ų113141.6 Ų141.673%0.73482%0.824SS**  trans-92.9174.7175.543.2-36.5000110.1
44P44Very low35.4Very low124 Ų124142.8 Ų142.881%0.80583%0.832SS**  -162.9-177.580.540.3-17000117.9
45A36.4Very low35Very low92 Ų92141.7 Ų141.776%0.7683%0.83SS**  trans95.7111.3145.200000120.3
46E37.6Very low34.8Very low188 Ų188142.8 Ų142.888%0.87982%0.824SS**  trans-169.6102.2130-106.1175.8176.700109.2
47R36.9Very low34.4Very low218 Ų218142.8 Ų142.882%0.82382%0.824SS**  52.4101.8102.9-76.1-174.9176.3-176.71.8115
48N33.6Very low33.8Very low175 Ų175146.4 Ų146.494%0.93682%0.823SS**  -145.6125.8129.7-109.1-25000111.7
49R34.3Very low33.2Very low221 Ų221149.7 Ų149.783%0.83483%0.827SS**  trans-88148.1-176.3-75.2173.3164.4179.3-5.1110.2
50L32.8Very low32.4Very low165 Ų165145.8 Ų145.886%0.86482%0.816SS**  trans179.387.5138.7-92.1159.9000105.5
51S32.8Very low31.7Very low95 Ų95144.2 Ų144.266%0.66481%0.811SS**  8388.296.662.20000114.8
52S26.7Very low31.3Very low118 Ų118148.4 Ų148.483%0.82582%0.815SS**  24.1149.4124.8-58.30000120.5
53P27.9Very low30.8Very low114 Ų114143.1 Ų143.174%0.7481%0.805SS**  cis-136.5152.643.337-17.9000118I55P53-I55 PolarHBondContact O-N 3.08Å
54M25.4Very low30.1Very low184 Ų184145.2 Ų145.291%0.90680%0.803SS**  trans-51.8125.9157.5-65.5168.376.400110.1
55I30.3Very low29.3Very low157 Ų157141.9 Ų141.981%0.80578%0.782SS**  trans-118.2121.7149.7-65.9179.4000106.9P53P53-I55 PolarHBondContact O-N 3.08Å
56S28.7Very low29Very low108 Ų108146.7 Ų146.776%0.75578%0.781SS**  trans-51156.9176.148.70000114
57G24.2Very low28.5Very low76 Ų76147.5 Ų147.578%0.78478%0.776SS**  trans-49.6142.9-17500000116.4
58Q25Very low28.2Very low185 Ų185143.3 Ų143.386%0.86477%0.765SS**  trans-143.8111.8144.6-111.7175.4-8.800107.7
59R24.6Very low28Very low257 Ų257138.1 Ų138.197%0.9774%0.74SS**  trans-64.4128.1159-79-179.7175.8-164.6-0.9107.1
60G24.1Very low27.8Very low62 Ų62130.8 Ų130.864%0.63972%0.716SS**  trans103.9115.1167.700000113.6
61S25.3Very low27.6Very low106 Ų106127.6 Ų127.674%0.74170%0.7SS**  trans156.823136.861.80000115.7A63S61-A63 PolarHBondContact O-N 3.36Å
62D26.5Very low27.4Very low163 Ų163128.5 Ų128.587%0.87270%0.697SS**  trans-81.442.2159.8-75-19.8000111.5F64D62-F64 PolarHBondContact O-N 3.25Å
63A26.2Very low27.5Very low84 Ų84127.3 Ų127.369%0.69468%0.68SS**  trans-71.582.6148.500000105.6S61 S65S61-A63 PolarHBondContact O-N 3.36Å; A63-S65 PolarHBondContact O-N 2.94Å
64F29.4Very low27.6Very low158 Ų158131.6 Ų131.669%0.69368%0.682SS**  trans-5790.4158.7-129.8-89.7000105.4D62 R66 V69D62-F64 PolarHBondContact O-N 3.25Å; F64-R66 PolarHBondContact O-N 2.97Å; F64-V69 HydrophobicContact CD1-CG2 3.91Å
65S27.7Very low27.7Very low53 Ų53127.5 Ų127.537%0.37167%0.667SS.*  trans-55.2127.4-165.3165.60000108A63 R67 H68 V69A63-S65 PolarHBondContact O-N 2.94Å; S65-R67 CarbonylContact O-C 3.57Å; S65-R67 PolarHBondContact O-N 3.15Å; S65-R67 PolarHBondContact OG-N 3.23Å; S65-H68 WeakPolarHBondContact O-CA 3.28Å; S65-H68 WeakPolarHBondContact O-CB 3.48Å; S65-H68 PolarHBondContact O-N 3.27Å; S65-V69 PolarHBondContact O-N 3.11Å
66R28.2Very low27.6Very low194 Ų194124.8 Ų124.873%0.73265%0.654SS**Hα-helixtrans-45.7-30.3176-147.6173.6-178.2-175.1-2.3111.3F64 L70F64-R66 PolarHBondContact O-N 2.97Å; R66-L70 WeakPolarHBondContact O-CB 3.49Å; R66-L70 WeakPolarHBondContact O-CD1 3.35Å; R66-L70 VanDerWaalsContact O-CG 3.25Å; R66-L70 WeakPolarHBondContact O-CG 3.39Å; R66-L70 PolarHBondContact O-N 3.35Å
67R28.1Very low27.5Very low205 Ų205125.4 Ų125.477%0.77466%0.656SS**Hα-helixtrans-67.2-36.4172.6-81.2-179.7169.8162.1-2.7115S65 N71S65-R67 CarbonylContact O-C 3.57Å; S65-R67 PolarHBondContact O-N 3.15Å; S65-R67 PolarHBondContact OG-N 3.23Å; R67-N71 WeakPolarHBondContact O-CB 3.44Å; R67-N71 PolarHBondContact O-N 3.1Å
68H30.6Very low27.6Very low130 Ų130128 Ų12860%0.60265%0.651SS**Hα-helixtrans-70.7-38.6178.6-98.998.2000112.4S65 L72S65-H68 WeakPolarHBondContact O-CA 3.28Å; S65-H68 WeakPolarHBondContact O-CB 3.48Å; S65-H68 PolarHBondContact O-N 3.27Å; H68-L72 PolarHBondContact O-N 3.11Å
69V30Very low27.6Very low66 Ų66124.9 Ų124.940%0.465%0.647SS.*Hα-helixtrans-68.8-43175.6-179.60000110.8F64 S65 N71 L72 I73F64-V69 HydrophobicContact CD1-CG2 3.91Å; S65-V69 PolarHBondContact O-N 3.11Å; V69-N71 PolarHBondContact O-N 2.83Å; V69-L72 PolarHBondContact O-N 2.76Å; V69-I73 HydrophobicContact CG1-CD1 4.03Å; V69-I73 WeakPolarHBondContact O-CG1 3.43Å; V69-I73 PolarHBondContact O-N 3.32Å; V69-I73 VanDerWaalsContact O-N 3.17Å
70L29.2Very low27.5Very low66 Ų66118 Ų11835%0.34663%0.628SS.*Hα-helixtrans-66.4-33.2177.1-71.3169000113R66 I73 R74R66-L70 WeakPolarHBondContact O-CB 3.49Å; R66-L70 WeakPolarHBondContact O-CD1 3.35Å; R66-L70 VanDerWaalsContact O-CG 3.25Å; R66-L70 WeakPolarHBondContact O-CG 3.39Å; R66-L70 PolarHBondContact O-N 3.35Å; L70-I73 PolarHBondContact O-N 3.18Å; L70-R74 WeakPolarHBondContact O-CB 3.12Å; L70-R74 WeakPolarHBondContact O-CG 3.17Å; L70-R74 PolarHBondContact O-N 3.33Å
71N29.7Very low27.4Very low99 Ų99126.8 Ų126.853%0.52964%0.642SS.*Hα-helixtrans-71.5-31.3173.9-96.7-1.5000113.6R67 V69 T75R67-N71 WeakPolarHBondContact O-CB 3.44Å; R67-N71 PolarHBondContact O-N 3.1Å; V69-N71 PolarHBondContact O-N 2.83Å; N71-T75 WeakPolarHBondContact O-CG2 3.03Å; N71-T75 PolarHBondContact O-N 3.41Å; N71-T75 PolarHBondContact O-OG1 2.68Å
72L27.8Very low27.3Very low113 Ų113130.8 Ų130.859%0.59264%0.642SS**Hα-helixtrans-70.3-33.5174.3-111.8139.2000112.3H68 V69H68-L72 PolarHBondContact O-N 3.11Å; V69-L72 PolarHBondContact O-N 2.76Å
73I28.2Very low27.1Very low93 Ų93128.3 Ų128.348%0.47764%0.638SS.*Hα-helixtrans-75.8-37.7176.8-65166.8000111.1V69 L70V69-I73 HydrophobicContact CG1-CD1 4.03Å; V69-I73 WeakPolarHBondContact O-CG1 3.43Å; V69-I73 PolarHBondContact O-N 3.32Å; V69-I73 VanDerWaalsContact O-N 3.17Å; L70-I73 PolarHBondContact O-N 3.18Å
74R29.8Very low26.9Very low204 Ų204131.4 Ų131.477%0.7764%0.641SS**Hα-helixtrans-70-28.3178.4-78.5-179.6175.3-178.1-2.1114.3L70L70-R74 WeakPolarHBondContact O-CB 3.12Å; L70-R74 WeakPolarHBondContact O-CG 3.17Å; L70-R74 PolarHBondContact O-N 3.33Å
75T29.2Very low26.4Very low98 Ų98128.9 Ų128.960%0.60164%0.639SS**Hα-helixtrans-94.8-13.1-174.449.20000113.7N71N71-T75 WeakPolarHBondContact O-CG2 3.03Å; N71-T75 PolarHBondContact O-N 3.41Å; N71-T75 PolarHBondContact O-OG1 2.68Å
76N27.9Very low26.2Very low100 Ų100132.7 Ų132.754%0.53565%0.65SS.*  trans-143.289.7177.8-89.3-63.3000110.8L78N76-L78 PolarHBondContact O-N 2.93Å
77P26.4Very low25.8Very low122 Ų122128.5 Ų128.579%0.79265%0.651SS**  trans-74.174.8172.432.2-33.1000109.2
78L25.7Very low25.5Very low129 Ų129124.8 Ų124.868%0.67565%0.65SS**  trans-92.7135.9171-71.6172.3000109.3N76 I80N76-L78 PolarHBondContact O-N 2.93Å; L78-I80 PolarHBondContact O-N 2.7Å
79P24.6Very low25.1Very low121 Ų121121.9 Ų121.979%0.78665%0.649SS**  trans-66.1104.717926.2-32.5000109.7R81P79-R81 PolarHBondContact O-N 3.19Å
80I23.4Very low24.7Very low112 Ų112125 Ų12557%0.57467%0.668SS**  trans-75.9108.8178.2-50.7176000109.1L78 Y82L78-I80 PolarHBondContact O-N 2.7Å; I80-Y82 HydrophobicContact CB-CD2 4.41Å; I80-Y82 HydrophobicContact CB-CE2 3.95Å; I80-Y82 HydrophobicContact CG2-CD1 4.28Å; I80-Y82 HydrophobicContact CG2-CD2 3.59Å; I80-Y82 HydrophobicContact CG2-CE1 3.93Å; I80-Y82 HydrophobicContact CG2-CE2 3.18Å; I80-Y82 HydrophobicContact CG2-CG 4.13Å
81R22.6Very low24.3Very low246 Ų246124.6 Ų124.693%0.92868%0.675SS**  trans-86.7111.7162.8-74.9-177.5173.2-175.3-1.6108.5P79P79-R81 PolarHBondContact O-N 3.19Å
82Y23Very low24Very low191 Ų191124.6 Ų124.675%0.74968%0.683SS**  trans-92.7126.1167.3-70.1-77.9000110I80I80-Y82 HydrophobicContact CB-CD2 4.41Å; I80-Y82 HydrophobicContact CB-CE2 3.95Å; I80-Y82 HydrophobicContact CG2-CD1 4.28Å; I80-Y82 HydrophobicContact CG2-CD2 3.59Å; I80-Y82 HydrophobicContact CG2-CE1 3.93Å; I80-Y82 HydrophobicContact CG2-CE2 3.18Å; I80-Y82 HydrophobicContact CG2-CG 4.13Å
83S21.4Very low23.8Very low111 Ų111123.2 Ų123.278%0.77668%0.675SS**  trans-114.5117.6162.669.10000108.6
84I21.5Very low23.6Very low149 Ų149124.9 Ų124.976%0.76468%0.675SS**  trans-109.2117.7172.6-60.1175.3000106.8
85V19.6Very low23.5Very low105 Ų105122 Ų12264%0.63667%0.665SS**  trans-118.3120.7176178.40000108.2
86H22.7Very low23.3Very low133 Ų133125.8 Ų125.862%0.61667%0.669SS**  trans-150.9131.1161.2-94.5-57.5000113.7R16R16-H86 PolarHBondContact NH2-CE1 3.44Å; R16-H86 PolarHBondContact NH2-NE2 3.37Å
87S20.9Very low23.3Very low106 Ų106125.8 Ų125.874%0.74167%0.668SS**  trans-88132.8-179.762.50000112.3
88V22.3Very low23.2Very low126 Ų126124.1 Ų124.176%0.76466%0.659SS**  trans-143144.3152.8-168.90000108.6
89A20.4Very low23.2Very low70 Ų70125.4 Ų125.458%0.57966%0.659SS**  trans-52.6148.4-166.300000117.1
90T21.7Very low23.3Very low130 Ų130122.2 Ų122.280%0.79864%0.637SS**  trans56.889.3144.354.40000118.2
91A22.4Very low23.4Very low59 Ų59122.8 Ų122.849%0.48864%0.638SS.*  trans-157130156.300000111.6L93A91-L93 PolarHBondContact O-N 3.49Å
92S22.2Very low23.6Very low99 Ų99114.7 Ų114.769%0.69262%0.615SS**  trans-69116.5174.259.20000110.5R94S92-R94 PolarHBondContact O-N 2.78Å
93L24Very low23.8Very low83 Ų83113.3 Ų113.344%0.43562%0.616SS.*  trans-83.5114.5179.3-91.2135.7000111.4A91 Y95 S118 L121A91-L93 PolarHBondContact O-N 3.49Å; L93-Y95 HydrophobicContact CB-CE1 4.48Å; L93-Y95 HydrophobicContact CB-CE2 3.91Å; L93-Y95 HydrophobicContact CD2-CD1 4.31Å; L93-Y95 HydrophobicContact CD2-CE1 3.47Å; L93-Y95 VanDerWaalsContact CD2-CE1 3.47Å; L93-Y95 HydrophobicContact CD2-CE2 4.41Å; L93-Y95 WeakPolarHBondContact CD2-OH 3.46Å; L93-S118 WeakPolarHBondContact CD2-OG 3.48Å; L93-L121 HydrophobicContact CD2-CD1 4.06Å
94R24.9Very low23.9Very low129 Ų129115.9 Ų115.949%0.48761%0.609SS.*EExtended strand (participates in β ladder)trans-102.1127.6160.2-69.5176.8178.7-154.8-9.4108.8S92 S118S92-R94 PolarHBondContact O-N 2.78Å; R94-S118 WeakPolarHBondContact O-CA 3.45Å
95Y26.8Very low24.1Very low142 Ų142112 Ų11256%0.55759%0.594SS**EExtended strand (participates in β ladder)trans-105.1130.2178-57.4-80.3000109.9L93 V116L93-Y95 HydrophobicContact CB-CE1 4.48Å; L93-Y95 HydrophobicContact CB-CE2 3.91Å; L93-Y95 HydrophobicContact CD2-CD1 4.31Å; L93-Y95 HydrophobicContact CD2-CE1 3.47Å; L93-Y95 VanDerWaalsContact CD2-CE1 3.47Å; L93-Y95 HydrophobicContact CD2-CE2 4.41Å; L93-Y95 WeakPolarHBondContact CD2-OH 3.46Å; Y95-V116 HydrophobicContact CD1-CG1 3.69Å; Y95-V116 HydrophobicContact CE1-CG1 4.06Å
96W25.4Very low24.3Very low179 Ų179115.7 Ų115.768%0.67861%0.609SS**EExtended strand (participates in β ladder)trans-120.1124.2167.3-66.976.8000108.3S117W96-S117 PolarHBondContact O-OG 2.81Å
97I27.6Very low24.3Very low99 Ų99111.5 Ų111.551%0.50859%0.594SS.*  trans-96.294.9172-56.6173.3000106.2V100 F241I97-V100 HydrophobicContact CG2-CG2 4.4Å; I97-F241 HydrophobicContact CB-CE1 4.49Å; I97-F241 HydrophobicContact CG2-CE1 3.88Å; I97-F241 HydrophobicContact CG2-CZ 4.03Å
98S23.4Very low24.4Very low88 Ų88111.6 Ų111.662%0.61559%0.593SS**  trans-100.1106.1176.356.80000109.1
99K25.9Very low24.6Very low156 Ų156107.3 Ų107.368%0.67857%0.566SS**  trans61.8119.4168.5-153.9-176.1-168.2-168.10115.7E101K99-E101 HydrophobicContact CD-CG 4.22Å; K99-E101 WeakPolarHBondContact CE-OE1 3.22Å; K99-E101 HydrophobicContact CG-CG 4.27Å; K99-E101 IonicContact NZ-OE1 2.63Å; K99-E101 PolarHBondContact NZ-OE1 3.25Å
100V27.4Very low25Very low53 Ų53105.4 Ų105.432%0.32155%0.554SS.*  trans-105.2107.2171.3178.10000107.3I97 V102 L239 F241I97-V100 HydrophobicContact CG2-CG2 4.4Å; V100-V102 HydrophobicContact CG1-CG2 4.03Å; V100-L239 HydrophobicContact CB-CD1 4.4Å; V100-L239 HydrophobicContact CG1-CD1 4.15Å; V100-F241 HydrophobicContact CG2-CZ 4.04Å
101E25.9Very low25.3Very low125 Ų125103.1 Ų103.158%0.58454%0.536SS*.  trans-98.2116.8170.6-72-175177.800109.2K99K99-E101 HydrophobicContact CD-CG 4.22Å; K99-E101 WeakPolarHBondContact CE-OE1 3.22Å; K99-E101 HydrophobicContact CG-CG 4.27Å; K99-E101 IonicContact NZ-OE1 2.63Å; K99-E101 PolarHBondContact NZ-OE1 3.25Å
102V26.8Very low25.6Very low75 Ų75101.6 Ų101.646%0.45552%0.521SS..  trans-97.497.7177.8-177.30000108V100V100-V102 HydrophobicContact CG1-CG2 4.03Å
103Q26Very low25.9Very low163 Ų163100.4 Ų100.476%0.76251%0.509SS*.  trans-85.4110.9167.1-80.9-172-12.200109.6S105Q103-S105 PolarHBondContact O-N 3.02Å; Q103-S105 VanDerWaalsContact O-N 3.13Å
104R25Very low26.1Very low165 Ų16598 Ų9862%0.62350%0.496SS*.  trans-73.4100.3168-71.3-173.6-179.7-167.33108.4
105S24Very low26.3Very low67 Ų6795.9 Ų95.947%0.46950%0.497SS..  trans-70.4141.8163.8150.60000109Q103 S107Q103-S105 PolarHBondContact O-N 3.02Å; Q103-S105 VanDerWaalsContact O-N 3.13Å; S105-S107 PolarHBondContact O-N 2.98Å; S105-S107 WeakPolarHBondContact OG-CB 3.3Å; S105-S107 PolarHBondContact OG-N 3Å
106I24.1Very low26.4Very low183 Ų18391.5 Ų91.594%0.93849%0.486SS*.SBendtrans-67.45.8179.1-50.3162.3000111.1
107S23.1Very low26.4Very low45 Ų4584.5 Ų84.532%0.31546%0.464SS..SBendtrans-84.3145174.6-176.90000111.3S105 V109S105-S107 PolarHBondContact O-N 2.98Å; S105-S107 WeakPolarHBondContact OG-CB 3.3Å; S105-S107 PolarHBondContact OG-N 3Å; S107-V109 PolarHBondContact O-N 2.69Å
108P24.1Very low26.4Very low108 Ų10881 Ų8170%0.70145%0.448SS*.SBendtrans-62.50.9173.726.3-35.1000114
109V26.1Very low26.4Very low35 Ų3580 Ų8021%0.21245%0.445CS..SBendtrans-108.299.3174.7-174.10000108S107 I111S107-V109 PolarHBondContact O-N 2.69Å; V109-I111 HydrophobicContact CG1-CG1 4.1Å; V109-I111 PolarHBondContact O-N 2.73Å
110G28.3Very low26.4Very low30 Ų3075 Ų7531%0.30944%0.438SS..  trans-71.6109168.200000109.6
111I27.3Very low26.3Very low82 Ų8277.2 Ų77.242%0.42145%0.447SS..EExtended strand (participates in β ladder)trans-91.2125.1174.9-56.7174.3000107.4V109 V113V109-I111 HydrophobicContact CG1-CG1 4.1Å; V109-I111 PolarHBondContact O-N 2.73Å; I111-V113 HydrophobicContact CG2-CG2 4.21Å
112T29.2Very low26.2Very low28 Ų2874.1 Ų74.117%0.17244%0.443CS..EExtended strand (participates in β ladder)trans-122.4114.7169.4-59.90000108.3I114 F131T112-I114 HydrophobicContact CG2-CG1 4.36Å; T112-F131 VanDerWaalsContact CB-CE2 3.43Å; T112-F131 HydrophobicContact CG2-CE2 4.36Å; T112-F131 HydrophobicContact CG2-CZ 4Å; T112-F131 WeakPolarHBondContact OG1-CE2 3.44Å
113V28.1Very low26.2Very low73 Ų7376.7 Ų76.744%0.44245%0.45SS..EExtended strand (participates in β ladder)trans-84.7118.6178.6-177.10000107.9I111I111-V113 HydrophobicContact CG2-CG2 4.21Å
114I29.8Very low26.1Very low32 Ų3274.7 Ų74.716%0.16444%0.436CS..EExtended strand (participates in β ladder)trans-103.599.8173.4-54.7178.7000107.9T112 V116 F129 I191T112-I114 HydrophobicContact CG2-CG1 4.36Å; I114-V116 HydrophobicContact CG2-CG2 4.15Å; I114-V116 PolarHBondContact O-N 3.19Å; I114-F129 HydrophobicContact CB-CD2 3.73Å; I114-F129 HydrophobicContact CB-CE2 3.96Å; I114-F129 HydrophobicContact CD1-CD2 3.77Å; I114-F129 HydrophobicContact CD1-CE2 4.17Å; I114-F129 HydrophobicContact CD1-CG 4.4Å; I114-F129 HydrophobicContact CG1-CD2 3.91Å; I114-F129 HydrophobicContact CG1-CE2 4.47Å; I114-F129 HydrophobicContact CG2-CE2 4.49Å; I114-I191 HydrophobicContact CD1-CD1 3.68Å
115T27.9Very low26.2Very low85 Ų8571.2 Ų71.252%0.52143%0.433SS..  trans-79.6108.7174.4-6.60000109.1
116V28.6Very low26.3Very low51 Ų5171.7 Ų71.731%0.30944%0.435SS..  trans-93.8107.4171.3-176.40000107.7Y95 I114 L127Y95-V116 HydrophobicContact CD1-CG1 3.69Å; Y95-V116 HydrophobicContact CE1-CG1 4.06Å; I114-V116 HydrophobicContact CG2-CG2 4.15Å; I114-V116 PolarHBondContact O-N 3.19Å; V116-L127 HydrophobicContact CB-CD1 4.43Å; V116-L127 HydrophobicContact CG2-CD1 4.05Å
117S26.4Very low26.5Very low31 Ų3166.8 Ų66.822%0.21741%0.41CS..EExtended strand (participates in β ladder)trans-88.8129.8171.973.40000109.6W96W96-S117 PolarHBondContact O-OG 2.81Å
118S26.7Very low26.7Very low26 Ų2669.1 Ų69.118%0.18242%0.418CS..EExtended strand (participates in β ladder)trans-119.8118170.7176.50000109.5L93 R94 G120L93-S118 WeakPolarHBondContact CD2-OG 3.48Å; R94-S118 WeakPolarHBondContact O-CA 3.45Å; S118-G120 PolarHBondContact O-N 2.98Å
119A24.1Very low26.9Very low67 Ų6766.5 Ų66.555%0.55440%0.396SS*.EExtended strand (participates in β ladder)trans-72.994.8165.400000107.9
120G25.1Very low26.9Very low51 Ų5168.7 Ų68.753%0.52642%0.418SS..THydrogen-bonded Turntrans143.2-8.6179.900000115.5S118S118-G120 PolarHBondContact O-N 2.98Å
121L26.7Very low26.8Very low99 Ų9969.3 Ų69.352%0.51841%0.412SS..  trans-102.3112.7173.8-70.1174.4000110.4L93 H123L93-L121 HydrophobicContact CD2-CD1 4.06Å; L121-H123 PolarHBondContact O-N 3.13Å
122A23Very low26.8Very low60 Ų6075.9 Ų75.950%0.49643%0.432SS..SBendtrans-58.3120.816500000109.2F258A122-F258 HydrophobicContact CB-CE1 4.12Å; A122-F258 HydrophobicContact CB-CE2 4.23Å; A122-F258 HydrophobicContact CB-CZ 3.63Å
123H26Very low26.7Very low129 Ų12977.2 Ų77.260%0.59744%0.441SS*.SBendtrans58.797.4-171.3-64.3-63.4000117.1L121 V125L121-H123 PolarHBondContact O-N 3.13Å; H123-V125 PolarHBondContact O-N 2.83Å
124Y25.3Very low26.7Very low121 Ų12177.2 Ų77.248%0.47544%0.442SS..  trans-13112.8153.7-74.3-97.1000114.5P126Y124-P126 VanDerWaalsContact O-CD 3.24Å; Y124-P126 WeakPolarHBondContact O-CD 3.15Å
125V26.2Very low26.7Very low92 Ų9281.4 Ų81.456%0.55847%0.472SS*.  trans-100.399.9162-179.20000107H123 L127H123-V125 PolarHBondContact O-N 2.83Å; V125-L127 HydrophobicContact CG1-CD2 4.26Å; V125-L127 PolarHBondContact O-N 3.03Å; V125-L127 VanDerWaalsContact O-N 3.11Å
126P26.2Very low26.9Very low78 Ų7885.1 Ų85.151%0.50648%0.483SS..  trans-62.4114.716524.9-29.7000107.6Y124 L128Y124-P126 VanDerWaalsContact O-CD 3.24Å; Y124-P126 WeakPolarHBondContact O-CD 3.15Å; P126-L128 PolarHBondContact O-N 2.91Å
127L27.9Very low26.9Very low79 Ų7988.9 Ų88.941%0.41451%0.509SS..EExtended strand (participates in β ladder)trans-80.995.2170.4-71.4170.4000107.7V116 V125 F129V116-L127 HydrophobicContact CB-CD1 4.43Å; V116-L127 HydrophobicContact CG2-CD1 4.05Å; V125-L127 HydrophobicContact CG1-CD2 4.26Å; V125-L127 PolarHBondContact O-N 3.03Å; V125-L127 VanDerWaalsContact O-N 3.11Å; L127-F129 HydrophobicContact CB-CD2 4.28Å; L127-F129 HydrophobicContact CB-CE2 3.53Å; L127-F129 HydrophobicContact CB-CZ 3.96Å; L127-F129 HydrophobicContact CD1-CE2 4.49Å; L127-F129 HydrophobicContact CD1-CZ 4.34Å; L127-F129 VanDerWaalsContact O-CD2 3.31Å; L127-F129 WeakPolarHBondContact O-CD2 3.47Å; L127-F129 PolarHBondContact O-N 3.44Å
128L27.1Very low27Very low94 Ų9493.7 Ų93.749%0.49253%0.532SS..EExtended strand (participates in β ladder)trans-73.2117.5170.4-111.8132.3000108.7P126P126-L128 PolarHBondContact O-N 2.91Å
129F28.5Very low27.1Very low53 Ų5397.6 Ų97.623%0.23255%0.554CS.*EExtended strand (participates in β ladder)trans-105.7115.4168.4-62.2-86.6000108.2I114 L127 F131 L196I114-F129 HydrophobicContact CB-CD2 3.73Å; I114-F129 HydrophobicContact CB-CE2 3.96Å; I114-F129 HydrophobicContact CD1-CD2 3.77Å; I114-F129 HydrophobicContact CD1-CE2 4.17Å; I114-F129 HydrophobicContact CD1-CG 4.4Å; I114-F129 HydrophobicContact CG1-CD2 3.91Å; I114-F129 HydrophobicContact CG1-CE2 4.47Å; I114-F129 HydrophobicContact CG2-CE2 4.49Å; L127-F129 HydrophobicContact CB-CD2 4.28Å; L127-F129 HydrophobicContact CB-CE2 3.53Å; L127-F129 HydrophobicContact CB-CZ 3.96Å; L127-F129 HydrophobicContact CD1-CE2 4.49Å; L127-F129 HydrophobicContact CD1-CZ 4.34Å; L127-F129 VanDerWaalsContact O-CD2 3.31Å; L127-F129 WeakPolarHBondContact O-CD2 3.47Å; L127-F129 PolarHBondContact O-N 3.44Å; F129-F131 HydrophobicContact CB-CD1 4Å; F129-F131 HydrophobicContact CB-CE1 3.5Å; F129-F131 HydrophobicContact CB-CZ 4.49Å; F129-L196 HydrophobicContact CD1-CD1 4.18Å; F129-L196 HydrophobicContact CE1-CD1 3.53Å; F129-L196 HydrophobicContact CZ-CD1 4.03Å
130A25.8Very low27.1Very low81 Ų8199.6 Ų99.667%0.66957%0.571SS**EExtended strand (participates in β ladder)trans-97.8125.1165.700000107.5
131F27.1Very low27.1Very low43 Ų43103.3 Ų103.319%0.18958%0.579CS.*  trans-122142.4170.310.9-89.6000109.7T112 F129 I191T112-F131 VanDerWaalsContact CB-CE2 3.43Å; T112-F131 HydrophobicContact CG2-CE2 4.36Å; T112-F131 HydrophobicContact CG2-CZ 4Å; T112-F131 WeakPolarHBondContact OG1-CE2 3.44Å; F129-F131 HydrophobicContact CB-CD1 4Å; F129-F131 HydrophobicContact CB-CE1 3.5Å; F129-F131 HydrophobicContact CB-CZ 4.49Å; F131-I191 HydrophobicContact CD1-CD1 4.33Å; F131-I191 HydrophobicContact CD1-CG2 4Å; F131-I191 HydrophobicContact CD2-CG2 3.93Å; F131-I191 HydrophobicContact CE1-CD1 3.44Å; F131-I191 VanDerWaalsContact CE1-CD1 3.44Å; F131-I191 HydrophobicContact CE1-CG1 4.49Å; F131-I191 HydrophobicContact CE1-CG2 3.71Å; F131-I191 HydrophobicContact CE2-CG2 3.6Å; F131-I191 HydrophobicContact CG-CG2 4.08Å; F131-I191 HydrophobicContact CZ-CD1 3.72Å; F131-I191 HydrophobicContact CZ-CG2 3.46Å; F131-I191 VanDerWaalsContact CZ-CG2 3.46Å
132R26.6Very low27.1Very low221 Ų221103 Ų10383%0.83458%0.584SS**PPolyproline II helixtrans-86.6117.5168.3-171.7175.3-178.4168.20.5106.8
133P27.8Very low27.1Very low55 Ų55107.5 Ų107.536%0.35760%0.6SS.*PPolyproline II helixtrans-58.6146.5169.324.1-30.3000108.9
134P28.4Very low27.1Very low74 Ų74106.4 Ų106.448%0.48161%0.607SS.*PPolyproline II helixtrans-53.3143.5170.523.9-31.6000108.7Q136P134-Q136 PolarHBondContact O-N 3.36Å
135P29.5Very low27Very low120 Ų120112.1 Ų112.178%0.77963%0.628SS**PPolyproline II helixtrans-51.1131.1179.821.5-31.4000109.1
136Q32.5Very low26.8Very low163 Ų163119.3 Ų119.376%0.76265%0.645SS**PPolyproline II helixtrans-57.4135.3169.7-81177.4-51.800107.9P134 D138P134-Q136 PolarHBondContact O-N 3.36Å; Q136-D138 PolarHBondContact O-N 3.48Å
137P28.8Very low26.7Very low130 Ų130120.8 Ų120.884%0.84466%0.655SS**  trans-7281169.231-30.8000107.5
138D27.9Very low26.4Very low132 Ų132127.6 Ų127.671%0.70668%0.682SS**  trans-81.5148.6155.3-79-30.1000107.7Q136Q136-D138 PolarHBondContact O-N 3.48Å
139V28.8Very low26.1Very low108 Ų108127.3 Ų127.366%0.65569%0.693SS**  trans86.394.3-174.5-155.80000112.9D141V139-D141 HydrophobicContact CG1-CB 3.75Å; V139-D141 WeakPolarHBondContact CG1-OD2 3.49Å; V139-D141 PolarHBondContact O-N 3.46Å
140A24.6Very low25.8Very low109 Ų109128.9 Ų128.990%0.90172%0.715SS**  trans-53.488.9142.900000107.7
141D25.1Very low25.6Very low129 Ų129131.7 Ų131.769%0.6973%0.725SS**  trans-117.6115.1163-105.2-22.9000107.9V139V139-D141 HydrophobicContact CG1-CB 3.75Å; V139-D141 WeakPolarHBondContact CG1-OD2 3.49Å; V139-D141 PolarHBondContact O-N 3.46Å
142S25.5Very low25.4Very low91 Ų91138.6 Ų138.664%0.63676%0.755SS**  trans-35.6151.9163.339.70000113.3
143D24.3Very low25.2Very low156 Ų156133.9 Ų133.983%0.83475%0.752SS**  trans93.730.6155.6-60.6-22.5000121.2
144S25Very low24.9Very low106 Ų106138.6 Ų138.674%0.74177%0.774SS**  trans-141.674.1160.557.70000115.9W146S144-W146 PolarHBondContact O-N 3.37Å
145R22.6Very low24.6Very low241 Ų241143.7 Ų143.791%0.90979%0.791SS**  trans27.868.3133.6-57.1-174.9-175.3-1661.5118
146W23.3Very low24.3Very low242 Ų242146.7 Ų146.792%0.91779%0.792SS**  trans-138.5133.1148.4-91.375.2000109.4S144S144-W146 PolarHBondContact O-N 3.37Å
147P22.8Very low23.8Very low110 Ų110147.5 Ų147.571%0.71480%0.796SS**  trans-80.6128.6-149.529.6-33.8000113.4A149P147-A149 PolarHBondContact O-N 2.94Å
148F21.9Very low23.6Very low221 Ų221147.5 Ų147.597%0.96980%0.796SS**  trans-54.3102.3149.5-82.2-96.8000108.7
149A21.7Very low23.3Very low88 Ų88149.4 Ų149.473%0.72780%0.798SS**  trans-111.292.9166.300000109P147P147-A149 PolarHBondContact O-N 2.94Å
150A22.4Very low22.9Very low86 Ų86150.9 Ų150.971%0.71181%0.807SS**  trans51.694.3137.600000118K152A150-K152 PolarHBondContact O-N 2.99Å
151T21.4Very low22.8Very low141 Ų141154.4 Ų154.487%0.86580%0.802SS**  -10.3110.9121.736.40000115.5
152K22.5Very low22.7Very low188 Ų188153.1 Ų153.182%0.81780%0.802SS**  trans-141.8125.3140.9-95.2-172.8-178.7177.10109.5A150 L154A150-K152 PolarHBondContact O-N 2.99Å; K152-L154 PolarHBondContact O-N 3.28Å; K152-L154 VanDerWaalsContact O-N 3.15Å
153P22.1Very low22.6Very low121 Ų121157 Ų15779%0.78681%0.81SS**  trans-81.397-178.532.3-29.4000108.3Q155P153-Q155 VanDerWaalsContact C-N 3.32Å; P153-Q155 PolarHBondContact O-N 3.29Å
154L22.3Very low22.5Very low154 Ų154157.1 Ų157.181%0.80681%0.806SS**  trans-81.789.4169.5-80.3167000109.3K152 K156K152-L154 PolarHBondContact O-N 3.28Å; K152-L154 VanDerWaalsContact O-N 3.15Å; L154-K156 PolarHBondContact O-N 3.24Å
155Q21.4Very low22.5Very low181 Ų181155.6 Ų155.685%0.84680%0.799SS**  trans-47.691.9146.4-71.1173.2-26.800108.9P153P153-Q155 VanDerWaalsContact C-N 3.32Å; P153-Q155 PolarHBondContact O-N 3.29Å
156K23.2Very low22.5Very low183 Ų183146.4 Ų146.480%0.79677%0.772SS**SBendtrans-173.6124.1160-102.9157.5-172.5-175.50107L154L154-K156 PolarHBondContact O-N 3.24Å
157Q21.8Very low22.5Very low180 Ų180139 Ų13984%0.84176%0.755SS**  trans-42.7125.4-177.2-66.7174.3-12.400111.6K159Q157-K159 PolarHBondContact O-N 3.29Å
158P24.2Very low22.6Very low131 Ų131141.2 Ų141.285%0.85175%0.754SS**  trans-71.7101.7170.926.8-27.3000107.9
159K22Very low22.7Very low172 Ų172133.4 Ų133.475%0.74873%0.73SS**  trans-47.5139.7168.9-72.5175.3174.3-179.80110Q157 F161Q157-K159 PolarHBondContact O-N 3.29Å; K159-F161 WeakPolarHBondContact O-CD2 3.41Å; K159-F161 PolarHBondContact O-N 3.14Å
160V21.8Very low22.8Very low138 Ų138135.6 Ų135.684%0.83672%0.723SS**  trans-46.9107.7165.4178.10000108.6C162V160-C162 HydrophobicContact CG1-CB 4.31Å; V160-C162 PolarHBondContact O-N 3.07Å
161F21.9Very low22.9Very low183 Ų183140.5 Ų140.580%0.80372%0.724SS**  trans-8887.7163-87-87.6000107.4K159 E163K159-F161 WeakPolarHBondContact O-CD2 3.41Å; K159-F161 PolarHBondContact O-N 3.14Å; F161-E163 VanDerWaalsContact C-N 3.25Å; F161-E163 PolarHBondContact O-N 3.45Å
162C22.3Very low23Very low103 Ų103141.7 Ų141.770%0.69672%0.719SS**  trans-77.285.3156-153.30000105.5V160 E164V160-C162 HydrophobicContact CG1-CB 4.31Å; V160-C162 PolarHBondContact O-N 3.07Å; C162-E164 PolarHBondContact O-N 3.34Å
163E23.1Very low23.1Very low172 Ų172136.4 Ų136.480%0.80471%0.706SS**  trans-73.192.6157.1-86.9-168163.600105.8F161 A165F161-E163 VanDerWaalsContact C-N 3.25Å; F161-E163 PolarHBondContact O-N 3.45Å; E163-A165 PolarHBondContact O-N 3.3Å
164E22.5Very low23.3Very low159 Ų159134.5 Ų134.574%0.74369%0.689SS**  trans-5295.2153.4-74.5-172.9154.500106.2C162 S166C162-E164 PolarHBondContact O-N 3.34Å; E164-S166 PolarHBondContact O-N 2.99Å
165A24.5Very low23.3Very low73 Ų73131.7 Ų131.760%0.60368%0.68SS**  trans-56.293.715400000104.3E163E163-A165 PolarHBondContact O-N 3.3Å
166S22.7Very low23.5Very low48 Ų48127.6 Ų127.634%0.33667%0.667SS.*  trans-53.9142.6-163.776.50000107.7E164 K168 A169E164-S166 PolarHBondContact O-N 2.99Å; S166-K168 PolarHBondContact O-N 2.72Å; S166-K168 WeakPolarHBondContact OG-CB 3.39Å; S166-K168 PolarHBondContact OG-N 3Å; S166-A169 PolarHBondContact O-N 3.42Å
167P24.5Very low23.7Very low87 Ų87121.7 Ų121.757%0.56564%0.644SS**Hα-helixtrans-50.5-15.9174.4-2733.3000113.2R171P167-R171 WeakPolarHBondContact O-CB 3.49Å; P167-R171 WeakPolarHBondContact O-CD 3.37Å; P167-R171 WeakPolarHBondContact O-CG 3.38Å; P167-R171 PolarHBondContact O-N 2.9Å
168K24.9Very low23.7Very low157 Ų157116.7 Ų116.768%0.68364%0.641SS**Hα-helixtrans-72.9-34.5173.3-60.9-178.8176178.20114S166 R171 Q172S166-K168 PolarHBondContact O-N 2.72Å; S166-K168 WeakPolarHBondContact OG-CB 3.39Å; S166-K168 PolarHBondContact OG-N 3Å; K168-R171 PolarHBondContact O-N 3.18Å; K168-Q172 PolarHBondContact O-N 3.45Å
169A23.8Very low23.7Very low57 Ų57115.9 Ų115.947%0.47164%0.638SS.*Hα-helixtrans-73.7-33.1175.300000112S166 R171S166-A169 PolarHBondContact O-N 3.42Å; A169-R171 VanDerWaalsContact C-N 3.33Å
170F24.4Very low23.9Very low133 Ų133112 Ų11258%0.58362%0.624SS**Hα-helixtrans-68.7-30.3170.5-115.2-95.7000112.5L174F170-L174 HydrophobicContact CD1-CD1 3.95Å; F170-L174 VanDerWaalsContact O-CD1 3.28Å; F170-L174 WeakPolarHBondContact O-CD1 3.44Å; F170-L174 WeakPolarHBondContact O-CG 3.25Å
171R23.6Very low24Very low190 Ų190109.8 Ų109.872%0.71763%0.629SS**Hα-helixtrans-74.8-20.1179.2-80.7172.6-173.3-164.13.4114.1P167 K168 A169P167-R171 WeakPolarHBondContact O-CB 3.49Å; P167-R171 WeakPolarHBondContact O-CD 3.37Å; P167-R171 WeakPolarHBondContact O-CG 3.38Å; P167-R171 PolarHBondContact O-N 2.9Å; K168-R171 PolarHBondContact O-N 3.18Å; A169-R171 VanDerWaalsContact C-N 3.33Å
172Q24Very low24.2Very low165 Ų165108 Ų10877%0.77162%0.623SS**Hα-helixtrans-82.3-21.6-176.1-75.2177.3-18.700114.2K168 P175K168-Q172 PolarHBondContact O-N 3.45Å; Q172-P175 WeakPolarHBondContact O-CD 3.41Å
173S24.5Very low24.5Very low78 Ų78113 Ų11355%0.54563%0.633SS.*SBendtrans-99.2-3.9175.351.90000113.9P175S173-P175 VanDerWaalsContact C-CD 3.44Å
174L25.2Very low24.7Very low81 Ų81108.9 Ų108.942%0.42462%0.616SS.*  trans-1028-177.3-81.5170.5000118.4F170 V176 L177F170-L174 HydrophobicContact CD1-CD1 3.95Å; F170-L174 VanDerWaalsContact O-CD1 3.28Å; F170-L174 WeakPolarHBondContact O-CD1 3.44Å; F170-L174 WeakPolarHBondContact O-CG 3.25Å; L174-V176 PolarHBondContact O-N 3.27Å; L174-L177 HydrophobicContact CD2-CD1 3.8Å
175P23.1Very low25Very low95 Ų95112.1 Ų112.162%0.61762%0.621SS**G310 helixtrans-67.4-13.3174.7-18.230.4000114.9Q172 S173Q172-P175 WeakPolarHBondContact O-CD 3.41Å; S173-P175 VanDerWaalsContact C-CD 3.44Å
176V25.4Very low25.2Very low95 Ų95111.9 Ų111.958%0.57661%0.609SS**G310 helixtrans-89.1-3.2-173.6-173.90000113L174L174-V176 PolarHBondContact O-N 3.27Å
177L27.3Very low25.5Very low59 Ų59116 Ų11631%0.30963%0.627SS.*G310 helixtrans-10926175.7-76.6164.4000112.9L174 S179 I184 K202L174-L177 HydrophobicContact CD2-CD1 3.8Å; L177-S179 VanDerWaalsContact C-N 3.29Å; L177-S179 PolarHBondContact O-N 3.28Å; L177-I184 HydrophobicContact CD1-CD1 4.16Å; L177-K202 HydrophobicContact CD2-CD 4.2Å
178G23Very low25.7Very low75 Ų75116.8 Ų116.877%0.77363%0.626SS**THydrogen-bonded Turntrans-73.538.6-17100000118.2
179S23.9Very low25.8Very low113 Ų113112.8 Ų112.879%0.7961%0.612SS**THydrogen-bonded Turntrans-149.78.117572.20000117.7L177L177-S179 VanDerWaalsContact C-N 3.29Å; L177-S179 PolarHBondContact O-N 3.28Å
180I25.7Very low26.1Very low91 Ų91115 Ų11547%0.46761%0.613SS.*SBendtrans-143.5115.2171-56.1177.3000106.9E182I180-E182 HydrophobicContact CG2-CG 4.31Å; I180-E182 PolarHBondContact O-N 3.46Å
181G23.8Very low26.3Very low91 Ų91110 Ų11094%0.93859%0.591SS**  trans-66.342.7-171.600000116.5
182E26.9Very low26.6Very low145 Ų145104 Ų10468%0.67858%0.578SS**  trans-116.1115.3-179.4-69-177.4159.200110.3I180 I184I180-E182 HydrophobicContact CG2-CG 4.31Å; I180-E182 PolarHBondContact O-N 3.46Å; E182-I184 PolarHBondContact O-N 3.06Å
183K27.3Very low26.7Very low209 Ų209102.4 Ų102.491%0.90958%0.575SS**PPolyproline II helixtrans-68.7117.3174-68.5176.4-179.8173.70109.3
184I28.2Very low26.7Very low85 Ų85102.6 Ų102.644%0.43657%0.573SS.*PPolyproline II helixtrans-83.5124.4172.8-58174.8000108.6L177 E182 I186 L200L177-I184 HydrophobicContact CD1-CD1 4.16Å; E182-I184 PolarHBondContact O-N 3.06Å; I184-I186 HydrophobicContact CG2-CG1 4.17Å; I184-L200 HydrophobicContact CG2-CD1 3.97Å
185R27.8Very low26.8Very low227 Ų227106.4 Ų106.486%0.85758%0.583SS**PPolyproline II helixtrans-98.4129.1168.5-76.3-174.8178.7177.7-0109.4
186I28.7Very low27Very low68 Ų68104.2 Ų104.235%0.34957%0.565SS.*  trans-113.3122.4177.3-57.6176.7000107.5I184 L200 I211I184-I186 HydrophobicContact CG2-CG1 4.17Å; I186-L200 HydrophobicContact CD1-CD1 4.16Å; I186-L200 HydrophobicContact CG1-CD1 3.98Å; I186-I211 HydrophobicContact CD1-CD1 3.67Å
187N29.4Very low27.1Very low134 Ų134104.8 Ų104.872%0.71757%0.573SS**  trans-98.6120.8172.1-70.2-23.9000108.9
188L28.3Very low27.2Very low104 Ų104105.4 Ų105.455%0.54558%0.579SS.*  trans-93.6125.5175.2-68.3166.2000108.9I215L188-I215 HydrophobicContact CD1-CD1 3.64Å
189I27.8Very low27.4Very low73 Ų73107 Ų10737%0.37457%0.574SS.*  trans-104.8114.7173.3-56.2175.9000107.2I191I189-I191 HydrophobicContact CG2-CG1 4.15Å
190Q29.4Very low27.6Very low105 Ų105105.8 Ų105.849%0.49156%0.558SS.*EExtended strand (participates in β ladder)trans-86.6128.6174.2-178178.6-300109.5
191I28.5Very low27.6Very low26 Ų26109.4 Ų109.413%0.13357%0.573CS.*EExtended strand (participates in β ladder)trans-125.9109.5174.6-53.9179.2000107.5I114 F131 I189 N193 T194I114-I191 HydrophobicContact CD1-CD1 3.68Å; F131-I191 HydrophobicContact CD1-CD1 4.33Å; F131-I191 HydrophobicContact CD1-CG2 4Å; F131-I191 HydrophobicContact CD2-CG2 3.93Å; F131-I191 HydrophobicContact CE1-CD1 3.44Å; F131-I191 VanDerWaalsContact CE1-CD1 3.44Å; F131-I191 HydrophobicContact CE1-CG1 4.49Å; F131-I191 HydrophobicContact CE1-CG2 3.71Å; F131-I191 HydrophobicContact CE2-CG2 3.6Å; F131-I191 HydrophobicContact CG-CG2 4.08Å; F131-I191 HydrophobicContact CZ-CD1 3.72Å; F131-I191 HydrophobicContact CZ-CG2 3.46Å; F131-I191 VanDerWaalsContact CZ-CG2 3.46Å; I189-I191 HydrophobicContact CG2-CG1 4.15Å; I191-N193 PolarHBondContact O-N 3.5Å; I191-T194 PolarHBondContact N-O 2.98Å; I191-T194 PolarHBondContact O-N 3.19Å; I191-T194 PolarHBondContact O-OG1 3.45Å
192C29.9Very low27.7Very low64 Ų64109.6 Ų109.643%0.43255%0.548SS..THydrogen-bonded Turntrans52.7-131.2-176.5-55.30000112.2T194C192-T194 PolarHBondContact O-N 3.17Å
193N26.4Very low27.8Very low132 Ų132110.1 Ų110.171%0.70655%0.551SS**THydrogen-bonded Turntrans-87.514.3177.4-60.2-12.4000112.3I191I191-N193 PolarHBondContact O-N 3.5Å
194T25.7Very low27.7Very low83 Ų83111.8 Ų111.851%0.50955%0.551SS.*EExtended strand (participates in β ladder)trans-124129.8-170.428.70000111.9I191 C192I191-T194 PolarHBondContact N-O 2.98Å; I191-T194 PolarHBondContact O-N 3.19Å; I191-T194 PolarHBondContact O-OG1 3.45Å; C192-T194 PolarHBondContact O-N 3.17Å
195Y26.6Very low27.5Very low161 Ų161117.1 Ų117.163%0.63157%0.566SS**EExtended strand (participates in β ladder)trans-87132.5177.5-58.2-80000110.3S197Y195-S197 PolarHBondContact O-N 2.82Å
196L28.1Very low27.4Very low49 Ų49118.4 Ų118.426%0.25757%0.571SS.*  trans-81.9108.8162.9-166.580.6000108.5F129 V198F129-L196 HydrophobicContact CD1-CD1 4.18Å; F129-L196 HydrophobicContact CE1-CD1 3.53Å; F129-L196 HydrophobicContact CZ-CD1 4.03Å; L196-V198 HydrophobicContact CD2-CG2 4.17Å
197S27.6Very low27.2Very low106 Ų106119.9 Ų119.974%0.74158%0.576SS**  trans-81.5115.2170.9-175.80000109.3Y195Y195-S197 PolarHBondContact O-N 2.82Å
198V28.1Very low27.1Very low72 Ų72123.3 Ų123.344%0.43659%0.585SS.*  trans-96.7113.1173-177.40000108L196 L200L196-V198 HydrophobicContact CD2-CG2 4.17Å; V198-L200 HydrophobicContact CG1-CD2 4.38Å; V198-L200 HydrophobicContact CG1-CG 4.4Å
199T27.6Very low27Very low108 Ų108123.4 Ų123.466%0.66359%0.585SS**  trans-87.1117.7173-54.60000108.6E201T199-E201 HydrophobicContact CG2-CG 4.35Å
200L27.5Very low27Very low88 Ų88127.6 Ų127.646%0.46160%0.603SS.*  trans-100.5109.2172-68.5171.6000108.8I184 I186 V198I184-L200 HydrophobicContact CG2-CD1 3.97Å; I186-L200 HydrophobicContact CD1-CD1 4.16Å; I186-L200 HydrophobicContact CG1-CD1 3.98Å; V198-L200 HydrophobicContact CG1-CD2 4.38Å; V198-L200 HydrophobicContact CG1-CG 4.4Å
201E25.6Very low26.8Very low167 Ų167126.9 Ų126.978%0.7860%0.602SS**  trans-91.1117.5169.9-70.9-167.6154.100109.8T199T199-E201 HydrophobicContact CG2-CG 4.35Å
202K26.8Very low26.6Very low95 Ų95129.4 Ų129.441%0.41362%0.622SS.*  trans-96.5140.6168.7-166.4173.8-177.7174.20109.8L177L177-K202 HydrophobicContact CD2-CD 4.2Å
203H28Very low26.4Very low157 Ų157133.3 Ų133.373%0.72763%0.633SS**THydrogen-bonded Turntrans-36.5134.7179.3-100.4-84.3000115.5R205H203-R205 PolarHBondContact O-N 3.42Å
204R25.5Very low26.4Very low243 Ų243134.6 Ų134.692%0.91763%0.633SS**THydrogen-bonded Turntrans68.2-1159-65.5-171.8175.6177.50.6119.9
205R24.4Very low26.3Very low198 Ų198135.7 Ų135.775%0.74764%0.635SS**SBendtrans-137.6120.5164.4-84.2-177.2172.7171.7-3.3110.1H203 Q207H203-R205 PolarHBondContact O-N 3.42Å; R205-Q207 VanDerWaalsContact C-N 3.34Å; R205-Q207 PolarHBondContact O-N 3.3Å
206R25.3Very low26.2Very low253 Ų253130.2 Ų130.296%0.95563%0.627SS**  trans-61.195169.6-82.3-180167.9172.7-2.1108.6
207Q25.4Very low26Very low99 Ų99135.3 Ų135.346%0.46365%0.649SS.*  trans-118104.9166.1-75-179.3-14.700107.3R205 L209R205-Q207 VanDerWaalsContact C-N 3.34Å; R205-Q207 PolarHBondContact O-N 3.3Å; Q207-L209 PolarHBondContact O-N 3.44Å; Q207-L209 VanDerWaalsContact O-N 3.1Å
208K25.9Very low25.9Very low206 Ų206135.1 Ų135.190%0.89664%0.643SS**  trans-67.4104.7169.1-75.7-178.8175.5-179.30107.1Q210K208-Q210 PolarHBondContact O-N 3.03Å
209L26Very low25.8Very low106 Ų106139.9 Ų139.956%0.55566%0.66SS**  trans-8391.2164.8-15491.3000107.5Q207 I211Q207-L209 PolarHBondContact O-N 3.44Å; Q207-L209 VanDerWaalsContact O-N 3.1Å; L209-I211 HydrophobicContact CD2-CD1 3.91Å; L209-I211 HydrophobicContact CD2-CG1 3.81Å; L209-I211 HydrophobicContact CG-CG1 4.35Å; L209-I211 PolarHBondContact O-N 3.1Å
210Q27.7Very low25.6Very low162 Ų162144.4 Ų144.476%0.75767%0.665SS**  trans-85.394.8172.4-167.4-177.4-21.600108.1K208 S212K208-Q210 PolarHBondContact O-N 3.03Å; Q210-S212 WeakPolarHBondContact CG-OG 3.5Å; Q210-S212 PolarHBondContact O-N 2.97Å; Q210-S212 VanDerWaalsContact O-N 3.11Å; Q210-S212 PolarHBondContact O-OG 3.41Å
211I26.7Very low25.5Very low89 Ų89149.3 Ų149.346%0.45668%0.683SS.*  trans-75.1103.9171.7-57.6177.7000107.2I186 L209 H213I186-I211 HydrophobicContact CD1-CD1 3.67Å; L209-I211 HydrophobicContact CD2-CD1 3.91Å; L209-I211 HydrophobicContact CD2-CG1 3.81Å; L209-I211 HydrophobicContact CG-CG1 4.35Å; L209-I211 PolarHBondContact O-N 3.1Å; I211-H213 HydrophobicContact CG2-CB 4.44Å
212S24.5Very low25.5Very low79 Ų79151.2 Ų151.255%0.55269%0.685SS**  trans-109.647.9-177.2-420000109.8Q210Q210-S212 WeakPolarHBondContact CG-OG 3.5Å; Q210-S212 PolarHBondContact O-N 2.97Å; Q210-S212 VanDerWaalsContact O-N 3.11Å; Q210-S212 PolarHBondContact O-OG 3.41Å
213H24.9Very low25.4Very low147 Ų147152.6 Ų152.668%0.68170%0.701SS**  trans-116.2127.7-173.9-78-9.6000112.8I211I211-H213 HydrophobicContact CG2-CB 4.44Å
214F25.5Very low25.3Very low158 Ų158151.2 Ų151.269%0.69370%0.704SS**  trans-68.8119.4170.7-179.2-96.7000108.6H217F214-H217 AromaticContact CZ-CD2 3.9Å
215I23.8Very low25.3Very low107 Ų107144.4 Ų144.455%0.54970%0.699SS.*  trans-130.478.8-178.9-53.8172.5000107.6L188L188-I215 HydrophobicContact CD1-CD1 3.64Å
216G25.4Very low25.4Very low45 Ų45138.9 Ų138.946%0.46470%0.696SS.*  trans79.5159.9160.900000118.5
217H23.4Very low25.3Very low157 Ų157136.4 Ų136.473%0.72769%0.692SS**  trans-105.6141.9173-101.2-118.6000109.7F214F214-H217 AromaticContact CZ-CD2 3.9Å
218V26.9Very low25.3Very low101 Ų101136.7 Ų136.761%0.61271%0.711SS**  trans-110.6121.9165.1179.30000108.6
219H24.4Very low25.4Very low173 Ų173131.7 Ų131.780%0.80170%0.702SS**  trans-88.4133.2175.7-111.3-88.1000110.6
220W25.2Very low25.4Very low203 Ų203135.3 Ų135.377%0.76972%0.721SS**  trans-76.7133.5170-64.576.5000109.6
221K25.4Very low25.3Very low190 Ų190134.7 Ų134.783%0.82672%0.722SS**  trans-115.7110.5168.5-164.5178.8-176.2-177.20108.3T223K221-T223 PolarHBondContact O-N 3.39Å
222Y24.4Very low25.3Very low208 Ų208134.3 Ų134.382%0.81673%0.733SS**  trans-71.1114.4170.1-70.8-89.8000108.6
223T25.4Very low25.4Very low123 Ų123136.2 Ų136.276%0.75574%0.743SS**  trans-9397.916445.80000107.8K221 A225K221-T223 PolarHBondContact O-N 3.39Å; T223-A225 VanDerWaalsContact C-N 3.33Å; T223-A225 PolarHBondContact O-N 3Å
224T25Very low25.4Very low129 Ų129137.5 Ų137.579%0.79175%0.75SS**  trans-67.796.8160.745.20000107.2A226T224-A226 PolarHBondContact O-N 3.24Å
225A27Very low25.5Very low99 Ų99135.3 Ų135.382%0.81875%0.745SS**  trans-67.182.6162.900000107.5T223T223-A225 VanDerWaalsContact C-N 3.33Å; T223-A225 PolarHBondContact O-N 3Å
226A24.6Very low25.6Very low82 Ų82136 Ų13668%0.67876%0.755SS**  trans-70.4130.2165.100000107.9T224T224-A226 PolarHBondContact O-N 3.24Å
227K24.8Very low25.6Very low202 Ų202138.6 Ų138.688%0.87876%0.764SS**SBendtrans88.5124.1172.6-57.1-179.4175.5-178.50115.5
228A25.6Very low25.7Very low105 Ų105138 Ų13887%0.86876%0.762SS**SBendtrans85.376.1165.900000117.1
229S27.1Very low25.7Very low100 Ų100138 Ų13870%0.69976%0.758SS**  160.9124.7128.4-179.60000110.1L231S229-L231 PolarHBondContact O-N 2.94Å
230L25.7Very low25.7Very low183 Ų183139.3 Ų139.396%0.95876%0.756SS**SBendtrans-72.132.2-176.5-88.1150.7000114.3
231L26.2Very low25.8Very low148 Ų148135.1 Ų135.178%0.77574%0.743SS**SBendtrans-137.1114-179.1-71.9165.2000109.8S229S229-L231 PolarHBondContact O-N 2.94Å
232A27.5Very low25.7Very low82 Ų82134.1 Ų134.168%0.67875%0.746SS**  trans16.2126171.600000118.9Q234A232-Q234 PolarHBondContact O-N 3.28Å
233P25Very low25.7Very low119 Ų119132.8 Ų132.877%0.77375%0.747SS**  trans-58.9106.4178.824.6-32.4000111.7N235P233-N235 PolarHBondContact O-N 3.17Å
234Q25.8Very low25.7Very low174 Ų174132.6 Ų132.681%0.81375%0.748SS**  trans-78.899.1171-69.1-171.1-1.200109.1A232 T236A232-Q234 PolarHBondContact O-N 3.28Å; Q234-T236 PolarHBondContact O-N 3.39Å; Q234-T236 VanDerWaalsContact O-N 3.13Å
235N26.6Very low25.6Very low111 Ų111132.6 Ų132.659%0.59475%0.748SS**  trans-76.292.6170.2-73.4-45.8000109.7P233P233-N235 PolarHBondContact O-N 3.17Å
236T25.5Very low25.4Very low123 Ų123132.9 Ų132.976%0.75574%0.741SS**  trans-91.4131.9172.647.70000110.6Q234Q234-T236 PolarHBondContact O-N 3.39Å; Q234-T236 VanDerWaalsContact O-N 3.13Å
237C26.3Very low25.3Very low99 Ų99136.5 Ų136.567%0.66975%0.748SS**  trans-103113.2170.7-174.90000107.2
238E25.4Very low25.1Very low144 Ų144135.9 Ų135.967%0.67374%0.741SS**  trans-91.5115.3178.6-155.8-178.1-133.400109.5R240E238-R240 HydrophobicContact CG-CG 4.49Å; E238-R240 IonicContact OE2-CZ 3.38Å; E238-R240 IonicContact OE2-NE 2.88Å; E238-R240 PolarHBondContact OE2-NE 3.17Å; E238-R240 IonicContact OE2-NH2 2.96Å; E238-R240 PolarHBondContact OE2-NH2 3.11Å
239L26.2Very low25Very low100 Ų100138.8 Ų138.852%0.52474%0.736SS.*  trans-97.3101.9175.3-124.6150.7000107.6V100 F241V100-L239 HydrophobicContact CB-CD1 4.4Å; V100-L239 HydrophobicContact CG1-CD1 4.15Å; L239-F241 HydrophobicContact CD2-CE2 4.42Å; L239-F241 HydrophobicContact CD2-CZ 4.26Å
240R25.7Very low24.7Very low202 Ų202141.3 Ų141.376%0.76274%0.742SS**  trans-87.3115.9176.9-67.5-173.7179.6-161.4-4.9110E238E238-R240 HydrophobicContact CG-CG 4.49Å; E238-R240 IonicContact OE2-CZ 3.38Å; E238-R240 IonicContact OE2-NE 2.88Å; E238-R240 PolarHBondContact OE2-NE 3.17Å; E238-R240 IonicContact OE2-NH2 2.96Å; E238-R240 PolarHBondContact OE2-NH2 3.11Å
241F26.6Very low24.6Very low115 Ų115138.3 Ų138.350%0.50473%0.726SS.*PPolyproline II helixtrans-82.5127.3169.3-68.6-87.7000109.2I97 V100 L239 E243I97-F241 HydrophobicContact CB-CE1 4.49Å; I97-F241 HydrophobicContact CG2-CE1 3.88Å; I97-F241 HydrophobicContact CG2-CZ 4.03Å; V100-F241 HydrophobicContact CG2-CZ 4.04Å; L239-F241 HydrophobicContact CD2-CE2 4.42Å; L239-F241 HydrophobicContact CD2-CZ 4.26Å; F241-E243 PolarHBondContact O-N 3.34Å
242L23.7Very low24.3Very low169 Ų169142.5 Ų142.589%0.88573%0.731SS**PPolyproline II helixtrans-68.7124166.5-71.3162.6000107.8
243E23.6Very low24.1Very low180 Ų180148.4 Ų148.484%0.84174%0.741SS**PPolyproline II helixtrans-54.5133179.9-70.1-175.2159.100111.3F241 T245F241-E243 PolarHBondContact O-N 3.34Å; E243-T245 PolarHBondContact O-N 2.71Å
244P25.4Very low24Very low119 Ų119152.5 Ų152.577%0.77375%0.748SS**  trans-70.1114.5174.926.3-30.1000109.9
245T23.1Very low24Very low129 Ų129149 Ų14979%0.79174%0.742SS**  trans-59.9126.5170.8-6.80000109.4E243 I247E243-T245 PolarHBondContact O-N 2.71Å; T245-I247 PolarHBondContact O-N 2.99Å
246P22.2Very low23.9Very low104 Ų104149 Ų14968%0.67575%0.751SS**  trans-75.2126.6-174.628.8-32000110.6
247I22.9Very low23.8Very low158 Ų158150 Ų15081%0.8175%0.752SS**  trans-122.6110.2165-58.1178.3000107.5T245T245-I247 PolarHBondContact O-N 2.99Å
248Y21.2Very low24Very low190 Ų190151.8 Ų151.875%0.74575%0.748SS**  trans-69.6137.4176.4-75.8-98.7000111.9
249H22.5Very low24.2Very low166 Ų166150.7 Ų150.777%0.76975%0.747SS**  154132.6124.6-84.6-64.5000115.5
250N21.3Very low24.3Very low153 Ų153149.7 Ų149.782%0.81875%0.746SS**  trans71.2101.7152.9-64.5-17.2000121.2
251I23.2Very low24.4Very low119 Ų119144.8 Ų144.861%0.6174%0.742SS**  trans-124.8123.7160-51.6159.3000108
252R21.2Very low24.6Very low236 Ų236146.5 Ų146.589%0.89176%0.757SS**  trans-91.3137.2164.1-76.7-176.2175.7-172.4-1109.5
253K22.1Very low25Very low206 Ų206140.4 Ų140.490%0.89673%0.725SS**  trans-56.9143.2175.7-82.2174.4168.9176.70112.3
254F24.5Very low25.1Very low206 Ų206136.1 Ų136.190%0.90471%0.713SS**  trans-127.6151.9154-86.3-80.6000110.2
255S24.2Very low25.2Very low99 Ų99135.8 Ų135.869%0.69270%0.699SS**  trans-95.5169.3-145.7520000117.3D257S255-D257 PolarHBondContact O-N 3.46Å; S255-D257 VanDerWaalsContact O-N 3.14Å
256S24.5Very low25.4Very low111 Ų111138.3 Ų138.378%0.77669%0.694SS**  trans-49.114.5-171.945.80000123.8F258S256-F258 PolarHBondContact O-N 3.4Å
257D24.4Very low25.5Very low146 Ų146138.6 Ų138.678%0.78169%0.694SS**  trans-100.351.4-165.5-62.4-18.2000115.9S255S255-D257 PolarHBondContact O-N 3.46Å; S255-D257 VanDerWaalsContact O-N 3.14Å
258F29.5Very low25.8Very low136 Ų136137 Ų13760%0.59668%0.683SS**  trans-107.4105176.6-152.4-94.4000112.2A122 S256 P260A122-F258 HydrophobicContact CB-CE1 4.12Å; A122-F258 HydrophobicContact CB-CE2 4.23Å; A122-F258 HydrophobicContact CB-CZ 3.63Å; S256-F258 PolarHBondContact O-N 3.4Å; F258-P260 WeakPolarHBondContact O-CD 3.43Å
259N30.6Very low26.1Very low121 Ų121131.4 Ų131.465%0.64767%0.665SS**  trans-94.4109.7175.2-168.2-13000110.9C261N259-C261 VanDerWaalsContact C-N 3.32Å; N259-C261 PolarHBondContact O-N 3.29Å
260P28.8Very low26.5Very low78 Ų78129.8 Ų129.851%0.50666%0.658SS.*G310 helixtrans-76.1-7.2-167.427.6-33.7000115.8F258F258-P260 WeakPolarHBondContact O-CD 3.43Å
261C27.9Very low26.8Very low100 Ų100125.2 Ų125.268%0.67664%0.641SS**G310 helixtrans-89.6-11.9-167.5-64.40000115.8N259N259-C261 VanDerWaalsContact C-N 3.32Å; N259-C261 PolarHBondContact O-N 3.29Å
262N30.5Very low27.4Very low151 Ų151122.7 Ų122.781%0.80763%0.634SS**G310 helixtrans-11122.5-177.2-84.7-15.7000113.8P264N262-P264 WeakPolarHBondContact O-CD 3.49Å
263N31Very low28.1Very low41 Ų41116.4 Ų116.422%0.21962%0.618CS.*  trans-91.5107.6-168.9-156.1-12.2000112.3F265 R266N263-F265 PolarHBondContact O-N 3Å; N263-F265 VanDerWaalsContact OD1-CB 3.3Å; N263-F265 WeakPolarHBondContact OD1-CB 3.28Å; N263-F265 WeakPolarHBondContact OD1-CD2 3.31Å; N263-F265 PolarHBondContact OD1-N 3.02Å; N263-R266 PolarHBondContact O-N 3.2Å
264P26.9Very low28.9Very low90 Ų90109.8 Ų109.858%0.58460%0.597SS**Hα-helixtrans-57.8-16.5174.123.3-33.3000113.1N262 R266 V267 Q268N262-P264 WeakPolarHBondContact O-CD 3.49Å; P264-R266 VanDerWaalsContact C-N 3.26Å; P264-R266 PolarHBondContact O-N 3.06Å; P264-V267 PolarHBondContact O-N 2.93Å; P264-Q268 PolarHBondContact O-N 3.46Å
265F27.3Very low29.9Very low111 Ų111103.9 Ų103.949%0.48758%0.581SS.*Hα-helixtrans-59.3-32.3170.3-81-103.8000113.4N263 V267 Q268 L269N263-F265 PolarHBondContact O-N 3Å; N263-F265 VanDerWaalsContact OD1-CB 3.3Å; N263-F265 WeakPolarHBondContact OD1-CB 3.28Å; N263-F265 WeakPolarHBondContact OD1-CD2 3.31Å; N263-F265 PolarHBondContact OD1-N 3.02Å; F265-V267 PolarHBondContact O-N 3.15Å; F265-Q268 PolarHBondContact O-N 3.48Å; F265-L269 VanDerWaalsContact O-CB 3.22Å; F265-L269 WeakPolarHBondContact O-CB 3.42Å; F265-L269 PolarHBondContact O-N 2.87Å
266R26.4Very low30.6Very low183 Ų183103.5 Ų103.569%0.69157%0.571SS**Hα-helixtrans-67-39.3-177.3-162.1176.1-178.9-176.60.4111.6N263 P264 Q270N263-R266 PolarHBondContact O-N 3.2Å; P264-R266 VanDerWaalsContact C-N 3.26Å; P264-R266 PolarHBondContact O-N 3.06Å; R266-Q270 WeakPolarHBondContact O-CB 3.34Å; R266-Q270 PolarHBondContact O-N 3.17Å
267V25.6Very low31.7Very low109 Ų109101.8 Ų101.866%0.66155%0.548SS*.Hα-helixtrans-71-40.6177.9-178.20000111.4P264 F265 A271P264-V267 PolarHBondContact O-N 2.93Å; F265-V267 PolarHBondContact O-N 3.15Å; V267-A271 PolarHBondContact O-N 3.34Å; V267-A271 VanDerWaalsContact O-N 3.13Å
268Q27.9Very low33.1Very low125 Ų12597.4 Ų97.458%0.58453%0.527SS*.Hα-helixtrans-70-38.3178-74.4-176.7-12.600113.1P264 F265 Q270 A271 S272P264-Q268 PolarHBondContact O-N 3.46Å; F265-Q268 PolarHBondContact O-N 3.48Å; Q268-Q270 VanDerWaalsContact C-N 3.35Å; Q268-A271 PolarHBondContact O-N 2.91Å; Q268-S272 WeakPolarHBondContact O-CB 3.24Å; Q268-S272 PolarHBondContact O-N 2.85Å; Q268-S272 PolarHBondContact O-OG 3.31Å
269L28.4Very low33.9Very low72 Ų7292.5 Ų92.538%0.37752%0.515SS..Hα-helixtrans-64.3-42.3176-169.775.3000110.8F265 S272 I273F265-L269 VanDerWaalsContact O-CB 3.22Å; F265-L269 WeakPolarHBondContact O-CB 3.42Å; F265-L269 PolarHBondContact O-N 2.87Å; L269-S272 PolarHBondContact O-N 3.46Å; L269-I273 HydrophobicContact CD2-CD1 4.41Å; L269-I273 HydrophobicContact CG-CD1 3.96Å; L269-I273 VanDerWaalsContact O-CG1 3.28Å; L269-I273 WeakPolarHBondContact O-CG1 3.3Å; L269-I273 PolarHBondContact O-N 3.15Å
270Q30.7Very low34.7Very low133 Ų13389.4 Ų89.462%0.62150%0.498SS*.Hα-helixtrans-62.9-44.5176.9-167.3169.2-200111.8R266 Q268 S272 I273 S274R266-Q270 WeakPolarHBondContact O-CB 3.34Å; R266-Q270 PolarHBondContact O-N 3.17Å; Q268-Q270 VanDerWaalsContact C-N 3.35Å; Q270-S272 VanDerWaalsContact C-N 3.31Å; Q270-S272 PolarHBondContact O-N 3.04Å; Q270-I273 PolarHBondContact O-N 2.98Å; Q270-S274 WeakPolarHBondContact O-CB 3.37Å; Q270-S274 PolarHBondContact O-N 3.34Å; Q270-S274 PolarHBondContact O-OG 3.14Å; Q270-S274 VanDerWaalsContact O-OG 3.1Å
271A27.8Very low35.9Very low56 Ų5688.6 Ų88.646%0.46349%0.487SS..Hα-helixtrans-62.5-36.2175.500000113.2V267 Q268 S275V267-A271 PolarHBondContact O-N 3.34Å; V267-A271 VanDerWaalsContact O-N 3.13Å; Q268-A271 PolarHBondContact O-N 2.91Å; A271-S275 PolarHBondContact O-N 3.12Å; A271-S275 PolarHBondContact O-OG 3.42Å
272S34.9Very low37.2Very low66 Ų6686.5 Ų86.546%0.46247%0.469SS..Hα-helixtrans-72.2-41.1179.3-56.60000111.9Q268 L269 Q270 S275 L276Q268-S272 WeakPolarHBondContact O-CB 3.24Å; Q268-S272 PolarHBondContact O-N 2.85Å; Q268-S272 PolarHBondContact O-OG 3.31Å; L269-S272 PolarHBondContact O-N 3.46Å; Q270-S272 VanDerWaalsContact C-N 3.31Å; Q270-S272 PolarHBondContact O-N 3.04Å; S272-S275 PolarHBondContact O-N 3.3Å; S272-L276 WeakPolarHBondContact O-CB 3.39Å; S272-L276 PolarHBondContact O-N 2.84Å
273I35.4Very low38Very low105 Ų10584.7 Ų84.754%0.53846%0.456SS..Hα-helixtrans-64.6-43.4174.8-68.2167.7000110.5L269 Q270 S275 L276 Y277L269-I273 HydrophobicContact CD2-CD1 4.41Å; L269-I273 HydrophobicContact CG-CD1 3.96Å; L269-I273 VanDerWaalsContact O-CG1 3.28Å; L269-I273 WeakPolarHBondContact O-CG1 3.3Å; L269-I273 PolarHBondContact O-N 3.15Å; Q270-I273 PolarHBondContact O-N 2.98Å; I273-S275 VanDerWaalsContact C-N 3.31Å; I273-S275 PolarHBondContact O-N 3.17Å; I273-L276 PolarHBondContact O-N 3.46Å; I273-Y277 PolarHBondContact O-N 2.9Å
274S40.6Very low39.1Very low66 Ų6688.3 Ų88.346%0.46247%0.467SS..Hα-helixtrans-60.4-40174.5-64.40000112.2Q270 Y277 T278Q270-S274 WeakPolarHBondContact O-CB 3.37Å; Q270-S274 PolarHBondContact O-N 3.34Å; Q270-S274 PolarHBondContact O-OG 3.14Å; Q270-S274 VanDerWaalsContact O-OG 3.1Å; S274-Y277 WeakPolarHBondContact O-CB 3.47Å; S274-Y277 PolarHBondContact O-N 2.92Å; S274-T278 PolarHBondContact O-N 3.38Å; S274-T278 PolarHBondContact O-OG1 3.24Å; S274-T278 VanDerWaalsContact O-OG1 3.04Å
275S44.2Very low40.4Very low82 Ų8288.4 Ų88.457%0.57346%0.462SS*.Hα-helixtrans-66.3-37.9176.8-57.50000112.4A271 S272 I273 Y277 T278 G279A271-S275 PolarHBondContact O-N 3.12Å; A271-S275 PolarHBondContact O-OG 3.42Å; S272-S275 PolarHBondContact O-N 3.3Å; I273-S275 VanDerWaalsContact C-N 3.31Å; I273-S275 PolarHBondContact O-N 3.17Å; S275-Y277 VanDerWaalsContact C-N 3.34Å; S275-T278 PolarHBondContact O-N 3.26Å; S275-G279 PolarHBondContact O-N 2.56Å
276L39.6Very low41.9Very low91 Ų9188.8 Ų88.848%0.47647%0.474SS..Hα-helixtrans-67.9-36.8176.6-154.6143.8000111.2S272 I273 L280S272-L276 WeakPolarHBondContact O-CB 3.39Å; S272-L276 PolarHBondContact O-N 2.84Å; I273-L276 PolarHBondContact O-N 3.46Å; L276-L280 HydrophobicContact CD2-CD1 3.79Å; L276-L280 WeakPolarHBondContact O-CG 3.25Å; L276-L280 PolarHBondContact O-N 3.25Å; L276-L280 VanDerWaalsContact O-N 3.14Å
277Y46.6Very low43Very low76 Ų7686.2 Ų86.230%0.29846%0.464SS..Hα-helixtrans-61-53171.5-167.2-84.6000112I273 S274 S275 G279 L280 E281 V299 L301I273-Y277 PolarHBondContact O-N 2.9Å; S274-Y277 WeakPolarHBondContact O-CB 3.47Å; S274-Y277 PolarHBondContact O-N 2.92Å; S275-Y277 VanDerWaalsContact C-N 3.34Å; Y277-G279 VanDerWaalsContact C-N 3.29Å; Y277-G279 PolarHBondContact O-N 2.85Å; Y277-L280 PolarHBondContact O-N 3.47Å; Y277-E281 WeakPolarHBondContact O-CB 3.34Å; Y277-E281 PolarHBondContact O-N 3.23Å; Y277-V299 WeakPolarHBondContact CE2-O 3.36Å; Y277-V299 PolarHBondContact OH-O 2.95Å; Y277-L301 HydrophobicContact CD2-CB 4.23Å; Y277-L301 HydrophobicContact CD2-CD1 3.25Å; Y277-L301 HydrophobicContact CD2-CG 3.63Å; Y277-L301 HydrophobicContact CE2-CB 4.46Å; Y277-L301 HydrophobicContact CE2-CD1 3.6Å; Y277-L301 HydrophobicContact CE2-CG 3.59Å; Y277-L301 HydrophobicContact CG-CD1 3.83Å
278T53.6Low44.2Very low54 Ų5484.3 Ų84.333%0.33147%0.467SS..Hα-helixtrans-60.5-39179.3-53.30000111.7S274 S275 L280 E281 D282S274-T278 PolarHBondContact O-N 3.38Å; S274-T278 PolarHBondContact O-OG1 3.24Å; S274-T278 VanDerWaalsContact O-OG1 3.04Å; S275-T278 PolarHBondContact O-N 3.26Å; T278-L280 PolarHBondContact O-N 3.26Å; T278-E281 PolarHBondContact O-N 3.29Å; T278-D282 VanDerWaalsContact O-CB 3.3Å; T278-D282 WeakPolarHBondContact O-CB 3.32Å; T278-D282 VanDerWaalsContact O-CG 3.28Å; T278-D282 PolarHBondContact O-N 3.46Å
279G46.9Very low45.5Very low33 Ų3383 Ų8334%0.3446%0.461SS..Hα-helixtrans-65.6-36176.900000114.1S275 Y277 Q283S275-G279 PolarHBondContact O-N 2.56Å; Y277-G279 VanDerWaalsContact C-N 3.29Å; Y277-G279 PolarHBondContact O-N 2.85Å; G279-Q283 WeakPolarHBondContact O-CG 3.46Å; G279-Q283 PolarHBondContact O-N 3.23Å; G279-Q283 VanDerWaalsContact O-N 3.15Å
280L47.2Very low46.6Very low56 Ų5684.7 Ų84.729%0.29347%0.47SS..Hα-helixtrans-74.6-41.8175.4-75.5170.7000111.6L276 Y277 T278 Q283 Y284 L301L276-L280 HydrophobicContact CD2-CD1 3.79Å; L276-L280 WeakPolarHBondContact O-CG 3.25Å; L276-L280 PolarHBondContact O-N 3.25Å; L276-L280 VanDerWaalsContact O-N 3.14Å; Y277-L280 PolarHBondContact O-N 3.47Å; T278-L280 PolarHBondContact O-N 3.26Å; L280-Q283 PolarHBondContact O-N 2.84Å; L280-Y284 WeakPolarHBondContact O-CD2 3.48Å; L280-Y284 PolarHBondContact O-N 3.38Å; L280-L301 HydrophobicContact CB-CD1 3.86Å; L280-L301 HydrophobicContact CD1-CD1 3.69Å; L280-L301 HydrophobicContact CG-CD1 4.42Å
281E54.6Low47.5Very low61 Ų6180.1 Ų80.129%0.28545%0.448SS..Hα-helixtrans-58.3-49.1173.9-171-179.6-173.800110.9Y277 T278 Q283 Y284 L285 F291Y277-E281 WeakPolarHBondContact O-CB 3.34Å; Y277-E281 PolarHBondContact O-N 3.23Å; T278-E281 PolarHBondContact O-N 3.29Å; E281-Q283 VanDerWaalsContact C-N 3.34Å; E281-Q283 PolarHBondContact O-N 3.26Å; E281-Y284 PolarHBondContact O-N 2.86Å; E281-L285 HydrophobicContact CG-CD1 4.08Å; E281-L285 WeakPolarHBondContact O-CB 3.19Å; E281-L285 WeakPolarHBondContact O-CG 3.36Å; E281-L285 PolarHBondContact O-N 3.1Å; E281-F291 HydrophobicContact CB-CE2 4.28Å; E281-F291 HydrophobicContact CB-CZ 4.35Å; E281-F291 HydrophobicContact CG-CD2 4.37Å; E281-F291 HydrophobicContact CG-CE2 3.86Å; E281-F291 HydrophobicContact CG-CZ 4.27Å
282D54.4Low48.5Very low56 Ų5681 Ų8130%0.29945%0.451SS..Hα-helixtrans-58.8-44.1175.8-78.5-17.5000111.2T278 Y284 L285 T286T278-D282 VanDerWaalsContact O-CB 3.3Å; T278-D282 WeakPolarHBondContact O-CB 3.32Å; T278-D282 VanDerWaalsContact O-CG 3.28Å; T278-D282 PolarHBondContact O-N 3.46Å; D282-Y284 PolarHBondContact O-N 3.36Å; D282-L285 PolarHBondContact O-N 3.3Å; D282-T286 VanDerWaalsContact O-CB 3.25Å; D282-T286 WeakPolarHBondContact O-CB 3.33Å; D282-T286 PolarHBondContact O-N 3.06Å; D282-T286 PolarHBondContact O-OG1 3.09Å
283Q47.2Very low48.9Very low113 Ų11382.2 Ų82.253%0.52846%0.459SS..Hα-helixtrans-63.9-39.5178.1-80-17516.900113.3G279 L280 E281 R287G279-Q283 WeakPolarHBondContact O-CG 3.46Å; G279-Q283 PolarHBondContact O-N 3.23Å; G279-Q283 VanDerWaalsContact O-N 3.15Å; L280-Q283 PolarHBondContact O-N 2.84Å; E281-Q283 VanDerWaalsContact C-N 3.34Å; E281-Q283 PolarHBondContact O-N 3.26Å; Q283-R287 WeakPolarHBondContact O-CG 3.41Å; Q283-R287 PolarHBondContact O-N 3.49Å
284Y54.2Low49.3Very low116 Ų11681.5 Ų81.546%0.45545%0.452SS..Hα-helixtrans-67.1-48.4176.8-97.6-103.6000111L280 E281 D282 T286 R287 H289 F291L280-Y284 WeakPolarHBondContact O-CD2 3.48Å; L280-Y284 PolarHBondContact O-N 3.38Å; E281-Y284 PolarHBondContact O-N 2.86Å; D282-Y284 PolarHBondContact O-N 3.36Å; Y284-T286 VanDerWaalsContact C-N 3.34Å; Y284-T286 PolarHBondContact O-N 3.36Å; Y284-R287 PolarHBondContact O-N 2.95Å; Y284-H289 HydrophobicContact CD1-CB 3.74Å; Y284-H289 HydrophobicContact CG-CB 4.48Å; Y284-H289 WeakPolarHBondContact O-CB 3.36Å; Y284-H289 PolarHBondContact O-N 3.2Å; Y284-H289 VanDerWaalsContact O-N 3.09Å; Y284-F291 HydrophobicContact CD1-CE2 4.35Å; Y284-F291 HydrophobicContact CD1-CZ 4.05Å; Y284-F291 HydrophobicContact CD2-CZ 4.18Å; Y284-F291 HydrophobicContact CG-CE1 4.47Å; Y284-F291 AromaticContact CG-CE2 3.91Å; Y284-F291 HydrophobicContact CG-CE2 3.91Å; Y284-F291 AromaticContact CG-CZ 3.63Å; Y284-F291 HydrophobicContact CG-CZ 3.63Å
285L55.3Low49.2Very low92 Ų9284.4 Ų84.448%0.48246%0.462SS..Hα-helixtrans-61.4-41177.1-70.8173.6000112E281 D282 R287 G288 F291E281-L285 HydrophobicContact CG-CD1 4.08Å; E281-L285 WeakPolarHBondContact O-CB 3.19Å; E281-L285 WeakPolarHBondContact O-CG 3.36Å; E281-L285 PolarHBondContact O-N 3.1Å; D282-L285 PolarHBondContact O-N 3.3Å; L285-R287 PolarHBondContact O-N 2.96Å; L285-G288 PolarHBondContact O-N 2.88Å; L285-G288 VanDerWaalsContact O-N 3.12Å; L285-F291 HydrophobicContact CD2-CD2 4.01Å; L285-F291 HydrophobicContact CG-CD2 4.09Å; L285-F291 HydrophobicContact CG-CE2 4.24Å
286T59.2Low49.2Very low120 Ų12088.8 Ų88.874%0.73648%0.479SS*.Hα-helixtrans-67.3-24179.9-48.30000112.3D282 Y284 G288D282-T286 VanDerWaalsContact O-CB 3.25Å; D282-T286 WeakPolarHBondContact O-CB 3.33Å; D282-T286 PolarHBondContact O-N 3.06Å; D282-T286 PolarHBondContact O-OG1 3.09Å; Y284-T286 VanDerWaalsContact C-N 3.34Å; Y284-T286 PolarHBondContact O-N 3.36Å; T286-G288 VanDerWaalsContact C-N 3.31Å
287R48.9Very low49.2Very low128 Ų12891.7 Ų91.748%0.48349%0.488SS..THydrogen-bonded Turntrans-88.96.5176.1-72.6-179.3-180-162.11.4113.5Q283 Y284 L285 H289Q283-R287 WeakPolarHBondContact O-CG 3.41Å; Q283-R287 PolarHBondContact O-N 3.49Å; Y284-R287 PolarHBondContact O-N 2.95Å; L285-R287 PolarHBondContact O-N 2.96Å; R287-H289 VanDerWaalsContact CB-CD2 3.48Å; R287-H289 WeakPolarHBondContact CB-CD2 3.42Å; R287-H289 PolarHBondContact O-N 2.95Å
288G50.1Low49Very low70 Ų7092.2 Ų92.272%0.72250%0.501SS*.THydrogen-bonded Turntrans70.616.1-177.600000113.3L285 T286 D290L285-G288 PolarHBondContact O-N 2.88Å; L285-G288 VanDerWaalsContact O-N 3.12Å; T286-G288 VanDerWaalsContact C-N 3.31Å; G288-D290 PolarHBondContact O-N 3.14Å
289H54.8Low48.6Very low97 Ų9790.9 Ų90.945%0.44949%0.492SS..  trans-78.8121.9170.9-62.3-59.9000108.6Y284 R287Y284-H289 HydrophobicContact CD1-CB 3.74Å; Y284-H289 HydrophobicContact CG-CB 4.48Å; Y284-H289 WeakPolarHBondContact O-CB 3.36Å; Y284-H289 PolarHBondContact O-N 3.2Å; Y284-H289 VanDerWaalsContact O-N 3.09Å; R287-H289 VanDerWaalsContact CB-CD2 3.48Å; R287-H289 WeakPolarHBondContact CB-CD2 3.42Å; R287-H289 PolarHBondContact O-N 2.95Å
290D51.7Low48.4Very low108 Ų10898.1 Ų98.158%0.57851%0.511SS*.  trans-81.2120.3177.5-165.9-4.4000109.9G288 S292 C293G288-D290 PolarHBondContact O-N 3.14Å; D290-S292 PolarHBondContact O-N 3.34Å; D290-S292 WeakPolarHBondContact OD1-CB 3.19Å; D290-S292 PolarHBondContact OD1-N 3.13Å; D290-S292 PolarHBondContact OD1-OG 2.63Å; D290-S292 WeakPolarHBondContact OD2-CB 3.03Å; D290-S292 PolarHBondContact OD2-OG 3.13Å; D290-C293 PolarHBondContact O-SG 3.26Å
291F50.4Low48.1Very low37 Ų3799.4 Ų99.416%0.16252%0.517CS..G310 helixtrans-71.5-2.1169.8-83.7-84.5000112.4E281 Y284 L285 C293 F294E281-F291 HydrophobicContact CB-CE2 4.28Å; E281-F291 HydrophobicContact CB-CZ 4.35Å; E281-F291 HydrophobicContact CG-CD2 4.37Å; E281-F291 HydrophobicContact CG-CE2 3.86Å; E281-F291 HydrophobicContact CG-CZ 4.27Å; Y284-F291 HydrophobicContact CD1-CE2 4.35Å; Y284-F291 HydrophobicContact CD1-CZ 4.05Å; Y284-F291 HydrophobicContact CD2-CZ 4.18Å; Y284-F291 HydrophobicContact CG-CE1 4.47Å; Y284-F291 AromaticContact CG-CE2 3.91Å; Y284-F291 HydrophobicContact CG-CE2 3.91Å; Y284-F291 AromaticContact CG-CZ 3.63Å; Y284-F291 HydrophobicContact CG-CZ 3.63Å; L285-F291 HydrophobicContact CD2-CD2 4.01Å; L285-F291 HydrophobicContact CG-CD2 4.09Å; L285-F291 HydrophobicContact CG-CE2 4.24Å; F291-C293 PolarHBondContact O-N 3.03Å; F291-C293 VanDerWaalsContact O-N 3.11Å; F291-F294 HydrophobicContact CB-CD2 4.43Å; F291-F294 AromaticContact CD1-CD2 3.64Å; F291-F294 HydrophobicContact CD1-CD2 3.64Å; F291-F294 AromaticContact CD1-CE2 3.67Å; F291-F294 HydrophobicContact CD1-CE2 3.67Å; F291-F294 HydrophobicContact CE1-CD2 4.45Å; F291-F294 HydrophobicContact CE1-CE2 4.08Å; F291-F294 HydrophobicContact CG-CD2 4.47Å; F291-F294 WeakPolarHBondContact O-CB 3.2Å; F291-F294 WeakPolarHBondContact O-CD2 3.18Å; F291-F294 PolarHBondContact O-N 2.57Å
292S48.5Very low47.5Very low73 Ų7399.2 Ų99.251%0.5153%0.532SS..G310 helixtrans-57.9-21.1174700000113.8D290 F294D290-S292 PolarHBondContact O-N 3.34Å; D290-S292 WeakPolarHBondContact OD1-CB 3.19Å; D290-S292 PolarHBondContact OD1-N 3.13Å; D290-S292 PolarHBondContact OD1-OG 2.63Å; D290-S292 WeakPolarHBondContact OD2-CB 3.03Å; D290-S292 PolarHBondContact OD2-OG 3.13Å; S292-F294 PolarHBondContact O-N 3.21Å; S292-F294 VanDerWaalsContact O-N 3.11Å
293C42.5Very low46.8Very low93 Ų93102.5 Ų102.563%0.62855%0.545SS*.G310 helixtrans-63.7-10.4171.655.80000113.8D290 F291D290-C293 PolarHBondContact O-SG 3.26Å; F291-C293 PolarHBondContact O-N 3.03Å; F291-C293 VanDerWaalsContact O-N 3.11Å
294F43.9Very low46.3Very low89 Ų89100.7 Ų100.739%0.3956%0.557SS.*SBendtrans-10280.1169.6-58.3-81.6000109.3F291 S292 N296 V299F291-F294 HydrophobicContact CB-CD2 4.43Å; F291-F294 AromaticContact CD1-CD2 3.64Å; F291-F294 HydrophobicContact CD1-CD2 3.64Å; F291-F294 AromaticContact CD1-CE2 3.67Å; F291-F294 HydrophobicContact CD1-CE2 3.67Å; F291-F294 HydrophobicContact CE1-CD2 4.45Å; F291-F294 HydrophobicContact CE1-CE2 4.08Å; F291-F294 HydrophobicContact CG-CD2 4.47Å; F291-F294 WeakPolarHBondContact O-CB 3.2Å; F291-F294 WeakPolarHBondContact O-CD2 3.18Å; F291-F294 PolarHBondContact O-N 2.57Å; S292-F294 PolarHBondContact O-N 3.21Å; S292-F294 VanDerWaalsContact O-N 3.11Å; F294-N296 VanDerWaalsContact C-N 3.3Å; F294-N296 PolarHBondContact O-N 2.86Å; F294-V299 HydrophobicContact CB-CG2 3.39Å; F294-V299 HydrophobicContact CD1-CB 4.28Å; F294-V299 HydrophobicContact CD1-CG1 4.09Å; F294-V299 HydrophobicContact CD1-CG2 3.32Å; F294-V299 HydrophobicContact CD2-CG2 3.62Å; F294-V299 HydrophobicContact CE1-CB 4.45Å; F294-V299 HydrophobicContact CE1-CG1 3.76Å; F294-V299 HydrophobicContact CE1-CG2 3.88Å; F294-V299 HydrophobicContact CE2-CG1 4.36Å; F294-V299 HydrophobicContact CE2-CG2 4.14Å; F294-V299 HydrophobicContact CG-CB 4.42Å; F294-V299 HydrophobicContact CG-CG2 3.14Å; F294-V299 HydrophobicContact CZ-CG1 3.91Å; F294-V299 HydrophobicContact CZ-CG2 4.25Å
295D40.4Very low45.2Very low128 Ų128100.1 Ų100.168%0.68456%0.56SS**  trans-45.779.4178.3-74.5-40.2000114K297D295-K297 WeakPolarHBondContact O-CG 3.49Å; D295-K297 PolarHBondContact O-N 3.28Å
296N43Very low44.1Very low173 Ų17397 Ų9793%0.92555%0.55SS**SBendtrans47.218.3-176.5-69.2-33.2000115.1F294F294-N296 VanDerWaalsContact C-N 3.3Å; F294-N296 PolarHBondContact O-N 2.86Å
297K39Very low42.7Very low152 Ų15296 Ų9666%0.66154%0.544SS*.  trans-91.2132.2-179-78.4172.5-173.1172.20108.2D295 V299D295-K297 WeakPolarHBondContact O-CG 3.49Å; D295-K297 PolarHBondContact O-N 3.28Å; K297-V299 PolarHBondContact O-N 2.68Å
298P44.2Very low41.8Very low88 Ų8898.4 Ų98.457%0.57156%0.561SS**  trans-58.4112173.823.4-31.5000108.9Y300P298-Y300 HydrophobicContact CB-CD2 4.46Å; P298-Y300 HydrophobicContact CB-CE2 3.85Å; P298-Y300 HydrophobicContact CG-CE2 3.75Å; P298-Y300 WeakPolarHBondContact O-CD2 3.49Å; P298-Y300 PolarHBondContact O-N 3.17Å
299V43.4Very low40.9Very low25 Ų25101.9 Ų101.915%0.15256%0.556CS.*  trans-75.7106173.3-170.50000106.5Y277 F294 K297 L301Y277-V299 WeakPolarHBondContact CE2-O 3.36Å; Y277-V299 PolarHBondContact OH-O 2.95Å; F294-V299 HydrophobicContact CB-CG2 3.39Å; F294-V299 HydrophobicContact CD1-CB 4.28Å; F294-V299 HydrophobicContact CD1-CG1 4.09Å; F294-V299 HydrophobicContact CD1-CG2 3.32Å; F294-V299 HydrophobicContact CD2-CG2 3.62Å; F294-V299 HydrophobicContact CE1-CB 4.45Å; F294-V299 HydrophobicContact CE1-CG1 3.76Å; F294-V299 HydrophobicContact CE1-CG2 3.88Å; F294-V299 HydrophobicContact CE2-CG1 4.36Å; F294-V299 HydrophobicContact CE2-CG2 4.14Å; F294-V299 HydrophobicContact CG-CB 4.42Å; F294-V299 HydrophobicContact CG-CG2 3.14Å; F294-V299 HydrophobicContact CZ-CG1 3.91Å; F294-V299 HydrophobicContact CZ-CG2 4.25Å; K297-V299 PolarHBondContact O-N 2.68Å; V299-L301 HydrophobicContact CG1-CD2 4.13Å; V299-L301 PolarHBondContact O-N 3.11Å
300Y44.2Very low39.6Very low186 Ų186100.4 Ų100.473%0.72956%0.561SS**  trans-84.3109.6170.4-63.7-81.4000108P298 G302P298-Y300 HydrophobicContact CB-CD2 4.46Å; P298-Y300 HydrophobicContact CB-CE2 3.85Å; P298-Y300 HydrophobicContact CG-CE2 3.75Å; P298-Y300 WeakPolarHBondContact O-CD2 3.49Å; P298-Y300 PolarHBondContact O-N 3.17Å; Y300-G302 PolarHBondContact O-N 2.94Å; Y300-G302 VanDerWaalsContact O-N 3.14Å
301L39.6Very low38.3Very low82 Ų82101.4 Ų101.443%0.42957%0.565SS.*SBendtrans-71.2-1175.3-63.5176.3000113.1Y277 L280 V299Y277-L301 HydrophobicContact CD2-CB 4.23Å; Y277-L301 HydrophobicContact CD2-CD1 3.25Å; Y277-L301 HydrophobicContact CD2-CG 3.63Å; Y277-L301 HydrophobicContact CE2-CB 4.46Å; Y277-L301 HydrophobicContact CE2-CD1 3.6Å; Y277-L301 HydrophobicContact CE2-CG 3.59Å; Y277-L301 HydrophobicContact CG-CD1 3.83Å; L280-L301 HydrophobicContact CB-CD1 3.86Å; L280-L301 HydrophobicContact CD1-CD1 3.69Å; L280-L301 HydrophobicContact CG-CD1 4.42Å; V299-L301 HydrophobicContact CG1-CD2 4.13Å; V299-L301 PolarHBondContact O-N 3.11Å
302G42.1Very low37.1Very low57 Ų57104.8 Ų104.859%0.58859%0.589SS**  trans168.9164175.800000110.2Y300Y300-G302 PolarHBondContact O-N 2.94Å; Y300-G302 VanDerWaalsContact O-N 3.14Å
303H39.5Very low36Very low125 Ų125108.6 Ų108.658%0.57960%0.598SS**  trans-128.7153.1167.868.583.1000109.1I305H303-I305 WeakPolarHBondContact CE1-CG1 3.46Å; H303-I305 PolarHBondContact O-N 3.11Å
304G37.2Very low35.3Very low75 Ų75107.9 Ų107.977%0.77360%0.598SS**  trans-60.1124.7169.100000109.4
305I32.3Very low34.5Very low104 Ų104111 Ų11153%0.53361%0.614SS.*  trans-101.3107.1168.1-61.6170.4000106H303H303-I305 WeakPolarHBondContact CE1-CG1 3.46Å; H303-I305 PolarHBondContact O-N 3.11Å
306G32.2Very low33.9Very low26 Ų26108.3 Ų108.327%0.26860%0.603SS.*  trans-101.2-179.316800000111E308 K309G306-E308 PolarHBondContact O-N 2.79Å; G306-E308 VanDerWaalsContact O-N 3.1Å; G306-K309 PolarHBondContact O-N 3.22Å
307T28Very low33.2Very low100 Ų100103.5 Ų103.561%0.61358%0.583SS**Hα-helixtrans-57.2-21.1168.243.50000112.6K309T307-K309 VanDerWaalsContact C-N 3.26Å; T307-K309 PolarHBondContact O-N 2.91Å
308E31.3Very low32.7Very low179 Ų179100.3 Ų100.384%0.83658%0.579SS**Hα-helixtrans-70-11.7-176.7-60.5176.1-17300114.7G306G306-E308 PolarHBondContact O-N 2.79Å; G306-E308 VanDerWaalsContact O-N 3.1Å
309K30.4Very low32Very low142 Ų142103.9 Ų103.962%0.61759%0.589SS**Hα-helixtrans-128-6.8174.1-76.1-171.5176.4-175.80115G306 T307 I311 V312G306-K309 PolarHBondContact O-N 3.22Å; T307-K309 VanDerWaalsContact C-N 3.26Å; T307-K309 PolarHBondContact O-N 2.91Å; K309-I311 PolarHBondContact O-N 2.81Å; K309-V312 PolarHBondContact O-N 2.94Å
310A27Very low31.4Very low67 Ų67109.9 Ų109.955%0.55462%0.619SS**Hα-helixtrans-71.8-16.1176.200000113.2
311I25.3Very low30.9Very low128 Ų128108 Ų10866%0.65662%0.621SS**THydrogen-bonded Turntrans-83.7-13.1177.6-61174.6000111.8K309K309-I311 PolarHBondContact O-N 2.81Å
312V24.8Very low30.6Very low109 Ų109112.7 Ų112.766%0.66164%0.64SS**SBendtrans-92.21.5-171.6-171.50000113.8K309K309-V312 PolarHBondContact O-N 2.94Å
313H26.6Very low30.1Very low153 Ų153113.4 Ų113.471%0.70865%0.647SS**SBendtrans-128.94.8178.9-113.2-56.5000115.6
314A26.8Very low29.8Very low77 Ų77116.5 Ų116.564%0.63666%0.664SS**SBendtrans-90.2-20.8175.300000113.3
315E26.4Very low29.5Very low155 Ų155118.2 Ų118.272%0.72466%0.664SS**SBendtrans-93.3-10.8-178.4-74.4-177155.700114.4
316T28.2Very low29.6Very low72 Ų72126.2 Ų126.244%0.44270%0.699SS.*SBendtrans-92.1-4.7177.532.70000114.2
317S27.8Very low29.4Very low72 Ų72131.2 Ų131.250%0.50372%0.721SS.*SBendtrans-91.7-10.7177.4-54.90000114.2
318S29.4Very low29.5Very low85 Ų85132.8 Ų132.859%0.59473%0.726SS**SBendtrans-85.7-16.6174.268.10000113.5
319Q30Very low29.4Very low163 Ų163130.3 Ų130.376%0.76272%0.72SS**SBendtrans-92.2-7.1177.2-69.7-175.6-9.700113.9
320L30.6Very low29.4Very low150 Ų150129.6 Ų129.679%0.78573%0.726SS**SBendtrans-93.8-2.2176-90.6154.3000113.8
321L32.6Very low29.5Very low148 Ų148133.5 Ų133.578%0.77574%0.737SS**SBendtrans-108.411.3-177.8-81.1160.4000114.2
322H34.2Very low29.8Very low180 Ų180133.9 Ų133.983%0.83374%0.743SS**SBendtrans-122.622.2178.1-89.7-10.8000114.7
323G31.2Very low30.2Very low71 Ų71135.6 Ų135.673%0.73275%0.748SS**SBendtrans-109.110.4-17900000116.3
324M32.6Very low30.4Very low191 Ų191134.3 Ų134.394%0.94175%0.751SS**  trans-136.468.4-178.4-70.5-16858.800111.5
325S30.9Very low30.7Very low110 Ų110139.1 Ų139.177%0.76976%0.761SS**  trans-131.695.3157.763.90000108.2
326E34.7Very low31.1Very low272 Ų272137.6 Ų137.6100%1.27176%0.764SS**  trans-119.90141.6-80-171.8165.300106.5

Retrieved 326 of 326 residues in 356.8 ms (Link to these results)