A0A077ZD16_TRITR Loading...

Protein naked cuticle homolog

Cell autonomous antagonist of the canonical Wnt signaling pathway.

AlphaFold DB , UniProt , Accession A0A077ZD16, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 529 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M50.8Low48.3Very low107 Ų10782.8 Ų82.853%0.52737%0.374SS..  01330-177.3-178.3-177.500109.8T194 Y196 M252 D254M1-T194 HydrophobicContact CE-CG2 3.51Å; M1-Y196 HydrophobicContact CE-CE1 4.25Å; M1-M252 PolarHBondContact N-O 2.64Å; M1-M252 WeakPolarHBondContact O-CA 3.26Å; M1-M252 VanDerWaalsContact O-CB 3.26Å; M1-M252 WeakPolarHBondContact O-CB 3.41Å; M1-M252 PolarHBondContact O-N 2.95Å; M1-D254 PolarHBondContact N-OD1 3.1Å; M1-D254 PolarHBondContact N-OD2 2.84Å
2C50Low47.5Very low10 Ų1086.9 Ų86.97%0.06841%0.414CS..EExtended strand (participates in β ladder)trans-111126.2-169.1-68.70000112.5T194 L195 V204C2-T194 CarbonylContact O-C 3.53Å; C2-T194 WeakPolarHBondContact O-CA 3.45Å; C2-L195 HydrophobicContact CB-CB 3.84Å; C2-L195 PolarHBondContact N-O 3.3Å; C2-L195 PolarHBondContact O-N 2.83Å; C2-V204 HydrophobicContact CB-CG2 4.39Å; C2-V204 VanDerWaalsContact SG-CG2 3.6Å
3R48.1Very low47.4Very low144 Ų14487.5 Ų87.554%0.54344%0.443SS..EExtended strand (participates in β ladder)trans-122.9128.7179.3-177177.6176.6174.1-1110.8V192 S250R3-V192 HydrophobicContact CG-CG1 4.07Å; R3-S250 CarbonylContact C-O 3.51Å; R3-S250 PolarHBondContact N-O 3.36Å; R3-S250 CarbonylContact O-C 3.42Å; R3-S250 WeakPolarHBondContact O-CA 3.12Å; R3-S250 PolarHBondContact O-N 2.78Å; R3-S250 PolarHBondContact O-OG 2.89Å
4I50Low46.8Very low6 Ų693.2 Ų93.23%0.03148%0.475CS..EExtended strand (participates in β ladder)trans-118.7141.5-176.9-63.8167.8000107.6I6 V192 F193 L195 L212 I247 L249I4-I6 HydrophobicContact CG2-CG1 4.43Å; I4-V192 CarbonylContact O-C 3.49Å; I4-V192 WeakPolarHBondContact O-CA 3.48Å; I4-V192 WeakPolarHBondContact O-CG1 3.38Å; I4-F193 HydrophobicContact CB-CB 4.18Å; I4-F193 HydrophobicContact CG2-CD2 4.44Å; I4-F193 PolarHBondContact N-O 3Å; I4-F193 PolarHBondContact O-N 2.98Å; I4-L195 HydrophobicContact CD1-CD1 4.12Å; I4-L195 HydrophobicContact CD1-CG 4.25Å; I4-L212 HydrophobicContact CD1-CD2 3.22Å; I4-I247 HydrophobicContact CG2-CG2 4.35Å; I4-L249 HydrophobicContact CB-CD2 4.35Å; I4-L249 HydrophobicContact CD1-CD2 3.64Å; I4-L249 HydrophobicContact CG1-CD2 3.67Å; I4-L249 HydrophobicContact CG2-CD2 3.82Å
5S48.4Very low46.4Very low22 Ų2294.2 Ų94.215%0.15450%0.503CS..EExtended strand (participates in β ladder)trans-131.1117.3171.3165.20000108.5E190 W191 K248S5-E190 VanDerWaalsContact OG-CG 3.26Å; S5-E190 WeakPolarHBondContact OG-CG 3.36Å; S5-E190 PolarHBondContact OG-OE1 3.38Å; S5-W191 WeakPolarHBondContact CA-O 3.41Å; S5-K248 PolarHBondContact N-O 2.91Å; S5-K248 WeakPolarHBondContact O-CA 3.39Å; S5-K248 WeakPolarHBondContact O-CB 3.27Å; S5-K248 PolarHBondContact O-N 3.35Å
6I51.2Low45.8Very low7 Ų793.4 Ų93.44%0.03651%0.514CS..EExtended strand (participates in β ladder)trans-95125.5169.6-46.5-177.4000107I4 E190 W191 F193 I216 F245 K246 I247I4-I6 HydrophobicContact CG2-CG1 4.43Å; I6-E190 CarbonylContact O-C 3.58Å; I6-E190 VanDerWaalsContact O-CA 3.25Å; I6-E190 WeakPolarHBondContact O-CA 3.1Å; I6-W191 HydrophobicContact CB-CB 4.21Å; I6-W191 PolarHBondContact N-O 3.41Å; I6-W191 PolarHBondContact O-N 3.23Å; I6-F193 HydrophobicContact CD1-CD2 4.21Å; I6-F193 HydrophobicContact CD1-CE2 3.58Å; I6-F193 HydrophobicContact CD1-CZ 4.49Å; I6-F193 HydrophobicContact CG1-CD2 4.35Å; I6-F193 HydrophobicContact CG1-CE2 4.07Å; I6-I216 HydrophobicContact CD1-CD1 4.07Å; I6-I216 HydrophobicContact CD1-CG2 4.05Å; I6-F245 HydrophobicContact CG2-CB 4.4Å; I6-K246 WeakPolarHBondContact CA-O 3.21Å; I6-I247 HydrophobicContact CD1-CD1 4.49Å; I6-I247 HydrophobicContact CD1-CG1 4.09Å; I6-I247 HydrophobicContact CG1-CB 4.43Å; I6-I247 HydrophobicContact CG1-CG1 4.05Å; I6-I247 HydrophobicContact CG1-CG2 4.26Å; I6-I247 HydrophobicContact CG2-CG1 3.94Å
7K48.5Very low45.4Very low97 Ų9796.6 Ų96.642%0.42253%0.53SS..EExtended strand (participates in β ladder)trans-123121.6178.5-160.1180-169.892.80111.1E190 K246K7-E190 HydrophobicContact CG-CG 4.49Å; K7-E190 IonicContact NZ-OE2 2.6Å; K7-E190 PolarHBondContact NZ-OE2 3.05Å; K7-K246 PolarHBondContact N-O 3.2Å; K7-K246 PolarHBondContact O-N 3.47Å
8E49.7Very low45.3Very low42 Ų42102.8 Ų102.820%0.19655%0.551CS.*EExtended strand (participates in β ladder)trans-66.9137.3168.8-171.8171.4-144.700110.7Q189 F245E8-Q189 PolarHBondContact N-O 2.75Å; E8-Q189 PolarHBondContact OE2-N 3.08Å; E8-F245 HydrophobicContact CG-CE1 4.41Å
9R45.4Very low45Very low183 Ų183107.6 Ų107.669%0.69157%0.567SS**EExtended strand (participates in β ladder)trans-127.1119.6171.4-81.4-170.4172.7-162.6-2.8109.6
10H48.4Very low44.7Very low143 Ų143111.7 Ų111.766%0.66258%0.582SS**  trans-75.7139.5158.8-81.3-79.6000110.3
11L40.7Very low44.3Very low150 Ų150116.9 Ų116.979%0.78560%0.595SS**  trans-76.3148160.4-65.9171.7000109.2A13L11-A13 PolarHBondContact O-N 3.33Å
12P39.2Very low43.5Very low132 Ų132117 Ų11786%0.85761%0.605SS**  trans-72.7109.4179.629.1-33.5000111.1
13A45.4Very low42.6Very low95 Ų95122 Ų12279%0.78564%0.639SS**  trans-93.3138.2166.300000110.3L11L11-A13 PolarHBondContact O-N 3.33Å
14N39.9Very low41.8Very low167 Ų167121 Ų12189%0.89365%0.649SS**  trans-78.4166.5173.6-84.1-31.3000111.9
15A40.3Very low40.8Very low108 Ų108129.2 Ų129.289%0.89369%0.687SS**  trans85.7153.1172.400000118.3
16A36.4Very low39.9Very low82 Ų82131.9 Ų131.968%0.67871%0.705SS**  trans-81.2171.5-153.300000117.1
17N39.2Very low38.8Very low148 Ų148136.6 Ų136.679%0.79174%0.735SS**  trans63117.6158.6-65.3-27000119.2
18F43.6Very low37.8Very low207 Ų207137.6 Ų137.691%0.90875%0.749SS**  -173.3175.2112.1-106.4-74.6000111
19K40.9Very low36.7Very low195 Ų195143.3 Ų143.385%0.84878%0.775SS**  trans-96169.3-162.5-67.1-177.9177.71790114.9
20H37.8Very low35.9Very low188 Ų188139.4 Ų139.487%0.8778%0.782SS**  trans-50.8145.8-173.3-68.1-61.4000117.1
21Y37.2Very low34.8Very low221 Ų221139 Ų13987%0.86779%0.789SS**  trans-137.7153.7150.9-86.5-87.9000109.8
22P33.2Very low34.2Very low111 Ų111136.5 Ų136.572%0.72179%0.79SS**  trans-80.5152.7-178.432.9-35000113
23S31Very low33.8Very low114 Ų114141.8 Ų141.880%0.79779%0.793SS**  trans-76.3144.1176.3-173.10000112.2
24V31Very low32.9Very low122 Ų122144.4 Ų144.474%0.73980%0.8SS**  trans-119.5111.6178.4-169.50000109.3
25H29Very low32.5Very low179 Ų179140.2 Ų140.283%0.82980%0.796SS**  trans-74.2134.3168.8-103.4-100.6000110.1
26S29.5Very low32.1Very low78 Ų78146.2 Ų146.255%0.54580%0.796SS.*  trans-133124.2173.1-171.20000110.2
27T28.2Very low32Very low106 Ų106148.9 Ų148.965%0.6580%0.799SS**  trans-112115.1-179-56.80000109.2
28V27.8Very low31.9Very low119 Ų119147 Ų14772%0.72180%0.797SS**PPolyproline II helixtrans-100.9118178.3-178.60000109.7
29H26.6Very low31.3Very low161 Ų161143.2 Ų143.275%0.74580%0.796SS**PPolyproline II helixtrans-94.4118.4171.1-74.1-90.9000110.4
30A28Very low30.8Very low102 Ų102137.4 Ų137.484%0.84379%0.792SS**PPolyproline II helixtrans-84.1130167.800000110.2
31V25.3Very low30.2Very low133 Ų133136.6 Ų136.681%0.80679%0.794SS**  trans-116.8108.2175.9178.50000108.9
32A29Very low29.7Very low98 Ų98134.7 Ų134.781%0.8180%0.798SS**PPolyproline II helixtrans-74.8130.7173.300000110.3
33R29.7Very low29.2Very low243 Ų243137.6 Ų137.692%0.91780%0.802SS**PPolyproline II helixtrans-77135.5177.9-77.1178165.5175.1-5.4111.1
34T28Very low29Very low150 Ų150138.8 Ų138.892%0.9280%0.798SS**PPolyproline II helixtrans-77.6132.4162.645.50000110.2
35G30.6Very low28.8Very low80 Ų80139.1 Ų139.183%0.82580%0.8SS**  trans-129127.617200000109.3
36R31.6Very low28.7Very low233 Ų233137.9 Ų137.988%0.87980%0.8SS**  trans-136.3145.8-173.2-132.2-172.2-164.8176.14.9110.8
37N34.9Very low28.7Very low139 Ų139142 Ų14274%0.74382%0.816SS**  trans98149.5155.7-55.3-11.1000120.2
38S37.6Very low28.7Very low109 Ų109143 Ų14376%0.76282%0.822SS**  trans65.485.3151.945.40000119.3
39S30.5Very low28.8Very low126 Ų126145.7 Ų145.788%0.88183%0.832SS**  trans-24.5139138.452.10000117
40G31.3Very low28.6Very low74 Ų74142.4 Ų142.476%0.76383%0.833SS**  trans-156.4124.1157.700000109.8
41N24.3Very low28.6Very low171 Ų171144.6 Ų144.691%0.91484%0.836SS**  trans-83138.2176.2-80.3-7000110.5
42L26.2Very low28.6Very low180 Ų180142.7 Ų142.794%0.94283%0.834SS**  trans-145.3149.1150.2-161.463.1000109.3
43E22.4Very low28.4Very low173 Ų173147.1 Ų147.181%0.80884%0.841SS**  trans-112.7-176.3-168.4-168.2177.5-179.400110.7
44I26.7Very low28.5Very low139 Ų139145.5 Ų145.571%0.71384%0.84SS**  trans95.592.4160.1-56173.9000117.3
45T27Very low28.7Very low129 Ų129149 Ų14979%0.79184%0.836SS**  trans59.5144.2138.662.30000123.5
46N27.1Very low28.9Very low152 Ų152150.9 Ų150.981%0.81383%0.834SS**  trans-61.3149.6162.5-65.7-37.7000112.3
47D30.4Very low29Very low165 Ų165149.6 Ų149.688%0.88284%0.835SS**  -158.3162.3121.2-108.8-25.1000110.9
48T27.6Very low28.8Very low127 Ų127146 Ų14678%0.77983%0.831SS**  trans-90.3133.5-172.550.70000113.3
49N29.4Very low28.6Very low175 Ų175149.7 Ų149.794%0.93684%0.84SS**  trans-167.4161.1141.5-108.3-59.8000112.4
50A23.8Very low28.6Very low93 Ų93146.7 Ų146.777%0.76983%0.829SS**  trans-105144.1-170.900000113.7
51T27.8Very low28.5Very low148 Ų148149.1 Ų149.191%0.90884%0.835SS**  trans-133.5129.6162.5-61.60000108.8
52A24.2Very low29Very low92 Ų92147.1 Ų147.176%0.7683%0.828SS**  trans-113.2144.9-176.700000112.2
53M25.2Very low29.3Very low192 Ų192146.6 Ų146.695%0.94682%0.818SS**  trans-120.5141.4161.9-81.6-168-8600110.4
54K31.4Very low29.6Very low209 Ų209144 Ų14491%0.90982%0.819SS**PPolyproline II helixtrans-89.4147-168.4-69.5179.5176.2177.90112.5
55R31.9Very low29.6Very low223 Ų223143.6 Ų143.684%0.84282%0.818SS**PPolyproline II helixtrans-80.1164.8165.3-59.2175.9174.5166.8-4.7111.2
56P36.2Very low29.6Very low119 Ų119147.3 Ų147.377%0.77382%0.823SS**PPolyproline II helixtrans-101.8170.4139.833.8-28.5000112.4
57F33Very low29.6Very low207 Ų207148.4 Ų148.491%0.90882%0.821SS**PPolyproline II helixtrans-102.8167.8-163-57.8-95000112.2
58G31.3Very low29.6Very low63 Ų63145.6 Ų145.665%0.64982%0.82SS**  cis164.2-147.2-1.100000112.1
59I33.6Very low29.6Very low187 Ų187143 Ų14396%0.95982%0.82SS**  trans68.7100.9179.1-46.8178.8000114.7
60G29.9Very low29.6Very low63 Ų63139.6 Ų139.665%0.64982%0.815SS**  trans157.5123.7174.400000110.4V62G60-V62 PolarHBondContact O-N 2.96Å
61S29.9Very low30Very low125 Ų125144.8 Ų144.887%0.87482%0.821SS**  trans-73.9120.2-175.5-171.40000111.2
62V34.9Very low30.1Very low128 Ų128141.5 Ų141.578%0.77682%0.817SS**  trans-131.2106.8175.7-76.60000110.4G60 S64G60-V62 PolarHBondContact O-N 2.96Å; V62-S64 PolarHBondContact O-N 3.33Å
63K31.3Very low30.4Very low170 Ų170142.1 Ų142.174%0.73982%0.815SS**  trans-74.5112168.8-70.1-179.5178.3177.60108.6L65K63-L65 PolarHBondContact O-N 3.14Å
64S28.2Very low31Very low119 Ų119139.3 Ų139.383%0.83281%0.813SS**  trans-70.4116.5173.7-59.30000110.5V62V62-S64 PolarHBondContact O-N 3.33Å
65L28.4Very low31.3Very low130 Ų130136.3 Ų136.368%0.68181%0.807SS**  trans-86.2139.5167.7-117.974.2000110.7K63 F67K63-L65 PolarHBondContact O-N 3.14Å; L65-F67 HydrophobicContact CB-CE2 4.04Å; L65-F67 HydrophobicContact CB-CZ 3.89Å; L65-F67 HydrophobicContact CD2-CE1 3.84Å; L65-F67 HydrophobicContact CD2-CZ 3.87Å; L65-F67 HydrophobicContact CG-CZ 4.49Å
66K26.4Very low32Very low207 Ų207133.8 Ų133.890%0.981%0.81SS**  trans-117.6118.2176.5-175.6179.1-179.1-178.20107.8
67F27.5Very low32.1Very low174 Ų174134.7 Ų134.776%0.76381%0.808SS**  trans-95.8137.4-173.7-59.4-85.2000111.7L65L65-F67 HydrophobicContact CB-CE2 4.04Å; L65-F67 HydrophobicContact CB-CZ 3.89Å; L65-F67 HydrophobicContact CD2-CE1 3.84Å; L65-F67 HydrophobicContact CD2-CZ 3.87Å; L65-F67 HydrophobicContact CG-CZ 4.49Å
68A29.7Very low32.4Very low106 Ų106132.2 Ų132.288%0.87681%0.805SS**  trans-135.7138.6161.600000106.4
69G27.1Very low32.5Very low74 Ų74138.5 Ų138.576%0.76381%0.814SS**  trans-120.5155.5-170.200000113.4
70A30.2Very low32.4Very low102 Ų102135.7 Ų135.784%0.84381%0.805SS**  trans-137.1139.816100000107.3
71F31.5Very low32.6Very low203 Ų203141.4 Ų141.489%0.8982%0.815SS**  trans-121.7128.5178-75.7-80.9000109.4
72G30Very low32.6Very low79 Ų79141.4 Ų141.481%0.81480%0.804SS**  trans-96.4144.215600000109.4
73S31.8Very low32.3Very low104 Ų104140 Ų14073%0.72779%0.792SS**  trans-98130.3172.251.70000110.3
74C36.2Very low32.2Very low133 Ų133135.1 Ų135.190%0.89978%0.784SS**  trans-121.4120.3158.3-640000107
75D37.3Very low32.2Very low147 Ų147136 Ų13679%0.78678%0.778SS**  trans-90.7104.6176.8-59.6-83.8000109.3
76D47.7Very low32.3Very low170 Ų170135.4 Ų135.491%0.90977%0.773SS**  trans-154.1131.3162.6-99.6-45.7000109.3
77D38.9Very low32.4Very low137 Ų137130.5 Ų130.573%0.73377%0.765SS**  trans-96.2-174.6-166.7-104.7-44.6000113.6K79D77-K79 PolarHBondContact O-N 3.12Å
78D38.3Very low32.6Very low156 Ų156129.2 Ų129.283%0.83476%0.761SS**SBendtrans84.1-25.6161.7-69.5-14.8000122.2
79K33.6Very low32.8Very low195 Ų195129.1 Ų129.185%0.84875%0.754SS**  trans-136.878.7-173.8-68.2-179.7-172.4163.20117.4D77D77-K79 PolarHBondContact O-N 3.12Å
80V32.5Very low32.9Very low128 Ų128133.1 Ų133.178%0.77676%0.758SS**  trans-9597.6170.3-174.30000112.1L82V80-L82 HydrophobicContact CG1-CD1 4.13Å; V80-L82 HydrophobicContact CG1-CG 4.15Å
81Q32.9Very low33.3Very low182 Ų182133.5 Ų133.585%0.8575%0.754SS**  trans-102.786.1165.4-70.7-161.753.200111.2L83Q81-L83 PolarHBondContact O-N 2.76Å
82L30.6Very low33.5Very low125 Ų125129.9 Ų129.965%0.65475%0.754SS**  trans-77.1101.1175.1-95.1165.1000111.3V80V80-L82 HydrophobicContact CG1-CD1 4.13Å; V80-L82 HydrophobicContact CG1-CG 4.15Å
83L28.7Very low34.2Very low100 Ų100131.5 Ų131.552%0.52475%0.753SS.*  trans-104.770.5-178.3-135.3172.6000110.7Q81 L85Q81-L83 PolarHBondContact O-N 2.76Å; L83-L85 HydrophobicContact CD2-CD1 4.31Å; L83-L85 HydrophobicContact CD2-CG 4.17Å; L83-L85 PolarHBondContact O-N 2.99Å; L83-L85 VanDerWaalsContact O-N 3.15Å
84A29.4Very low34.9Very low67 Ų67132.3 Ų132.355%0.55476%0.758SS**  trans-67.8110.1176.500000111.1
85L28.4Very low35.1Very low137 Ų137130.5 Ų130.572%0.71775%0.748SS**  trans-113.6107.5166.7-78.9170.5000108.4L83L83-L85 HydrophobicContact CD2-CD1 4.31Å; L83-L85 HydrophobicContact CD2-CG 4.17Å; L83-L85 PolarHBondContact O-N 2.99Å; L83-L85 VanDerWaalsContact O-N 3.15Å
86M30.4Very low35.4Very low118 Ų118130.2 Ų130.258%0.58175%0.746SS**  trans-10098172.6-67.4-178.17000109.2
87S27.6Very low35.5Very low103 Ų103127.8 Ų127.872%0.7274%0.742SS**  trans-109122.4165.7-69.20000108.5
88H31.3Very low35.7Very low148 Ų148126.7 Ų126.769%0.68575%0.745SS**  trans-91114.9169.6-67.5-78.6000108.8
89S34.1Very low36Very low103 Ų103125.1 Ų125.172%0.7275%0.745SS**  trans-111.6109.6174.3-62.50000108.9S91S89-S91 PolarHBondContact O-N 2.75Å; S89-S91 VanDerWaalsContact O-N 3.12Å
90D30Very low36.4Very low159 Ų159122.8 Ų122.885%0.8574%0.742SS**  trans-76.695.5177.2-67.3-47.8000110.4
91S37.5Very low37.1Very low110 Ų110122.6 Ų122.677%0.76975%0.747SS**  trans-10282.9177.259.20000111.7S89S89-S91 PolarHBondContact O-N 2.75Å; S89-S91 VanDerWaalsContact O-N 3.12Å
92S37.3Very low37.6Very low126 Ų126121.8 Ų121.888%0.88175%0.745SS**  trans-84.3108.8166.657.80000110.7
93S43.7Very low38.2Very low113 Ų113125.1 Ų125.179%0.7976%0.757SS**  trans-121.8126170.856.10000110.4
94S46.6Very low38.7Very low121 Ų121125 Ų12585%0.84676%0.764SS**  trans-71.7158.7177.448.10000112.7
95S40.8Very low39.7Very low96 Ų96130 Ų13067%0.67178%0.78SS**  trans-75.2159.3172.854.20000112.6
96D42.6Very low40.4Very low140 Ų140131.3 Ų131.375%0.74979%0.788SS**  173.7163.8112.3-84.8-2.1000112.3
97S50.6Low41.2Very low119 Ų119129.3 Ų129.383%0.83280%0.798SS**  trans65.6132.3-173.272.20000116.3
98S43.5Very low42Very low114 Ų114130.7 Ų130.780%0.79780%0.797SS**  cis88.391.813.3-162.90000117.3
99C44.7Very low42.7Very low123 Ų123131 Ų13183%0.83180%0.799SS**  -175172.7109.560.30000113.3
100D42.1Very low42.9Very low147 Ų147131.7 Ų131.779%0.78680%0.804SS**  trans-74.9151.6-167.3-48.7-104.3000116.3
101S45.7Very low43.6Very low124 Ų124129.1 Ų129.187%0.86781%0.805SS**  -176154.9111.8-79.80000112.8
102M43.5Very low43.7Very low165 Ų165131.1 Ų131.181%0.81381%0.812SS**  trans-90.9154.7178.6-55.9-174.77500112.1
103H44.4Very low43.8Very low195 Ų195128.7 Ų128.790%0.90381%0.807SS**  -165.3133.3127-103.5-70.2000110.7
104S39.4Very low43.9Very low97 Ų97127.2 Ų127.268%0.67880%0.797SS**  trans-100.6150.4167.4-55.90000110
105L50.5Low44Very low172 Ų172130.5 Ų130.590%0.90180%0.799SS**  trans-167.8149.3142.1-107169.4000110.1
106D41.6Very low44.5Very low164 Ų164133 Ų13388%0.87780%0.8SS**  trans-94154.3-171.3-61.3-83.9000114.2
107G46.9Very low44.6Very low76 Ų76133.1 Ų133.178%0.78480%0.801SS**  trans148.9150.4163.400000111.9
108N45.7Very low44.1Very low132 Ų132131.9 Ų131.971%0.70679%0.791SS**  cis173.1139.6-14150.7-96000103.6
109E45Very low43.7Very low156 Ų156135.7 Ų135.773%0.72979%0.789SS**  trans47.9112.4163.1-72.1174.6104.800122.8
110S39.6Very low43.7Very low117 Ų117136.2 Ų136.282%0.81878%0.779SS**  trans59.3110.7132.567.20000121.4
111A44.4Very low43.6Very low105 Ų105133.6 Ų133.687%0.86877%0.769SS**  trans-144.3145.7142.600000110.6
112T39.5Very low43.4Very low151 Ų151133.5 Ų133.593%0.92676%0.758SS**  trans-70135.9177.447.40000112.3
113G39.4Very low43.2Very low76 Ų76133.3 Ų133.378%0.78475%0.752SS**  trans-141.4147179.300000113.2
114S46Very low43.2Very low82 Ų82129.9 Ų129.957%0.57374%0.735SS**  trans-63.9163.9-168.738.80000117.7E116S114-E116 WeakPolarHBondContact CB-OE2 3.18Å; S114-E116 PolarHBondContact O-N 3.47Å; S114-E116 PolarHBondContact OG-OE2 2.83Å
115E48.7Very low43.2Very low190 Ų190132.6 Ų132.689%0.88874%0.742SS**THydrogen-bonded Turntrans-71.421.8-176.6-61.1178.591.200115.5
116E49.9Very low42.9Very low147 Ų147128.7 Ų128.769%0.68773%0.725SS**THydrogen-bonded Turntrans-101-19.3-162.3-67.2170.6120.200114.2S114 C118S114-E116 WeakPolarHBondContact CB-OE2 3.18Å; S114-E116 PolarHBondContact O-N 3.47Å; S114-E116 PolarHBondContact OG-OE2 2.83Å; E116-C118 PolarHBondContact O-N 3.21Å
117D45.3Very low42.6Very low143 Ų143128.8 Ų128.877%0.76572%0.718SS**G310 helixtrans-82-4.3-175-76.5-36.7000115.6Y119D117-Y119 PolarHBondContact O-N 3.32Å; D117-Y119 VanDerWaalsContact O-N 3.12Å
118C39.8Very low42.8Very low94 Ų94130.5 Ų130.564%0.63572%0.715SS**G310 helixtrans-73.20.1-174.5-78.60000115.9E116E116-C118 PolarHBondContact O-N 3.21Å
119Y36.6Very low42.2Very low194 Ų194132 Ų13276%0.76172%0.723SS**G310 helixtrans-99.5-16-175-74.8-84.2000115.3D117D117-Y119 PolarHBondContact O-N 3.32Å; D117-Y119 VanDerWaalsContact O-N 3.12Å
120E44.4Very low42Very low133 Ų133134 Ų13462%0.62173%0.729SS**SBendtrans-90.9-14.3-173.8-104.4-78.5125.100114.9K124E120-K124 PolarHBondContact O-NZ 3.31Å; E120-K124 IonicContact OE2-NZ 2.57Å; E120-K124 PolarHBondContact OE2-NZ 2.77Å
121T40.4Very low42.1Very low92 Ų92135 Ų13556%0.56473%0.73SS**SBendtrans-88.8-30.5-173.834.30000114F123 K124T121-F123 PolarHBondContact O-N 2.57Å; T121-F123 VanDerWaalsContact O-N 3.15Å; T121-K124 PolarHBondContact O-N 3.44Å
122I41.1Very low41.7Very low123 Ų123138.5 Ų138.563%0.63173%0.727SS**THydrogen-bonded Turntrans-65.8-21.6-172.7-62.5175.8000113.2
123F39.4Very low41.8Very low160 Ų160140 Ų14070%0.70272%0.723SS**THydrogen-bonded Turntrans-93.1-11.8-178.1-77.1-81.8000115.3T121T121-F123 PolarHBondContact O-N 2.57Å; T121-F123 VanDerWaalsContact O-N 3.15Å
124K44.2Very low41.7Very low124 Ų124144.8 Ų144.854%0.53972%0.724SS.*THydrogen-bonded Turntrans-84.3-30.3-176.6-77161.4-173.9146.40113.4E120 T121 V126 F127E120-K124 PolarHBondContact O-NZ 3.31Å; E120-K124 IonicContact OE2-NZ 2.57Å; E120-K124 PolarHBondContact OE2-NZ 2.77Å; T121-K124 PolarHBondContact O-N 3.44Å; K124-V126 PolarHBondContact O-N 3.07Å; K124-F127 PolarHBondContact O-N 2.85Å
125D39Very low41.6Very low153 Ų153146.8 Ų146.882%0.81874%0.737SS**THydrogen-bonded Turntrans-73.9-5.1178.9-71.1-21.2000114.4
126V43.8Very low41.1Very low90 Ų90144 Ų14455%0.54573%0.728SS.*THydrogen-bonded Turntrans-84.3-26.4174.7-167.40000111.9K124K124-V126 PolarHBondContact O-N 3.07Å
127F36.5Very low40.9Very low167 Ų167146 Ų14673%0.73274%0.737SS**  trans-146.276.5-172.9-62.2-70.3000114.2K124 N129K124-F127 PolarHBondContact O-N 2.85Å; F127-N129 PolarHBondContact O-N 2.76Å; F127-N129 VanDerWaalsContact O-N 3.14Å
128P49.5Very low40.5Very low111 Ų111146.6 Ų146.672%0.72174%0.74SS**  trans-74.6101.9174.829.5-34.3000112.4K130P128-K130 PolarHBondContact O-N 3.09Å
129N34.6Very low40.7Very low164 Ų164148.2 Ų148.288%0.87775%0.751SS**  trans-67116.2169.7-87.5-28.3000111.4F127F127-N129 PolarHBondContact O-N 2.76Å; F127-N129 VanDerWaalsContact O-N 3.14Å
130K40.4Very low40.6Very low198 Ų198145.6 Ų145.686%0.86175%0.75SS**  trans-137.1155.4162.8-71.6-164.1175.8-177.30112.1P128P128-K130 PolarHBondContact O-N 3.09Å
131T42Very low40.5Very low137 Ų137145.7 Ų145.784%0.8476%0.76SS**PPolyproline II helixtrans-78.2155.3-160.236.40000115
132F35.2Very low40.2Very low180 Ų180148.5 Ų148.579%0.78977%0.772SS**PPolyproline II helixtrans-84.6143.7171.3-86.2-105.7000111.2
133H41.9Very low40.1Very low181 Ų181149.5 Ų149.584%0.83878%0.784SS**PPolyproline II helixtrans-95.4138.6154.8-87.5-88.1000109.5
134H36.6Very low40.1Very low177 Ų177151 Ų15182%0.81979%0.793SS**PPolyproline II helixtrans-70.4150.2165-90.4-29.9000111.1
135C44.6Very low39.9Very low125 Ų125150.3 Ų150.385%0.84580%0.804SS**  trans-141.4116.4150.547.40000107.4
136D38Very low39.7Very low132 Ų132150.8 Ų150.871%0.70681%0.805SS**  trans-75.5143.5178-56.7-76.4000110.7
137H45.7Very low39.2Very low188 Ų188157.4 Ų157.487%0.8782%0.822SS**  trans-160.1116.9153.2-123.6-61.9000112
138D37.3Very low39.3Very low155 Ų155158.8 Ų158.883%0.82983%0.828SS**  trans-70.4138.8174-62.7-79.6000112.6
139C43.2Very low38.6Very low128 Ų128163.4 Ų163.487%0.86583%0.831SS**  trans-149.282.4158.458.20000111.8
140N35.9Very low38.8Very low139 Ų139162.6 Ų162.674%0.74382%0.822SS**  trans-78.6131.8170170.917.9000111.1
141T40.8Very low38.8Very low136 Ų136161.2 Ų161.283%0.83482%0.824SS**  trans-172.1150.9134.914.70000113.1
142N34.5Very low38.6Very low151 Ų151164.6 Ų164.681%0.80783%0.827SS**  trans-82.6147.5177.2-69-46.6000113
143T39.7Very low38.7Very low143 Ų143161.3 Ų161.388%0.87783%0.825SS**  trans-144120.2144.849.40000110.6
144E39Very low38.5Very low193 Ų193160.7 Ų160.790%0.90282%0.823SS**  trans-77.2148.4167-60.6173.584.300111.1
145S39.4Very low38.4Very low109 Ų109157.8 Ų157.876%0.76282%0.822SS**  -173.2116.2128.860.80000113.4
146L35.3Very low38.2Very low162 Ų162157.6 Ų157.685%0.84882%0.817SS**  trans30.8116.5134.9-59.4169.5000119.7
147Y32.5Very low38.3Very low230 Ų230157.1 Ų157.190%0.90282%0.819SS**  -151.2138.8115.3-122.7-80.5000111.8
148K38.8Very low38.4Very low195 Ų195154.4 Ų154.485%0.84882%0.82SS**  trans-142.5103.5-173.1179-176.71781800111.1
149R36Very low38.5Very low209 Ų209156.6 Ų156.679%0.78982%0.823SS**  trans-144.9110.6162.4-92-164.7152.8134.40.5109
150Q38.7Very low38.5Very low147 Ų147158.6 Ų158.669%0.68782%0.824SS**  78.899.599.1-75.7-175.5-79.800113.2
151N40.7Very low38.9Very low169 Ų169155.3 Ų155.390%0.90482%0.816SS**  -173.5104125.8-90.8-13.4000109.5
152K36.8Very low39.2Very low208 Ų208155.8 Ų155.890%0.90481%0.813SS**  trans-156.2100.9170.1-173.2178.6-178.8-179.40110.2
153C36.9Very low40.2Very low111 Ų111156.7 Ų156.775%0.7581%0.813SS**  trans-150.5147.1171.7-78.20000106.4
154E38.3Very low40.3Very low168 Ų168155.1 Ų155.179%0.78581%0.805SS**  cis-160.6156.7-22.2-134.9160.2142.700107.7
155S33.9Very low40.9Very low116 Ų116155.1 Ų155.181%0.81181%0.805SS**  trans-136.697.6-177.361.10000111.5
156V41.2Very low41.1Very low120 Ų120157.2 Ų157.273%0.72780%0.8SS**  trans-136.9107.1-179.6-178.80000111.5
157V40.8Very low41.8Very low123 Ų123157.6 Ų157.675%0.74580%0.798SS**  trans42.9120.6139.5-174.30000119.9
158S47.7Very low42.4Very low130 Ų130153 Ų15391%0.90978%0.784SS**  -148.1125.1126.8-78.40000110.4
159K39.3Very low42.9Very low201 Ų201153.4 Ų153.487%0.87479%0.789SS**  trans-120.4139.6170-91.1-170.3172.4-167.80107.9
160L43.3Very low43.2Very low171 Ų171147.8 Ų147.890%0.89579%0.787SS**  trans-165.3129.2149.7-87165.8000103.2
161A42.7Very low43.5Very low70 Ų70147.3 Ų147.358%0.57980%0.799SS**  cis85.5121.337.900000113.9
162D47.6Very low43.7Very low145 Ų145147.5 Ų147.578%0.77579%0.794SS**  cis-126.1-110.4-27.3-89-60.2000111.4
163E55.1Low44.5Very low171 Ų171141.8 Ų141.880%0.79978%0.779SS**  cis-149159.20.4-75.3-77.629.900109.1
164P43.2Very low45Very low110 Ų110143.3 Ų143.371%0.71478%0.779SS**  trans-120.6150.7-168.440.5-29.6000117.6
165E50.9Low45.6Very low193 Ų193140.8 Ų140.890%0.90278%0.78SS**  trans-170.3129151.2-107.3172.2-174.800106.9
166K44.3Very low46Very low152 Ų152142.4 Ų142.466%0.66178%0.78SS**  cis82.296.643.9-157-150.7177.3-153.10114.7E168K166-E168 WeakPolarHBondContact CE-OE2 3.27Å; K166-E168 IonicContact NZ-OE2 2.82Å; K166-E168 PolarHBondContact NZ-OE2 2.74Å
167H48.4Very low46.5Very low171 Ų171142.3 Ų142.379%0.79278%0.78SS**  trans-149.4156.2133.5-135.9-85.3000113.1
168E46.3Very low46.8Very low132 Ų132142.7 Ų142.762%0.61778%0.782SS**  trans-105.1146.9-176.6-61.3151.9102.500110.3K166K166-E168 WeakPolarHBondContact CE-OE2 3.27Å; K166-E168 IonicContact NZ-OE2 2.82Å; K166-E168 PolarHBondContact NZ-OE2 2.74Å
169E49.5Very low47.1Very low204 Ų204143.6 Ų143.695%0.95377%0.772SS**  -161.1166.8123.7-130.3178.2153.800111
170A42Very low47.8Very low91 Ų91144 Ų14475%0.75277%0.774SS**  trans-127.4155.2-165.200000113.7
171C44.6Very low48.1Very low137 Ų137143.7 Ų143.793%0.92677%0.768SS**  trans-160.5107.2155.4-112.20000111.9
172E45.9Very low48.4Very low173 Ų173145 Ų14581%0.80878%0.779SS**  trans-76.5178.7161-81.5-82.1139.300110.5
173P52.8Low48.8Very low89 Ų89147.7 Ų147.758%0.57878%0.783SS**  cis-133.3-171.2-9.125.9-1.6000114.3
174N46.6Very low48.7Very low142 Ų142143.2 Ų143.276%0.75978%0.776SS**  trans70.4112.3149.2-67.4-30.7000120.9
175S51.4Low49.1Very low116 Ų116143.8 Ų143.881%0.81178%0.78SS**  -158.8121.81039.20000111.6T177S175-T177 PolarHBondContact O-N 2.78Å
176D42Very low49.5Very low150 Ų150138.7 Ų138.780%0.80277%0.771SS**  trans-69.5122.6170.7-115.8-48.5000110
177T52.5Low50.3Low118 Ų118136.2 Ų136.272%0.72478%0.779SS**  trans-150.898.9162.9-59.10000109.4S175 E179S175-T177 PolarHBondContact O-N 2.78Å; T177-E179 VanDerWaalsContact C-N 3.27Å; T177-E179 PolarHBondContact O-N 2.85Å
178T45.9Very low51.4Low130 Ų130129.4 Ų129.480%0.79876%0.755SS**  trans-7965.5-175.634.90000112.7K180T178-K180 PolarHBondContact O-N 3.35Å; T178-K180 VanDerWaalsContact O-N 3.09Å
179E55.4Low52.5Low150 Ų150128 Ų12870%0.70175%0.748SS**  trans-66.3108.4169.1-94.4-156.3149.800111.2T177 Q181T177-E179 VanDerWaalsContact C-N 3.27Å; T177-E179 PolarHBondContact O-N 2.85Å; E179-Q181 PolarHBondContact O-N 2.82Å
180K53.5Low53.7Low208 Ų208122.7 Ų122.790%0.90472%0.723SS**  trans-68.980.7165.5-75.1-179.2175.7174.70109.9T178 A182T178-K180 PolarHBondContact O-N 3.35Å; T178-K180 VanDerWaalsContact O-N 3.09Å; K180-A182 PolarHBondContact O-N 3.4Å
181Q49.6Very low55.3Low166 Ų166122.8 Ų122.878%0.77670%0.704SS**  trans-61.8102.8170.2-68.9-166.9-0.600109.7E179 K183E179-Q181 PolarHBondContact O-N 2.82Å; Q181-K183 PolarHBondContact O-N 3.3Å
182A49.4Very low56.9Low97 Ų97119.5 Ų119.580%0.80268%0.68SS**  trans-66.299.9178.600000109.1K180 A184K180-A182 PolarHBondContact O-N 3.4Å; A182-A184 PolarHBondContact O-N 3.15Å
183K54.8Low58.5Low201 Ų201115 Ų11587%0.87466%0.658SS**  trans-49107.1175.8-179.7179.7179.8-179.40109.2Q181Q181-K183 PolarHBondContact O-N 3.3Å
184A54Low59.8Low78 Ų78113.3 Ų113.365%0.64565%0.646SS**PPolyproline II helixtrans-53.4134.517900000109.1A182 A186A182-A184 PolarHBondContact O-N 3.15Å; A184-A186 PolarHBondContact O-N 3.34Å; A184-A186 VanDerWaalsContact O-N 3.17Å
185P51.2Low61.5Low122 Ų122108.5 Ų108.579%0.79262%0.62SS**PPolyproline II helixtrans-58.1126.8177.624.8-33000108.1A187P185-A187 PolarHBondContact O-N 3.12Å
186A59.4Low62.9Low86 Ų86109.8 Ų109.871%0.71161%0.608SS**PPolyproline II helixtrans-50.6132.1176.200000108.4A184 G188A184-A186 PolarHBondContact O-N 3.34Å; A184-A186 VanDerWaalsContact O-N 3.17Å; A186-G188 VanDerWaalsContact C-N 3.26Å; A186-G188 PolarHBondContact O-N 3.09Å
187A61.8Low65Low100 Ų100105.1 Ų105.183%0.82658%0.583SS**  trans-67.882.5-166.300000111.3P185 Q189P185-A187 PolarHBondContact O-N 3.12Å; A187-Q189 PolarHBondContact O-N 2.9Å
188G70.8Confident66.2Low28 Ų28108.7 Ų108.729%0.28959%0.589SS.*  trans-57.2131.8-177.700000110.1A186 E190A186-G188 VanDerWaalsContact C-N 3.26Å; A186-G188 PolarHBondContact O-N 3.09Å; G188-E190 PolarHBondContact O-N 3.01Å
189Q69Low68.2Low102 Ų102106.7 Ų106.748%0.47757%0.573SS.*  trans-65.9121.3-169-60.6-173.4-4.400109.8E8 A187E8-Q189 PolarHBondContact N-O 2.75Å; E8-Q189 PolarHBondContact OE2-N 3.08Å; A187-Q189 PolarHBondContact O-N 2.9Å
190E75.8Confident69.8Low93 Ų93102.7 Ų102.744%0.43557%0.573SS.*EExtended strand (participates in β ladder)trans-106.9105175.6-168.5169.4151.900110.2S5 I6 K7 G188 V192S5-E190 VanDerWaalsContact OG-CG 3.26Å; S5-E190 WeakPolarHBondContact OG-CG 3.36Å; S5-E190 PolarHBondContact OG-OE1 3.38Å; I6-E190 CarbonylContact O-C 3.58Å; I6-E190 VanDerWaalsContact O-CA 3.25Å; I6-E190 WeakPolarHBondContact O-CA 3.1Å; K7-E190 HydrophobicContact CG-CG 4.49Å; K7-E190 IonicContact NZ-OE2 2.6Å; K7-E190 PolarHBondContact NZ-OE2 3.05Å; G188-E190 PolarHBondContact O-N 3.01Å; E190-V192 HydrophobicContact CG-CG2 4.4Å
191W75.4Confident71.4Confident93 Ų93100 Ų10035%0.35256%0.561SS.*EExtended strand (participates in β ladder)trans-94.9110.2-178.1-6189000109.8S5 I6 F193S5-W191 WeakPolarHBondContact CA-O 3.41Å; I6-W191 HydrophobicContact CB-CB 4.21Å; I6-W191 PolarHBondContact N-O 3.41Å; I6-W191 PolarHBondContact O-N 3.23Å; W191-F193 HydrophobicContact CB-CD2 4.43Å; W191-F193 HydrophobicContact CB-CE2 3.61Å; W191-F193 HydrophobicContact CB-CZ 4.19Å
192V77.9Confident73.2Confident68 Ų6894.2 Ų94.241%0.41255%0.546SS..EExtended strand (participates in β ladder)trans-99.2118.9-179.8-178.70000110.2R3 I4 E190R3-V192 HydrophobicContact CG-CG1 4.07Å; I4-V192 CarbonylContact O-C 3.49Å; I4-V192 WeakPolarHBondContact O-CA 3.48Å; I4-V192 WeakPolarHBondContact O-CG1 3.38Å; E190-V192 HydrophobicContact CG-CG2 4.4Å
193F79Confident74.9Confident78 Ų7896.7 Ų96.734%0.34254%0.538SS..EExtended strand (participates in β ladder)trans-111.4137.9175.7-58.8-95.7000110I4 I6 W191I4-F193 HydrophobicContact CB-CB 4.18Å; I4-F193 HydrophobicContact CG2-CD2 4.44Å; I4-F193 PolarHBondContact N-O 3Å; I4-F193 PolarHBondContact O-N 2.98Å; I6-F193 HydrophobicContact CD1-CD2 4.21Å; I6-F193 HydrophobicContact CD1-CE2 3.58Å; I6-F193 HydrophobicContact CD1-CZ 4.49Å; I6-F193 HydrophobicContact CG1-CD2 4.35Å; I6-F193 HydrophobicContact CG1-CE2 4.07Å; W191-F193 HydrophobicContact CB-CD2 4.43Å; W191-F193 HydrophobicContact CB-CE2 3.61Å; W191-F193 HydrophobicContact CB-CZ 4.19Å
194T81.3Confident76.3Confident54 Ų5488.8 Ų88.833%0.33151%0.507SS..EExtended strand (participates in β ladder)trans-111.6119.4172.9-590000108.5M1 C2 Y196M1-T194 HydrophobicContact CE-CG2 3.51Å; C2-T194 CarbonylContact O-C 3.53Å; C2-T194 WeakPolarHBondContact O-CA 3.45Å; T194-Y196 HydrophobicContact CG2-CD2 4.22Å; T194-Y196 HydrophobicContact CG2-CE1 4.19Å; T194-Y196 HydrophobicContact CG2-CE2 3.63Å
195L80.5Confident78Confident40 Ų4087 Ų8721%0.20949%0.49CS..EExtended strand (participates in β ladder)trans-91.2131.6170.2-74.9-178.7000109.5C2 I4 V204 L212C2-L195 HydrophobicContact CB-CB 3.84Å; C2-L195 PolarHBondContact N-O 3.3Å; C2-L195 PolarHBondContact O-N 2.83Å; I4-L195 HydrophobicContact CD1-CD1 4.12Å; I4-L195 HydrophobicContact CD1-CG 4.25Å; L195-V204 HydrophobicContact CD1-CG1 4.15Å; L195-L212 HydrophobicContact CD1-CD2 3.77Å; L195-L212 HydrophobicContact CD2-CD2 4.1Å; L195-L212 HydrophobicContact CG-CD2 3.98Å
196Y81.8Confident79.7Confident143 Ų14388.2 Ų88.256%0.56148%0.482SS*.  trans-104.1144.7175.6-65.6-88.6000109.8M1 T194 F198M1-Y196 HydrophobicContact CE-CE1 4.25Å; T194-Y196 HydrophobicContact CG2-CD2 4.22Å; T194-Y196 HydrophobicContact CG2-CE1 4.19Å; T194-Y196 HydrophobicContact CG2-CE2 3.63Å; Y196-F198 VanDerWaalsContact O-CD2 3.23Å; Y196-F198 WeakPolarHBondContact O-CD2 3.29Å; Y196-F198 PolarHBondContact O-N 3.37Å
197D85.9Confident81.3Confident53 Ų5389.7 Ų89.728%0.28348%0.475SS..  trans-78.995177.3-172.283000108.9G200 K201 G202 K203D197-G200 WeakPolarHBondContact OD2-CA 3.41Å; D197-G200 PolarHBondContact OD2-N 3.29Å; D197-G200 VanDerWaalsContact OD2-N 3.1Å; D197-K201 PolarHBondContact OD2-N 3.27Å; D197-G202 VanDerWaalsContact CG-N 3.25Å; D197-G202 WeakPolarHBondContact OD1-CA 3.29Å; D197-G202 PolarHBondContact OD1-N 2.9Å; D197-G202 PolarHBondContact OD2-N 3.18Å; D197-K203 PolarHBondContact OD1-N 3.41Å
198F77.2Confident82.5Confident192 Ų19288.8 Ų88.884%0.84246%0.456SS*.SBendtrans-81.2-16.7-171.1-77.2-74.6000114.4Y196Y196-F198 VanDerWaalsContact O-CD2 3.23Å; Y196-F198 WeakPolarHBondContact O-CD2 3.29Å; Y196-F198 PolarHBondContact O-N 3.37Å
199D88Confident83.4Confident88 Ų8889.6 Ų89.647%0.47145%0.453SS..SBendtrans-100.8-3.9178.971.61.4000114K201D199-K201 WeakPolarHBondContact OD1-CB 3.36Å; D199-K201 WeakPolarHBondContact OD1-CG 3.23Å; D199-K201 PolarHBondContact OD1-N 2.94Å; D199-K201 VanDerWaalsContact OD2-CD 3.24Å; D199-K201 WeakPolarHBondContact OD2-CD 3.27Å; D199-K201 WeakPolarHBondContact OD2-CE 3.3Å; D199-K201 IonicContact OD2-NZ 2.64Å; D199-K201 PolarHBondContact OD2-NZ 3.15Å
200G90Very high84.4Confident67 Ų6788 Ų8869%0.69145%0.447SS*.SBendtrans76.716174.300000114.8D197D197-G200 WeakPolarHBondContact OD2-CA 3.41Å; D197-G200 PolarHBondContact OD2-N 3.29Å; D197-G200 VanDerWaalsContact OD2-N 3.1Å
201K87.3Confident85.2Confident152 Ų15286.9 Ų86.966%0.66145%0.45SS*.SBendtrans-85.1-11.8179-64.2178.7-165.4141.90114.1D197 D199 K203D197-K201 PolarHBondContact OD2-N 3.27Å; D199-K201 WeakPolarHBondContact OD1-CB 3.36Å; D199-K201 WeakPolarHBondContact OD1-CG 3.23Å; D199-K201 PolarHBondContact OD1-N 2.94Å; D199-K201 VanDerWaalsContact OD2-CD 3.24Å; D199-K201 WeakPolarHBondContact OD2-CD 3.27Å; D199-K201 WeakPolarHBondContact OD2-CE 3.3Å; D199-K201 IonicContact OD2-NZ 2.64Å; D199-K201 PolarHBondContact OD2-NZ 3.15Å; K201-K203 VanDerWaalsContact C-N 3.25Å; K201-K203 HydrophobicContact CB-CB 4.42Å; K201-K203 PolarHBondContact O-N 2.94Å
202G85.8Confident85.9Confident44 Ų4483.9 Ų83.945%0.45444%0.44SS..SBendtrans66.326.4-17100000113.1D197D197-G202 VanDerWaalsContact CG-N 3.25Å; D197-G202 WeakPolarHBondContact OD1-CA 3.29Å; D197-G202 PolarHBondContact OD1-N 2.9Å; D197-G202 PolarHBondContact OD2-N 3.18Å
203K85.3Confident86.5Confident148 Ų14882.1 Ų82.164%0.64343%0.43SS*.  trans-144.894.4-172.6-71.3-160.2174.4-1550111.2D197 K201 S205D197-K203 PolarHBondContact OD1-N 3.41Å; K201-K203 VanDerWaalsContact C-N 3.25Å; K201-K203 HydrophobicContact CB-CB 4.42Å; K201-K203 PolarHBondContact O-N 2.94Å; K203-S205 PolarHBondContact O-N 3.01Å
204V85.2Confident87Confident36 Ų3685.2 Ų85.222%0.21844%0.439CS..  trans-65122164.3-179.50000108.7C2 L195 D208 I209C2-V204 HydrophobicContact CB-CG2 4.39Å; C2-V204 VanDerWaalsContact SG-CG2 3.6Å; L195-V204 HydrophobicContact CD1-CG1 4.15Å; V204-D208 HydrophobicContact CG1-CB 3.75Å; V204-I209 HydrophobicContact CG1-CD1 4.49Å; V204-I209 HydrophobicContact CG1-CG1 3.92Å
205S88.6Confident87.6Confident40 Ų4085.1 Ų85.128%0.2844%0.441SS..  trans-75.7163.5-175.970.50000112.8K203 E207 D208 I209K203-S205 PolarHBondContact O-N 3.01Å; S205-E207 PolarHBondContact O-N 2.71Å; S205-E207 PolarHBondContact OG-N 3.41Å; S205-D208 WeakPolarHBondContact CB-OD2 3.45Å; S205-D208 PolarHBondContact N-OD2 3.4Å; S205-D208 PolarHBondContact O-N 3.41Å; S205-D208 PolarHBondContact OG-N 2.87Å; S205-D208 PolarHBondContact OG-OD2 3.43Å; S205-I209 PolarHBondContact O-N 3.34Å; S205-I209 VanDerWaalsContact O-N 3.13Å
206K88.4Confident88Confident148 Ų14883.9 Ų83.964%0.64344%0.435SS*.Hα-helixtrans-58.9-35.9170.4-176.4179-177.7175.90110.4I209 L210K206-I209 PolarHBondContact O-N 3.23Å; K206-L210 HydrophobicContact CG-CD1 4.05Å; K206-L210 WeakPolarHBondContact O-CB 3.19Å; K206-L210 VanDerWaalsContact O-CG 3.22Å; K206-L210 WeakPolarHBondContact O-CG 3.33Å; K206-L210 PolarHBondContact O-N 2.78Å
207E91.3Very high88.2Confident117 Ų11782.4 Ų82.455%0.54743%0.429SS..Hα-helixtrans-67.4-39.9179.5-69.154.2-121.100111.2S205 L210 S211S205-E207 PolarHBondContact O-N 2.71Å; S205-E207 PolarHBondContact OG-N 3.41Å; E207-L210 PolarHBondContact O-N 3.47Å; E207-S211 WeakPolarHBondContact O-CB 3.39Å; E207-S211 PolarHBondContact O-N 3.48Å
208D88.7Confident88.4Confident81 Ų8184.5 Ų84.543%0.43344%0.44SS..Hα-helixtrans-65-44.9174-63.4-53.3000111.7V204 S205 S211 L212V204-D208 HydrophobicContact CG1-CB 3.75Å; S205-D208 WeakPolarHBondContact CB-OD2 3.45Å; S205-D208 PolarHBondContact N-OD2 3.4Å; S205-D208 PolarHBondContact O-N 3.41Å; S205-D208 PolarHBondContact OG-N 2.87Å; S205-D208 PolarHBondContact OG-OD2 3.43Å; D208-S211 WeakPolarHBondContact O-CB 3.22Å; D208-S211 PolarHBondContact O-N 2.9Å; D208-L212 PolarHBondContact O-N 3.25Å
209I89.6Confident89Confident45 Ų4580.4 Ų80.423%0.23143%0.43CS..Hα-helixtrans-62.8-45.6177.1-65.4172.7000110.2V204 S205 K206 S211 L212 V213 L249V204-I209 HydrophobicContact CG1-CD1 4.49Å; V204-I209 HydrophobicContact CG1-CG1 3.92Å; S205-I209 PolarHBondContact O-N 3.34Å; S205-I209 VanDerWaalsContact O-N 3.13Å; K206-I209 PolarHBondContact O-N 3.23Å; I209-S211 VanDerWaalsContact C-N 3.32Å; I209-S211 PolarHBondContact O-N 3.42Å; I209-L212 PolarHBondContact O-N 3.01Å; I209-V213 HydrophobicContact CG2-CG2 4.47Å; I209-V213 WeakPolarHBondContact O-CB 3.44Å; I209-V213 VanDerWaalsContact O-CG2 3.3Å; I209-V213 WeakPolarHBondContact O-CG2 3.49Å; I209-V213 PolarHBondContact O-N 3.45Å; I209-L249 HydrophobicContact CG2-CD1 3.63Å
210L89.8Confident88.9Confident68 Ų6878.5 Ų78.536%0.35642%0.42SS..Hα-helixtrans-65.8-33.5175.8-71.2171.6000112.2K206 E207 R214K206-L210 HydrophobicContact CG-CD1 4.05Å; K206-L210 WeakPolarHBondContact O-CB 3.19Å; K206-L210 VanDerWaalsContact O-CG 3.22Å; K206-L210 WeakPolarHBondContact O-CG 3.33Å; K206-L210 PolarHBondContact O-N 2.78Å; E207-L210 PolarHBondContact O-N 3.47Å; L210-R214 WeakPolarHBondContact O-CB 3.32Å; L210-R214 VanDerWaalsContact O-CG 3.23Å; L210-R214 WeakPolarHBondContact O-CG 3.25Å; L210-R214 PolarHBondContact O-N 3.41Å; L210-R214 PolarHBondContact O-NH1 3.17Å
211S91.4Very high88.6Confident70 Ų7078.3 Ų78.349%0.4942%0.418SS..Hα-helixtrans-65.9-47.6174.7-170.80000111.1E207 D208 I209 R214 S215E207-S211 WeakPolarHBondContact O-CB 3.39Å; E207-S211 PolarHBondContact O-N 3.48Å; D208-S211 WeakPolarHBondContact O-CB 3.22Å; D208-S211 PolarHBondContact O-N 2.9Å; I209-S211 VanDerWaalsContact C-N 3.32Å; I209-S211 PolarHBondContact O-N 3.42Å; S211-R214 PolarHBondContact O-N 3.13Å; S211-S215 PolarHBondContact O-N 3.44Å
212L91.1Very high88.1Confident29 Ų2977.8 Ų77.815%0.15242%0.423CS..Hα-helixtrans-60.6-49.6174.3177.466000111.3I4 L195 D208 I209 R214 S215 I216I4-L212 HydrophobicContact CD1-CD2 3.22Å; L195-L212 HydrophobicContact CD1-CD2 3.77Å; L195-L212 HydrophobicContact CD2-CD2 4.1Å; L195-L212 HydrophobicContact CG-CD2 3.98Å; D208-L212 PolarHBondContact O-N 3.25Å; I209-L212 PolarHBondContact O-N 3.01Å; L212-R214 VanDerWaalsContact C-N 3.33Å; L212-R214 PolarHBondContact O-N 2.91Å; L212-S215 PolarHBondContact O-N 2.56Å; L212-S215 VanDerWaalsContact O-N 3.08Å; L212-S215 PolarHBondContact O-OG 2.93Å; L212-I216 HydrophobicContact CD1-CD1 4.09Å; L212-I216 HydrophobicContact CD1-CG1 4.31Å; L212-I216 HydrophobicContact CD2-CD1 4.36Å; L212-I216 HydrophobicContact CG-CD1 3.83Å; L212-I216 HydrophobicContact CG-CG1 4.46Å; L212-I216 WeakPolarHBondContact O-CG1 3.3Å; L212-I216 PolarHBondContact O-N 3.33Å
213V89.9Confident87.3Confident32 Ų3277.9 Ų77.919%0.19442%0.419CS..Hα-helixtrans-60.2-42.6-179.6169.60000110.8I209 I216 Y217 L249I209-V213 HydrophobicContact CG2-CG2 4.47Å; I209-V213 WeakPolarHBondContact O-CB 3.44Å; I209-V213 VanDerWaalsContact O-CG2 3.3Å; I209-V213 WeakPolarHBondContact O-CG2 3.49Å; I209-V213 PolarHBondContact O-N 3.45Å; V213-I216 PolarHBondContact O-N 2.86Å; V213-Y217 HydrophobicContact CG1-CD2 3.74Å; V213-Y217 HydrophobicContact CG1-CE2 3.66Å; V213-Y217 VanDerWaalsContact O-CD2 3.27Å; V213-Y217 WeakPolarHBondContact O-CD2 3.23Å; V213-Y217 PolarHBondContact O-N 3.18Å; V213-L249 HydrophobicContact CG2-CD1 4.4Å
214R90.6Very high86.3Confident142 Ų14280.1 Ų80.154%0.53643%0.429SS..Hα-helixtrans-58.4-49.1170.8-74.3177.9-158.2107.7-3.3111.7L210 S211 L212 I216 Y217 D218L210-R214 WeakPolarHBondContact O-CB 3.32Å; L210-R214 VanDerWaalsContact O-CG 3.23Å; L210-R214 WeakPolarHBondContact O-CG 3.25Å; L210-R214 PolarHBondContact O-N 3.41Å; L210-R214 PolarHBondContact O-NH1 3.17Å; S211-R214 PolarHBondContact O-N 3.13Å; L212-R214 VanDerWaalsContact C-N 3.33Å; L212-R214 PolarHBondContact O-N 2.91Å; R214-I216 PolarHBondContact O-N 2.91Å; R214-Y217 CarbonylContact O-C 3.51Å; R214-Y217 WeakPolarHBondContact O-CA 3.49Å; R214-Y217 PolarHBondContact O-N 3.33Å; R214-D218 VanDerWaalsContact O-CG 3.3Å; R214-D218 PolarHBondContact O-N 3.17Å
215S92.2Very high85.3Confident53 Ų5381.1 Ų81.137%0.37143%0.433SS..Hα-helixtrans-60.5-32.7179.476.50000113.4S211 L212 V219S211-S215 PolarHBondContact O-N 3.44Å; L212-S215 PolarHBondContact O-N 2.56Å; L212-S215 VanDerWaalsContact O-N 3.08Å; L212-S215 PolarHBondContact O-OG 2.93Å; S215-V219 WeakPolarHBondContact O-CB 3.24Å; S215-V219 VanDerWaalsContact O-CG2 3.27Å; S215-V219 WeakPolarHBondContact O-CG2 3.46Å; S215-V219 PolarHBondContact O-N 2.98Å
216I89.5Confident83.8Confident14 Ų1484.4 Ų84.47%0.07245%0.453CS..Hα-helixtrans-68.2-45.6172.8-67.3162.4000110.2I6 L212 V213 R214 V219 L220 I247I6-I216 HydrophobicContact CD1-CD1 4.07Å; I6-I216 HydrophobicContact CD1-CG2 4.05Å; L212-I216 HydrophobicContact CD1-CD1 4.09Å; L212-I216 HydrophobicContact CD1-CG1 4.31Å; L212-I216 HydrophobicContact CD2-CD1 4.36Å; L212-I216 HydrophobicContact CG-CD1 3.83Å; L212-I216 HydrophobicContact CG-CG1 4.46Å; L212-I216 WeakPolarHBondContact O-CG1 3.3Å; L212-I216 PolarHBondContact O-N 3.33Å; V213-I216 PolarHBondContact O-N 2.86Å; R214-I216 PolarHBondContact O-N 2.91Å; I216-V219 PolarHBondContact O-N 2.88Å; I216-L220 HydrophobicContact CG2-CD1 3.7Å; I216-L220 HydrophobicContact CG2-CG 4.27Å; I216-L220 VanDerWaalsContact O-CB 3.29Å; I216-L220 WeakPolarHBondContact O-CB 3.38Å; I216-L220 VanDerWaalsContact O-CG 3.29Å; I216-L220 WeakPolarHBondContact O-CG 3.26Å; I216-L220 PolarHBondContact O-N 2.88Å; I216-I247 HydrophobicContact CG2-CD1 3.88Å
217Y87.3Confident82.4Confident112 Ų11282.4 Ų82.444%0.43945%0.448SS..Hα-helixtrans-66.8-34.5175.3-82.2-69000113.3V213 R214 G221V213-Y217 HydrophobicContact CG1-CD2 3.74Å; V213-Y217 HydrophobicContact CG1-CE2 3.66Å; V213-Y217 VanDerWaalsContact O-CD2 3.27Å; V213-Y217 WeakPolarHBondContact O-CD2 3.23Å; V213-Y217 PolarHBondContact O-N 3.18Å; R214-Y217 CarbonylContact O-C 3.51Å; R214-Y217 WeakPolarHBondContact O-CA 3.49Å; R214-Y217 PolarHBondContact O-N 3.33Å; Y217-G221 WeakPolarHBondContact O-CA 3.35Å; Y217-G221 PolarHBondContact O-N 3.29Å
218D90.2Very high80.7Confident97 Ų9784 Ų8452%0.51946%0.455SS..Hα-helixtrans-67-43174.7-68.5-35.9000110.4R214 N222R214-D218 VanDerWaalsContact O-CG 3.3Å; R214-D218 PolarHBondContact O-N 3.17Å; D218-N222 VanDerWaalsContact O-CB 3.27Å; D218-N222 WeakPolarHBondContact O-CB 3.09Å; D218-N222 PolarHBondContact O-N 3.26Å; D218-N222 PolarHBondContact O-ND2 2.64Å
219V88.6Confident79Confident105 Ų10587 Ų8764%0.63647%0.471SS*.Hα-helixtrans-68.1-45.9175.5170.20000111.3S215 I216 A223S215-V219 WeakPolarHBondContact O-CB 3.24Å; S215-V219 VanDerWaalsContact O-CG2 3.27Å; S215-V219 WeakPolarHBondContact O-CG2 3.46Å; S215-V219 PolarHBondContact O-N 2.98Å; I216-V219 PolarHBondContact O-N 2.88Å; V219-A223 WeakPolarHBondContact O-CB 3.44Å; V219-A223 PolarHBondContact O-N 2.7Å
220L86.3Confident77.3Confident48 Ų4887 Ų8725%0.25148%0.482SS..Hα-helixtrans-74.8-26.2-178.9-68.9178.2000113.9I216 F245I216-L220 HydrophobicContact CG2-CD1 3.7Å; I216-L220 HydrophobicContact CG2-CG 4.27Å; I216-L220 VanDerWaalsContact O-CB 3.29Å; I216-L220 WeakPolarHBondContact O-CB 3.38Å; I216-L220 VanDerWaalsContact O-CG 3.29Å; I216-L220 WeakPolarHBondContact O-CG 3.26Å; I216-L220 PolarHBondContact O-N 2.88Å; L220-F245 HydrophobicContact CD1-CG 4.32Å
221G82.7Confident75.4Confident64 Ų6487.4 Ų87.466%0.6650%0.503SS*.Hα-helixtrans-84.1-32.1177.400000113.4Y217Y217-G221 WeakPolarHBondContact O-CA 3.35Å; Y217-G221 PolarHBondContact O-N 3.29Å
222N76.8Confident73.7Confident141 Ų14191.1 Ų91.175%0.75452%0.518SS*.Hα-helixtrans-81.3-27.6169.1-70.9-64.7000112.2D218 K224D218-N222 VanDerWaalsContact O-CB 3.27Å; D218-N222 WeakPolarHBondContact O-CB 3.09Å; D218-N222 PolarHBondContact O-N 3.26Å; D218-N222 PolarHBondContact O-ND2 2.64Å; N222-K224 PolarHBondContact O-N 2.8Å; N222-K224 VanDerWaalsContact O-N 3.09Å
223A69.7Low72.1Confident45 Ų4596.7 Ų96.737%0.37255%0.547SS..SBendtrans-62.811216400000108.3V219 L225V219-A223 WeakPolarHBondContact O-CB 3.44Å; V219-A223 PolarHBondContact O-N 2.7Å; A223-L225 PolarHBondContact O-N 2.6Å
224K64Low70.6Confident195 Ų195102.8 Ų102.885%0.84858%0.579SS**  trans-68.881.1165.2-171.6176.8-177.4177.90107.9N222N222-K224 PolarHBondContact O-N 2.8Å; N222-K224 VanDerWaalsContact O-N 3.09Å
225L64.4Low69Low58 Ų58100.9 Ų100.930%0.30459%0.588SS.*  trans-43.2132.5172.8-71.7168.1000108.1A223 I227 F245A223-L225 PolarHBondContact O-N 2.6Å; L225-I227 VanDerWaalsContact C-N 3.34Å; L225-I227 PolarHBondContact O-N 2.93Å; L225-F245 HydrophobicContact CD1-CE2 3.71Å; L225-F245 HydrophobicContact CD1-CZ 4.45Å; L225-F245 HydrophobicContact CD2-CE2 3.9Å; L225-F245 HydrophobicContact CD2-CZ 3.8Å; L225-F245 HydrophobicContact CG-CE2 4.48Å
226P58.3Low67.1Low109 Ų109107.9 Ų107.971%0.70861%0.614SS**  trans-64.1100.4-177.926.1-33000108.2H228P226-H228 VanDerWaalsContact C-N 3.31Å; P226-H228 PolarHBondContact O-N 2.91Å
227I57.6Low65.6Low106 Ų106116 Ų11654%0.54465%0.649SS.*  trans-58.7105.7165.7-56.3176.9000104.5L225 N229 V242L225-I227 VanDerWaalsContact C-N 3.34Å; L225-I227 PolarHBondContact O-N 2.93Å; I227-N229 WeakPolarHBondContact CG2-OD1 3.44Å; I227-N229 PolarHBondContact O-N 2.91Å; I227-V242 HydrophobicContact CG2-CG2 4.46Å
228H56.2Low63.9Low150 Ų150115.5 Ų115.569%0.69466%0.662SS**  trans-68.679.9177.8-177.3-77.7000108P226 G230 V242P226-H228 VanDerWaalsContact C-N 3.31Å; P226-H228 PolarHBondContact O-N 2.91Å; H228-G230 PolarHBondContact ND1-N 3.09Å; H228-G230 PolarHBondContact O-N 2.86Å; H228-V242 HydrophobicContact CB-CG1 4.4Å; H228-V242 HydrophobicContact CB-CG2 4.26Å
229N52.6Low62.1Low144 Ų144114.6 Ų114.677%0.7768%0.675SS**  trans-63.275.7163-72.13.6000107.2I227 G231I227-N229 WeakPolarHBondContact CG2-OD1 3.44Å; I227-N229 PolarHBondContact O-N 2.91Å; N229-G231 PolarHBondContact O-N 3.44Å
230G54.4Low60.5Low45 Ų45117 Ų11746%0.46468%0.68SS.*  trans-63.5104.7176.300000107.7H228 N232H228-G230 PolarHBondContact ND1-N 3.09Å; H228-G230 PolarHBondContact O-N 2.86Å; G230-N232 VanDerWaalsContact C-N 3.33Å; G230-N232 PolarHBondContact O-N 2.92Å
231G49.4Very low59.2Low77 Ų77119.9 Ų119.979%0.79470%0.701SS**  trans-67.486.7-171.600000112.7N229N229-G231 PolarHBondContact O-N 3.44Å
232N57Low58Low148 Ų148119.2 Ų119.279%0.79168%0.684SS**  trans-129.7119.7151.9-98.3-23.7000106.6G230G230-N232 VanDerWaalsContact C-N 3.33Å; G230-N232 PolarHBondContact O-N 2.92Å
233D56Low57.4Low145 Ų145113.9 Ų113.978%0.77566%0.663SS**SBendtrans-65.7162.4-176.7-64.2-64.1000112.4
234N58.1Low57.3Low161 Ų161115.1 Ų115.186%0.86167%0.673SS**  trans78.535.5169.2-46.5-51.5000118.3
235S58.2Low57.6Low102 Ų102108.3 Ų108.371%0.71364%0.643SS**  trans-132.694.3158.868.70000114.6K237S235-K237 VanDerWaalsContact C-N 3.28Å; S235-K237 PolarHBondContact O-N 3.45Å
236H52.6Low58Low199 Ų199109.2 Ų109.292%0.92165%0.645SS**  trans-8166.4171.5-72.7-80.4000111.6
237K56.4Low58.8Low184 Ų184105.6 Ų105.680%0.862%0.619SS**SBendtrans-137.1122.8173.9-67.3-169.3177.3-176.30111.7S235S235-K237 VanDerWaalsContact C-N 3.28Å; S235-K237 PolarHBondContact O-N 3.45Å
238S52.7Low59.8Low102 Ų102107 Ų10771%0.71362%0.622SS**  trans31.891.5163.557.10000116.5Q240S238-Q240 PolarHBondContact O-N 3.33Å
239G51.4Low60.6Low78 Ų78102.5 Ų102.580%0.80460%0.602SS**  trans-66.298.6170.300000111.4
240Q56.4Low61.4Low157 Ų15798.2 Ų98.273%0.73458%0.583SS**  trans-58.9138.3173-84.7-172.9-41.700110.6S238 V242S238-Q240 PolarHBondContact O-N 3.33Å; Q240-V242 PolarHBondContact O-N 2.64Å
241P57.9Low62.1Low108 Ų108100.5 Ų100.570%0.70159%0.588SS**  trans-63129172.926.7-33.2000109.8G243P241-G243 PolarHBondContact O-N 3.1Å
242V58.5Low63Low49 Ų49102.6 Ų102.630%0.29758%0.579SS.*SBendtrans-79.9112.6-172.4178.20000110.5I227 H228 Q240I227-V242 HydrophobicContact CG2-CG2 4.46Å; H228-V242 HydrophobicContact CB-CG1 4.4Å; H228-V242 HydrophobicContact CB-CG2 4.26Å; Q240-V242 PolarHBondContact O-N 2.64Å
243G64.3Low63.5Low30 Ų30100.3 Ų100.331%0.30957%0.572SS.*  trans88.7108.6171.400000114.3P241 F245P241-G243 PolarHBondContact O-N 3.1Å; G243-F245 VanDerWaalsContact O-CD2 3.3Å; G243-F245 WeakPolarHBondContact O-CD2 3.35Å; G243-F245 WeakPolarHBondContact O-CE2 3.43Å; G243-F245 PolarHBondContact O-N 3.19Å
244A66.1Low63.9Low71 Ų7197.4 Ų97.459%0.58756%0.556SS**EExtended strand (participates in β ladder)trans-81.5105161.900000109.1K246A244-K246 PolarHBondContact O-N 3.2Å
245F71.2Confident64.3Low52 Ų5298.1 Ų98.123%0.22856%0.559CS.*EExtended strand (participates in β ladder)trans-74.5110-179.4-68.6-87.3000111.1I6 E8 L220 L225 G243 I247I6-F245 HydrophobicContact CG2-CB 4.4Å; E8-F245 HydrophobicContact CG-CE1 4.41Å; L220-F245 HydrophobicContact CD1-CG 4.32Å; L225-F245 HydrophobicContact CD1-CE2 3.71Å; L225-F245 HydrophobicContact CD1-CZ 4.45Å; L225-F245 HydrophobicContact CD2-CE2 3.9Å; L225-F245 HydrophobicContact CD2-CZ 3.8Å; L225-F245 HydrophobicContact CG-CE2 4.48Å; G243-F245 VanDerWaalsContact O-CD2 3.3Å; G243-F245 WeakPolarHBondContact O-CD2 3.35Å; G243-F245 WeakPolarHBondContact O-CE2 3.43Å; G243-F245 PolarHBondContact O-N 3.19Å; F245-I247 PolarHBondContact O-N 2.78Å
246K73.1Confident64.6Low77 Ų77100.4 Ų100.434%0.33556%0.562SS.*EExtended strand (participates in β ladder)trans-86.2100.2176.7-173.5162.6-176165.20110.8I6 K7 A244I6-K246 WeakPolarHBondContact CA-O 3.21Å; K7-K246 PolarHBondContact N-O 3.2Å; K7-K246 PolarHBondContact O-N 3.47Å; A244-K246 PolarHBondContact O-N 3.2Å
247I75.7Confident64.9Low32 Ų3296 Ų9616%0.16455%0.553CS.*EExtended strand (participates in β ladder)trans-75.8120.1169.4-56.2177.4000108.7I4 I6 I216 F245 L249I4-I247 HydrophobicContact CG2-CG2 4.35Å; I6-I247 HydrophobicContact CD1-CD1 4.49Å; I6-I247 HydrophobicContact CD1-CG1 4.09Å; I6-I247 HydrophobicContact CG1-CB 4.43Å; I6-I247 HydrophobicContact CG1-CG1 4.05Å; I6-I247 HydrophobicContact CG1-CG2 4.26Å; I6-I247 HydrophobicContact CG2-CG1 3.94Å; I216-I247 HydrophobicContact CG2-CD1 3.88Å; F245-I247 PolarHBondContact O-N 2.78Å; I247-L249 HydrophobicContact CG2-CD2 3.77Å; I247-L249 HydrophobicContact CG2-CG 4.18Å
248K77.1Confident64.8Low137 Ų13792.5 Ų92.560%0.59655%0.549SS*.EExtended strand (participates in β ladder)trans-108.6108167.1-174.7-177177.5-177.10109.4S5S5-K248 PolarHBondContact N-O 2.91Å; S5-K248 WeakPolarHBondContact O-CA 3.39Å; S5-K248 WeakPolarHBondContact O-CB 3.27Å; S5-K248 PolarHBondContact O-N 3.35Å
249L73.2Confident64.6Low55 Ų5592.4 Ų92.429%0.28855%0.545SS..EExtended strand (participates in β ladder)trans-80.4140.9169.8-52.1175.1000109.5I4 I209 V213 I247I4-L249 HydrophobicContact CB-CD2 4.35Å; I4-L249 HydrophobicContact CD1-CD2 3.64Å; I4-L249 HydrophobicContact CG1-CD2 3.67Å; I4-L249 HydrophobicContact CG2-CD2 3.82Å; I209-L249 HydrophobicContact CG2-CD1 3.63Å; V213-L249 HydrophobicContact CG2-CD1 4.4Å; I247-L249 HydrophobicContact CG2-CD2 3.77Å; I247-L249 HydrophobicContact CG2-CG 4.18Å
250S70.2Confident64.8Low53 Ų5393.8 Ų93.837%0.37155%0.549SS..EExtended strand (participates in β ladder)trans-143.7115.8165.347.50000112R3R3-S250 CarbonylContact C-O 3.51Å; R3-S250 PolarHBondContact N-O 3.36Å; R3-S250 CarbonylContact O-C 3.42Å; R3-S250 WeakPolarHBondContact O-CA 3.12Å; R3-S250 PolarHBondContact O-N 2.78Å; R3-S250 PolarHBondContact O-OG 2.89Å
251V69.3Low64.6Low94 Ų9492.5 Ų92.557%0.5755%0.547SS*.EExtended strand (participates in β ladder)trans-78.9122.8167.4177.80000107.2
252M67.8Low64.5Low121 Ų12195.3 Ų95.360%0.59655%0.551SS**PPolyproline II helixtrans-90118.9162.8-61-12364.600106.9M1 D254M1-M252 PolarHBondContact N-O 2.64Å; M1-M252 WeakPolarHBondContact O-CA 3.26Å; M1-M252 VanDerWaalsContact O-CB 3.26Å; M1-M252 WeakPolarHBondContact O-CB 3.41Å; M1-M252 PolarHBondContact O-N 2.95Å; M252-D254 PolarHBondContact O-N 3.47Å
253P67.1Low64.6Low99 Ų99101.1 Ų101.164%0.64357%0.572SS**PPolyproline II helixtrans-60.3139.6175.127.5-34.3000108.5L255P253-L255 PolarHBondContact O-N 3.22Å; P253-L255 VanDerWaalsContact O-N 3.15Å
254D65.9Low64.1Low84 Ų84106.5 Ų106.545%0.44959%0.589SS.*  trans-70.5115179.8-71.9-55.4000109.4M1 M252 I256M1-D254 PolarHBondContact N-OD1 3.1Å; M1-D254 PolarHBondContact N-OD2 2.84Å; M252-D254 PolarHBondContact O-N 3.47Å; D254-I256 PolarHBondContact O-N 2.91Å
255L65.9Low63.7Low176 Ų176110.2 Ų110.292%0.92160%0.597SS**SBendtrans-65.813-177.8-69.1164.8000113.8P253P253-L255 PolarHBondContact O-N 3.22Å; P253-L255 VanDerWaalsContact O-N 3.15Å
256I64Low63Low150 Ų150115.1 Ų115.177%0.76962%0.619SS**  trans-131.662.5-175.8-44.2179000107.6D254 P258D254-I256 PolarHBondContact O-N 2.91Å; I256-P258 WeakPolarHBondContact O-CD 3.2Å
257S57.9Low62.1Low107 Ų107118.4 Ų118.475%0.74864%0.639SS**  trans-82.4105.9166.3480000109.2T259S257-T259 PolarHBondContact O-N 3.01Å
258P55.1Low61Low110 Ų110122.4 Ų122.471%0.71467%0.667SS**  trans-72.9119.1-175.129.3-34.5000111.4I256I256-P258 WeakPolarHBondContact O-CD 3.2Å
259T48.5Very low60.1Low101 Ų101127.6 Ų127.662%0.6268%0.683SS**  trans58.189.2157.5550000118.5S257 Q262S257-T259 PolarHBondContact O-N 3.01Å; T259-Q262 HydrophobicContact CG2-CG 4.35Å
260A56.3Low59.2Low107 Ų107129.1 Ų129.188%0.88470%0.704SS**SBendtrans-91.75.7150.100000113.1
261N52.6Low58.6Low129 Ų129134.9 Ų134.969%0.6972%0.724SS**  trans-129.737.1-171.4-98.5-57.5000114.2K263N261-K263 PolarHBondContact O-N 2.7Å
262Q55.6Low57.7Low168 Ų168141.2 Ų141.279%0.78574%0.738SS**  trans-73.672.6156-72.4-159.824.800109.7T259 E264T259-Q262 HydrophobicContact CG2-CG 4.35Å; Q262-E264 PolarHBondContact O-N 3.47Å
263K59.2Low56.8Low171 Ų171142.3 Ų142.374%0.74375%0.746SS**  trans-64.7117.9164.4-84-175.5176176.50108.2N261 I265N261-K263 PolarHBondContact O-N 2.7Å; K263-I265 PolarHBondContact O-N 3.15Å
264E54.1Low56.4Low142 Ų142144.6 Ų144.666%0.66475%0.752SS**  trans-33.594175.8-172.6-161.6179.900112.9Q262 K266Q262-E264 PolarHBondContact O-N 3.47Å; E264-K266 VanDerWaalsContact C-N 3.32Å; E264-K266 VanDerWaalsContact CD-NZ 3.26Å; E264-K266 HydrophobicContact CG-CG 4.13Å; E264-K266 PolarHBondContact O-N 2.94Å; E264-K266 WeakPolarHBondContact OE1-CE 3.47Å; E264-K266 IonicContact OE1-NZ 3.28Å; E264-K266 PolarHBondContact OE1-NZ 2.82Å; E264-K266 WeakPolarHBondContact OE2-CE 3.17Å; E264-K266 IonicContact OE2-NZ 2.64Å; E264-K266 PolarHBondContact OE2-NZ 3Å
265I59Low56.1Low150 Ų150150 Ų15077%0.76977%0.772SS**  trans-72.495171.3-60.5-178.2000106.7K263 L267K263-I265 PolarHBondContact O-N 3.15Å; I265-L267 HydrophobicContact CG2-CD1 4.45Å; I265-L267 PolarHBondContact O-N 2.94Å
266K55.3Low55.8Low155 Ų155147.5 Ų147.567%0.67477%0.767SS**  trans-6484.2173.2-78.8-177.4164.6100.60109.9E264E264-K266 VanDerWaalsContact C-N 3.32Å; E264-K266 VanDerWaalsContact CD-NZ 3.26Å; E264-K266 HydrophobicContact CG-CG 4.13Å; E264-K266 PolarHBondContact O-N 2.94Å; E264-K266 WeakPolarHBondContact OE1-CE 3.47Å; E264-K266 IonicContact OE1-NZ 3.28Å; E264-K266 PolarHBondContact OE1-NZ 2.82Å; E264-K266 WeakPolarHBondContact OE2-CE 3.17Å; E264-K266 IonicContact OE2-NZ 2.64Å; E264-K266 PolarHBondContact OE2-NZ 3Å
267L53.6Low55.4Low146 Ų146149.6 Ų149.676%0.76477%0.773SS**  trans-55.6126.2176-140.975.4000108.8I265 R269I265-L267 HydrophobicContact CG2-CD1 4.45Å; I265-L267 PolarHBondContact O-N 2.94Å; L267-R269 PolarHBondContact O-N 3.27Å
268P54.3Low55.5Low116 Ų116153.7 Ų153.775%0.75378%0.777SS**  trans-60.9128.8-176.323-32.8000110.2A270P268-A270 VanDerWaalsContact C-N 3.27Å; P268-A270 PolarHBondContact O-N 3.18Å
269R58Low55.9Low246 Ų246154.2 Ų154.293%0.92878%0.778SS**  trans-69.578-172.5-170.9178.8-176.9169.91.3111.5L267 Q271L267-R269 PolarHBondContact O-N 3.27Å; R269-Q271 PolarHBondContact O-N 2.94Å
270A53.6Low56.6Low87 Ų87154.9 Ų154.972%0.71978%0.784SS**  trans-55.3122.4179.500000111P268 R272P268-A270 VanDerWaalsContact C-N 3.27Å; P268-A270 PolarHBondContact O-N 3.18Å; A270-R272 PolarHBondContact O-N 3.09Å
271Q56.6Low57.3Low173 Ų173155.5 Ų155.581%0.80878%0.779SS**  trans-71.389.2-176.5-68.9-177.9-11.900111.4R269 N273R269-Q271 PolarHBondContact O-N 2.94Å; Q271-N273 VanDerWaalsContact C-N 3.26Å; Q271-N273 PolarHBondContact O-N 2.93Å
272R52.4Low57.3Low227 Ų227156.3 Ų156.386%0.85778%0.779SS**  trans-72.184.8163.7-78.8-173.4171.5159.9-0.6110A270 L274A270-R272 PolarHBondContact O-N 3.09Å; R272-L274 PolarHBondContact O-N 3.12Å
273N47.9Very low57.2Low144 Ų144158.4 Ų158.477%0.7778%0.78SS**  trans-65.577.2164.9-87.4-57.4000110.4Q271Q271-N273 VanDerWaalsContact C-N 3.26Å; Q271-N273 PolarHBondContact O-N 2.93Å
274L58.9Low56.7Low147 Ų147159.1 Ų159.177%0.7778%0.783SS**  trans-104.4107.5168.6-74.1169.5000108.3R272R272-L274 PolarHBondContact O-N 3.12Å
275K59.8Low56.8Low197 Ų197157.4 Ų157.486%0.85778%0.782SS**  trans-61.6136.6177-66.8177.6178.1177.50109.5Q277K275-Q277 PolarHBondContact O-N 3.24Å
276P58.5Low56.5Low125 Ų125157.2 Ų157.281%0.81278%0.783SS**  trans-65.2120.8173.826.8-33.2000110K278P276-K278 PolarHBondContact O-N 2.88Å
277Q55.7Low56.2Low193 Ų193154.5 Ų154.590%0.90279%0.789SS**  trans-7496.2175.1-169.8177.435.300108.8K275 V279K275-Q277 PolarHBondContact O-N 3.24Å; Q277-V279 PolarHBondContact O-N 3.22Å
278K61.3Low56Low194 Ų194154.9 Ų154.984%0.84379%0.787SS**  trans-74.3115.7-177.1-169.8176.9-179-177.70110.4P276P276-K278 PolarHBondContact O-N 2.88Å
279V63.4Low55.9Low121 Ų121156.8 Ų156.873%0.73379%0.786SS**PPolyproline II helixtrans-63.3133.1174.5-178.30000109.9Q277Q277-V279 PolarHBondContact O-N 3.22Å
280P63.3Low55.5Low115 Ų115153.3 Ų153.375%0.74778%0.78SS**PPolyproline II helixtrans-83.7125.3174.831.9-31.9000111.4
281P69.6Low55.2Low120 Ų120155.3 Ų155.378%0.77979%0.787SS**PPolyproline II helixtrans-79.5146.9162.332.9-32000110.7
282E53.8Low54.4Low146 Ų146153.8 Ų153.868%0.68279%0.785SS**PPolyproline II helixtrans-75.7168.5172.7-53.3-176.3107.600112.9
283R52.3Low54.3Low212 Ų212150.3 Ų150.380%0.878%0.782SS**  trans75.6145.3162-54.3158.4-155.2-161.84.6115.2
284K50.3Low54.2Low185 Ų185151.5 Ų151.580%0.80478%0.78SS**  cis-172.8168.4-32.3-124.4179.9-178.7-174.30106
285T55.1Low53.6Low107 Ų107151.8 Ų151.866%0.65678%0.781SS**  trans58.797.7162.554.50000119.3
286D54.1Low52.9Low146 Ų146146.4 Ų146.478%0.78177%0.774SS**  72.1140.3116.9-42.9-31000123.5
287A48.9Very low52.2Low98 Ų98151.9 Ų151.981%0.8178%0.778SS**  trans64.5153157.100000119.1
288E49.2Very low51.9Low154 Ų154150.2 Ų150.272%0.7278%0.775SS**  cis-163.8170-32.2-156.2-173.390.200107
289Q51.1Low51.1Low156 Ų156151.7 Ų151.773%0.72978%0.775SS**  trans66.5126.2169.3-61.6154.531.900115.7
290Q50.1Low50.3Low172 Ų172150.1 Ų150.180%0.80477%0.77SS**  cis96.7110.132.5-174.9174.3400113.8
291C46.4Very low49.8Very low129 Ų129152.9 Ų152.987%0.87277%0.77SS**  trans-175.6134.4138.1-105.90000111.4
292D41.7Very low48.7Very low141 Ų141154.7 Ų154.775%0.75477%0.773SS**  trans-83.4171.6175-54.3-94.3000113.3
293I50.1Low48.3Very low155 Ų155151.6 Ų151.680%0.79577%0.773SS**  trans-170.7121.6141.6-100.8148.7000113
294F44Very low48Very low169 Ų169150.3 Ų150.374%0.74177%0.773SS**  trans50.5132.4151.6-66.3-110.4000121
295I47.7Very low48Very low152 Ų152146.6 Ų146.678%0.77976%0.762SS**  cis73.2127.148.2-59165.2000111.6
296A43.7Very low47.5Very low85 Ų85151.2 Ų151.270%0.70277%0.769SS**  cis-137.4169.412.500000111.3
297R44.5Very low46.9Very low240 Ų240151 Ų15191%0.90677%0.768SS**  cis91.597.515.1-178-156.9145.7155.6-5.9117.3
298D49.9Very low46.8Very low158 Ų158151.8 Ų151.885%0.84576%0.762SS**  trans-154.7179.1147.1-149.5-4.9000114.9
299R45.3Very low46.8Very low224 Ų224151.3 Ų151.385%0.84577%0.769SS**  trans-137.9159.5-169.3-62.3169.2156.3174.4-7.5114.4
300S45.2Very low46.5Very low88 Ų88147 Ų14762%0.61577%0.766SS**  126.3150.1114.681.60000120.8
301K53.5Low46Very low173 Ų173147.7 Ų147.775%0.75277%0.769SS**  trans80.6118.2149.1-68.9157.6-166.6167.60121.7
302N46.5Very low45.8Very low158 Ų158147.7 Ų147.785%0.84577%0.766SS**  53.1140.6126.2-54.1-8.7000119.8
303A44.9Very low45.7Very low81 Ų81145.1 Ų145.167%0.66976%0.764SS**  cis-15116035.500000112.6
304K46.7Very low45Very low186 Ų186145.7 Ų145.781%0.80977%0.767SS**  55.2140.8103.5-62-173.7179.3-174.20115.5
305N49.4Very low44.9Very low107 Ų107149.6 Ų149.657%0.57278%0.777SS**  cis-164157.818.4-128.84.3000113.7
306Y44.9Very low44.4Very low204 Ų204148.4 Ų148.480%0.878%0.777SS**  trans60.3165.1161.4-58.2-62000122.1
307D42.4Very low44.4Very low141 Ų141153.7 Ų153.775%0.75478%0.78SS**  -174.4-178.9-60.7-166.611.8000109.7
308V46.5Very low44Very low115 Ų115150.8 Ų150.870%0.69777%0.774SS**  trans99.194.7158.6-170.50000118.7
309V47.9Very low43.6Very low144 Ų144153.5 Ų153.587%0.87377%0.772SS**  trans52.2133.1131.3-175.30000120
310G44.6Very low43.3Very low64 Ų64146.8 Ų146.866%0.6676%0.76SS**  cis173-177.4-0.200000115.2
311H39.6Very low43.1Very low187 Ų187152.6 Ų152.687%0.86678%0.775SS**  trans-88-176.3-178.5-55.8-103.2000111.9
312T42.3Very low42.5Very low130 Ų130148.1 Ų148.180%0.79878%0.777SS**  cis-165.9165.717.1-21.80000112.5
313A39.9Very low42.4Very low87 Ų87148.7 Ų148.772%0.71978%0.78SS**  trans69.7110.4137.900000123.4
314L35.2Very low42.2Very low166 Ų166147.7 Ų147.787%0.86978%0.778SS**  6133.1128.8-72.4161.8000119.9
315R41.7Very low41.9Very low252 Ų252145.2 Ų145.295%0.95178%0.782SS**  trans-155.7150.1131.9-118171.4-170.5166.74.4113.6
316V38.3Very low41.5Very low127 Ų127144.8 Ų144.877%0.7779%0.794SS**  trans-98.6144.3177.4172.70000109.7
317Y43Very low41.4Very low195 Ų195139.2 Ų139.277%0.76580%0.799SS**  trans-145.3156.2152.5-139.3-101.6000113.1
318K36.9Very low41.3Very low180 Ų180136.2 Ų136.278%0.78380%0.801SS**  trans-151.3119.7-166.7172.4-173.4178.6-1790109.8
319R40Very low41.1Very low214 Ų214137 Ų13781%0.80881%0.806SS**  trans178.3165.1166.4-100.2158.8-170.3-161.33.4109.7
320S39.9Very low40.6Very low84 Ų84135.1 Ų135.159%0.58780%0.8SS**  cis173.5139.5-49.2-98.60000111.5
321F41.2Very low40.4Very low210 Ų210140.8 Ų140.892%0.92181%0.808SS**  trans67.8147.1160.2-60.1-61.3000120.7
322G41.2Very low40.6Very low78 Ų78137.9 Ų137.980%0.80480%0.804SS**  trans129.8121.6168.300000115.3
323N43.2Very low40.2Very low170 Ų170139 Ų13991%0.90980%0.8SS**  -164.2138.6-73.3-172.840.9000109.9
324G41Very low40.3Very low61 Ų61141.3 Ų141.363%0.62981%0.805SS**  trans76165176.400000116.4
325C40.8Very low40.5Very low133 Ų133141.3 Ų141.390%0.89980%0.799SS**  cis-170.2163.5-10.3-97.20000108.5
326A41.7Very low40.7Very low98 Ų98137.4 Ų137.481%0.8180%0.795SS**  cis-173.1154-26.700000109.9
327G41Very low40.7Very low88 Ų88136.4 Ų136.491%0.90779%0.793SS**  trans113143168.500000116
328G41.9Very low40.6Very low77 Ų77132.1 Ų132.179%0.79480%0.798SS**  trans144.456.317600000117.7
329T40.8Very low40.9Very low132 Ų132128.4 Ų128.481%0.8180%0.795SS**  trans-1.4116.7165.951.10000121.2
330S37.8Very low40.6Very low105 Ų105124 Ų12473%0.73480%0.796SS**  trans50116.8135.963.10000122.1
331H41Very low40.5Very low183 Ų183127 Ų12785%0.84781%0.805SS**  -151.2167.8114-123.3-87.7000111.8
332T43.9Very low40.5Very low126 Ų126126.2 Ų126.277%0.77380%0.804SS**  trans-67.8128.2-164.647.40000115.9
333E33.7Very low40.2Very low152 Ų152132.8 Ų132.871%0.7180%0.804SS**  trans-78.3115.8176.7-178.5-169.6-153.600112.8K335E333-K335 VanDerWaalsContact CD-CE 3.43Å; E333-K335 HydrophobicContact CG-CG 4.17Å; E333-K335 PolarHBondContact O-N 2.92Å; E333-K335 WeakPolarHBondContact OE2-CE 3.47Å; E333-K335 IonicContact OE2-NZ 3.56Å
334T42.9Very low40Very low136 Ų136130.8 Ų130.883%0.83479%0.793SS**  trans-84.396.2169.726.50000111.3L336T334-L336 PolarHBondContact O-N 2.64Å
335K38.6Very low39.8Very low167 Ų167139 Ų13973%0.72681%0.807SS**  trans-67.1122177.5-66.6-173.6178.6-179.30111.6E333E333-K335 VanDerWaalsContact CD-CE 3.43Å; E333-K335 HydrophobicContact CG-CG 4.17Å; E333-K335 PolarHBondContact O-N 2.92Å; E333-K335 WeakPolarHBondContact OE2-CE 3.47Å; E333-K335 IonicContact OE2-NZ 3.56Å
336L46.2Very low39.8Very low169 Ų169138 Ų13889%0.88580%0.796SS**  trans-64.1141.9175.3-73.3159000111.1T334 A338T334-L336 PolarHBondContact O-N 2.64Å; L336-A338 PolarHBondContact O-N 3.28Å
337C37.5Very low39.8Very low106 Ų106137.9 Ų137.972%0.71678%0.782SS**  trans-76.1113.9177.7-167.40000110.5S339C337-S339 VanDerWaalsContact C-N 3.27Å; C337-S339 PolarHBondContact O-N 3.29Å; C337-S339 PolarHBondContact SG-OG 2.91Å; C337-S339 VanDerWaalsContact SG-OG 3.32Å
338A41.4Very low40.1Very low106 Ų106140.2 Ų140.288%0.87677%0.774SS**THydrogen-bonded Turntrans-80.46.3-170.900000115.5L336L336-A338 PolarHBondContact O-N 3.28Å
339S43Very low40.8Very low101 Ų101139.5 Ų139.571%0.70676%0.756SS**THydrogen-bonded Turntrans-97.6-18.2-173.456.80000115.3C337 N341C337-S339 VanDerWaalsContact C-N 3.27Å; C337-S339 PolarHBondContact O-N 3.29Å; C337-S339 PolarHBondContact SG-OG 2.91Å; C337-S339 VanDerWaalsContact SG-OG 3.32Å; S339-N341 PolarHBondContact O-N 3.36Å
340C34.8Very low41.4Very low123 Ų123138.5 Ų138.583%0.83174%0.742SS**  trans-94.975.1-172.3-156.50000111.6
341N36.9Very low41.8Very low145 Ų145136.7 Ų136.778%0.77572%0.724SS**  trans-130.852.7-175.4-169.935.3000112.9S339S339-N341 PolarHBondContact O-N 3.36Å
342H41.4Very low42.3Very low194 Ų194135 Ų13590%0.89872%0.717SS**  trans-138.5141.9166.7-104.1-87000111.8
343R35.7Very low42.8Very low216 Ų216133 Ų13382%0.81570%0.701SS**  trans-85.6146.8172.9-85.4-179.6171.3152.7-5.9110.6
344D38.7Very low43.5Very low128 Ų128130.3 Ų130.368%0.68470%0.698SS**SBendtrans53.3122.6150.8-45.5-31.9000117.6
345Y35.7Very low43.8Very low233 Ų233128.2 Ų128.291%0.91469%0.688SS**  trans72104.4-172-55.4-86.9000115.2
346V41.1Very low44.7Very low112 Ų112129.5 Ų129.568%0.67969%0.688SS**  trans-108.5139.4162.9175.80000107.7E350V346-E350 HydrophobicContact CG1-CB 4.12Å
347N42Very low45Very low96 Ų96126.3 Ų126.351%0.51367%0.672SS.*  trans-78.8142.8-178.2-166.4-4.5000110.8S349 E350 L351N347-S349 PolarHBondContact ND2-OG 3.33Å; N347-S349 PolarHBondContact O-N 3.35Å; N347-S349 VanDerWaalsContact O-N 3.17Å; N347-E350 HydrophobicContact CB-CG 4.08Å; N347-E350 WeakPolarHBondContact CB-OE2 3.42Å; N347-E350 PolarHBondContact N-OE2 3.19Å; N347-E350 WeakPolarHBondContact O-CB 3.4Å; N347-E350 PolarHBondContact O-N 2.97Å; N347-L351 PolarHBondContact O-N 3.07Å
348L46.6Very low45.5Very low138 Ų138133.1 Ų133.172%0.72368%0.683SS**Hα-helixtrans-58.8-33.1-178.2-76.8166.1000112.4E350 L351 E352L348-E350 VanDerWaalsContact C-N 3.26Å; L348-E350 PolarHBondContact O-N 3.37Å; L348-L351 PolarHBondContact O-N 3.17Å; L348-E352 PolarHBondContact O-N 3.32Å
349S56.2Low45.8Very low61 Ų61135.3 Ų135.343%0.42768%0.675SS.*Hα-helixtrans-69.7-15.8175.156.70000114.7N347 N353N347-S349 PolarHBondContact ND2-OG 3.33Å; N347-S349 PolarHBondContact O-N 3.35Å; N347-S349 VanDerWaalsContact O-N 3.17Å; S349-N353 PolarHBondContact O-ND2 3.27Å
350E54.7Low45.9Very low112 Ų112136.6 Ų136.652%0.52368%0.683SS.*Hα-helixtrans-86.8-33.8174.6-64.1167157.700110.5V346 N347 L348 N353 C354V346-E350 HydrophobicContact CG1-CB 4.12Å; N347-E350 HydrophobicContact CB-CG 4.08Å; N347-E350 WeakPolarHBondContact CB-OE2 3.42Å; N347-E350 PolarHBondContact N-OE2 3.19Å; N347-E350 WeakPolarHBondContact O-CB 3.4Å; N347-E350 PolarHBondContact O-N 2.97Å; L348-E350 VanDerWaalsContact C-N 3.26Å; L348-E350 PolarHBondContact O-N 3.37Å; E350-N353 PolarHBondContact O-N 3.47Å; E350-C354 PolarHBondContact O-N 3.12Å
351L46.5Very low46.1Very low67 Ų67134.4 Ų134.435%0.35167%0.669SS.*Hα-helixtrans-65.7-38.7176.9-163.170000112.1N347 L348 N353 C354N347-L351 PolarHBondContact O-N 3.07Å; L348-L351 PolarHBondContact O-N 3.17Å; L351-N353 VanDerWaalsContact C-N 3.26Å; L351-N353 PolarHBondContact O-N 3.16Å; L351-C354 WeakPolarHBondContact O-CB 3.46Å; L351-C354 PolarHBondContact O-N 2.9Å
352E51.1Low46.6Very low148 Ų148131 Ų13169%0.69266%0.656SS**Hα-helixtrans-61.4-31.3174.9-73-163.7125.200113.4L348 R356L348-E352 PolarHBondContact O-N 3.32Å; E352-R356 WeakPolarHBondContact O-CB 3.4Å
353N53.5Low46.8Very low82 Ų82126.1 Ų126.144%0.43966%0.659SS.*Hα-helixtrans-77.2-34.6178.2-67.9-33.8000112S349 E350 L351 C355 R356 D357S349-N353 PolarHBondContact O-ND2 3.27Å; E350-N353 PolarHBondContact O-N 3.47Å; L351-N353 VanDerWaalsContact C-N 3.26Å; L351-N353 PolarHBondContact O-N 3.16Å; N353-C355 VanDerWaalsContact C-N 3.25Å; N353-C355 PolarHBondContact O-N 3.1Å; N353-R356 WeakPolarHBondContact O-CB 3.48Å; N353-R356 PolarHBondContact O-N 2.88Å; N353-D357 PolarHBondContact O-N 3.1Å; N353-D357 VanDerWaalsContact O-N 3.16Å
354C48.2Very low47.8Very low96 Ų96120 Ų12065%0.64964%0.642SS**Hα-helixtrans-57.7-35179-172.50000113.2E350 L351E350-C354 PolarHBondContact O-N 3.12Å; L351-C354 WeakPolarHBondContact O-CB 3.46Å; L351-C354 PolarHBondContact O-N 2.9Å
355C49.3Very low49.1Very low93 Ų93118.9 Ų118.963%0.62864%0.64SS**THydrogen-bonded Turntrans-88.9-4175.4-61.80000114.3N353N353-C355 VanDerWaalsContact C-N 3.25Å; N353-C355 PolarHBondContact O-N 3.1Å
356R58.6Low50.4Low193 Ų193112.6 Ų112.673%0.72862%0.621SS**THydrogen-bonded Turntrans-100.1-38.5-173.5-169.8174.2-173.5156.41.4112.6E352 N353E352-R356 WeakPolarHBondContact O-CB 3.4Å; N353-R356 WeakPolarHBondContact O-CB 3.48Å; N353-R356 PolarHBondContact O-N 2.88Å
357D51.7Low51.3Low103 Ų103112.9 Ų112.955%0.55162%0.615SS**SBendtrans-80.8121.3175.5-71.8-40.4000111N353 H359N353-D357 PolarHBondContact O-N 3.1Å; N353-D357 VanDerWaalsContact O-N 3.16Å; D357-H359 PolarHBondContact O-N 3.37Å
358R47.9Very low52Low249 Ų249113.5 Ų113.594%0.9461%0.614SS**  trans-73.565.8-172.9-68.7-177.7170.8-167.3-1.7112.9
359H48Very low52.7Low152 Ų152111.2 Ų111.270%0.70460%0.602SS**  trans-70.4137.7173.1-72.6-73.8000111.5D357 C361D357-H359 PolarHBondContact O-N 3.37Å; H359-C361 PolarHBondContact O-N 3.01Å
360S45Very low53.2Low127 Ų127116.6 Ų116.689%0.88861%0.613SS**  trans-7465.5-172-56.60000113.7
361C40.2Very low53.6Low77 Ų77115.9 Ų115.952%0.5261%0.609SS.*  trans-62.9143159.7-63.10000109.3H359H359-C361 PolarHBondContact O-N 3.01Å
362S46.6Very low54.5Low73 Ų73114.6 Ų114.651%0.5161%0.606SS.*  trans-58.6143.9-167.550.40000113.3N364S362-N364 PolarHBondContact O-N 3.4Å
363G46.1Very low54.9Low93 Ų93113.4 Ų113.496%0.95960%0.604SS**SBendtrans-67.122.7-174.200000116.8
364N57.2Low55.3Low86 Ų86119.8 Ų119.846%0.4662%0.622SS.*  trans-102.8110.7170.2-176.9-18.2000109.1S362 I366 H367 H368S362-N364 PolarHBondContact O-N 3.4Å; N364-I366 PolarHBondContact O-N 2.78Å; N364-I366 VanDerWaalsContact O-N 3.09Å; N364-I366 WeakPolarHBondContact OD1-CB 3.42Å; N364-I366 PolarHBondContact OD1-N 2.87Å; N364-I366 VanDerWaalsContact OD1-N 3.07Å; N364-H367 HydrophobicContact CB-CB 4.44Å; N364-H367 WeakPolarHBondContact O-CB 3.4Å; N364-H367 PolarHBondContact O-N 3.16Å; N364-H368 PolarHBondContact O-N 3.27Å
365V64.4Low56.2Low106 Ų106121.5 Ų121.564%0.64262%0.62SS**Hα-helixtrans-50.3-36.9-179177.20000112.6H367 H368 I369V365-H367 PolarHBondContact O-N 2.93Å; V365-H368 PolarHBondContact O-N 3.23Å; V365-I369 HydrophobicContact CG1-CD1 3.87Å; V365-I369 HydrophobicContact CG1-CG1 4.46Å; V365-I369 WeakPolarHBondContact O-CG1 3.35Å; V365-I369 PolarHBondContact O-N 3.25Å; V365-I369 VanDerWaalsContact O-N 3.1Å
366I64.4Low56.3Low100 Ų100118.3 Ų118.351%0.51360%0.599SS.*Hα-helixtrans-63.6-32.5179.7-56.1174.6000111.3N364 R370N364-I366 PolarHBondContact O-N 2.78Å; N364-I366 VanDerWaalsContact O-N 3.09Å; N364-I366 WeakPolarHBondContact OD1-CB 3.42Å; N364-I366 PolarHBondContact OD1-N 2.87Å; N364-I366 VanDerWaalsContact OD1-N 3.07Å; I366-R370 WeakPolarHBondContact O-CG 3.44Å; I366-R370 PolarHBondContact O-N 2.91Å
367H59.8Low56.3Low119 Ų119118.9 Ų118.955%0.55161%0.609SS**Hα-helixtrans-78.3-31.5-179.9-137.7-73.3000112.4N364 V365 H371N364-H367 HydrophobicContact CB-CB 4.44Å; N364-H367 WeakPolarHBondContact O-CB 3.4Å; N364-H367 PolarHBondContact O-N 3.16Å; V365-H367 PolarHBondContact O-N 2.93Å; H367-H371 WeakPolarHBondContact O-CB 2.82Å; H367-H371 PolarHBondContact O-N 3.3Å
368H56.9Low56Low109 Ų109118.1 Ų118.151%0.50561%0.611SS.*Hα-helixtrans-68.5-46173.4-171.1-11.2000111.3N364 V365 H371 C372N364-H368 PolarHBondContact O-N 3.27Å; V365-H368 PolarHBondContact O-N 3.23Å; H368-H371 PolarHBondContact O-N 3.43Å; H368-C372 VanDerWaalsContact CE1-SG 3.55Å; H368-C372 PolarHBondContact ND1-SG 3.2Å; H368-C372 VanDerWaalsContact ND1-SG 3.43Å; H368-C372 PolarHBondContact O-N 3.31Å; H368-C372 PolarHBondContact O-SG 3.09Å
369I61.3Low55.6Low89 Ų89111.3 Ų111.346%0.45660%0.599SS.*Hα-helixtrans-57-52.9176.7-67166000110.2V365 H371 C372 D373V365-I369 HydrophobicContact CG1-CD1 3.87Å; V365-I369 HydrophobicContact CG1-CG1 4.46Å; V365-I369 WeakPolarHBondContact O-CG1 3.35Å; V365-I369 PolarHBondContact O-N 3.25Å; V365-I369 VanDerWaalsContact O-N 3.1Å; I369-H371 PolarHBondContact O-N 3.41Å; I369-H371 VanDerWaalsContact O-N 3.16Å; I369-C372 PolarHBondContact O-N 2.88Å; I369-C372 VanDerWaalsContact O-N 3.12Å; I369-D373 WeakPolarHBondContact CG2-OD2 3.39Å; I369-D373 PolarHBondContact O-N 3.19Å
370R65.2Low55.2Low175 Ų175109.9 Ų109.966%0.6660%0.603SS**Hα-helixtrans-63.5-21.4179.6-73.2177.6174.2-176.2-1.4114.8I366I366-R370 WeakPolarHBondContact O-CG 3.44Å; I366-R370 PolarHBondContact O-N 2.91Å
371H64.2Low55.1Low96 Ų96110.7 Ų110.744%0.44460%0.596SS.*Hα-helixtrans-79.6-43.9173.9-171.550.6000110.8H367 H368 I369 R374 H375H367-H371 WeakPolarHBondContact O-CB 2.82Å; H367-H371 PolarHBondContact O-N 3.3Å; H368-H371 PolarHBondContact O-N 3.43Å; I369-H371 PolarHBondContact O-N 3.41Å; I369-H371 VanDerWaalsContact O-N 3.16Å; H371-R374 PolarHBondContact O-N 3.07Å; H371-H375 AromaticContact CE1-CD2 3.64Å; H371-H375 AromaticContact ND1-CD2 3.51Å; H371-H375 PolarHBondContact O-CD2 2.77Å; H371-H375 PolarHBondContact O-N 3.36Å
372C64.3Low55.2Low41 Ų41112.9 Ų112.928%0.27761%0.607SS.*Hα-helixtrans-63.2-47.7174.6-66.30000112H368 I369 R374 H375 C376H368-C372 VanDerWaalsContact CE1-SG 3.55Å; H368-C372 PolarHBondContact ND1-SG 3.2Å; H368-C372 VanDerWaalsContact ND1-SG 3.43Å; H368-C372 PolarHBondContact O-N 3.31Å; H368-C372 PolarHBondContact O-SG 3.09Å; I369-C372 PolarHBondContact O-N 2.88Å; I369-C372 VanDerWaalsContact O-N 3.12Å; C372-R374 PolarHBondContact O-N 3.23Å; C372-H375 PolarHBondContact O-N 3.25Å; C372-H375 VanDerWaalsContact O-N 3.1Å; C372-C376 PolarHBondContact O-N 2.8Å
373D60.6Low54.8Low122 Ų122116.8 Ų116.865%0.65262%0.617SS**Hα-helixtrans-56.1-23.4179.3-71.9-22.9000114I369I369-D373 WeakPolarHBondContact CG2-OD2 3.39Å; I369-D373 PolarHBondContact O-N 3.19Å
374R61.4Low54Low216 Ų216121.8 Ų121.882%0.81561%0.612SS**Hα-helixtrans-100.3-12.4-178.6-81.9-173.5166.1-169.2-4.3115.1H371 C372H371-R374 PolarHBondContact O-N 3.07Å; C372-R374 PolarHBondContact O-N 3.23Å
375H66.4Low53.1Low132 Ų132122.9 Ų122.961%0.61163%0.626SS**Hα-helixtrans-132.1-7.2-173.6-66.4-68.4000114.5H371 C372H371-H375 AromaticContact CE1-CD2 3.64Å; H371-H375 AromaticContact ND1-CD2 3.51Å; H371-H375 PolarHBondContact O-CD2 2.77Å; H371-H375 PolarHBondContact O-N 3.36Å; C372-H375 PolarHBondContact O-N 3.25Å; C372-H375 VanDerWaalsContact O-N 3.1Å
376C51.1Low51.5Low27 Ų27129.2 Ų129.218%0.18264%0.639CS.*  trans-129.3115.8178.5-66.60000110C372 C378C372-C376 PolarHBondContact O-N 2.8Å; C376-C378 HydrophobicContact CB-CB 4.41Å; C376-C378 PolarHBondContact O-N 2.8Å
377H58.8Low50.3Low205 Ų205132.4 Ų132.495%0.94966%0.657SS**  trans-73.235.4169.4-76-66.5000112.6
378C45.3Very low49.1Very low86 Ų86131.6 Ų131.658%0.58167%0.671SS**PPolyproline II helixtrans-75.2127.8177.6-67.70000109.6C376C376-C378 HydrophobicContact CB-CB 4.41Å; C376-C378 PolarHBondContact O-N 2.8Å
379P40Very low48.4Very low106 Ų106132.2 Ų132.269%0.68869%0.687SS**PPolyproline II helixtrans-62.4147.4169.728-33.9000109.8I381P379-I381 PolarHBondContact O-N 2.76Å; P379-I381 VanDerWaalsContact O-N 3.12Å
380P40.7Very low47.1Very low122 Ų122135.8 Ų135.879%0.79271%0.707SS**PPolyproline II helixtrans-63.1117.1-172.724-33.9000111.5V382P380-V382 PolarHBondContact O-N 3.06Å; P380-V382 VanDerWaalsContact O-N 3.09Å
381I41.8Very low45.7Very low144 Ų144131.9 Ų131.974%0.73871%0.713SS**  trans-68.7106.8174.2-62.1175.4000108.2P379 H383P379-I381 PolarHBondContact O-N 2.76Å; P379-I381 VanDerWaalsContact O-N 3.12Å; I381-H383 PolarHBondContact O-N 3.32Å
382V42.1Very low44.3Very low124 Ų124136.8 Ų136.875%0.75274%0.736SS**  trans-7390.4178.7-170.50000109.6P380 F384P380-V382 PolarHBondContact O-N 3.06Å; P380-V382 VanDerWaalsContact O-N 3.09Å; V382-F384 PolarHBondContact O-N 2.85Å
383H38.1Very low42.7Very low155 Ų155140.7 Ų140.772%0.71876%0.762SS**  trans-68.8116.3178.6-108.1-88.3000111.5I381 S385I381-H383 PolarHBondContact O-N 3.32Å; H383-S385 VanDerWaalsContact C-N 3.35Å; H383-S385 PolarHBondContact O-N 3.23Å
384F30.8Very low41.3Very low197 Ų197144.7 Ų144.786%0.86477%0.77SS**  trans-70.188.3168.1-81.8-91.9000110.6V382 R386V382-F384 PolarHBondContact O-N 2.85Å; F384-R386 PolarHBondContact O-N 2.92Å
385S36.9Very low40.1Very low109 Ų109142.5 Ų142.576%0.76277%0.769SS**  trans-68.296.5173.5-67.70000111.1H383 N387H383-S385 VanDerWaalsContact C-N 3.35Å; H383-S385 PolarHBondContact O-N 3.23Å; S385-N387 PolarHBondContact O-N 2.91Å
386R32.2Very low38.7Very low240 Ų240148.2 Ų148.291%0.90679%0.785SS**  trans-57.9115.5167.3-73.1176.9170.6174.4-4109.8F384F384-R386 PolarHBondContact O-N 2.92Å
387N38.2Very low38.1Very low166 Ų166155.3 Ų155.389%0.88882%0.82SS**  trans-14997.2159.1-98.8-24.8000109.2S385S385-N387 PolarHBondContact O-N 2.91Å
388A33.9Very low37Very low103 Ų103154.3 Ų154.385%0.85181%0.813SS**  trans-136.8103.8169.600000107.4
389S43.3Very low36.9Very low121 Ų121161.4 Ų161.485%0.84683%0.827SS**  trans-73.8157.8172.451.30000111
390N34.6Very low37.3Very low164 Ų164163.3 Ų163.388%0.87784%0.838SS**SBendtrans-60164.7-176-82.2-52.9000115.5
391A34.6Very low37.2Very low93 Ų93163.8 Ų163.877%0.76984%0.842SS**  trans96.2148.4169.700000117.4
392Q35.7Very low37.1Very low199 Ų199161 Ų16193%0.9384%0.841SS**  trans63.861.1175.4-56.7-169.1-0.500117.7
393C29.4Very low37.4Very low123 Ų123160.9 Ų160.983%0.83184%0.84SS**  trans-143.760.3160.4-159.30000113.4
394Y31.9Very low37.9Very low207 Ų207160.4 Ų160.481%0.81284%0.843SS**  trans-159.3110.2168.7-101.9-81.3000108.6
395E35.5Very low38.4Very low170 Ų170159.9 Ų159.979%0.79484%0.843SS**SBendtrans163.940.5153.2-97.3-51.4129.900115.3
396R38.1Very low38.9Very low251 Ų251159.3 Ų159.395%0.94785%0.845SS**SBendtrans-148.911.8174.8-122.8169.4-162.4-176.74.5119.6
397L38.2Very low39.9Very low177 Ų177155.5 Ų155.593%0.92784%0.843SS**SBendtrans-139.133.5-179.3-105.9163000114.2
398K36.5Very low39.8Very low183 Ų183157.7 Ų157.780%0.79684%0.84SS**  trans-132.169171.8-81.1-169.1172.2-176.60112.2
399R42.2Very low40.3Very low235 Ų235160 Ų16089%0.88784%0.844SS**  trans-145.761.7169.2-72.3-162.2-175.5-174.42.8113.7
400T49.6Very low40.2Very low147 Ų147158.7 Ų158.790%0.90284%0.84SS**  trans-159.6107.2156.512.30000108.6
401C36.6Very low40.5Very low132 Ų132159 Ų15989%0.89284%0.841SS**  trans-106.4134.8178.5-58.10000110
402A41.7Very low40.7Very low86 Ų86165.5 Ų165.571%0.71185%0.846SS**  trans-170.9109.514300000112.5
403T47.2Very low40.8Very low121 Ų121162.6 Ų162.674%0.74284%0.841SS**  trans62.4140.1139.256.10000123
404N48.4Very low41.5Very low145 Ų145162.4 Ų162.478%0.77584%0.838SS**  trans74.4108.6162.8-50-12000115.5
405E41.8Very low41.7Very low186 Ų186160.9 Ų160.987%0.86984%0.839SS**  cis103.1140.722.6-164.1167.6-123.100113.9
406A48Very low41.7Very low97 Ų97158.9 Ų158.980%0.80284%0.838SS**  trans66.7141.8-170.100000115.5
407D51.8Low42Very low159 Ų159153.1 Ų153.185%0.8584%0.837SS**  cis-146.2167-5.2-157.2-3.2000111.4
408Y36.6Very low41.7Very low213 Ų213150.6 Ų150.684%0.83583%0.832SS**  trans-111.5131-175.3-110.9-94.7000112.7
409T45.4Very low41.9Very low150 Ų150147 Ų14792%0.9283%0.829SS**  trans-164.3151.4140.44.80000111.3
410A41.5Very low41.7Very low94 Ų94143.3 Ų143.378%0.77782%0.819SS**  trans-125.4150.7-172.900000112.1
411L40.7Very low41.3Very low170 Ų170142.5 Ų142.589%0.8981%0.805SS**  trans-144.4144.6166.6-109.8170.9000113.4
412R38.1Very low41.4Very low230 Ų230143.7 Ų143.787%0.86880%0.798SS**  trans-67.6158.6-157.9-65.4164.1166.6153.3-5.6117
413V38Very low41.2Very low139 Ų139146.6 Ų146.684%0.84280%0.797SS**  trans-94.6138.8153.4179.10000109.7
414P44.4Very low40.7Very low118 Ų118145.3 Ų145.377%0.76679%0.791SS**  trans-104.2160.316736.9-30.2000113.3
415Q36.1Very low40.2Very low175 Ų175145.4 Ų145.482%0.81879%0.791SS**  trans-111152.8178-69.8-176-49.900112.9
416T35Very low39.8Very low129 Ų129147.3 Ų147.379%0.79179%0.791SS**  trans37.1128.7144.7590000122.1
417S43.5Very low39.3Very low130 Ų130147.8 Ų147.891%0.90979%0.789SS**  trans-162.1175.5130.159.80000111.2
418C32.9Very low38.7Very low123 Ų123152 Ų15283%0.83179%0.793SS**  trans-145.7142-168.9177.90000112.3
419C41Very low38.7Very low108 Ų108149.9 Ų149.973%0.7380%0.795SS**  trans-177.1145.2157.8-93.40000107.7
420K37.9Very low38.6Very low158 Ų158151.4 Ų151.469%0.68780%0.796SS**  59.2135.264.2-73.8179.4157.5-78.50112.9
421E41.1Very low38.5Very low130 Ų130150.9 Ų150.961%0.60779%0.792SS**  cis-168.8155.4-3.9-121.7155.7176.400109.7
422Q37.6Very low39Very low157 Ų157149 Ų14973%0.73479%0.79SS**  trans61.2165.9162.7-65.5176.5-77.600117
423E39.1Very low39.2Very low146 Ų146143.9 Ų143.968%0.68279%0.785SS**  cis-156.7168.4-23.5-117.6178.7-13800112.5
424C36.2Very low39.8Very low94 Ų94143.3 Ų143.364%0.63578%0.781SS**  trans46.4110.7147.1-65.20000124.4
425I37.5Very low39.9Very low148 Ų148144.7 Ų144.776%0.75978%0.778SS**  60.4146.5121.7-58.4167.3000120.7
426Y33.7Very low40.4Very low226 Ų226144.2 Ų144.289%0.88677%0.773SS**  trans91.5134.3-176.4-76-85.8000114.4
427S36.9Very low41.1Very low107 Ų107147 Ų14775%0.74877%0.774SS**  cis-143.8155.910.3-75.70000112.3
428R38.8Very low41.3Very low248 Ų248147.2 Ų147.294%0.93677%0.765SS**  trans-151.157.8168.4-148.8-178.3-160.5-166.76.4115.1
429L37.5Very low42.2Very low168 Ų168150.5 Ų150.588%0.8877%0.768SS**  trans-142.3106.4170.3-80.6177.6000111.7
430L43.3Very low43Very low181 Ų181150.7 Ų150.795%0.94877%0.768SS**  trans-147.1135.3151.5-80.4-176000108.4
431A39.2Very low43.7Very low83 Ų83148 Ų14869%0.68677%0.766SS**  trans-95.6-177.4173.500000110.6
432P50.7Low44.3Very low131 Ų131149.3 Ų149.385%0.85178%0.777SS**  -137.5169.796.837.9-26.7000115.2
433T42.9Very low44.9Very low123 Ų123148.4 Ų148.476%0.75578%0.782SS**  trans-104.4-158.1174.751.40000110.6
434V49.9Very low45.5Very low127 Ų127148 Ų14877%0.7779%0.789SS**  trans84128.7174.1-178.10000113.9
435E47.8Very low46.2Very low147 Ų147154.7 Ų154.769%0.68780%0.801SS**  cis-151.3-163.9-6.1-129.6-166.8146.700115
436K45.9Very low46.9Very low164 Ų164153 Ų15371%0.71380%0.799SS**  trans-94.3155.8-167.7-29.9107.9178.2172.60114.8
437K50.1Low47.4Very low187 Ų187147.5 Ų147.581%0.81379%0.794SS**  177.8143.7114.2-100.2178.4177.1175.20117.1
438N48.4Very low47.9Very low136 Ų136148.8 Ų148.873%0.72780%0.797SS**  trans49.697.2141.1-60.212.8000123.4
439Q51.7Low48.3Very low192 Ų192142.5 Ų142.590%0.89779%0.786SS**  45.8157.2117.4-76.5-169.1-16.600125.4
440P55.9Low48.8Very low112 Ų112143.9 Ų143.973%0.72779%0.785SS**  trans-112.8-136.4-172.940.3-19.7000109.9
441P54.6Low48.7Very low100 Ų100143.8 Ų143.865%0.64978%0.78SS**  cis-134.9-172.8-19.630-6000114.8
442L53.1Low49.5Very low159 Ų159146 Ų14683%0.83279%0.787SS**  158.2159.6119.8-82.7176000113.9
443V50.6Low49.2Very low137 Ų137146.5 Ų146.583%0.8378%0.778SS**  trans-137.9121.3-179.4173.30000110.5
444V51.3Low49.4Very low137 Ų137148 Ų14883%0.8377%0.774SS**  trans-143.6105.2167.1-175.50000112
445R51.3Low49.4Very low236 Ų236151.9 Ų151.989%0.89178%0.78SS**  trans30.4160.9145-79.1-167.6161.7-167.2-5.9124.4
446P50.4Low49.2Very low112 Ų112151.9 Ų151.973%0.72778%0.784SS**  trans-121.6177.9-154.144.3-33.1000116
447S44.7Very low50Low111 Ų111149.8 Ų149.878%0.77679%0.788SS**  trans-165.3129.6142.4-86.30000115.8
448V48Very low49.9Very low133 Ų133146.7 Ų146.781%0.80678%0.784SS**  trans30.3144.2135.4-150.40000122.1
449V47.6Very low49.8Very low117 Ų117144.1 Ų144.171%0.70979%0.79SS**  trans123.3104.6143.8-177.90000117.5
450K47.8Very low49.5Very low196 Ų196139 Ų13985%0.85279%0.789SS**  trans55.7147144.2-63.3176-178177.80123.2
451Q40.7Very low49Very low180 Ų180137.6 Ų137.684%0.84180%0.795SS**  trans-74.7167.7161.4-63177.2-26.200112.1
452P55.4Low48.5Very low130 Ų130136.4 Ų136.484%0.84480%0.8SS**  -141-168105.940.5-27.7000114.8
453E46.2Very low48.3Very low140 Ų140137.4 Ų137.465%0.65480%0.801SS**  trans-97.3178.6-164.7-36.6164.980.300116.6
454K46.1Very low48.8Very low154 Ų154138 Ų13867%0.6780%0.796SS**  trans66.5108.2142.6-75.1161-178.5149.40120.2
455K50.1Low48.8Very low209 Ų209136.1 Ų136.191%0.90979%0.787SS**  176.2164.4103.7-98.1162.8-176.3178.30116.1
456L43.7Very low48.9Very low147 Ų147133.5 Ų133.577%0.7778%0.782SS**  trans-74158.7173.7-117.669.4000112.9
457P62.2Low48.9Very low121 Ų121135.1 Ų135.179%0.78678%0.781SS**  -130.9160.691.236.2-26.3000113.2
458T48.6Very low49.1Very low121 Ų121137.6 Ų137.674%0.74278%0.783SS**  cis104119.920.6-57.90000114.1
459G46Very low49Very low82 Ų82139.1 Ų139.185%0.84578%0.779SS**  trans91.5144177.900000113.6
460G44.8Very low48.8Very low85 Ų85142.6 Ų142.688%0.87678%0.784SS**  cis173.8166.3-4.200000108.4
461G45.2Very low48.5Very low82 Ų82137.6 Ų137.685%0.84578%0.78SS**  cis174.4178.7-2.300000111.2
462G45.2Very low48.7Very low75 Ų75135.4 Ų135.477%0.77378%0.778SS**  trans86.7158.7176.600000114.9
463H48.6Very low48.1Very low181 Ų181136.4 Ų136.484%0.83877%0.772SS**  cis172.7149-12.7-134.5-122.2000103.5
464M60.8Low48.2Very low150 Ų150136 Ų13674%0.73977%0.774SS**  cis-164.7172.4-21-107.3-84.1106.500106.4
465P51.7Low48.3Very low96 Ų96136.5 Ų136.562%0.62378%0.779SS**  trans-109-172.2-164.943.1-37.7000113.7
466K52.5Low48Very low181 Ų181130.9 Ų130.979%0.78777%0.766SS**  trans-178.1149.3131-108.5165.1-173.6176.40117.4
467M51.5Low48.2Very low146 Ų146129.6 Ų129.672%0.71976%0.764SS**  trans54.8134.1156.8-49-58.4-171.700118.2
468M48.5Very low47.4Very low164 Ų164131.2 Ų131.281%0.80877%0.765SS**  cis63.2118.944.3-67.1-160.2176.100116.2
469F45.9Very low47.2Very low164 Ų164129.5 Ų129.572%0.71976%0.763SS**  177.2141107.9-111-85.1000114.8
470K44.4Very low47.2Very low190 Ų190130.4 Ų130.483%0.82676%0.763SS**  trans37.7154.5152.1-83.4176.5-177.9177.60124.2
471A40.8Very low47.3Very low92 Ų92131.3 Ų131.376%0.7676%0.756SS**  trans-107.3173.8167.200000112
472V44Very low47.7Very low134 Ų134135.8 Ų135.881%0.81275%0.752SS**  trans-169.3167.3149.1133.90000111
473Q44.2Very low47.9Very low151 Ų151140.8 Ų140.871%0.70676%0.756SS**  trans-80.5173.4-168.6-53.2127.8-7800115.9
474N48.6Very low47.9Very low131 Ų131137.1 Ų137.170%0.70176%0.756SS**  172.4128.7127.1-81.7-16.2000110.3
475H48.1Very low47.4Very low165 Ų165133.6 Ų133.676%0.76476%0.759SS**  63139.288.6-65.8-51.2000115.3
476S43.7Very low47.5Very low91 Ų91138.8 Ų138.864%0.63677%0.771SS**  cis-174.7162-3.147.60000114.8
477V47.1Very low47.4Very low120 Ų120136 Ų13673%0.72778%0.775SS**  trans59.4150.1150-65.70000125.6
478N44.4Very low47.2Very low154 Ų154132.9 Ų132.982%0.82478%0.78SS**  trans76.1152150.1-67.7-17.2000120.6
479A46Very low47.2Very low85 Ų85137.1 Ų137.170%0.70279%0.787SS**  cis-172.5172.3-23.600000110.6
480A45.8Very low47.5Very low102 Ų102138.3 Ų138.384%0.84380%0.795SS**  trans69.5157.9162.900000118.5
481S46.7Very low47.6Very low104 Ų104137.6 Ų137.673%0.72779%0.794SS**  cis-170.6175-24.4-177.20000110.3
482K52.6Low48.3Very low175 Ų175141.6 Ų141.676%0.76180%0.797SS**  trans78.8123.7175.8-59.3179.5-178.7178.90115
483Q51.2Low48.8Very low181 Ų181140.5 Ų140.585%0.84679%0.793SS**  70.2139.357.9-67.6176.1-13.200113.3
484A47.6Very low49.2Very low103 Ų103142.5 Ų142.585%0.85180%0.799SS**  cis-166.9150.6-18.700000109
485G51.3Low49.7Very low77 Ų77144.7 Ų144.779%0.79481%0.806SS**  trans-166.8138.4175.200000112.4
486K52.1Low49.6Very low204 Ų204142.1 Ų142.189%0.88780%0.803SS**  trans-133.7167-176.8-77.9-173.3176-177.50111.3
487S51.8Low50.1Low124 Ų124147 Ų14787%0.86782%0.818SS**  trans70.3138.5-177.575.60000114.5
488G45.6Very low50.7Low79 Ų79150.6 Ų150.681%0.81482%0.824SS**  cis117.8108.1-10.400000114
489R50.5Low51.7Low253 Ų253149.4 Ų149.496%0.95583%0.825SS**  trans-147.2147.9165.2-165.5168.4-175.2169.51.8109.3
490Q51.2Low52.4Low190 Ų190150.9 Ų150.989%0.88883%0.83SS**  trans-77.6163.5-169.5-70.8168.8-84.200114.6
491E46.1Very low53Low175 Ų175154.6 Ų154.682%0.81883%0.83SS**  trans-65.9159170.2-53.9161.9112.200112.6
492H55.8Low54Low175 Ų175155.5 Ų155.581%0.8183%0.834SS**  trans-157.9112.4144.8-108.9-73.5000109.2
493P54.8Low54.1Low112 Ų112155.2 Ų155.273%0.72784%0.839SS**  trans-86134.1173.132.6-31.3000110.9
494F51.8Low53.9Low192 Ų192156.9 Ų156.984%0.84284%0.838SS**  trans-122.9122.1164.4-100.2-87.3000109.3
495Q60.3Low54.4Low178 Ų178155.6 Ų155.683%0.83284%0.835SS**  trans-101.4-169.5166.3-54.7-170.4-15.100109.5
496P45.5Very low54.4Low111 Ų111158.1 Ų158.172%0.72183%0.83SS**  -122.4158.5-100.934-15.7000113.5
497M54.6Low54.2Low193 Ų193152.9 Ų152.995%0.95183%0.825SS**PPolyproline II helixtrans-95.1134.9166.8-78.3-167.8163.100111.6
498K60.1Low54.1Low196 Ų196155 Ų15585%0.85283%0.827SS**PPolyproline II helixtrans-80.9145.6175.4-58.1176.6-179.8179.90110.4
499P65.1Low54.1Low129 Ų129154.1 Ų154.184%0.83882%0.818SS**PPolyproline II helixtrans-70.4139.4152.1-7.425000109.5
500S59.7Low54Low116 Ų116147.8 Ų147.881%0.81181%0.812SS**PPolyproline II helixtrans-94146.6170.751.70000111.2
501E59.7Low53.5Low179 Ų179146 Ų14684%0.83681%0.808SS**PPolyproline II helixtrans-67.4148.7175.2-59.9174.6119.300112.2
502P66.6Low53.4Low124 Ų124145.4 Ų145.481%0.80581%0.81SS**PPolyproline II helixtrans-78139.9160.332.9-31.6000110.4
503L55.6Low52.7Low168 Ų168146 Ų14688%0.8881%0.811SS**PPolyproline II helixtrans-66154.9177.2-96.969.9000112.6
504R46.7Very low52.3Low216 Ų216149.2 Ų149.282%0.81582%0.821SS**PPolyproline II helixtrans-60.4142.1157.9-70.6-178.3173.3-167.3-1.5110.5
505G57.8Low51.8Low77 Ų77143.1 Ų143.179%0.79481%0.812SS**  trans-117.7125.4151.200000107.8
506D50.3Low50.9Low129 Ų129145.6 Ų145.669%0.6982%0.815SS**  trans-89.7159.7179.5-65.4-69.5000111.6
507A49Very low50.8Low94 Ų94150.3 Ų150.378%0.77782%0.819SS**  trans48.3124.8162.100000118.2
508D49.8Very low50.4Low169 Ų169149.4 Ų149.490%0.90481%0.812SS**  -150.2166.572.7-132.6-30.9000114.4
509G44.5Very low49.9Very low61 Ų61149.7 Ų149.763%0.62981%0.809SS**  trans-94155.4-16900000116.5
510S48.2Very low49.2Very low120 Ų120151.6 Ų151.684%0.83981%0.807SS**  trans-159.992.7165.1-73.40000111
511D40.8Very low49.1Very low151 Ų151154.1 Ų154.181%0.80781%0.805SS**  trans-70.4128.3169.4-101.1-44.7000110.7
512L45.7Very low48.8Very low164 Ų164153 Ų15386%0.85980%0.8SS**  trans-133.592.7168.6-81.6177.5000111.5L514L512-L514 PolarHBondContact O-N 3.25Å
513F40.6Very low48.3Very low187 Ų187154 Ų15482%0.8279%0.794SS**  trans-57.6124.7165-88-116.9000111.3
514L45.1Very low48.5Very low180 Ų180153.1 Ų153.194%0.94278%0.784SS**  trans-177.6126.1155.2-100.9149.9000108.6L512L512-L514 PolarHBondContact O-N 3.25Å
515G42.5Very low48.9Very low63 Ų63151.7 Ų151.765%0.64978%0.78SS**  cis169.5107.1-7.400000109.6R517G515-R517 PolarHBondContact O-N 3.23Å; G515-R517 VanDerWaalsContact O-N 3.09Å
516Y40.2Very low49.1Very low231 Ų231157.4 Ų157.491%0.90678%0.779SS**  trans-63.8109.8-175.5-95.5-93.7000111.8
517R45.5Very low49.3Very low209 Ų209160.7 Ų160.779%0.78978%0.783SS**  trans-103.9110166.2-81.3-171.6167.1-175.4-3.7110.4G515 Y519G515-R517 PolarHBondContact O-N 3.23Å; G515-R517 VanDerWaalsContact O-N 3.09Å; R517-Y519 HydrophobicContact CB-CE2 4.47Å
518H44.7Very low50.1Low174 Ų174162.9 Ų162.981%0.80678%0.782SS**  trans-62.9137161.1-80.856.9000109.3
519Y49.7Very low50.2Low203 Ų203164.6 Ų164.680%0.79681%0.805SS**  trans-106.7115.4169.1-88.2-96.2000108.9R517R517-Y519 HydrophobicContact CB-CE2 4.47Å
520H51.4Low50.5Low169 Ų169169.8 Ų169.878%0.78281%0.814SS**  trans-87117.4165.4-105.3-88000108.7H522H520-H522 PolarHBondContact O-N 3.32Å
521E56.1Low50.6Low168 Ų168172.4 Ų172.479%0.78581%0.813SS**  trans-80.7111.2168.3-71.8-166.1117.100110.1H523E521-H523 PolarHBondContact O-N 3.33Å
522H55.3Low51.2Low155 Ų155173.6 Ų173.672%0.71881%0.813SS**  trans-80.8102.2173-98.8-95.9000110.7H520 H524H520-H522 PolarHBondContact O-N 3.32Å; H522-H524 PolarHBondContact O-N 3.25Å; H522-H524 VanDerWaalsContact O-N 3.1Å
523H55.6Low51.5Low147 Ų147174.2 Ų174.268%0.68181%0.81SS**  trans-74.293.9170.6-81.3-92.4000111.7E521 Y525E521-H523 PolarHBondContact O-N 3.33Å; H523-Y525 HydrophobicContact CB-CD2 4.45Å; H523-Y525 HydrophobicContact CB-CE2 4.44Å; H523-Y525 PolarHBondContact O-N 3.35Å
524H59.3Low52.2Low148 Ų148173.4 Ų173.469%0.68581%0.81SS**  trans-7798.6166.4-89.3-91.4000111.2H522 Y526H522-H524 PolarHBondContact O-N 3.25Å; H522-H524 VanDerWaalsContact O-N 3.1Å; H524-Y526 PolarHBondContact O-N 3.32Å
525Y54.3Low52.6Low186 Ų186172.9 Ų172.973%0.72980%0.801SS**  trans-79.3110.8163.5-85.9-92.2000110.3H523 Y527H523-Y525 HydrophobicContact CB-CD2 4.45Å; H523-Y525 HydrophobicContact CB-CE2 4.44Å; H523-Y525 PolarHBondContact O-N 3.35Å; Y525-Y527 HydrophobicContact CD1-CE2 4.3Å
526Y63.2Low53.4Low197 Ų197180.8 Ų180.877%0.77381%0.812SS**  trans-91.4102.1161.6-91.9-86.7000109.5H524H524-Y526 PolarHBondContact O-N 3.32Å
527Y54.5Low54.4Low198 Ų198176.9 Ų176.978%0.77681%0.805SS**  trans-88122.8155.3-89-88.4000108.1Y525Y525-Y527 HydrophobicContact CD1-CE2 4.3Å
528N64.9Low55.1Low140 Ų140174.3 Ų174.375%0.74981%0.806SS**  trans-100.4140.7160.2-76.7-8.2000108.4
529C52.5Low56.1Low206 Ų206174.3 Ų174.3100%1.39281%0.806SS**  trans-80.30166.6-58.50000111.5

Retrieved 529 of 529 residues in 154.2 ms (Link to these results)