A0A077Z612_TRITR Loading...

Paraspeckle component 1

AlphaFold DB , UniProt , Accession A0A077Z612, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 371 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M79.9Confident75.4Confident75 Ų7553.7 Ų53.737%0.36926%0.261SS..  0138.30176.9173.5-179.900106.9L3 F178 K181 A184 Q185 P209M1-L3 HydrophobicContact CE-CD2 3.88Å; M1-L3 HydrophobicContact CG-CD2 4.46Å; M1-F178 PolarHBondContact N-O 3.35Å; M1-F178 PolarHBondContact O-N 3.21Å; M1-K181 HydrophobicContact SD-CG 4.07Å; M1-A184 HydrophobicContact CB-CB 3.71Å; M1-A184 HydrophobicContact CG-CB 3.86Å; M1-A184 HydrophobicContact SD-CB 3.67Å; M1-Q185 HydrophobicContact SD-CG 4.29Å; M1-P209 HydrophobicContact CE-CB 4.17Å
2L84.1Confident72.3Confident49 Ų4959.3 Ų59.326%0.25730%0.3SS..EExtended strand (participates in β ladder)trans-98.3134.1178-64.8171000108.9I175 V176 E177 Y210L2-I175 HydrophobicContact CB-CG2 4.44Å; L2-I175 HydrophobicContact CD2-CG2 3.95Å; L2-V176 CarbonylContact C-O 3.6Å; L2-V176 WeakPolarHBondContact CA-O 3.44Å; L2-E177 HydrophobicContact CD2-CB 3.53Å; L2-E177 HydrophobicContact CD2-CG 3.58Å; L2-Y210 HydrophobicContact CB-CD1 3.72Å; L2-Y210 HydrophobicContact CB-CG 4.1Å; L2-Y210 HydrophobicContact CD1-CD1 3.57Å; L2-Y210 HydrophobicContact CD1-CE1 3.89Å; L2-Y210 HydrophobicContact CG-CD1 4.28Å; L2-Y210 PolarHBondContact O-N 3.33Å
3L86.3Confident69.3Low0 Ų058.7 Ų58.70%030%0.304CS..EExtended strand (participates in β ladder)trans-115.7137.2170.5-59.8-176.1000108.6M1 I175 V176 F178 A184 A187 L188 C207 E208M1-L3 HydrophobicContact CE-CD2 3.88Å; M1-L3 HydrophobicContact CG-CD2 4.46Å; L3-I175 WeakPolarHBondContact O-CA 3.18Å; L3-V176 PolarHBondContact N-O 3.06Å; L3-V176 PolarHBondContact O-N 3.36Å; L3-F178 HydrophobicContact CB-CE2 4.39Å; L3-F178 HydrophobicContact CD1-CD2 4.08Å; L3-F178 HydrophobicContact CD1-CE2 3.37Å; L3-F178 HydrophobicContact CD1-CZ 3.97Å; L3-F178 HydrophobicContact CG-CD2 4.19Å; L3-F178 HydrophobicContact CG-CE2 3.86Å; L3-A184 HydrophobicContact CD1-CB 4.27Å; L3-A184 WeakPolarHBondContact CD1-O 3.47Å; L3-A184 HydrophobicContact CD2-CB 4.47Å; L3-A184 HydrophobicContact CG-CB 4.34Å; L3-A187 HydrophobicContact CD1-CB 4.3Å; L3-L188 HydrophobicContact CD1-CB 4.3Å; L3-L188 HydrophobicContact CD2-CB 4.45Å; L3-C207 VanDerWaalsContact CD1-SG 3.56Å; L3-E208 CarbonylContact C-O 3.53Å; L3-E208 WeakPolarHBondContact CA-O 3.48Å
4K88.2Confident66.5Low50 Ų5065.8 Ų65.822%0.21733%0.334CS..EExtended strand (participates in β ladder)trans-88.7125.9168.2-173.5178.3176.81790107.5E173 G174 C207 E208 Y210K4-E173 WeakPolarHBondContact CE-OE1 3.44Å; K4-E173 WeakPolarHBondContact CE-OE2 3.42Å; K4-E173 IonicContact NZ-OE1 3.36Å; K4-E173 PolarHBondContact NZ-OE1 3.22Å; K4-E173 IonicContact NZ-OE2 3.03Å; K4-E173 PolarHBondContact NZ-OE2 3.47Å; K4-G174 CarbonylContact C-O 3.59Å; K4-G174 WeakPolarHBondContact CA-O 3.33Å; K4-C207 WeakPolarHBondContact O-CA 3.48Å; K4-E208 PolarHBondContact N-O 3.14Å; K4-E208 PolarHBondContact O-N 2.6Å; K4-Y210 HydrophobicContact CB-CD2 4.25Å
5I85.8Confident63.9Low6 Ų674.9 Ų74.93%0.03136%0.363CS..EExtended strand (participates in β ladder)trans-103126.5168.6-58.6-174.9000106.6F154 E173 G174 V176 V205 V206I5-F154 HydrophobicContact CD1-CE1 4.14Å; I5-F154 HydrophobicContact CD1-CZ 3.76Å; I5-E173 CarbonylContact O-C 3.46Å; I5-E173 WeakPolarHBondContact O-CA 3.41Å; I5-G174 PolarHBondContact N-O 2.88Å; I5-G174 PolarHBondContact O-N 2.97Å; I5-V176 HydrophobicContact CD1-CB 4.41Å; I5-V176 HydrophobicContact CD1-CG2 3.39Å; I5-V176 HydrophobicContact CG1-CG2 3.98Å; I5-V205 HydrophobicContact CG2-CB 3.81Å; I5-V205 HydrophobicContact CG2-CG1 4.21Å; I5-V205 HydrophobicContact CG2-CG2 4.31Å; I5-V206 CarbonylContact C-O 3.57Å; I5-V206 WeakPolarHBondContact CA-O 3.46Å
6S84.2Confident61.7Low9 Ų981.9 Ų81.96%0.06339%0.392CS..EExtended strand (participates in β ladder)trans-123.7167.6179.8670000110.9C8 V206S6-C8 PolarHBondContact O-N 3.1Å; S6-V206 PolarHBondContact N-O 2.94Å; S6-V206 PolarHBondContact O-N 2.67Å; S6-V206 VanDerWaalsContact O-N 3.1Å
7R78.5Confident59.6Low141 Ų14181.5 Ų81.553%0.53239%0.392SS..  trans65.218.9177.2-47.5-60.4-177.1-168.9-3.2114.7K9 G172 V206 R276R7-K9 PolarHBondContact O-N 3.07Å; R7-G172 PolarHBondContact N-O 3.32Å; R7-G172 VanDerWaalsContact N-O 3.15Å; R7-V206 HydrophobicContact CG-CG2 4.17Å; R7-R276 VanDerWaalsContact NH1-NH1 3.15Å
8C64.8Low58Low23 Ų2382.9 Ų82.916%0.15540%0.402CS..  trans-62.7123.1166.5-67.10000108.1S6 G172 V205S6-C8 PolarHBondContact O-N 3.1Å; C8-G172 PolarHBondContact N-O 2.92Å; C8-G172 VanDerWaalsContact N-O 3.16Å; C8-G172 VanDerWaalsContact O-CA 3.3Å; C8-G172 WeakPolarHBondContact O-CA 3.5Å; C8-V205 WeakPolarHBondContact SG-CG1 3.44Å
9K66.7Low56.5Low96 Ų9685.5 Ų85.542%0.41741%0.414SS..  trans-54.3129.5166.9-168.7171-175165.10106.2R7 L11R7-K9 PolarHBondContact O-N 3.07Å; K9-L11 PolarHBondContact O-N 3.32Å
10P57.4Low55.2Low69 Ų6987.7 Ų87.745%0.44844%0.438SS..  trans-52.7111.517619.3-30.8000107.3V12 P170P10-V12 PolarHBondContact O-N 3.49Å; P10-P170 HydrophobicContact CB-CB 3.77Å; P10-P170 HydrophobicContact CB-CG 3.24Å
11L53.3Low54.3Low73 Ų7386.9 Ų86.938%0.38245%0.445SS..  trans-53.3136.7165.1-79.6168.8000104.6K9 C13 I146 C199K9-L11 PolarHBondContact O-N 3.32Å; L11-C13 PolarHBondContact O-N 2.99Å; L11-I146 HydrophobicContact CD1-CD1 4.17Å; L11-I146 HydrophobicContact CD1-CG2 4.42Å; L11-C199 WeakPolarHBondContact CD2-SG 3.35Å
12V38Very low51.9Low121 Ų12190.6 Ų90.673%0.73346%0.455SS*.  trans-58.695.7155.5179.30000102.9P10 H14P10-V12 PolarHBondContact O-N 3.49Å; V12-H14 PolarHBondContact O-N 3.36Å
13C33.4Very low49.3Very low51 Ų5191.9 Ų91.935%0.34548%0.48SS..  trans-62.487.6166.4-60.40000102.3L11 R15L11-C13 PolarHBondContact O-N 2.99Å; C13-R15 PolarHBondContact O-N 3.09Å
14H30.2Very low46.6Very low158 Ų15896.4 Ų96.473%0.73152%0.518SS*.  trans-51.3110146.8-82.8-74.7000102.2V12 F16V12-H14 PolarHBondContact O-N 3.36Å; H14-F16 PolarHBondContact O-N 2.84Å
15R28Very low43.9Very low203 Ų203105.2 Ų105.277%0.76655%0.549SS*.  trans-42.5114.4151.5-86.9-176.3-177.8170.61102.5C13 D17C13-R15 PolarHBondContact O-N 3.09Å; R15-D17 WeakPolarHBondContact CD-OD1 3.46Å; R15-D17 PolarHBondContact O-N 3.35Å
16F27.6Very low41.2Very low187 Ų187110 Ų11082%0.8258%0.583SS**  trans-59.683.7141.6-97.8-90.3000102.7H14 N18H14-F16 PolarHBondContact O-N 2.84Å; F16-N18 PolarHBondContact O-N 3.02Å
17D26.8Very low38.6Very low75 Ų75114.6 Ų114.640%0.40162%0.616SS.*  trans-56.599152.7-83.3-21.8000101.1R15 E19 R22R15-D17 WeakPolarHBondContact CD-OD1 3.46Å; R15-D17 PolarHBondContact O-N 3.35Å; D17-E19 HydrophobicContact CB-CG 4.29Å; D17-E19 PolarHBondContact O-N 2.95Å; D17-R22 IonicContact OD1-NH2 3.5Å; D17-R22 IonicContact OD2-NH2 3.76Å; D17-R22 PolarHBondContact OD2-NH2 3.03Å
18N30.1Very low36.3Very low106 Ų106115.4 Ų115.457%0.56763%0.63SS**  trans-59.678.9156.6-89.2-23.2000104.6F16 S20 A21F16-N18 PolarHBondContact O-N 3.02Å; N18-S20 PolarHBondContact O-N 3.29Å; N18-A21 HydrophobicContact CB-CB 3.68Å; N18-A21 WeakPolarHBondContact O-CA 3.46Å; N18-A21 PolarHBondContact O-N 3.15Å
19E30.1Very low34.5Very low133 Ų133123.3 Ų123.362%0.62166%0.662SS**G310 helixtrans-62.2-15.9164.5-89.7179.8164.800109.8D17 A21 R22D17-E19 HydrophobicContact CB-CG 4.29Å; D17-E19 PolarHBondContact O-N 2.95Å; E19-A21 VanDerWaalsContact C-N 3.31Å; E19-R22 VanDerWaalsContact CG-NH1 3.26Å; E19-R22 IonicContact OE1-CZ 3.66Å; E19-R22 IonicContact OE1-NH1 2.67Å; E19-R22 PolarHBondContact OE1-NH1 3.42Å
20S31.2Very low32.7Very low129 Ų129127.6 Ų127.690%0.90268%0.683SS**G310 helixtrans-79.91.4163.8-60.20000115.6N18N18-S20 PolarHBondContact O-N 3.29Å
21A35.3Very low31.2Very low70 Ų70133.5 Ų133.558%0.57970%0.702SS**G310 helixtrans-112.11.2169.800000113.1N18 E19 G23N18-A21 HydrophobicContact CB-CB 3.68Å; N18-A21 WeakPolarHBondContact O-CA 3.46Å; N18-A21 PolarHBondContact O-N 3.15Å; E19-A21 VanDerWaalsContact C-N 3.31Å; A21-G23 PolarHBondContact O-N 3.37Å
22R30.2Very low30Very low153 Ų153135.3 Ų135.358%0.57772%0.721SS**THydrogen-bonded Turntrans-79.464172.8-68.8-172.7-176152.67110.6D17 E19D17-R22 IonicContact OD1-NH2 3.5Å; D17-R22 IonicContact OD2-NH2 3.76Å; D17-R22 PolarHBondContact OD2-NH2 3.03Å; E19-R22 VanDerWaalsContact CG-NH1 3.26Å; E19-R22 IonicContact OE1-CZ 3.66Å; E19-R22 IonicContact OE1-NH1 2.67Å; E19-R22 PolarHBondContact OE1-NH1 3.42Å
23G28.5Very low29.5Very low77 Ų77137 Ų13779%0.79473%0.725SS**THydrogen-bonded Turntrans-122.5-9.9174.600000114.5A21A21-G23 PolarHBondContact O-N 3.37Å
24A31.4Very low29.2Very low95 Ų95144.1 Ų144.179%0.78575%0.751SS**SBendtrans-121.286.8177.200000110.3S26A24-S26 PolarHBondContact O-N 3.11Å
25R30.6Very low29.2Very low235 Ų235139.7 Ų139.789%0.88774%0.742SS**  trans-46121.3166.9-85173.4157.8171.8-7.1111.2
26S28.5Very low29.3Very low105 Ų105135.6 Ų135.673%0.73474%0.74SS**  60.5100.299.680.70000115.2A24A24-S26 PolarHBondContact O-N 3.11Å
27S30.1Very low29.4Very low107 Ų107136.8 Ų136.875%0.74874%0.739SS**  trans-167.5134.6131.151.90000110.5
28L30.6Very low29.4Very low158 Ų158139 Ų13983%0.82775%0.747SS**  trans79.599.5152-65.3157.9000119.2
29F27.1Very low29.3Very low189 Ų189141.4 Ų141.483%0.82976%0.755SS**  trans-42.5126.1132.4-95.8-107000110.6
30E27.3Very low29.4Very low186 Ų186140.5 Ų140.587%0.86976%0.763SS**  trans-162.8129.3137.4-122.2169.517900110.6
31F26.5Very low29.2Very low193 Ų193140.6 Ų140.685%0.84675%0.753SS**  trans-70127167.8-84.2-101.4000108.8
32S29Very low29Very low110 Ų110144.5 Ų144.577%0.76976%0.763SS**  trans172.3133.8134.7460000112.4
33N28.1Very low28.9Very low156 Ų156146.1 Ų146.183%0.83477%0.774SS**  trans22.6136.9147.5-68.4-25.5000121.8
34F26.7Very low29Very low202 Ų202146.1 Ų146.189%0.88677%0.767SS**  trans86.3111.5140.3-130.2-108.3000118.9
35A29.5Very low28.8Very low64 Ų64148.2 Ų148.253%0.52977%0.77SS.*  trans76.1131131.300000122
36T30.2Very low28.7Very low118 Ų118142.1 Ų142.172%0.72476%0.763SS**  trans84.1126.5135.435.90000121.5
37W28.9Very low28.8Very low211 Ų211141.7 Ų141.780%0.79977%0.766SS**  trans78.9115.1145.7-77.855.8000118
38Q27.5Very low29Very low123 Ų123144.6 Ų144.658%0.57577%0.772SS**  95.3118.169.9-117.8-159.25.700112
39Q28.6Very low28.9Very low156 Ų156144.3 Ų144.373%0.72977%0.766SS**  trans65.2127.9155-60.5165.112.900115.7
40S31.1Very low29Very low113 Ų113145.4 Ų145.479%0.7977%0.767SS**  -175.7153.960.3-49.70000110.8
41N27.6Very low29Very low132 Ų132146.2 Ų146.271%0.70676%0.762SS**  trans-58.1162.5165.4-72.4-36.9000112.8
42I31.5Very low29.4Very low152 Ų152143.7 Ų143.778%0.77976%0.756SS**  173129122.3-89.1156.2000112.3
43F28.7Very low29.7Very low187 Ų187142.8 Ų142.882%0.8275%0.75SS**  trans49116.9148.7-74.6-110.5000120.6
44A28.8Very low29.9Very low77 Ų77141.1 Ų141.164%0.63675%0.75SS**  66.411273.500000114.4
45T28.4Very low30.2Very low138 Ų138135.6 Ų135.685%0.84775%0.75SS**  168.2134.9119.530.20000114.5
46S27.4Very low30.3Very low107 Ų107137.6 Ų137.675%0.74876%0.76SS**  trans49.3114.5146.259.90000124
47A30.4Very low30.6Very low96 Ų96139.2 Ų139.279%0.79377%0.77SS**  37.8130.1117.600000121.8
48L34.6Very low30.8Very low169 Ų169133 Ų13389%0.88576%0.759SS**  trans-178.3103.3137.3-94.6162000107.8
49H28.7Very low31.2Very low151 Ų151135.1 Ų135.170%0.69977%0.774SS**  57.5104.4101.7-147.5-98.7000115.8
50Y30.1Very low31.3Very low213 Ų213137.4 Ų137.484%0.83578%0.776SS**  trans-154.9135.7138.2-134.2-93.3000112.2L52Y50-L52 HydrophobicContact CD1-CG 4.44Å; Y50-L52 HydrophobicContact CE1-CD1 3.98Å; Y50-L52 HydrophobicContact CE1-CG 4.13Å
51R26.9Very low31.5Very low202 Ų202139.9 Ų139.976%0.76278%0.781SS**  trans-121.1122.4-176.4166.1-163.7-80.2-176.2-4.7106.3
52L35Very low32.3Very low141 Ų141142.3 Ų142.374%0.73879%0.788SS**  trans-154.8107155.7-82.5175.4000107.6Y50Y50-L52 HydrophobicContact CD1-CG 4.44Å; Y50-L52 HydrophobicContact CE1-CD1 3.98Å; Y50-L52 HydrophobicContact CE1-CG 4.13Å
53S34.1Very low32.9Very low90 Ų90140.8 Ų140.863%0.62979%0.787SS**  77.391.390.9-550000111.8
54S33.6Very low33.6Very low121 Ų121137.3 Ų137.385%0.84678%0.784SS**  77.3112.285.668.10000114.8
55G32Very low34.4Very low86 Ų86139.2 Ų139.289%0.88779%0.79SS**  trans-150103.7162.500000108.8
56S31.5Very low35.3Very low106 Ų106138.2 Ų138.274%0.74179%0.786SS**  trans-96.6138-172.3150.80000110.9
57V36.4Very low35.8Very low152 Ų152138.9 Ų138.992%0.92179%0.787SS**  trans-138.2128.2145.9-178.20000108.7
58S34.5Very low36.4Very low82 Ų82142.3 Ų142.357%0.57378%0.784SS**  trans-102.9137.7-164.6-163.40000110.4
59N34.4Very low36.1Very low167 Ų167142.9 Ų142.989%0.89378%0.783SS**  trans-145.3113.5143-157.6-4.6000109.3
60R31.6Very low36.6Very low204 Ų204142.7 Ų142.777%0.7778%0.784SS**  trans-97133.6-175.5-71.2174.4170.4-180-4108.3
61N36.2Very low36.8Very low165 Ų165141.6 Ų141.688%0.88279%0.786SS**  trans178.175.6138.8-89.7-14.6000110
62Q43.2Very low36.8Very low183 Ų183140.6 Ų140.686%0.85579%0.79SS**  trans-151.9124.2153.1-109.3170.924.900108.1
63P44.5Very low36.7Very low119 Ų119139.2 Ų139.277%0.77379%0.793SS**PPolyproline II helixtrans-67.3139.8174.627.5-31.3000109.4
64P42.6Very low36.3Very low115 Ų115141.7 Ų141.775%0.74780%0.804SS**PPolyproline II helixtrans-63.9144.4172.327.5-32.7000110.1
65P47.3Very low36.2Very low117 Ų117139.2 Ų139.276%0.7680%0.797SS**PPolyproline II helixtrans-61.5147.9172.126.3-32.8000110.5
66P46.3Very low36Very low117 Ų117140.8 Ų140.876%0.7680%0.795SS**PPolyproline II helixtrans-61.6147-176.424.1-32.5000111.7F68P66-F68 PolarHBondContact O-N 3.39Å
67P38.7Very low35.9Very low120 Ų120140.3 Ų140.378%0.77979%0.792SS**PPolyproline II helixtrans-61125.6172.5-14.228.1000109.2E69P67-E69 PolarHBondContact O-N 2.88Å; P67-E69 VanDerWaalsContact O-N 3.11Å
68F41.5Very low35.6Very low168 Ų168138.3 Ų138.374%0.73779%0.791SS**  trans-70.7104.6167.6-175.3-113000107.6P66 M70P66-F68 PolarHBondContact O-N 3.39Å; F68-M70 HydrophobicContact CD1-CB 4.46Å; F68-M70 HydrophobicContact CD1-CE 3.76Å; F68-M70 HydrophobicContact CD1-CG 3.73Å; F68-M70 HydrophobicContact CD1-SD 4.32Å; F68-M70 HydrophobicContact CE1-CE 3.96Å; F68-M70 HydrophobicContact CE1-CG 3.42Å; F68-M70 VanDerWaalsContact CE1-CG 3.42Å; F68-M70 HydrophobicContact CE1-SD 3.97Å; F68-M70 HydrophobicContact CZ-CG 4.45Å; F68-M70 PolarHBondContact O-N 2.92Å
69E29.5Very low35.6Very low181 Ų181138.7 Ų138.785%0.84680%0.799SS**  trans-63.496.6169.7-68.3178.1175.300108.2P67P67-E69 PolarHBondContact O-N 2.88Å; P67-E69 VanDerWaalsContact O-N 3.11Å
70M38.7Very low35.8Very low148 Ų148138.9 Ų138.973%0.72979%0.787SS**  trans-91112.4162.5-104.1-178.2-69.900107.6F68 E72F68-M70 HydrophobicContact CD1-CB 4.46Å; F68-M70 HydrophobicContact CD1-CE 3.76Å; F68-M70 HydrophobicContact CD1-CG 3.73Å; F68-M70 HydrophobicContact CD1-SD 4.32Å; F68-M70 HydrophobicContact CE1-CE 3.96Å; F68-M70 HydrophobicContact CE1-CG 3.42Å; F68-M70 VanDerWaalsContact CE1-CG 3.42Å; F68-M70 HydrophobicContact CE1-SD 3.97Å; F68-M70 HydrophobicContact CZ-CG 4.45Å; F68-M70 PolarHBondContact O-N 2.92Å; M70-E72 PolarHBondContact O-N 2.69Å; M70-E72 VanDerWaalsContact O-N 3.15Å
71E33.3Very low36.1Very low189 Ų189141 Ų14188%0.88380%0.796SS**  trans-49.3116.4172.2-63.7-177155.900110.3S73E71-S73 VanDerWaalsContact C-N 3.3Å; E71-S73 PolarHBondContact O-N 3.3Å
72E28.3Very low36.4Very low181 Ų181134.1 Ų134.185%0.84676%0.761SS**  trans-67.390.1168.8-80.5-176.8148.300108.7M70 T74M70-E72 PolarHBondContact O-N 2.69Å; M70-E72 VanDerWaalsContact O-N 3.15Å; E72-T74 VanDerWaalsContact C-N 3.3Å; E72-T74 PolarHBondContact O-N 3.38Å
73S32.4Very low37Very low113 Ų113127 Ų12779%0.7973%0.731SS**  trans-65.397.7161.263.80000108E71 G75E71-S73 VanDerWaalsContact C-N 3.3Å; E71-S73 PolarHBondContact O-N 3.3Å; S73-G75 VanDerWaalsContact C-N 3.29Å; S73-G75 PolarHBondContact O-N 3.3Å
74T26.9Very low37.5Very low142 Ų142122.7 Ų122.787%0.87171%0.709SS**  trans-62.886.8169.941.30000109.3E72E72-T74 VanDerWaalsContact C-N 3.3Å; E72-T74 PolarHBondContact O-N 3.38Å
75G29.9Very low38.3Very low68 Ų68119.8 Ų119.870%0.70168%0.683SS**  trans-126.199.3177.200000110.9S73S73-G75 VanDerWaalsContact C-N 3.29Å; S73-G75 PolarHBondContact O-N 3.3Å
76S27.6Very low39.2Very low119 Ų119114.4 Ų114.483%0.83265%0.648SS**  trans-48130.7177.8-174.50000115.7
77S30.6Very low40.4Very low97 Ų97114.7 Ų114.768%0.67863%0.634SS**  trans141.493.7130.176.50000115A79S77-A79 PolarHBondContact O-N 3.36Å
78A29.9Very low42Very low109 Ų109110.2 Ų110.290%0.90160%0.604SS**  2933.411700000121.9R80A78-R80 PolarHBondContact O-N 2.96Å
79A34Very low43.6Very low91 Ų91108.4 Ų108.475%0.75260%0.596SS**  trans-87.899.9166.600000110.7S77 R81S77-A79 PolarHBondContact O-N 3.36Å; A79-R81 PolarHBondContact O-N 3.36Å
80R37.9Very low45.9Very low170 Ų170101 Ų10164%0.64256%0.563SS**  trans-42.8120.8178.3-70.3162.4161.4-178.3-6.3113A78 A82 D111 V128A78-R80 PolarHBondContact O-N 2.96Å; R80-A82 PolarHBondContact O-N 3.03Å; R80-D111 IonicContact NH1-OD2 2.74Å; R80-D111 PolarHBondContact NH1-OD2 3.39Å; R80-V128 HydrophobicContact CB-CG1 4.39Å
81R39.3Very low47.5Very low250 Ų25095.6 Ų95.694%0.94355%0.545SS*.  trans-55.889.2171.9-68.9176.9174.7109.6-0.9111.4A79A79-R81 PolarHBondContact O-N 3.36Å
82A43.1Very low49.3Very low20 Ų2094.4 Ų94.417%0.16555%0.545CS..  trans-90.9111.1-17900000111.3R80 R126R80-A82 PolarHBondContact O-N 3.03Å; A82-R126 HydrophobicContact CB-CG 4.43Å; A82-R126 PolarHBondContact O-NH1 3.03Å
83S54.3Low51.6Low32 Ų3287.2 Ų87.222%0.22451%0.512CS..  trans-52139.2177.7179.80000112.3R85 C86 R126S83-R85 PolarHBondContact O-N 3.44Å; S83-C86 VanDerWaalsContact O-CB 3.27Å; S83-C86 WeakPolarHBondContact O-CB 3.17Å; S83-C86 PolarHBondContact O-N 2.86Å; S83-R126 PolarHBondContact O-NH1 3.5Å
84G56.4Low53.6Low30 Ų3085.6 Ų85.631%0.30950%0.499SS..G310 helixtrans-57-27.4174.400000113.5C86 R87 L158G84-C86 PolarHBondContact O-N 2.88Å; G84-C86 VanDerWaalsContact O-N 3.11Å; G84-R87 WeakPolarHBondContact O-CB 3.28Å; G84-R87 PolarHBondContact O-N 2.84Å; G84-R87 VanDerWaalsContact O-N 3.13Å; G84-L158 VanDerWaalsContact N-CD1 3.26Å
85R57.8Low56Low53 Ų5384.8 Ų84.820%0.249%0.493CS..G310 helixtrans-60.6-14.7169.7-70.4-169.1-73.2168.53.2113.9S83 R87 W134 R138 R159 E177S83-R85 PolarHBondContact O-N 3.44Å; R85-R87 VanDerWaalsContact C-N 3.3Å; R85-W134 HydrophobicContact CB-CZ2 4.06Å; R85-W134 WeakPolarHBondContact O-CZ2 3.32Å; R85-W134 PolarHBondContact O-NE1 3.47Å; R85-R138 VanDerWaalsContact NH1-CZ 3.26Å; R85-R159 VanDerWaalsContact CZ-NE 3.28Å; R85-R159 VanDerWaalsContact NH1-CZ 3.26Å; R85-R159 VanDerWaalsContact NH1-NH1 3.18Å; R85-E177 PolarHBondContact N-OE1 2.96Å; R85-E177 IonicContact NE-OE2 2.68Å
86C65.9Low58.4Low4 Ų487.8 Ų87.83%0.02749%0.494CS..G310 helixtrans-87.91.9176.6-58.90000115.8S83 G84 L88 R126 L127 C130S83-C86 VanDerWaalsContact O-CB 3.27Å; S83-C86 WeakPolarHBondContact O-CB 3.17Å; S83-C86 PolarHBondContact O-N 2.86Å; G84-C86 PolarHBondContact O-N 2.88Å; G84-C86 VanDerWaalsContact O-N 3.11Å; C86-L88 PolarHBondContact O-N 3.39Å; C86-R126 HydrophobicContact CB-CG 4.23Å; C86-R126 VanDerWaalsContact O-CA 3.28Å; C86-R126 WeakPolarHBondContact O-CA 3.32Å; C86-L127 WeakPolarHBondContact CB-O 3.41Å; C86-L127 PolarHBondContact O-N 3.23Å; C86-C130 WeakPolarHBondContact CA-SG 3.39Å; C86-C130 HydrophobicContact CB-CB 4.2Å; C86-C130 WeakPolarHBondContact CB-SG 3.27Å; C86-C130 WeakPolarHBondContact SG-CB 3.5Å; C86-C130 CovalentContact SG-SG 2Å; C86-C130 PolarHBondContact SG-SG 3.42Å
87R71.5Confident61Low124 Ų12483.1 Ų83.147%0.46846%0.46SS..EExtended strand (participates in β ladder)trans-87.4104.7175.4-166.3178.7-171.8-167.20.4108.9G84 R85 F124 V125G84-R87 WeakPolarHBondContact O-CB 3.28Å; G84-R87 PolarHBondContact O-N 2.84Å; G84-R87 VanDerWaalsContact O-N 3.13Å; R85-R87 VanDerWaalsContact C-N 3.3Å; R87-F124 HydrophobicContact CG-CB 4.27Å; R87-F124 HydrophobicContact CG-CD1 4.07Å; R87-V125 CarbonylContact C-O 3.5Å; R87-V125 WeakPolarHBondContact CA-O 3.45Å
88L73.6Confident63.4Low25 Ų2580.4 Ų80.413%0.13144%0.441CS..EExtended strand (participates in β ladder)trans-79.8137.3171.6-57.3176.6000109C86 F106 F124 V125 L127 F133C86-L88 PolarHBondContact O-N 3.39Å; L88-F106 HydrophobicContact CD1-CD1 3.99Å; L88-F106 HydrophobicContact CD1-CE1 3.67Å; L88-F124 VanDerWaalsContact O-CA 3.31Å; L88-F124 WeakPolarHBondContact O-CA 3.19Å; L88-V125 PolarHBondContact N-O 2.66Å; L88-V125 PolarHBondContact O-N 3.44Å; L88-L127 HydrophobicContact CD1-CD1 3.83Å; L88-L127 HydrophobicContact CD1-CG 4.3Å; L88-F133 HydrophobicContact CD2-CD1 4.01Å; L88-F133 HydrophobicContact CD2-CE1 3.42Å; L88-F133 VanDerWaalsContact CD2-CE1 3.42Å; L88-F133 HydrophobicContact CD2-CE2 4.37Å; L88-F133 HydrophobicContact CD2-CZ 3.63Å
89F74.6Confident66Low130 Ų13077.2 Ų77.257%0.5741%0.409SS*.EExtended strand (participates in β ladder)trans-95.7126.8164.6174.7-100.5000108.1F122 F124F89-F122 HydrophobicContact CE2-CB 3.68Å; F89-F122 AromaticContact CE2-CD2 3.81Å; F89-F122 HydrophobicContact CE2-CD2 3.81Å; F89-F122 AromaticContact CE2-CG 3.84Å; F89-F122 HydrophobicContact CE2-CG 3.84Å; F89-F122 HydrophobicContact CZ-CB 3.81Å; F89-F122 HydrophobicContact CZ-CG 4.28Å; F89-F124 HydrophobicContact CB-CD1 4.37Å; F89-F124 HydrophobicContact CB-CE1 4.14Å; F89-F124 HydrophobicContact CD2-CD1 4.17Å; F89-F124 AromaticContact CD2-CE1 3.59Å; F89-F124 HydrophobicContact CD2-CE1 3.59Å; F89-F124 HydrophobicContact CD2-CE2 4.44Å; F89-F124 AromaticContact CD2-CZ 3.74Å; F89-F124 HydrophobicContact CD2-CZ 3.74Å; F89-F124 HydrophobicContact CE2-CZ 4.25Å; F89-F124 HydrophobicContact CG-CE1 4.34Å
90V78Confident68.5Low26 Ų2679.2 Ų79.216%0.15840%0.402CS..EExtended strand (participates in β ladder)trans-116.6100.5178.5-169.60000106.5L93 F106 F122 A123 V125V90-L93 HydrophobicContact CB-CD1 4.19Å; V90-L93 HydrophobicContact CG1-CD1 3.94Å; V90-L93 HydrophobicContact CG1-CD2 3.74Å; V90-L93 HydrophobicContact CG1-CG 3.91Å; V90-F106 HydrophobicContact CG2-CE2 3.79Å; V90-F106 HydrophobicContact CG2-CZ 3.55Å; V90-F122 CarbonylContact O-C 3.58Å; V90-F122 WeakPolarHBondContact O-CA 3.21Å; V90-F122 WeakPolarHBondContact O-CB 3.23Å; V90-A123 HydrophobicContact CB-CB 4.43Å; V90-A123 PolarHBondContact N-O 3.3Å; V90-A123 PolarHBondContact O-N 3.46Å; V90-V125 HydrophobicContact CG2-CG2 4.17Å
91G72.6Confident70.8Confident35 Ų3576 Ų7636%0.36140%0.395SS..EExtended strand (participates in β ladder)trans-90169.6176.800000112.2L93G91-L93 VanDerWaalsContact C-N 3.29Å; G91-L93 PolarHBondContact O-N 3.39Å
92N71.1Confident72.8Confident163 Ų16364.1 Ų64.187%0.87235%0.35SS*.SBendtrans60.336.2172.7-149.268.9000114G121N92-G121 PolarHBondContact N-O 2.93Å
93L75.3Confident74.8Confident31 Ų3167.3 Ų67.316%0.16236%0.358CS..  trans-81.4139.5173.1-67.3173.2000109.9V90 G91 V97 L102 G121 A123V90-L93 HydrophobicContact CB-CD1 4.19Å; V90-L93 HydrophobicContact CG1-CD1 3.94Å; V90-L93 HydrophobicContact CG1-CD2 3.74Å; V90-L93 HydrophobicContact CG1-CG 3.91Å; G91-L93 VanDerWaalsContact C-N 3.29Å; G91-L93 PolarHBondContact O-N 3.39Å; L93-V97 HydrophobicContact CB-CG2 4.42Å; L93-L102 HydrophobicContact CD1-CD1 3.99Å; L93-L102 HydrophobicContact CD1-CD2 3.95Å; L93-L102 HydrophobicContact CD2-CD2 4.08Å; L93-G121 PolarHBondContact N-O 3.14Å; L93-G121 WeakPolarHBondContact O-CA 3.26Å; L93-A123 HydrophobicContact CD1-CB 3.45Å; L93-A123 VanDerWaalsContact CD1-CB 3.45Å
94P75.6Confident76.3Confident79 Ų7969.2 Ų69.251%0.51338%0.375SS..  trans-66154171.528.6-30000110.1D96 V97P94-D96 VanDerWaalsContact CB-OD1 3.24Å; P94-D96 WeakPolarHBondContact CB-OD1 3.48Å; P94-D96 PolarHBondContact O-N 2.97Å; P94-D96 VanDerWaalsContact O-N 3.16Å; P94-V97 HydrophobicContact CG-CG2 3.54Å; P94-V97 WeakPolarHBondContact O-CG2 3.36Å; P94-V97 PolarHBondContact O-N 3.21Å
95V77.1Confident77.6Confident124 Ų12472.6 Ų72.675%0.75239%0.386SS*.THydrogen-bonded Turntrans-67.8-18.3-165.5-178.10000112.4
96D81Confident78.6Confident132 Ų13271.7 Ų71.771%0.70638%0.383SS*.THydrogen-bonded Turntrans-92.1-4.6-176.156.5-30.6000114.7P94 S98P94-D96 VanDerWaalsContact CB-OD1 3.24Å; P94-D96 WeakPolarHBondContact CB-OD1 3.48Å; P94-D96 PolarHBondContact O-N 2.97Å; P94-D96 VanDerWaalsContact O-N 3.16Å; D96-S98 PolarHBondContact O-N 3.02Å
97V80.6Confident79.3Confident21 Ų2175.2 Ų75.213%0.12741%0.408CS..  trans-65.2126.6-179.31770000111.6L93 P94 E101 L102L93-V97 HydrophobicContact CB-CG2 4.42Å; P94-V97 HydrophobicContact CG-CG2 3.54Å; P94-V97 WeakPolarHBondContact O-CG2 3.36Å; P94-V97 PolarHBondContact O-N 3.21Å; V97-E101 HydrophobicContact CG1-CB 4.33Å; V97-L102 HydrophobicContact CG1-CD1 3.93Å; V97-L102 HydrophobicContact CG1-CD2 4.2Å; V97-L102 HydrophobicContact CG1-CG 3.65Å
98S82.4Confident79.7Confident39 Ų3976.2 Ų76.227%0.27342%0.416SS..  trans-87.8160.3177.895.30000112.8D96 E100 E101 L102D96-S98 PolarHBondContact O-N 3.02Å; S98-E100 WeakPolarHBondContact CB-OE2 3.44Å; S98-E100 PolarHBondContact O-N 3.27Å; S98-E100 PolarHBondContact OG-N 2.85Å; S98-E100 PolarHBondContact OG-OE2 2.73Å; S98-E101 PolarHBondContact N-OE2 3.44Å; S98-E101 PolarHBondContact O-N 3.33Å; S98-E101 PolarHBondContact OG-N 3.23Å; S98-L102 PolarHBondContact O-N 3.04Å
99D84.8Confident79.6Confident43 Ų4381.1 Ų81.123%0.2343%0.434CS..Hα-helixtrans-61.2-35.5175.5-167.373.7000111.1L102 R103 C115 V117D99-L102 PolarHBondContact O-N 2.97Å; D99-R103 VanDerWaalsContact O-CG 3.31Å; D99-R103 WeakPolarHBondContact O-CG 3.36Å; D99-R103 PolarHBondContact O-N 2.88Å; D99-R103 IonicContact OD1-NH2 2.71Å; D99-R103 IonicContact OD2-CZ 2.69Å; D99-R103 VanDerWaalsContact OD2-CZ 3.25Å; D99-R103 IonicContact OD2-NE 3.99Å; D99-R103 PolarHBondContact OD2-NE 3.49Å; D99-R103 IonicContact OD2-NH2 3.66Å; D99-R103 PolarHBondContact OD2-NH2 2.67Å; D99-C115 WeakPolarHBondContact OD1-CB 3.44Å; D99-C115 PolarHBondContact OD1-SG 2.85Å; D99-V117 HydrophobicContact CB-CG2 4.26Å
100E86.1Confident79.6Confident132 Ų13275.8 Ų75.862%0.61742%0.415SS*.Hα-helixtrans-65.5-42.1178.4-59.476.6-161.500112.1S98 R103 A104S98-E100 WeakPolarHBondContact CB-OE2 3.44Å; S98-E100 PolarHBondContact O-N 3.27Å; S98-E100 PolarHBondContact OG-N 2.85Å; S98-E100 PolarHBondContact OG-OE2 2.73Å; E100-R103 PolarHBondContact O-N 3.42Å; E100-A104 WeakPolarHBondContact O-CB 3.4Å; E100-A104 PolarHBondContact O-N 3.39Å
101E84.8Confident79.8Confident103 Ų10378.7 Ų78.748%0.48143%0.43SS..Hα-helixtrans-62.8-45.4177.5-70.1178.2168.600111.3V97 S98 A104 L105V97-E101 HydrophobicContact CG1-CB 4.33Å; S98-E101 PolarHBondContact N-OE2 3.44Å; S98-E101 PolarHBondContact O-N 3.33Å; S98-E101 PolarHBondContact OG-N 3.23Å; E101-A104 PolarHBondContact O-N 3.05Å; E101-L105 WeakPolarHBondContact O-CB 3.4Å; E101-L105 VanDerWaalsContact O-CG 3.26Å; E101-L105 WeakPolarHBondContact O-CG 3.27Å; E101-L105 PolarHBondContact O-N 3.45Å
102L82.7Confident80.2Confident1 Ų178.3 Ų78.31%0.00542%0.421CS..Hα-helixtrans-62.9-43.9175.5-74.3165.8000111.2L93 V97 S98 D99 A104 L105 F106 V117 A123L93-L102 HydrophobicContact CD1-CD1 3.99Å; L93-L102 HydrophobicContact CD1-CD2 3.95Å; L93-L102 HydrophobicContact CD2-CD2 4.08Å; V97-L102 HydrophobicContact CG1-CD1 3.93Å; V97-L102 HydrophobicContact CG1-CD2 4.2Å; V97-L102 HydrophobicContact CG1-CG 3.65Å; S98-L102 PolarHBondContact O-N 3.04Å; D99-L102 PolarHBondContact O-N 2.97Å; L102-A104 VanDerWaalsContact C-N 3.34Å; L102-A104 PolarHBondContact O-N 2.91Å; L102-L105 PolarHBondContact O-N 3.14Å; L102-F106 HydrophobicContact CD2-CE2 4.08Å; L102-F106 WeakPolarHBondContact O-CD2 3.11Å; L102-F106 PolarHBondContact O-N 3.31Å; L102-V117 HydrophobicContact CD1-CG1 4.44Å; L102-V117 HydrophobicContact CD1-CG2 3.5Å; L102-A123 HydrophobicContact CD1-CB 3.5Å
103R85.3Confident80.8Confident86 Ų8672.9 Ų72.933%0.32540%0.395SS..Hα-helixtrans-60.3-43.6175.8-75179.5-165.6-90.2-2.5112.1D99 E100 L105 F106 S107 V112 C115D99-R103 VanDerWaalsContact O-CG 3.31Å; D99-R103 WeakPolarHBondContact O-CG 3.36Å; D99-R103 PolarHBondContact O-N 2.88Å; D99-R103 IonicContact OD1-NH2 2.71Å; D99-R103 IonicContact OD2-CZ 2.69Å; D99-R103 VanDerWaalsContact OD2-CZ 3.25Å; D99-R103 IonicContact OD2-NE 3.99Å; D99-R103 PolarHBondContact OD2-NE 3.49Å; D99-R103 IonicContact OD2-NH2 3.66Å; D99-R103 PolarHBondContact OD2-NH2 2.67Å; E100-R103 PolarHBondContact O-N 3.42Å; R103-L105 PolarHBondContact O-N 3.05Å; R103-F106 PolarHBondContact O-N 3.25Å; R103-S107 VanDerWaalsContact O-CB 3.28Å; R103-S107 WeakPolarHBondContact O-CB 3.35Å; R103-S107 PolarHBondContact O-N 3.46Å; R103-V112 HydrophobicContact CG-CB 4.35Å; R103-V112 HydrophobicContact CG-CG1 4.18Å; R103-C115 HydrophobicContact CG-CB 4.29Å
104A85.8Confident81.1Confident72 Ų7276.5 Ų76.560%0.59541%0.411SS*.Hα-helixtrans-61.4-44176.800000111.5E100 E101 L102 F106 S107E100-A104 WeakPolarHBondContact O-CB 3.4Å; E100-A104 PolarHBondContact O-N 3.39Å; E101-A104 PolarHBondContact O-N 3.05Å; L102-A104 VanDerWaalsContact C-N 3.34Å; L102-A104 PolarHBondContact O-N 2.91Å; A104-F106 PolarHBondContact O-N 2.93Å; A104-S107 PolarHBondContact O-N 3.23Å
105L82.8Confident81.5Confident101 Ų10173.8 Ų73.853%0.52939%0.394SS..Hα-helixtrans-62.5-39.7177.3-74.2169.4000112.9E101 L102 R103 K108E101-L105 WeakPolarHBondContact O-CB 3.4Å; E101-L105 VanDerWaalsContact O-CG 3.26Å; E101-L105 WeakPolarHBondContact O-CG 3.27Å; E101-L105 PolarHBondContact O-N 3.45Å; L102-L105 PolarHBondContact O-N 3.14Å; R103-L105 PolarHBondContact O-N 3.05Å; L105-K108 VanDerWaalsContact O-CE 3.27Å; L105-K108 WeakPolarHBondContact O-CE 3.4Å; L105-K108 WeakPolarHBondContact O-CG 3.47Å
106F79.4Confident81.8Confident34 Ų3474.3 Ų74.315%0.14938%0.383CS..Hα-helixtrans-88.5-16.1-178.7-75.2-72.2000114.2L88 V90 L102 R103 A104 K108 Y109 G110 V112 V125 L127L88-F106 HydrophobicContact CD1-CD1 3.99Å; L88-F106 HydrophobicContact CD1-CE1 3.67Å; V90-F106 HydrophobicContact CG2-CE2 3.79Å; V90-F106 HydrophobicContact CG2-CZ 3.55Å; L102-F106 HydrophobicContact CD2-CE2 4.08Å; L102-F106 WeakPolarHBondContact O-CD2 3.11Å; L102-F106 PolarHBondContact O-N 3.31Å; R103-F106 PolarHBondContact O-N 3.25Å; A104-F106 PolarHBondContact O-N 2.93Å; F106-K108 PolarHBondContact O-N 2.91Å; F106-K108 VanDerWaalsContact O-N 3.1Å; F106-Y109 HydrophobicContact CD1-CD2 4.26Å; F106-Y109 PolarHBondContact O-N 3.29Å; F106-G110 PolarHBondContact O-N 2.73Å; F106-V112 HydrophobicContact CB-CG2 3.81Å; F106-V125 HydrophobicContact CB-CG1 4.12Å; F106-V125 HydrophobicContact CD2-CB 4.16Å; F106-V125 HydrophobicContact CD2-CG1 3.84Å; F106-V125 HydrophobicContact CD2-CG2 3.75Å; F106-V125 HydrophobicContact CE2-CB 4.31Å; F106-V125 HydrophobicContact CE2-CG1 4.48Å; F106-V125 HydrophobicContact CE2-CG2 3.73Å; F106-V125 HydrophobicContact CG-CG1 3.91Å; F106-L127 HydrophobicContact CB-CD2 4.29Å
107S80.6Confident81.9Confident78 Ų7870.3 Ų70.355%0.54536%0.364SS..Hα-helixtrans-56.8-28.6178.9-1710000112.8R103 A104 Y109 G110R103-S107 VanDerWaalsContact O-CB 3.28Å; R103-S107 WeakPolarHBondContact O-CB 3.35Å; R103-S107 PolarHBondContact O-N 3.46Å; A104-S107 PolarHBondContact O-N 3.23Å; S107-Y109 PolarHBondContact O-N 3.11Å; S107-G110 PolarHBondContact O-N 3.45Å
108K78.9Confident82Confident146 Ų14670 Ų7064%0.63536%0.363SS*.THydrogen-bonded Turntrans-68-20.9176.270-166.7178.5-178.90114.1L105 F106L105-K108 VanDerWaalsContact O-CE 3.27Å; L105-K108 WeakPolarHBondContact O-CE 3.4Å; L105-K108 WeakPolarHBondContact O-CG 3.47Å; F106-K108 PolarHBondContact O-N 2.91Å; F106-K108 VanDerWaalsContact O-N 3.1Å
109Y71.3Confident81.9Confident128 Ų12879.4 Ų79.450%0.50239%0.392SS..THydrogen-bonded Turntrans-101.2-11.1-178.9-58.9-66.9000113.3F106 S107F106-Y109 HydrophobicContact CD1-CD2 4.26Å; F106-Y109 PolarHBondContact O-N 3.29Å; S107-Y109 PolarHBondContact O-N 3.11Å
110G75.9Confident81.5Confident18 Ų1886 Ų8619%0.18642%0.418CS..SBendtrans146.5175174.800000112.7F106 S107 V112F106-G110 PolarHBondContact O-N 2.73Å; S107-G110 PolarHBondContact O-N 3.45Å; G110-V112 PolarHBondContact O-N 3.38Å
111D81.6Confident81Confident86 Ų8680.2 Ų80.246%0.4640%0.395SS..  trans-62.7128179.6-53.5-30.3000111.1R80 V128R80-D111 IonicContact NH1-OD2 2.74Å; R80-D111 PolarHBondContact NH1-OD2 3.39Å; D111-V128 HydrophobicContact CB-CB 4.09Å; D111-V128 HydrophobicContact CB-CG2 3.91Å; D111-V128 WeakPolarHBondContact O-CG2 3.46Å; D111-V128 PolarHBondContact O-N 2.68Å
112V81.3Confident80.8Confident28 Ų2877.9 Ų77.917%0.1738%0.383CS..EExtended strand (participates in β ladder)trans-85.5114.2174.6-178.60000109.3R103 F106 G110 C115 V125 R126 L127R103-V112 HydrophobicContact CG-CB 4.35Å; R103-V112 HydrophobicContact CG-CG1 4.18Å; F106-V112 HydrophobicContact CB-CG2 3.81Å; G110-V112 PolarHBondContact O-N 3.38Å; V112-C115 HydrophobicContact CG1-CB 4.12Å; V112-V125 HydrophobicContact CG1-CG1 3.74Å; V112-V125 HydrophobicContact CG2-CG1 4.08Å; V112-R126 CarbonylContact C-O 3.44Å; V112-L127 HydrophobicContact CG2-CD2 3.93Å
113S82.6Confident80.7Confident49 Ų4977.8 Ų77.834%0.34338%0.383SS..EExtended strand (participates in β ladder)trans-79.5-46.9176.350.20000113.2R126S113-R126 PolarHBondContact N-O 3.48Å; S113-R126 WeakPolarHBondContact OG-CB 3.31Å; S113-R126 VanDerWaalsContact OG-CD 3.26Å; S113-R126 WeakPolarHBondContact OG-CD 3.41Å; S113-R126 VanDerWaalsContact OG-CG 3.23Å; S113-R126 WeakPolarHBondContact OG-CG 3.32Å; S113-R126 PolarHBondContact OG-O 3.11Å
114E82.2Confident80.6Confident107 Ų10776.3 Ų76.350%0.538%0.379SS..EExtended strand (participates in β ladder)trans-133.9136-177.8-59.8171.3175.900107.9R126E114-R126 HydrophobicContact CB-CB 3.87Å; E114-R126 HydrophobicContact CG-CB 4.45Å; E114-R126 PolarHBondContact O-N 3.28Å; E114-R126 IonicContact OE1-NE 2.77Å; E114-R126 IonicContact OE2-CZ 2.68Å; E114-R126 IonicContact OE2-NE 3.03Å; E114-R126 PolarHBondContact OE2-NE 3.43Å; E114-R126 IonicContact OE2-NH2 3.44Å; E114-R126 PolarHBondContact OE2-NH2 3.43Å
115C83.7Confident80.5Confident21 Ų2172.9 Ų72.914%0.14235%0.35CS..EExtended strand (participates in β ladder)trans-133134.1169-168.90000107.5D99 R103 V112 F124D99-C115 WeakPolarHBondContact OD1-CB 3.44Å; D99-C115 PolarHBondContact OD1-SG 2.85Å; R103-C115 HydrophobicContact CG-CB 4.29Å; V112-C115 HydrophobicContact CG1-CB 4.12Å; C115-F124 WeakPolarHBondContact CA-O 3.4Å
116Y84Confident80.2Confident136 Ų13669.8 Ų69.853%0.53333%0.332SS..EExtended strand (participates in β ladder)trans-135.4117.4178.6173.6-91.3000108.1A123 F124Y116-A123 CarbonylContact O-C 3.42Å; Y116-A123 WeakPolarHBondContact O-CA 3.45Å; Y116-A123 WeakPolarHBondContact O-CB 3.34Å; Y116-F124 HydrophobicContact CD1-CD2 4.11Å; Y116-F124 PolarHBondContact N-O 3.36Å; Y116-F124 PolarHBondContact O-N 3.01Å
117V83.7Confident80.1Confident48 Ų4868.2 Ų68.229%0.29133%0.325SS..EExtended strand (participates in β ladder)trans-103126.5178-168.90000109.3D99 L102 A123D99-V117 HydrophobicContact CB-CG2 4.26Å; L102-V117 HydrophobicContact CD1-CG1 4.44Å; L102-V117 HydrophobicContact CD1-CG2 3.5Å; V117-A123 HydrophobicContact CG2-CB 4.38Å
118S82.6Confident79.7Confident15 Ų1565.9 Ų65.911%0.10531%0.307CS..EExtended strand (participates in β ladder)trans-96.8138.5175.7-172.10000110.1K120 G121 F122S118-K120 PolarHBondContact O-N 3Å; S118-K120 PolarHBondContact OG-N 3.27Å; S118-G121 PolarHBondContact O-N 3.5Å; S118-F122 WeakPolarHBondContact CA-O 3.43Å; S118-F122 VanDerWaalsContact CB-CE2 3.4Å; S118-F122 WeakPolarHBondContact CB-O 3Å; S118-F122 PolarHBondContact N-O 3.42Å; S118-F122 WeakPolarHBondContact OG-CE1 3.4Å; S118-F122 WeakPolarHBondContact OG-CZ 3.3Å
119R79.2Confident78.9Confident236 Ų23663.1 Ų63.189%0.89130%0.3SS*.THydrogen-bonded Turntrans-63-6.3172.4-59.5-172.7-174.8-156.10.4114G121R119-G121 VanDerWaalsContact C-N 3.31Å
120K76.8Confident78.3Confident180 Ų18057.6 Ų57.678%0.78328%0.28SS*.THydrogen-bonded Turntrans-90.315.1177.8-63-179178.4-176.20113.1S118 F122S118-K120 PolarHBondContact O-N 3Å; S118-K120 PolarHBondContact OG-N 3.27Å; K120-F122 HydrophobicContact CB-CD1 3.81Å; K120-F122 HydrophobicContact CB-CE1 3.51Å; K120-F122 HydrophobicContact CD-CE1 4.04Å; K120-F122 HydrophobicContact CG-CE1 4.33Å
121G76.4Confident77.2Confident12 Ų1266.9 Ų66.912%0.12431%0.309CS..THydrogen-bonded Turntrans75.730.8177.600000114.4N92 L93 S118 R119N92-G121 PolarHBondContact N-O 2.93Å; L93-G121 PolarHBondContact N-O 3.14Å; L93-G121 WeakPolarHBondContact O-CA 3.26Å; S118-G121 PolarHBondContact O-N 3.5Å; R119-G121 VanDerWaalsContact C-N 3.31Å
122F79.6Confident75.7Confident53 Ų5372.5 Ų72.523%0.23232%0.324CS..EExtended strand (participates in β ladder)trans-141.6153.5172.766.2-98.7000111.4F89 V90 S118 K120 F124F89-F122 HydrophobicContact CE2-CB 3.68Å; F89-F122 AromaticContact CE2-CD2 3.81Å; F89-F122 HydrophobicContact CE2-CD2 3.81Å; F89-F122 AromaticContact CE2-CG 3.84Å; F89-F122 HydrophobicContact CE2-CG 3.84Å; F89-F122 HydrophobicContact CZ-CB 3.81Å; F89-F122 HydrophobicContact CZ-CG 4.28Å; V90-F122 CarbonylContact O-C 3.58Å; V90-F122 WeakPolarHBondContact O-CA 3.21Å; V90-F122 WeakPolarHBondContact O-CB 3.23Å; S118-F122 WeakPolarHBondContact CA-O 3.43Å; S118-F122 VanDerWaalsContact CB-CE2 3.4Å; S118-F122 WeakPolarHBondContact CB-O 3Å; S118-F122 PolarHBondContact N-O 3.42Å; S118-F122 WeakPolarHBondContact OG-CE1 3.4Å; S118-F122 WeakPolarHBondContact OG-CZ 3.3Å; K120-F122 HydrophobicContact CB-CD1 3.81Å; K120-F122 HydrophobicContact CB-CE1 3.51Å; K120-F122 HydrophobicContact CD-CE1 4.04Å; K120-F122 HydrophobicContact CG-CE1 4.33Å; F122-F124 HydrophobicContact CD2-CD2 4.42Å; F122-F124 HydrophobicContact CD2-CE2 4.02Å; F122-F124 HydrophobicContact CE2-CD2 4.36Å; F122-F124 AromaticContact CE2-CE2 3.75Å; F122-F124 HydrophobicContact CE2-CE2 3.75Å
123A82Confident73.8Confident0 Ų075.5 Ų75.50%034%0.335CS..EExtended strand (participates in β ladder)trans-133156.9175.700000111.6V90 L93 L102 Y116 V117V90-A123 HydrophobicContact CB-CB 4.43Å; V90-A123 PolarHBondContact N-O 3.3Å; V90-A123 PolarHBondContact O-N 3.46Å; L93-A123 HydrophobicContact CD1-CB 3.45Å; L93-A123 VanDerWaalsContact CD1-CB 3.45Å; L102-A123 HydrophobicContact CD1-CB 3.5Å; Y116-A123 CarbonylContact O-C 3.42Å; Y116-A123 WeakPolarHBondContact O-CA 3.45Å; Y116-A123 WeakPolarHBondContact O-CB 3.34Å; V117-A123 HydrophobicContact CG2-CB 4.38Å
124F82.4Confident72Confident55 Ų5576 Ų7624%0.24133%0.329CS..EExtended strand (participates in β ladder)trans-114.6125.9167.9-69.6-79.7000109.2R87 L88 F89 C115 Y116 F122R87-F124 HydrophobicContact CG-CB 4.27Å; R87-F124 HydrophobicContact CG-CD1 4.07Å; L88-F124 VanDerWaalsContact O-CA 3.31Å; L88-F124 WeakPolarHBondContact O-CA 3.19Å; F89-F124 HydrophobicContact CB-CD1 4.37Å; F89-F124 HydrophobicContact CB-CE1 4.14Å; F89-F124 HydrophobicContact CD2-CD1 4.17Å; F89-F124 AromaticContact CD2-CE1 3.59Å; F89-F124 HydrophobicContact CD2-CE1 3.59Å; F89-F124 HydrophobicContact CD2-CE2 4.44Å; F89-F124 AromaticContact CD2-CZ 3.74Å; F89-F124 HydrophobicContact CD2-CZ 3.74Å; F89-F124 HydrophobicContact CE2-CZ 4.25Å; F89-F124 HydrophobicContact CG-CE1 4.34Å; C115-F124 WeakPolarHBondContact CA-O 3.4Å; Y116-F124 HydrophobicContact CD1-CD2 4.11Å; Y116-F124 PolarHBondContact N-O 3.36Å; Y116-F124 PolarHBondContact O-N 3.01Å; F122-F124 HydrophobicContact CD2-CD2 4.42Å; F122-F124 HydrophobicContact CD2-CE2 4.02Å; F122-F124 HydrophobicContact CE2-CD2 4.36Å; F122-F124 AromaticContact CE2-CE2 3.75Å; F122-F124 HydrophobicContact CE2-CE2 3.75Å
125V82.6Confident70Confident0 Ų074.1 Ų74.10%033%0.332CS..EExtended strand (participates in β ladder)trans-121.2123.6179.7-176.80000108.8R87 L88 V90 F106 V112R87-V125 CarbonylContact C-O 3.5Å; R87-V125 WeakPolarHBondContact CA-O 3.45Å; L88-V125 PolarHBondContact N-O 2.66Å; L88-V125 PolarHBondContact O-N 3.44Å; V90-V125 HydrophobicContact CG2-CG2 4.17Å; F106-V125 HydrophobicContact CB-CG1 4.12Å; F106-V125 HydrophobicContact CD2-CB 4.16Å; F106-V125 HydrophobicContact CD2-CG1 3.84Å; F106-V125 HydrophobicContact CD2-CG2 3.75Å; F106-V125 HydrophobicContact CE2-CB 4.31Å; F106-V125 HydrophobicContact CE2-CG1 4.48Å; F106-V125 HydrophobicContact CE2-CG2 3.73Å; F106-V125 HydrophobicContact CG-CG1 3.91Å; V112-V125 HydrophobicContact CG1-CG1 3.74Å; V112-V125 HydrophobicContact CG2-CG1 4.08Å
126R77.5Confident67.7Low35 Ų3581.5 Ų81.513%0.13236%0.364CS..EExtended strand (participates in β ladder)trans-103.7115.9176.6-170.6-172.2-68.9-101.47.3111A82 S83 C86 V112 S113 E114A82-R126 HydrophobicContact CB-CG 4.43Å; A82-R126 PolarHBondContact O-NH1 3.03Å; S83-R126 PolarHBondContact O-NH1 3.5Å; C86-R126 HydrophobicContact CB-CG 4.23Å; C86-R126 VanDerWaalsContact O-CA 3.28Å; C86-R126 WeakPolarHBondContact O-CA 3.32Å; V112-R126 CarbonylContact C-O 3.44Å; S113-R126 PolarHBondContact N-O 3.48Å; S113-R126 WeakPolarHBondContact OG-CB 3.31Å; S113-R126 VanDerWaalsContact OG-CD 3.26Å; S113-R126 WeakPolarHBondContact OG-CD 3.41Å; S113-R126 VanDerWaalsContact OG-CG 3.23Å; S113-R126 WeakPolarHBondContact OG-CG 3.32Å; S113-R126 PolarHBondContact OG-O 3.11Å; E114-R126 HydrophobicContact CB-CB 3.87Å; E114-R126 HydrophobicContact CG-CB 4.45Å; E114-R126 PolarHBondContact O-N 3.28Å; E114-R126 IonicContact OE1-NE 2.77Å; E114-R126 IonicContact OE2-CZ 2.68Å; E114-R126 IonicContact OE2-NE 3.03Å; E114-R126 PolarHBondContact OE2-NE 3.43Å; E114-R126 IonicContact OE2-NH2 3.44Å; E114-R126 PolarHBondContact OE2-NH2 3.43Å
127L77.2Confident65.7Low1 Ų178.8 Ų78.81%0.00536%0.358CS..EExtended strand (participates in β ladder)trans-85.7138.1173.7-62.8176.9000111.5C86 L88 F106 V112C86-L127 WeakPolarHBondContact CB-O 3.41Å; C86-L127 PolarHBondContact O-N 3.23Å; L88-L127 HydrophobicContact CD1-CD1 3.83Å; L88-L127 HydrophobicContact CD1-CG 4.3Å; F106-L127 HydrophobicContact CB-CD2 4.29Å; V112-L127 HydrophobicContact CG2-CD2 3.93Å
128V72Confident63.5Low29 Ų2981 Ų8118%0.17636%0.361CS..SBendtrans-68.6-41.5175.6175.90000110.7R80 D111R80-V128 HydrophobicContact CB-CG1 4.39Å; D111-V128 HydrophobicContact CB-CB 4.09Å; D111-V128 HydrophobicContact CB-CG2 3.91Å; D111-V128 WeakPolarHBondContact O-CG2 3.46Å; D111-V128 PolarHBondContact O-N 2.68Å
129N63Low61.2Low89 Ų8990.9 Ų90.948%0.47640%0.398SS..  trans-114.275-172.1-83.6-32.6000112.3R131N129-R131 PolarHBondContact O-N 2.87Å
130C58.2Low59.2Low12 Ų1291.1 Ų91.18%0.08140%0.398CS..THydrogen-bonded Turntrans-65.3-10.2172.2-92.80000117.2C86 R132 F133 W134C86-C130 WeakPolarHBondContact CA-SG 3.39Å; C86-C130 HydrophobicContact CB-CB 4.2Å; C86-C130 WeakPolarHBondContact CB-SG 3.27Å; C86-C130 WeakPolarHBondContact SG-CB 3.5Å; C86-C130 CovalentContact SG-SG 2Å; C86-C130 PolarHBondContact SG-SG 3.42Å; C130-R132 PolarHBondContact O-N 3.31Å; C130-F133 PolarHBondContact O-N 3.38Å; C130-F133 VanDerWaalsContact O-N 3.16Å; C130-W134 VanDerWaalsContact CB-CD1 3.5Å; C130-W134 PolarHBondContact O-N 3.48Å; C130-W134 PolarHBondContact SG-NE1 3.08Å
131R53.3Low57.3Low213 Ų21390.2 Ų90.280%0.80440%0.397SS*.Hα-helixtrans-56.5-36.9-173.7-78.2-171.4175.4-162.9-0.2110.8N129 A135N129-R131 PolarHBondContact O-N 2.87Å; R131-A135 WeakPolarHBondContact O-CA 3.25Å; R131-A135 WeakPolarHBondContact O-CB 3.5Å; R131-A135 PolarHBondContact O-N 3.38Å
132R48.8Very low55.4Low204 Ų20492.1 Ų92.177%0.7742%0.417SS*.Hα-helixtrans-73.5-42.7175.7-90.8-177.9156.5143.3-5.2114.1C130C130-R132 PolarHBondContact O-N 3.31Å
133F42.7Very low53.3Low91 Ų9193.7 Ų93.740%0.39943%0.427SS..Hα-helixtrans-68.6-37.5-179.1-168-97.9000112.7L88 C130L88-F133 HydrophobicContact CD2-CD1 4.01Å; L88-F133 HydrophobicContact CD2-CE1 3.42Å; L88-F133 VanDerWaalsContact CD2-CE1 3.42Å; L88-F133 HydrophobicContact CD2-CE2 4.37Å; L88-F133 HydrophobicContact CD2-CZ 3.63Å; C130-F133 PolarHBondContact O-N 3.38Å; C130-F133 VanDerWaalsContact O-N 3.16Å
134W43.4Very low51.1Low59 Ų5996.4 Ų96.422%0.22344%0.443CS..Hα-helixtrans-96.4-12.3-179-68.689.8000114.9R85 C130 Q136 I137 R138R85-W134 HydrophobicContact CB-CZ2 4.06Å; R85-W134 WeakPolarHBondContact O-CZ2 3.32Å; R85-W134 PolarHBondContact O-NE1 3.47Å; C130-W134 VanDerWaalsContact CB-CD1 3.5Å; C130-W134 PolarHBondContact O-N 3.48Å; C130-W134 PolarHBondContact SG-NE1 3.08Å; W134-Q136 PolarHBondContact O-N 3.12Å; W134-I137 HydrophobicContact CE3-CB 4.25Å; W134-I137 HydrophobicContact CE3-CD1 4.21Å; W134-I137 HydrophobicContact CE3-CG2 4.25Å; W134-I137 HydrophobicContact CZ3-CD1 4.21Å; W134-I137 HydrophobicContact CZ3-CG2 4.28Å; W134-I137 PolarHBondContact O-N 3.4Å; W134-I137 VanDerWaalsContact O-N 3.16Å; W134-R138 HydrophobicContact CB-CG 4.42Å; W134-R138 VanDerWaalsContact CB-CZ 3.44Å; W134-R138 VanDerWaalsContact CG-NH2 3.31Å; W134-R138 VanDerWaalsContact O-CB 3.3Å; W134-R138 WeakPolarHBondContact O-CB 3.41Å; W134-R138 VanDerWaalsContact O-CG 3.3Å; W134-R138 WeakPolarHBondContact O-CG 3.27Å; W134-R138 PolarHBondContact O-N 3.31Å; W134-R138 VanDerWaalsContact O-N 3.12Å
135A40Very low49Very low67 Ų6798.6 Ų98.655%0.55446%0.461SS*.Hα-helixtrans-62.5-28.6174.300000112.1R131 I137R131-A135 WeakPolarHBondContact O-CA 3.25Å; R131-A135 WeakPolarHBondContact O-CB 3.5Å; R131-A135 PolarHBondContact O-N 3.38Å; A135-I137 VanDerWaalsContact C-N 3.32Å; A135-I137 PolarHBondContact O-N 3.34Å
136Q37.2Very low46.9Very low177 Ų177100.9 Ų100.983%0.82747%0.473SS*.THydrogen-bonded Turntrans-71.2-25.2176.1-155.476.427.400112.9W134W134-Q136 PolarHBondContact O-N 3.12Å
137I40.5Very low45Very low79 Ų79103.7 Ų103.741%0.40550%0.496SS..THydrogen-bonded Turntrans-101.8-18.5-173.5-61.8174.7000112.2W134 A135 Y139W134-I137 HydrophobicContact CE3-CB 4.25Å; W134-I137 HydrophobicContact CE3-CD1 4.21Å; W134-I137 HydrophobicContact CE3-CG2 4.25Å; W134-I137 HydrophobicContact CZ3-CD1 4.21Å; W134-I137 HydrophobicContact CZ3-CG2 4.28Å; W134-I137 PolarHBondContact O-N 3.4Å; W134-I137 VanDerWaalsContact O-N 3.16Å; A135-I137 VanDerWaalsContact C-N 3.32Å; A135-I137 PolarHBondContact O-N 3.34Å; I137-Y139 PolarHBondContact O-N 2.87Å
138R37.3Very low43.4Very low93 Ų93107.1 Ų107.135%0.35151%0.511SS..  trans-92.611.9-163.6-84-174.5-166.1156.611.1118.1R85 W134 R140R85-R138 VanDerWaalsContact NH1-CZ 3.26Å; W134-R138 HydrophobicContact CB-CG 4.42Å; W134-R138 VanDerWaalsContact CB-CZ 3.44Å; W134-R138 VanDerWaalsContact CG-NH2 3.31Å; W134-R138 VanDerWaalsContact O-CB 3.3Å; W134-R138 WeakPolarHBondContact O-CB 3.41Å; W134-R138 VanDerWaalsContact O-CG 3.3Å; W134-R138 WeakPolarHBondContact O-CG 3.27Å; W134-R138 PolarHBondContact O-N 3.31Å; W134-R138 VanDerWaalsContact O-N 3.12Å; R138-R140 PolarHBondContact O-N 3.45Å
139Y35.9Very low42Very low223 Ų223115.5 Ų115.588%0.87555%0.545SS*.SBendtrans-86.112.6-169.2-146.4-96.7000116.6I137I137-Y139 PolarHBondContact O-N 2.87Å
140R36.2Very low40.8Very low241 Ų241114.7 Ų114.791%0.90955%0.546SS*.SBendtrans-128.41.1-167-98-171.7176.9173.5-0.7120.2R138R138-R140 PolarHBondContact O-N 3.45Å
141Q37.6Very low40.3Very low161 Ų161117 Ų11775%0.75256%0.562SS**SBendtrans-130.6125176.9-63.9-163.7-2.600111.4I143Q141-I143 WeakPolarHBondContact O-CG1 3.49Å; Q141-I143 PolarHBondContact O-N 2.89Å
142G35.1Very low40.3Very low52 Ų52113.5 Ų113.554%0.53656%0.559SS.*  trans-62.497.4179.700000111.4V144 V164G142-V144 PolarHBondContact O-N 3.16Å; G142-V164 WeakPolarHBondContact O-CG2 3.27Å
143I37.4Very low40.9Very low86 Ų86106.1 Ų106.144%0.44153%0.534SS..  trans-81.2102.2-179.7-60.1174.5000108.9Q141 V161Q141-I143 WeakPolarHBondContact O-CG1 3.49Å; Q141-I143 PolarHBondContact O-N 2.89Å; I143-V161 HydrophobicContact CG1-CG1 4.38Å; I143-V161 HydrophobicContact CG2-CG1 4.15Å; I143-V161 HydrophobicContact CG2-CG2 4.06Å
144V35.9Very low41.7Very low58 Ų58102.6 Ų102.635%0.35252%0.519SS..BIsolated β-bridgetrans-86.9110.9160.9-176.40000107.5G142 I146 H162 V164G142-V144 PolarHBondContact O-N 3.16Å; V144-I146 PolarHBondContact O-N 3.26Å; V144-H162 PolarHBondContact O-N 2.9Å; V144-V164 HydrophobicContact CG2-CG1 4.22Å
145T37.1Very low42.3Very low100 Ų100104.4 Ų104.461%0.61353%0.532SS*.  trans-84.8109.7174-53.40000107.8P147T145-P147 WeakPolarHBondContact O-CD 3.32Å
146I38.7Very low43.5Very low48 Ų48107.6 Ų107.625%0.24654%0.535CS..  trans-77.7123.6172.9-55.7173.5000107.1L11 V144 F148 H162L11-I146 HydrophobicContact CD1-CD1 4.17Å; L11-I146 HydrophobicContact CD1-CG2 4.42Å; V144-I146 PolarHBondContact O-N 3.26Å; I146-F148 HydrophobicContact CB-CE2 4.32Å; I146-F148 PolarHBondContact O-N 3.42Å; I146-H162 HydrophobicContact CD1-CB 3.86Å; I146-H162 HydrophobicContact CG1-CB 4.31Å
147P37.8Very low45Very low95 Ų95101.3 Ų101.362%0.61751%0.509SS*.  trans-66.896.7171.726.9-31.6000108.8T145 K149T145-P147 WeakPolarHBondContact O-CD 3.32Å; P147-K149 PolarHBondContact O-N 3.03Å
148F43.8Very low46.3Very low72 Ų72100.1 Ų100.132%0.31650%0.503SS..  trans-69.781.2165.3-79.8-90.1000108.3I146 S150 F154 A160 L198I146-F148 HydrophobicContact CB-CE2 4.32Å; I146-F148 PolarHBondContact O-N 3.42Å; F148-S150 VanDerWaalsContact C-N 3.28Å; F148-F154 HydrophobicContact CD1-CD2 4.3Å; F148-F154 HydrophobicContact CE1-CD2 4.34Å; F148-F154 HydrophobicContact CE1-CE2 4.28Å; F148-A160 HydrophobicContact CD2-CB 3.79Å; F148-A160 HydrophobicContact CE2-CB 3.58Å; F148-L198 HydrophobicContact CE1-CD1 4.24Å; F148-L198 HydrophobicContact CE1-CD2 4.06Å; F148-L198 HydrophobicContact CZ-CD1 4.42Å
149K42.6Very low47.8Very low205 Ų20598.9 Ų98.989%0.89150%0.499SS*.  trans-86.45.1169.2-81-170.4175.8-1770112.8P147P147-K149 PolarHBondContact O-N 3.03Å
150S37.9Very low49.4Very low72 Ų7288.9 Ų88.950%0.50346%0.462SS..SBendtrans-127.1134.1-172.761.60000113.5F148F148-S150 VanDerWaalsContact C-N 3.28Å
151S48Very low51.2Low61 Ų6178.5 Ų78.543%0.42743%0.426SS..  trans82.2129168.977.30000118.7I153 M196S151-I153 PolarHBondContact O-N 2.9Å; S151-M196 VanDerWaalsContact OG-CE 3.27Å; S151-M196 WeakPolarHBondContact OG-CE 3.43Å
152L52.2Low53Low139 Ų13971.3 Ų71.373%0.72839%0.392SS*.G310 helixtrans-56.8-6.9173.5-70.6123.5000114.3L155L152-L155 HydrophobicContact CB-CD1 4.13Å; L152-L155 HydrophobicContact CD2-CD1 4.09Å; L152-L155 WeakPolarHBondContact O-CD1 3.32Å; L152-L155 VanDerWaalsContact O-CG 3.24Å; L152-L155 WeakPolarHBondContact O-CG 3.29Å
153I61Low55.1Low49 Ų4971 Ų7125%0.25138%0.378SS..G310 helixtrans-74-33.6-173.6-57.7174.1000111.1S151 A187 R190 V191 M196S151-I153 PolarHBondContact O-N 2.9Å; I153-A187 HydrophobicContact CG2-CB 4.26Å; I153-R190 HydrophobicContact CG2-CB 4.28Å; I153-V191 HydrophobicContact CG2-CG2 4.37Å; I153-M196 HydrophobicContact CD1-CE 4.22Å; I153-M196 HydrophobicContact CD1-SD 4.36Å
154F60Low57.2Low17 Ų1768.4 Ų68.48%0.07537%0.365CS..G310 helixtrans-100.625.5-178-70.2-69.3000113.6I5 F148 H156 T157 V176 F178 A187 V191 M196I5-F154 HydrophobicContact CD1-CE1 4.14Å; I5-F154 HydrophobicContact CD1-CZ 3.76Å; F148-F154 HydrophobicContact CD1-CD2 4.3Å; F148-F154 HydrophobicContact CE1-CD2 4.34Å; F148-F154 HydrophobicContact CE1-CE2 4.28Å; F154-H156 PolarHBondContact O-N 2.86Å; F154-T157 WeakPolarHBondContact O-CB 3.38Å; F154-T157 PolarHBondContact O-N 3.45Å; F154-T157 PolarHBondContact O-OG1 3.5Å; F154-V176 HydrophobicContact CD1-CG1 4.16Å; F154-V176 HydrophobicContact CE1-CG1 4.33Å; F154-F178 HydrophobicContact CD1-CE1 4.05Å; F154-F178 HydrophobicContact CD1-CE2 4.26Å; F154-F178 AromaticContact CD1-CZ 3.42Å; F154-F178 HydrophobicContact CD1-CZ 3.42Å; F154-F178 VanDerWaalsContact CD1-CZ 3.42Å; F154-F178 HydrophobicContact CE1-CE2 4.34Å; F154-F178 AromaticContact CE1-CZ 3.74Å; F154-F178 HydrophobicContact CE1-CZ 3.74Å; F154-A187 HydrophobicContact CE1-CB 4.4Å; F154-V191 HydrophobicContact CZ-CG2 4.28Å; F154-M196 HydrophobicContact CD2-CE 3.78Å; F154-M196 HydrophobicContact CD2-SD 4.5Å; F154-M196 HydrophobicContact CE2-CE 3.33Å; F154-M196 HydrophobicContact CE2-SD 3.57Å; F154-M196 VanDerWaalsContact CE2-SD 3.57Å; F154-M196 HydrophobicContact CZ-CE 4.41Å; F154-M196 HydrophobicContact CZ-SD 4.12Å
155L56.4Low59.3Low97 Ų9768.1 Ų68.151%0.50836%0.362SS..THydrogen-bonded Turntrans-56.5138.6173-71164.8000110.3L152 T157L152-L155 HydrophobicContact CB-CD1 4.13Å; L152-L155 HydrophobicContact CD2-CD1 4.09Å; L152-L155 WeakPolarHBondContact O-CD1 3.32Å; L152-L155 VanDerWaalsContact O-CG 3.24Å; L152-L155 WeakPolarHBondContact O-CG 3.29Å; L155-T157 VanDerWaalsContact C-N 3.35Å
156H65.4Low61.5Low134 Ų13471.4 Ų71.462%0.6238%0.376SS*.THydrogen-bonded Turntrans65.730-177.7-42.786.8000115F154 E179F154-H156 PolarHBondContact O-N 2.86Å; H156-E179 HydrophobicContact CB-CB 4.35Å; H156-E179 WeakPolarHBondContact O-CB 3.47Å; H156-E179 PolarHBondContact O-N 3.12Å
157T68.3Low63.3Low46 Ų4675.9 Ų75.928%0.28240%0.396SS..EExtended strand (participates in β ladder)trans-71.4127.7165.6-59.40000109.8F154 L155 R159 V176 E177F154-T157 WeakPolarHBondContact O-CB 3.38Å; F154-T157 PolarHBondContact O-N 3.45Å; F154-T157 PolarHBondContact O-OG1 3.5Å; L155-T157 VanDerWaalsContact C-N 3.35Å; T157-R159 WeakPolarHBondContact CG2-O 3.19Å; T157-V176 HydrophobicContact CG2-CG1 3.52Å; T157-E177 WeakPolarHBondContact CG2-O 3.1Å
158L68.9Low65.1Low53 Ų5373.6 Ų73.628%0.27739%0.389SS..EExtended strand (participates in β ladder)trans-81.8-39.9174.6-70.8174.5000112.2G84 E177 E179G84-L158 VanDerWaalsContact N-CD1 3.26Å; L158-E177 HydrophobicContact CB-CG 4.32Å; L158-E177 WeakPolarHBondContact CB-O 3.15Å; L158-E177 HydrophobicContact CD1-CG 4.32Å; L158-E177 PolarHBondContact N-O 3.11Å; L158-E179 HydrophobicContact CD1-CB 4.22Å; L158-E179 HydrophobicContact CD2-CB 4.04Å; L158-E179 HydrophobicContact CD2-CG 4.15Å; L158-E179 HydrophobicContact CG-CB 3.87Å; L158-E179 HydrophobicContact CG-CG 4.42Å
159R67Low66.5Low68 Ų6877.3 Ų77.326%0.25740%0.401SS..EExtended strand (participates in β ladder)trans-155.4139.9-177.2-178.6171.964.7129.12.5110.3R85 T157 V161 E177R85-R159 VanDerWaalsContact CZ-NE 3.28Å; R85-R159 VanDerWaalsContact NH1-CZ 3.26Å; R85-R159 VanDerWaalsContact NH1-NH1 3.18Å; T157-R159 WeakPolarHBondContact CG2-O 3.19Å; R159-V161 HydrophobicContact CG-CG2 3.76Å; R159-E177 HydrophobicContact CB-CB 4.1Å; R159-E177 IonicContact CZ-OE2 3.25Å; R159-E177 PolarHBondContact N-O 3.39Å; R159-E177 IonicContact NE-OE2 2.92Å; R159-E177 PolarHBondContact NE-OE2 3.03Å; R159-E177 IonicContact NH2-OE2 3.93Å; R159-E177 PolarHBondContact O-N 2.95Å
160A70.1Confident68.2Low13 Ų1369 Ų6911%0.10737%0.368CS..EExtended strand (participates in β ladder)trans-126.5131.8165.400000108.4F148 I175 V176F148-A160 HydrophobicContact CD2-CB 3.79Å; F148-A160 HydrophobicContact CE2-CB 3.58Å; A160-I175 CarbonylContact C-O 3.59Å; A160-I175 WeakPolarHBondContact CA-O 3.37Å; A160-V176 HydrophobicContact CB-CG2 4.12Å
161V73.3Confident70.3Confident23 Ų2368.8 Ų68.814%0.13936%0.364CS..EExtended strand (participates in β ladder)trans-129.1130.8179.2-176.80000108.4I143 R159 G174 I175I143-V161 HydrophobicContact CG1-CG1 4.38Å; I143-V161 HydrophobicContact CG2-CG1 4.15Å; I143-V161 HydrophobicContact CG2-CG2 4.06Å; R159-V161 HydrophobicContact CG-CG2 3.76Å; V161-G174 CarbonylContact O-C 3.58Å; V161-G174 WeakPolarHBondContact O-CA 3.44Å; V161-I175 PolarHBondContact N-O 2.92Å; V161-I175 PolarHBondContact O-N 3.29Å
162H76.7Confident71.9Confident9 Ų966.2 Ų66.24%0.04235%0.347CS..EExtended strand (participates in β ladder)trans-88.7131.1166.9-164.5-150.1000109.3V144 I146 P170 E173V144-H162 PolarHBondContact O-N 2.9Å; I146-H162 HydrophobicContact CD1-CB 3.86Å; I146-H162 HydrophobicContact CG1-CB 4.31Å; H162-P170 WeakPolarHBondContact CE1-CB 3.38Å; H162-E173 PolarHBondContact CD2-O 2.74Å
163I79.7Confident73.4Confident47 Ų4762.9 Ų62.924%0.24133%0.327CS..EExtended strand (participates in β ladder)trans-78.1131.1179.1-59.7168.3000107.4T171 E173 I175I163-T171 WeakPolarHBondContact CB-OG1 3.49Å; I163-T171 HydrophobicContact CG2-CG2 3.96Å; I163-T171 PolarHBondContact O-N 2.94Å; I163-T171 PolarHBondContact O-OG1 3.15Å; I163-E173 HydrophobicContact CB-CB 4.48Å; I163-E173 WeakPolarHBondContact CB-O 3.42Å; I163-E173 HydrophobicContact CD1-CB 3.91Å; I163-E173 PolarHBondContact N-O 2.9Å; I163-I175 HydrophobicContact CD1-CD1 4.13Å; I163-I175 HydrophobicContact CD1-CG1 4.06Å; I163-I175 HydrophobicContact CG1-CG1 4.5Å
164V80.1Confident74.5Confident30 Ų3060.9 Ų60.918%0.18232%0.319CS..EExtended strand (participates in β ladder)trans-118.7150.3176.2-640000109.4G142 V144 R169G142-V164 WeakPolarHBondContact O-CG2 3.27Å; V144-V164 HydrophobicContact CG2-CG1 4.22Å; V164-R169 CarbonylContact C-O 3.48Å; V164-R169 WeakPolarHBondContact CA-O 3.21Å
165D79.5Confident75.7Confident53 Ų5361.5 Ų61.528%0.28332%0.323SS..  trans-71.7177.4170.272.37.6000111.3H167 G168 R169 T171D165-H167 PolarHBondContact O-N 3.48Å; D165-H167 VanDerWaalsContact O-N 3.08Å; D165-H167 VanDerWaalsContact OD1-C 3.27Å; D165-H167 VanDerWaalsContact OD1-CA 3.28Å; D165-H167 WeakPolarHBondContact OD1-CA 3.18Å; D165-H167 WeakPolarHBondContact OD1-CB 3.24Å; D165-H167 PolarHBondContact OD1-N 2.96Å; D165-H167 IonicContact OD2-ND1 3.25Å; D165-G168 PolarHBondContact O-N 3.11Å; D165-G168 PolarHBondContact OD1-N 3.25Å; D165-R169 PolarHBondContact N-O 2.88Å; D165-R169 WeakPolarHBondContact OD1-CA 3.45Å; D165-R169 WeakPolarHBondContact OD1-CB 3.27Å; D165-R169 PolarHBondContact OD1-N 3.21Å; D165-R169 WeakPolarHBondContact OD2-CB 3.34Å; D165-R169 WeakPolarHBondContact OD2-CD 3.41Å; D165-R169 IonicContact OD2-NE 3.31Å; D165-T171 HydrophobicContact CB-CG2 4.41Å
166D83.3Confident77Confident169 Ų16957.1 Ų57.190%0.90430%0.3SS*.THydrogen-bonded Turntrans-61.7-17.6178.6-60.5-31.1000113.4
167H78.2Confident77.8Confident142 Ų14251.3 Ų51.366%0.65727%0.273SS*.THydrogen-bonded Turntrans-93.42.1176.5-56.786.7000112.5D165 R169D165-H167 PolarHBondContact O-N 3.48Å; D165-H167 VanDerWaalsContact O-N 3.08Å; D165-H167 VanDerWaalsContact OD1-C 3.27Å; D165-H167 VanDerWaalsContact OD1-CA 3.28Å; D165-H167 WeakPolarHBondContact OD1-CA 3.18Å; D165-H167 WeakPolarHBondContact OD1-CB 3.24Å; D165-H167 PolarHBondContact OD1-N 2.96Å; D165-H167 IonicContact OD2-ND1 3.25Å; H167-R169 VanDerWaalsContact C-N 3.28Å; H167-R169 HydrophobicContact CB-CG 4.13Å; H167-R169 PolarHBondContact O-N 2.92Å
168G74Confident78.4Confident46 Ų4649.3 Ų49.347%0.47426%0.261SS..SBendtrans75.312.6-175.800000114.2D165D165-G168 PolarHBondContact O-N 3.11Å; D165-G168 PolarHBondContact OD1-N 3.25Å
169R74.6Confident78.8Confident150 Ų15050.9 Ų50.957%0.56627%0.267SS*.  trans-79.7138.4175.5-49.3176.9-143.9-175.17.9109.6V164 D165 H167 T171V164-R169 CarbonylContact C-O 3.48Å; V164-R169 WeakPolarHBondContact CA-O 3.21Å; D165-R169 PolarHBondContact N-O 2.88Å; D165-R169 WeakPolarHBondContact OD1-CA 3.45Å; D165-R169 WeakPolarHBondContact OD1-CB 3.27Å; D165-R169 PolarHBondContact OD1-N 3.21Å; D165-R169 WeakPolarHBondContact OD2-CB 3.34Å; D165-R169 WeakPolarHBondContact OD2-CD 3.41Å; D165-R169 IonicContact OD2-NE 3.31Å; H167-R169 VanDerWaalsContact C-N 3.28Å; H167-R169 HydrophobicContact CB-CG 4.13Å; H167-R169 PolarHBondContact O-N 2.92Å; R169-T171 PolarHBondContact O-N 3.49Å
170P78.6Confident79.5Confident32 Ų3255.9 Ų55.921%0.20829%0.285CS..EExtended strand (participates in β ladder)trans-61.4126.2175.923.9-35.3000112.5P10 H162 G172P10-P170 HydrophobicContact CB-CB 3.77Å; P10-P170 HydrophobicContact CB-CG 3.24Å; H162-P170 WeakPolarHBondContact CE1-CB 3.38Å; P170-G172 VanDerWaalsContact C-N 3.26Å; P170-G172 PolarHBondContact O-N 3Å
171T80.3Confident80.2Confident67 Ų6761.7 Ų61.741%0.41131%0.308SS..EExtended strand (participates in β ladder)trans-78.6-11.4177.164.20000113.3I163 D165 R169 E173I163-T171 WeakPolarHBondContact CB-OG1 3.49Å; I163-T171 HydrophobicContact CG2-CG2 3.96Å; I163-T171 PolarHBondContact O-N 2.94Å; I163-T171 PolarHBondContact O-OG1 3.15Å; D165-T171 HydrophobicContact CB-CG2 4.41Å; R169-T171 PolarHBondContact O-N 3.49Å; T171-E173 VanDerWaalsContact C-N 3.27Å; T171-E173 PolarHBondContact OG1-N 2.77Å
172G82.1Confident80.9Confident7 Ų765.1 Ų65.17%0.07233%0.331CS..EExtended strand (participates in β ladder)trans81.74.8-172.500000113.9R7 C8 P170R7-G172 PolarHBondContact N-O 3.32Å; R7-G172 VanDerWaalsContact N-O 3.15Å; C8-G172 PolarHBondContact N-O 2.92Å; C8-G172 VanDerWaalsContact N-O 3.16Å; C8-G172 VanDerWaalsContact O-CA 3.3Å; C8-G172 WeakPolarHBondContact O-CA 3.5Å; P170-G172 VanDerWaalsContact C-N 3.26Å; P170-G172 PolarHBondContact O-N 3Å
173E84.5Confident81.3Confident68 Ų6866.2 Ų66.232%0.31835%0.345SS..EExtended strand (participates in β ladder)trans-113.6147.3174.4-56-166152.300111.1K4 I5 H162 I163 T171K4-E173 WeakPolarHBondContact CE-OE1 3.44Å; K4-E173 WeakPolarHBondContact CE-OE2 3.42Å; K4-E173 IonicContact NZ-OE1 3.36Å; K4-E173 PolarHBondContact NZ-OE1 3.22Å; K4-E173 IonicContact NZ-OE2 3.03Å; K4-E173 PolarHBondContact NZ-OE2 3.47Å; I5-E173 CarbonylContact O-C 3.46Å; I5-E173 WeakPolarHBondContact O-CA 3.41Å; H162-E173 PolarHBondContact CD2-O 2.74Å; I163-E173 HydrophobicContact CB-CB 4.48Å; I163-E173 WeakPolarHBondContact CB-O 3.42Å; I163-E173 HydrophobicContact CD1-CB 3.91Å; I163-E173 PolarHBondContact N-O 2.9Å; T171-E173 VanDerWaalsContact C-N 3.27Å; T171-E173 PolarHBondContact OG1-N 2.77Å
174G83Confident81.6Confident7 Ų764 Ų647%0.07233%0.333CS..EExtended strand (participates in β ladder)trans-145.3160.8175.800000111.7K4 I5 V161K4-G174 CarbonylContact C-O 3.59Å; K4-G174 WeakPolarHBondContact CA-O 3.33Å; I5-G174 PolarHBondContact N-O 2.88Å; I5-G174 PolarHBondContact O-N 2.97Å; V161-G174 CarbonylContact O-C 3.58Å; V161-G174 WeakPolarHBondContact O-CA 3.44Å
175I85.3Confident82.1Confident31 Ų3166.6 Ų66.616%0.15934%0.343CS..EExtended strand (participates in β ladder)trans-120127.4178.8-59.2172.4000108.4L2 L3 A160 V161 I163 Y210L2-I175 HydrophobicContact CB-CG2 4.44Å; L2-I175 HydrophobicContact CD2-CG2 3.95Å; L3-I175 WeakPolarHBondContact O-CA 3.18Å; A160-I175 CarbonylContact C-O 3.59Å; A160-I175 WeakPolarHBondContact CA-O 3.37Å; V161-I175 PolarHBondContact N-O 2.92Å; V161-I175 PolarHBondContact O-N 3.29Å; I163-I175 HydrophobicContact CD1-CD1 4.13Å; I163-I175 HydrophobicContact CD1-CG1 4.06Å; I163-I175 HydrophobicContact CG1-CG1 4.5Å; I175-Y210 HydrophobicContact CD1-CD2 4.27Å; I175-Y210 HydrophobicContact CD1-CE2 3.8Å; I175-Y210 HydrophobicContact CG1-CD2 4.34Å; I175-Y210 HydrophobicContact CG1-CE2 4.34Å
176V84.3Confident82.5Confident5 Ų567.5 Ų67.53%0.0335%0.346CS..EExtended strand (participates in β ladder)trans-115.2123.5176.1-176.40000109.8L2 L3 I5 F154 T157 A160 F178L2-V176 CarbonylContact C-O 3.6Å; L2-V176 WeakPolarHBondContact CA-O 3.44Å; L3-V176 PolarHBondContact N-O 3.06Å; L3-V176 PolarHBondContact O-N 3.36Å; I5-V176 HydrophobicContact CD1-CB 4.41Å; I5-V176 HydrophobicContact CD1-CG2 3.39Å; I5-V176 HydrophobicContact CG1-CG2 3.98Å; F154-V176 HydrophobicContact CD1-CG1 4.16Å; F154-V176 HydrophobicContact CE1-CG1 4.33Å; T157-V176 HydrophobicContact CG2-CG1 3.52Å; A160-V176 HydrophobicContact CB-CG2 4.12Å; V176-F178 HydrophobicContact CB-CE2 4.17Å; V176-F178 HydrophobicContact CG1-CD2 4.02Å; V176-F178 HydrophobicContact CG1-CE2 3.52Å; V176-F178 HydrophobicContact CG1-CZ 4.09Å
177E81.7Confident82.7Confident11 Ų1159.6 Ų59.65%0.05130%0.304CS..EExtended strand (participates in β ladder)trans-103.7117.6179.5-171.8-179.5162.400109.6L2 R85 T157 L158 R159L2-E177 HydrophobicContact CD2-CB 3.53Å; L2-E177 HydrophobicContact CD2-CG 3.58Å; R85-E177 PolarHBondContact N-OE1 2.96Å; R85-E177 IonicContact NE-OE2 2.68Å; T157-E177 WeakPolarHBondContact CG2-O 3.1Å; L158-E177 HydrophobicContact CB-CG 4.32Å; L158-E177 WeakPolarHBondContact CB-O 3.15Å; L158-E177 HydrophobicContact CD1-CG 4.32Å; L158-E177 PolarHBondContact N-O 3.11Å; R159-E177 HydrophobicContact CB-CB 4.1Å; R159-E177 IonicContact CZ-OE2 3.25Å; R159-E177 PolarHBondContact N-O 3.39Å; R159-E177 IonicContact NE-OE2 2.92Å; R159-E177 PolarHBondContact NE-OE2 3.03Å; R159-E177 IonicContact NH2-OE2 3.93Å; R159-E177 PolarHBondContact O-N 2.95Å
178F81.2Confident83.3Confident5 Ų554.4 Ų54.42%0.02228%0.281CS..EExtended strand (participates in β ladder)trans-97.4145.9176.6-71.2-101.7000111.8M1 L3 F154 V176 R180 A184 A187M1-F178 PolarHBondContact N-O 3.35Å; M1-F178 PolarHBondContact O-N 3.21Å; L3-F178 HydrophobicContact CB-CE2 4.39Å; L3-F178 HydrophobicContact CD1-CD2 4.08Å; L3-F178 HydrophobicContact CD1-CE2 3.37Å; L3-F178 HydrophobicContact CD1-CZ 3.97Å; L3-F178 HydrophobicContact CG-CD2 4.19Å; L3-F178 HydrophobicContact CG-CE2 3.86Å; F154-F178 HydrophobicContact CD1-CE1 4.05Å; F154-F178 HydrophobicContact CD1-CE2 4.26Å; F154-F178 AromaticContact CD1-CZ 3.42Å; F154-F178 HydrophobicContact CD1-CZ 3.42Å; F154-F178 VanDerWaalsContact CD1-CZ 3.42Å; F154-F178 HydrophobicContact CE1-CE2 4.34Å; F154-F178 AromaticContact CE1-CZ 3.74Å; F154-F178 HydrophobicContact CE1-CZ 3.74Å; V176-F178 HydrophobicContact CB-CE2 4.17Å; V176-F178 HydrophobicContact CG1-CD2 4.02Å; V176-F178 HydrophobicContact CG1-CE2 3.52Å; V176-F178 HydrophobicContact CG1-CZ 4.09Å; F178-R180 PolarHBondContact O-N 2.88Å; F178-A184 HydrophobicContact CB-CB 3.86Å; F178-A184 HydrophobicContact CD1-CB 4.34Å; F178-A184 HydrophobicContact CD2-CB 3.71Å; F178-A184 HydrophobicContact CE2-CB 4.31Å; F178-A184 HydrophobicContact CG-CB 3.71Å; F178-A187 HydrophobicContact CE1-CB 3.81Å; F178-A187 HydrophobicContact CE2-CB 4.38Å; F178-A187 HydrophobicContact CZ-CB 3.42Å; F178-A187 VanDerWaalsContact CZ-CB 3.42Å
179E76.9Confident84.1Confident86 Ų8657.3 Ų57.340%0.40228%0.281SS..SBendtrans-60.3-44.1176.7-169.3-171.214300112.1H156 L158H156-E179 HydrophobicContact CB-CB 4.35Å; H156-E179 WeakPolarHBondContact O-CB 3.47Å; H156-E179 PolarHBondContact O-N 3.12Å; L158-E179 HydrophobicContact CD1-CB 4.22Å; L158-E179 HydrophobicContact CD2-CB 4.04Å; L158-E179 HydrophobicContact CD2-CG 4.15Å; L158-E179 HydrophobicContact CG-CB 3.87Å; L158-E179 HydrophobicContact CG-CG 4.42Å
180R81.1Confident84.7Confident173 Ų17356.1 Ų56.165%0.65328%0.276SS*.SBendtrans-127.8149.4-175.2-56.6-176.5-176.8-172.2-2.5111.4F178 A184F178-R180 PolarHBondContact O-N 2.88Å; R180-A184 PolarHBondContact O-N 2.92Å
181K86.3Confident85.2Confident134 Ų13454.7 Ų54.758%0.58327%0.267SS*.Hα-helixtrans-61.8-42.5179.4-174.8178.4178.7-179.90113.8M1 G183 A184 Q185M1-K181 HydrophobicContact SD-CG 4.07Å; K181-G183 VanDerWaalsContact C-N 3.34Å; K181-G183 PolarHBondContact O-N 3.13Å; K181-A184 PolarHBondContact O-N 3.04Å; K181-Q185 HydrophobicContact CG-CG 4.37Å; K181-Q185 PolarHBondContact O-N 3.32Å
182P87.4Confident85.7Confident95 Ų9555.8 Ų55.862%0.61727%0.27SS*.Hα-helixtrans-60.6-40.2-179.9-25.636000113.4A184 Q185 E186P182-A184 PolarHBondContact O-N 3.36Å; P182-Q185 PolarHBondContact O-N 2.96Å; P182-E186 PolarHBondContact O-N 2.92Å
183G85.4Confident86.1Confident32 Ų3265.5 Ų65.533%0.3330%0.304SS..Hα-helixtrans-62.3-42.2176.500000112.6K181 E186 A187K181-G183 VanDerWaalsContact C-N 3.34Å; K181-G183 PolarHBondContact O-N 3.13Å; G183-E186 PolarHBondContact O-N 2.89Å; G183-A187 WeakPolarHBondContact O-CB 3.22Å; G183-A187 PolarHBondContact O-N 2.92Å
184A86.8Confident86.3Confident0 Ų064.2 Ų64.20%031%0.31CS..Hα-helixtrans-64.7-41.3175.500000112.7M1 L3 F178 R180 K181 P182 A187 L188M1-A184 HydrophobicContact CB-CB 3.71Å; M1-A184 HydrophobicContact CG-CB 3.86Å; M1-A184 HydrophobicContact SD-CB 3.67Å; L3-A184 HydrophobicContact CD1-CB 4.27Å; L3-A184 WeakPolarHBondContact CD1-O 3.47Å; L3-A184 HydrophobicContact CD2-CB 4.47Å; L3-A184 HydrophobicContact CG-CB 4.34Å; F178-A184 HydrophobicContact CB-CB 3.86Å; F178-A184 HydrophobicContact CD1-CB 4.34Å; F178-A184 HydrophobicContact CD2-CB 3.71Å; F178-A184 HydrophobicContact CE2-CB 4.31Å; F178-A184 HydrophobicContact CG-CB 3.71Å; R180-A184 PolarHBondContact O-N 2.92Å; K181-A184 PolarHBondContact O-N 3.04Å; P182-A184 PolarHBondContact O-N 3.36Å; A184-A187 PolarHBondContact O-N 3.31Å; A184-L188 WeakPolarHBondContact O-CB 3.45Å; A184-L188 PolarHBondContact O-N 3.48Å
185Q89.9Confident86.6Confident85 Ų8569.2 Ų69.240%0.39734%0.339SS..Hα-helixtrans-67.9-37179-72.6-174.1-53.800112.2M1 K181 P182 K189M1-Q185 HydrophobicContact SD-CG 4.29Å; K181-Q185 HydrophobicContact CG-CG 4.37Å; K181-Q185 PolarHBondContact O-N 3.32Å; P182-Q185 PolarHBondContact O-N 2.96Å; Q185-K189 VanDerWaalsContact O-CG 3.32Å; Q185-K189 WeakPolarHBondContact O-CG 3.4Å; Q185-K189 PolarHBondContact O-N 3Å
186E87.7Confident86.5Confident73 Ų7368.7 Ų68.734%0.34134%0.336SS..Hα-helixtrans-68.1-42.6175.4-172.359.6-163.300111.4P182 G183 K189 R190P182-E186 PolarHBondContact O-N 2.92Å; G183-E186 PolarHBondContact O-N 2.89Å; E186-K189 PolarHBondContact O-N 3.44Å; E186-R190 VanDerWaalsContact CG-CZ 3.4Å; E186-R190 WeakPolarHBondContact O-CB 3.19Å; E186-R190 WeakPolarHBondContact O-CG 3.46Å; E186-R190 PolarHBondContact O-N 3.35Å; E186-R190 IonicContact OE1-CZ 3.31Å; E186-R190 IonicContact OE1-NE 2.73Å; E186-R190 PolarHBondContact OE1-NE 2.89Å; E186-R190 IonicContact OE1-NH2 3.29Å; E186-R190 PolarHBondContact OE1-NH2 2.82Å
187A87.1Confident86.4Confident2 Ų272.6 Ų72.62%0.01736%0.356CS..Hα-helixtrans-59.1-49.3172.700000111.6L3 I153 F154 F178 G183 A184 K189 R190 V191L3-A187 HydrophobicContact CD1-CB 4.3Å; I153-A187 HydrophobicContact CG2-CB 4.26Å; F154-A187 HydrophobicContact CE1-CB 4.4Å; F178-A187 HydrophobicContact CE1-CB 3.81Å; F178-A187 HydrophobicContact CE2-CB 4.38Å; F178-A187 HydrophobicContact CZ-CB 3.42Å; F178-A187 VanDerWaalsContact CZ-CB 3.42Å; G183-A187 WeakPolarHBondContact O-CB 3.22Å; G183-A187 PolarHBondContact O-N 2.92Å; A184-A187 PolarHBondContact O-N 3.31Å; A187-K189 VanDerWaalsContact C-N 3.32Å; A187-K189 PolarHBondContact O-N 3.45Å; A187-R190 PolarHBondContact O-N 3.02Å; A187-V191 WeakPolarHBondContact O-CB 3.47Å; A187-V191 WeakPolarHBondContact O-CG2 3.33Å; A187-V191 PolarHBondContact O-N 3.16Å
188L90.5Very high86.1Confident34 Ų3474.6 Ų74.618%0.17837%0.367CS..Hα-helixtrans-54.7-46.3176.9-178.766.7000111.9L3 A184 N192 C207L3-L188 HydrophobicContact CD1-CB 4.3Å; L3-L188 HydrophobicContact CD2-CB 4.45Å; A184-L188 WeakPolarHBondContact O-CB 3.45Å; A184-L188 PolarHBondContact O-N 3.48Å; L188-N192 WeakPolarHBondContact O-CB 3.31Å; L188-N192 PolarHBondContact O-N 2.99Å; L188-N192 VanDerWaalsContact O-N 3.16Å; L188-C207 HydrophobicContact CD1-CB 4.04Å; L188-C207 WeakPolarHBondContact CD1-O 3.45Å
189K90.8Very high85.7Confident107 Ų10776.3 Ų76.347%0.46538%0.379SS..Hα-helixtrans-65.7-45.2178.2-73.9176.3-175.5178.60112.3Q185 E186 A187 R193Q185-K189 VanDerWaalsContact O-CG 3.32Å; Q185-K189 WeakPolarHBondContact O-CG 3.4Å; Q185-K189 PolarHBondContact O-N 3Å; E186-K189 PolarHBondContact O-N 3.44Å; A187-K189 VanDerWaalsContact C-N 3.32Å; A187-K189 PolarHBondContact O-N 3.45Å; K189-R193 WeakPolarHBondContact O-CB 3.36Å; K189-R193 WeakPolarHBondContact O-CG 3.48Å; K189-R193 PolarHBondContact O-N 2.93Å
190R89.1Confident85.7Confident124 Ų12475.4 Ų75.447%0.46839%0.393SS..Hα-helixtrans-67.7-42-178.4-74.4-176-172.8154.84.1112.2I153 E186 A187 G194I153-R190 HydrophobicContact CG2-CB 4.28Å; E186-R190 VanDerWaalsContact CG-CZ 3.4Å; E186-R190 WeakPolarHBondContact O-CB 3.19Å; E186-R190 WeakPolarHBondContact O-CG 3.46Å; E186-R190 PolarHBondContact O-N 3.35Å; E186-R190 IonicContact OE1-CZ 3.31Å; E186-R190 IonicContact OE1-NE 2.73Å; E186-R190 PolarHBondContact OE1-NE 2.89Å; E186-R190 IonicContact OE1-NH2 3.29Å; E186-R190 PolarHBondContact OE1-NH2 2.82Å; A187-R190 PolarHBondContact O-N 3.02Å; R190-G194 PolarHBondContact O-N 3.33Å
191V88.2Confident85.5Confident3 Ų368.3 Ų68.32%0.01837%0.37CS..Hα-helixtrans-65.8-41.5179.6176.60000111.1I153 F154 A187 M196 V205 C207I153-V191 HydrophobicContact CG2-CG2 4.37Å; F154-V191 HydrophobicContact CZ-CG2 4.28Å; A187-V191 WeakPolarHBondContact O-CB 3.47Å; A187-V191 WeakPolarHBondContact O-CG2 3.33Å; A187-V191 PolarHBondContact O-N 3.16Å; V191-M196 HydrophobicContact CG1-CB 4.26Å; V191-M196 HydrophobicContact CG2-SD 3.63Å; V191-V205 HydrophobicContact CG1-CG2 4.01Å; V191-C207 HydrophobicContact CB-CB 3.85Å; V191-C207 HydrophobicContact CG1-CB 3.57Å; V191-C207 HydrophobicContact CG2-CB 4.5Å
192N89.9Confident85.3Confident89 Ų8963.7 Ų63.748%0.47636%0.36SS..Hα-helixtrans-82.5-21.8-178.6-68.2-11000113.8L188 C207L188-N192 WeakPolarHBondContact O-CB 3.31Å; L188-N192 PolarHBondContact O-N 2.99Å; L188-N192 VanDerWaalsContact O-N 3.16Å; N192-C207 PolarHBondContact ND2-O 3.21Å; N192-C207 PolarHBondContact OD1-N 3.15Å; N192-C207 PolarHBondContact OD1-O 3.01Å
193R91.5Very high85.2Confident211 Ų21162.1 Ų62.180%0.79634%0.341SS*.Hα-helixtrans-84.4-33.3173.9-73.1174.9178.2-171-3.7112.9K189K189-R193 WeakPolarHBondContact O-CB 3.36Å; K189-R193 WeakPolarHBondContact O-CG 3.48Å; K189-R193 PolarHBondContact O-N 2.93Å
194G88.2Confident85.3Confident42 Ų4263.6 Ų63.643%0.43335%0.345SS..THydrogen-bonded Turntrans-100.5178.2179.500000112.6R190R190-G194 PolarHBondContact O-N 3.33Å
195V88.9Confident85.4Confident112 Ų11264 Ų6468%0.67935%0.348SS*.THydrogen-bonded Turntrans-102.687.9171.8-177.60000107.4L197 P204V195-L197 HydrophobicContact CG1-CD2 3.86Å; V195-L197 HydrophobicContact CG1-CG 4.28Å; V195-L197 PolarHBondContact O-N 2.9Å; V195-P204 HydrophobicContact CG1-CB 3.81Å; V195-P204 HydrophobicContact CG1-CG 4.27Å
196M83.2Confident85.4Confident19 Ų1962.5 Ų62.59%0.09434%0.344CS..  trans-80.6112.2179-173.9170.7-162.200110.8S151 I153 F154 V191 L198 P204 V205S151-M196 VanDerWaalsContact OG-CE 3.27Å; S151-M196 WeakPolarHBondContact OG-CE 3.43Å; I153-M196 HydrophobicContact CD1-CE 4.22Å; I153-M196 HydrophobicContact CD1-SD 4.36Å; F154-M196 HydrophobicContact CD2-CE 3.78Å; F154-M196 HydrophobicContact CD2-SD 4.5Å; F154-M196 HydrophobicContact CE2-CE 3.33Å; F154-M196 HydrophobicContact CE2-SD 3.57Å; F154-M196 VanDerWaalsContact CE2-SD 3.57Å; F154-M196 HydrophobicContact CZ-CE 4.41Å; F154-M196 HydrophobicContact CZ-SD 4.12Å; V191-M196 HydrophobicContact CG1-CB 4.26Å; V191-M196 HydrophobicContact CG2-SD 3.63Å; M196-L198 HydrophobicContact CE-CD2 3.88Å; M196-L198 HydrophobicContact CG-CD2 4.42Å; M196-L198 HydrophobicContact SD-CD2 4.42Å; M196-P204 WeakPolarHBondContact O-CA 3.3Å; M196-V205 HydrophobicContact CB-CG2 3.94Å; M196-V205 HydrophobicContact CG-CG2 4.03Å; M196-V205 PolarHBondContact O-N 3.5Å; M196-V205 HydrophobicContact SD-CG2 4.3Å
197L82.9Confident85.6Confident87 Ų8759.1 Ų59.146%0.45533%0.329SS..BIsolated β-bridgetrans-100.3121.2176.2-55.5-177.8000110.2V195 G202 P204V195-L197 HydrophobicContact CG1-CD2 3.86Å; V195-L197 HydrophobicContact CG1-CG 4.28Å; V195-L197 PolarHBondContact O-N 2.9Å; L197-G202 WeakPolarHBondContact CD2-O 3.25Å; L197-P204 HydrophobicContact CD2-CB 4.31Å
198L76.3Confident85.9Confident54 Ų5463.3 Ų63.328%0.28335%0.348SS..SBendtrans-89-21174.6-63.3-172.9000113.1F148 M196 V205F148-L198 HydrophobicContact CE1-CD1 4.24Å; F148-L198 HydrophobicContact CE1-CD2 4.06Å; F148-L198 HydrophobicContact CZ-CD1 4.42Å; M196-L198 HydrophobicContact CE-CD2 3.88Å; M196-L198 HydrophobicContact CG-CD2 4.42Å; M196-L198 HydrophobicContact SD-CD2 4.42Å; L198-V205 HydrophobicContact CB-CG1 4.42Å; L198-V205 HydrophobicContact CD1-CG1 3.59Å; L198-V205 HydrophobicContact CG-CG1 3.64Å; L198-V205 HydrophobicContact CG-CG2 4.31Å
199C72.2Confident86Confident41 Ų4165.1 Ų65.128%0.27736%0.362SS..SBendtrans-140.5161.4-173.6-60.80000110.7L11 S201L11-C199 WeakPolarHBondContact CD2-SG 3.35Å; C199-S201 PolarHBondContact O-N 3.1Å
200G76.1Confident85.9Confident67 Ų6763.9 Ų63.969%0.69136%0.355SS*.THydrogen-bonded Turntrans-67.812.5174.600000115.1G202G200-G202 VanDerWaalsContact C-N 3.29Å
201S77.9Confident85.7Confident24 Ų2465.2 Ų65.217%0.16837%0.366CS..THydrogen-bonded Turntrans-81.2-4.8177.360.70000113.4C199 R203 M283C199-S201 PolarHBondContact O-N 3.1Å; S201-R203 PolarHBondContact O-N 3.04Å; S201-M283 WeakPolarHBondContact O-CE 3.39Å
202G81.1Confident85.4Confident36 Ų3670 Ų7037%0.37140%0.397SS..  trans69.6-1.3-179.200000115.2L197 G200 P204L197-G202 WeakPolarHBondContact CD2-O 3.25Å; G200-G202 VanDerWaalsContact C-N 3.29Å; G202-P204 WeakPolarHBondContact O-CD 3.29Å
203R85.3Confident85.1Confident62 Ų6274 Ų7423%0.23441%0.41CS..PPolyproline II helixtrans-86.2122.2-179.6-61.8-168.2-158.6173.211.9111.7S201 E280S201-R203 PolarHBondContact O-N 3.04Å; R203-E280 VanDerWaalsContact CZ-CG 3.49Å; R203-E280 IonicContact CZ-OE1 3.24Å; R203-E280 IonicContact CZ-OE2 3.51Å; R203-E280 IonicContact NE-OE1 3.41Å; R203-E280 PolarHBondContact NE-OE1 2.76Å; R203-E280 IonicContact NH1-OE1 3.83Å; R203-E280 PolarHBondContact NH1-OE1 3.43Å; R203-E280 IonicContact NH1-OE2 2.64Å; R203-E280 IonicContact NH2-OE1 3.58Å; R203-E280 PolarHBondContact NH2-OE1 3.13Å; R203-E280 IonicContact NH2-OE2 3.23Å; R203-E280 PolarHBondContact NH2-OE2 2Å
204P88.5Confident84.6Confident63 Ų6368.5 Ų68.541%0.40940%0.397SS..BIsolated β-bridgetrans-71.7148174.427.8-31.5000111.8V195 M196 L197 G202V195-P204 HydrophobicContact CG1-CB 3.81Å; V195-P204 HydrophobicContact CG1-CG 4.27Å; M196-P204 WeakPolarHBondContact O-CA 3.3Å; L197-P204 HydrophobicContact CD2-CB 4.31Å; G202-P204 WeakPolarHBondContact O-CD 3.29Å
205V88.4Confident84.2Confident8 Ų874.8 Ų74.85%0.04842%0.415CS..PPolyproline II helixtrans-85.9147169.8-62.40000110.9I5 C8 V191 M196 L198I5-V205 HydrophobicContact CG2-CB 3.81Å; I5-V205 HydrophobicContact CG2-CG1 4.21Å; I5-V205 HydrophobicContact CG2-CG2 4.31Å; C8-V205 WeakPolarHBondContact SG-CG1 3.44Å; V191-V205 HydrophobicContact CG1-CG2 4.01Å; M196-V205 HydrophobicContact CB-CG2 3.94Å; M196-V205 HydrophobicContact CG-CG2 4.03Å; M196-V205 PolarHBondContact O-N 3.5Å; M196-V205 HydrophobicContact SD-CG2 4.3Å; L198-V205 HydrophobicContact CB-CG1 4.42Å; L198-V205 HydrophobicContact CD1-CG1 3.59Å; L198-V205 HydrophobicContact CG-CG1 3.64Å; L198-V205 HydrophobicContact CG-CG2 4.31Å
206V90.3Very high83.7Confident55 Ų5576.6 Ų76.633%0.33342%0.416SS..EExtended strand (participates in β ladder)trans-106137.5174.6178.70000108.5I5 S6 R7 E208I5-V206 CarbonylContact C-O 3.57Å; I5-V206 WeakPolarHBondContact CA-O 3.46Å; S6-V206 PolarHBondContact N-O 2.94Å; S6-V206 PolarHBondContact O-N 2.67Å; S6-V206 VanDerWaalsContact O-N 3.1Å; R7-V206 HydrophobicContact CG-CG2 4.17Å; V206-E208 HydrophobicContact CG1-CG 4.43Å
207C91.8Very high83.6Confident1 Ų180.7 Ų80.71%0.00744%0.439CS..EExtended strand (participates in β ladder)trans-117.6129.8179.5-1710000111.1L3 K4 L188 V191 N192L3-C207 VanDerWaalsContact CD1-SG 3.56Å; K4-C207 WeakPolarHBondContact O-CA 3.48Å; L188-C207 HydrophobicContact CD1-CB 4.04Å; L188-C207 WeakPolarHBondContact CD1-O 3.45Å; V191-C207 HydrophobicContact CB-CB 3.85Å; V191-C207 HydrophobicContact CG1-CB 3.57Å; V191-C207 HydrophobicContact CG2-CB 4.5Å; N192-C207 PolarHBondContact ND2-O 3.21Å; N192-C207 PolarHBondContact OD1-N 3.15Å; N192-C207 PolarHBondContact OD1-O 3.01Å
208E92.5Very high83.7Confident90 Ų9078.3 Ų78.342%0.42144%0.435SS..EExtended strand (participates in β ladder)trans-130.2148.8179.6-69.1171176.900109.6L3 K4 V206 Y210L3-E208 CarbonylContact C-O 3.53Å; L3-E208 WeakPolarHBondContact CA-O 3.48Å; K4-E208 PolarHBondContact N-O 3.14Å; K4-E208 PolarHBondContact O-N 2.6Å; V206-E208 HydrophobicContact CG1-CG 4.43Å; E208-Y210 PolarHBondContact O-N 2.96Å
209P92.3Very high84.2Confident73 Ų7382 Ų8247%0.47445%0.454SS..EExtended strand (participates in β ladder)trans-61.1130.4168.527.5-32.8000109.4M1M1-P209 HydrophobicContact CE-CB 4.17Å
210Y89.1Confident84.7Confident80 Ų8085.5 Ų85.531%0.31446%0.461SS..  trans-83.9120.5176.7177.7-97.4000110L2 K4 I175 E208 P212L2-Y210 HydrophobicContact CB-CD1 3.72Å; L2-Y210 HydrophobicContact CB-CG 4.1Å; L2-Y210 HydrophobicContact CD1-CD1 3.57Å; L2-Y210 HydrophobicContact CD1-CE1 3.89Å; L2-Y210 HydrophobicContact CG-CD1 4.28Å; L2-Y210 PolarHBondContact O-N 3.33Å; K4-Y210 HydrophobicContact CB-CD2 4.25Å; I175-Y210 HydrophobicContact CD1-CD2 4.27Å; I175-Y210 HydrophobicContact CD1-CE2 3.8Å; I175-Y210 HydrophobicContact CG1-CD2 4.34Å; I175-Y210 HydrophobicContact CG1-CE2 4.34Å; E208-Y210 PolarHBondContact O-N 2.96Å; Y210-P212 HydrophobicContact CE1-CB 4.14Å; Y210-P212 WeakPolarHBondContact O-CD 3.49Å
211E86.3Confident85.3Confident153 Ų15386.4 Ų86.472%0.71545%0.448SS*.  trans-89.5110.5172.1-66.4-175170.900109.4K213E211-K213 PolarHBondContact O-N 3.14Å
212P81.9Confident85.9Confident103 Ų10393.7 Ų93.767%0.66947%0.472SS*.  trans-66.8120.1175.528.3-32.2000108.9Y210Y210-P212 HydrophobicContact CE1-CB 4.14Å; Y210-P212 WeakPolarHBondContact O-CD 3.49Å
213K82.2Confident86.2Confident172 Ų17297.4 Ų97.475%0.74848%0.481SS*.  trans-87.4131.2168.9-64-177.8-179.9-178.10107.9E211 E215E211-K213 PolarHBondContact O-N 3.14Å; K213-E215 PolarHBondContact O-N 3.38Å
214D80.7Confident86.4Confident96 Ų9696.5 Ų96.551%0.51348%0.48SS..  trans-79.6110.9173.5176.323.4000109.2E216 D217 G218D214-E216 PolarHBondContact OD1-N 2.87Å; D214-D217 PolarHBondContact OD1-N 3.38Å; D214-D217 WeakPolarHBondContact OD2-CB 3.45Å; D214-G218 PolarHBondContact OD2-N 3.48Å
215E81Confident86.5Confident174 Ų174100.2 Ų100.281%0.81350%0.495SS*.  trans-104.1-7.2177.1-64.3179.3-178.100112K213K213-E215 PolarHBondContact O-N 3.38Å
216E76.7Confident86.5Confident151 Ų151108.7 Ų108.771%0.70653%0.526SS*.SBendtrans-98.9-53.2-173.4-68.1-173.2179.800112D214D214-E216 PolarHBondContact OD1-N 2.87Å
217D82.1Confident86.6Confident105 Ų105110.3 Ų110.356%0.56153%0.533SS*.SBendtrans-87.8-48.1-178.1-68.1-41000110.4D214 W220D214-D217 PolarHBondContact OD1-N 3.38Å; D214-D217 WeakPolarHBondContact OD2-CB 3.45Å; D217-W220 PolarHBondContact O-NE1 3.46Å
218G85.3Confident86.6Confident36 Ų36114.4 Ų114.437%0.37157%0.567SS.*  trans64.6-162.7-175.800000112.4D214 W220D214-G218 PolarHBondContact OD2-N 3.48Å; G218-W220 PolarHBondContact O-N 3.39Å
219L86.8Confident86.6Confident133 Ų133111.9 Ų111.970%0.69656%0.561SS**  trans-96.199.5-178.3-173.265.5000111.7M223 I224L219-M223 HydrophobicContact CD1-CB 4.2Å; L219-I224 HydrophobicContact CD2-CG1 4.1Å; L219-I224 HydrophobicContact CG-CG1 4.06Å
220W83.1Confident86.5Confident113 Ų113110.7 Ų110.743%0.42855%0.548SS..  trans-74.7146.6179.1-66.829.8000111.1D217 G218 R222 M223 I224D217-W220 PolarHBondContact O-NE1 3.46Å; G218-W220 PolarHBondContact O-N 3.39Å; W220-R222 HydrophobicContact CB-CG 4.13Å; W220-R222 VanDerWaalsContact CE3-NE 3.26Å; W220-R222 VanDerWaalsContact CZ3-CZ 3.44Å; W220-R222 PolarHBondContact O-N 3.49Å; W220-R222 VanDerWaalsContact O-N 3.07Å; W220-M223 HydrophobicContact CB-CG 4.38Å; W220-M223 WeakPolarHBondContact O-CA 3.48Å; W220-M223 WeakPolarHBondContact O-CB 3.5Å; W220-M223 PolarHBondContact O-N 3.47Å; W220-I224 PolarHBondContact O-N 3.03Å
221E87.4Confident86.5Confident87 Ų87108.8 Ų108.841%0.40755%0.552SS.*G310 helixtrans-49.7-39.2179.3-174.770.2177.300113.6M223 I224 Y230 R234E221-M223 VanDerWaalsContact C-N 3.27Å; E221-M223 PolarHBondContact O-N 2.7Å; E221-I224 PolarHBondContact O-N 3.23Å; E221-I224 WeakPolarHBondContact OE2-CD1 3.5Å; E221-Y230 PolarHBondContact OE1-OH 2.96Å; E221-R234 IonicContact OE1-CZ 2.7Å; E221-R234 VanDerWaalsContact OE1-CZ 3.25Å; E221-R234 IonicContact OE1-NH1 3.49Å; E221-R234 PolarHBondContact OE1-NH1 2.96Å; E221-R234 IonicContact OE1-NH2 2.94Å; E221-R234 PolarHBondContact OE1-NH2 3.45Å; E221-R234 IonicContact OE2-CZ 3.4Å; E221-R234 IonicContact OE2-NH1 3.25Å; E221-R234 PolarHBondContact OE2-NH1 3.3Å; E221-R234 IonicContact OE2-NH2 2.76Å; E221-R234 PolarHBondContact OE2-NH2 3.07Å
222R90.8Very high86.9Confident177 Ų177109.5 Ų109.567%0.66855%0.548SS*.G310 helixtrans-68.7-21.2178.665.4-177.7174.11780.7114.3W220W220-R222 HydrophobicContact CB-CG 4.13Å; W220-R222 VanDerWaalsContact CE3-NE 3.26Å; W220-R222 VanDerWaalsContact CZ3-CZ 3.44Å; W220-R222 PolarHBondContact O-N 3.49Å; W220-R222 VanDerWaalsContact O-N 3.07Å
223M87.4Confident87.3Confident114 Ų114111.7 Ų111.756%0.56255%0.55SS*.G310 helixtrans-91.5-8.8179.2-63.3-177.4178.500112.4L219 W220 E221 I225L219-M223 HydrophobicContact CD1-CB 4.2Å; W220-M223 HydrophobicContact CB-CG 4.38Å; W220-M223 WeakPolarHBondContact O-CA 3.48Å; W220-M223 WeakPolarHBondContact O-CB 3.5Å; W220-M223 PolarHBondContact O-N 3.47Å; E221-M223 VanDerWaalsContact C-N 3.27Å; E221-M223 PolarHBondContact O-N 2.7Å; M223-I225 PolarHBondContact O-N 3.46Å
224I89.1Confident87.7Confident42 Ų42109.4 Ų109.422%0.21554%0.536CS..SBendtrans-72.6128.7179.9-55.7177000110L219 W220 E221 R226 Y230L219-I224 HydrophobicContact CD2-CG1 4.1Å; L219-I224 HydrophobicContact CG-CG1 4.06Å; W220-I224 PolarHBondContact O-N 3.03Å; E221-I224 PolarHBondContact O-N 3.23Å; E221-I224 WeakPolarHBondContact OE2-CD1 3.5Å; I224-R226 PolarHBondContact O-N 3.38Å; I224-Y230 HydrophobicContact CB-CE2 4.26Å; I224-Y230 HydrophobicContact CD1-CE2 4.31Å; I224-Y230 HydrophobicContact CG2-CD2 3.52Å; I224-Y230 HydrophobicContact CG2-CE2 3.64Å
225I90.4Very high88.2Confident141 Ų141112.2 Ų112.272%0.72355%0.546SS*.  trans-69.3114174.8-60.2171.1000108.9M223 N227M223-I225 PolarHBondContact O-N 3.46Å; I225-N227 PolarHBondContact O-N 2.86Å
226R89.9Confident88.6Confident186 Ų186108 Ų10870%0.70253%0.532SS*.  trans-80.981.7179.8-61.1-179.5-177.2-177.1-0.5110.7I224 Y230I224-R226 PolarHBondContact O-N 3.38Å; R226-Y230 HydrophobicContact CB-CD1 4.32Å; R226-Y230 HydrophobicContact CG-CD1 4.23Å; R226-Y230 HydrophobicContact CG-CE1 4.14Å
227N91.7Very high89.4Confident90 Ų90107.5 Ų107.548%0.48153%0.534SS..  trans-95.8176.1171.865.616.5000111.5I225 A229 Y230 G231I225-N227 PolarHBondContact O-N 2.86Å; N227-A229 PolarHBondContact O-N 2.86Å; N227-A229 WeakPolarHBondContact OD1-CB 3.47Å; N227-A229 PolarHBondContact OD1-N 2.88Å; N227-Y230 WeakPolarHBondContact O-CB 3.39Å; N227-Y230 PolarHBondContact O-N 3.22Å; N227-Y230 WeakPolarHBondContact OD1-CB 3.39Å; N227-Y230 PolarHBondContact OD1-N 2.88Å; N227-G231 PolarHBondContact O-N 3.36Å
228A92Very high90.1Very high86 Ų86108.9 Ų108.971%0.71155%0.549SS*.Hα-helixtrans-60.2-32.4178.400000112.8G231 R232A228-G231 PolarHBondContact O-N 3.35Å; A228-R232 WeakPolarHBondContact O-CG 3.44Å; A228-R232 PolarHBondContact O-N 2.77Å; A228-R232 VanDerWaalsContact O-N 3.14Å
229A91.4Very high90.5Very high37 Ų37112.1 Ų112.131%0.30655%0.554SS.*Hα-helixtrans-64.9-44176.200000111.6N227 G231 R232 E233N227-A229 PolarHBondContact O-N 2.86Å; N227-A229 WeakPolarHBondContact OD1-CB 3.47Å; N227-A229 PolarHBondContact OD1-N 2.88Å; A229-G231 PolarHBondContact O-N 3.25Å; A229-R232 PolarHBondContact O-N 3.16Å; A229-E233 WeakPolarHBondContact O-CG 3.43Å; A229-E233 PolarHBondContact O-N 3.15Å
230Y91.4Very high91Very high49 Ų49115.5 Ų115.519%0.19256%0.563CS.*Hα-helixtrans-53.9-42.2174.3172.2-87.6000112.1E221 I224 R226 N227 R234E221-Y230 PolarHBondContact OE1-OH 2.96Å; I224-Y230 HydrophobicContact CB-CE2 4.26Å; I224-Y230 HydrophobicContact CD1-CE2 4.31Å; I224-Y230 HydrophobicContact CG2-CD2 3.52Å; I224-Y230 HydrophobicContact CG2-CE2 3.64Å; R226-Y230 HydrophobicContact CB-CD1 4.32Å; R226-Y230 HydrophobicContact CG-CD1 4.23Å; R226-Y230 HydrophobicContact CG-CE1 4.14Å; N227-Y230 WeakPolarHBondContact O-CB 3.39Å; N227-Y230 PolarHBondContact O-N 3.22Å; N227-Y230 WeakPolarHBondContact OD1-CB 3.39Å; N227-Y230 PolarHBondContact OD1-N 2.88Å; Y230-R234 PolarHBondContact OH-NE 3.06Å; Y230-R234 PolarHBondContact OH-NH1 2.92Å
231G89.7Confident91.6Very high40 Ų40111.5 Ų111.541%0.41255%0.554SS.*Hα-helixtrans-66-38.9176.100000113.5N227 A228 A229 Q235N227-G231 PolarHBondContact O-N 3.36Å; A228-G231 PolarHBondContact O-N 3.35Å; A229-G231 PolarHBondContact O-N 3.25Å; G231-Q235 WeakPolarHBondContact O-CG 3.4Å
232R93.1Very high92Very high167 Ų167110.7 Ų110.763%0.6356%0.557SS**Hα-helixtrans-70-47.9179.5-70.7-170.8-57.7178.94112.7A228 A229 R234 Q235A228-R232 WeakPolarHBondContact O-CG 3.44Å; A228-R232 PolarHBondContact O-N 2.77Å; A228-R232 VanDerWaalsContact O-N 3.14Å; A229-R232 PolarHBondContact O-N 3.16Å; R232-R234 PolarHBondContact O-N 3.01Å; R232-Q235 WeakPolarHBondContact O-CG 3.46Å; R232-Q235 PolarHBondContact O-N 3.38Å
233E90.7Very high92.3Very high149 Ų149107.4 Ų107.470%0.69656%0.558SS**Hα-helixtrans-62.5-25.3-177.4-65.9-62.9144.500112.7A229A229-E233 WeakPolarHBondContact O-CG 3.43Å; A229-E233 PolarHBondContact O-N 3.15Å
234R91.4Very high92.6Very high124 Ų124105.4 Ų105.447%0.46857%0.567SS.*THydrogen-bonded Turntrans-95.33.5-178.4-68.5-170.7171.8-137.57.8115.1E221 Y230 R232 V236E221-R234 IonicContact OE1-CZ 2.7Å; E221-R234 VanDerWaalsContact OE1-CZ 3.25Å; E221-R234 IonicContact OE1-NH1 3.49Å; E221-R234 PolarHBondContact OE1-NH1 2.96Å; E221-R234 IonicContact OE1-NH2 2.94Å; E221-R234 PolarHBondContact OE1-NH2 3.45Å; E221-R234 IonicContact OE2-CZ 3.4Å; E221-R234 IonicContact OE2-NH1 3.25Å; E221-R234 PolarHBondContact OE2-NH1 3.3Å; E221-R234 IonicContact OE2-NH2 2.76Å; E221-R234 PolarHBondContact OE2-NH2 3.07Å; Y230-R234 PolarHBondContact OH-NE 3.06Å; Y230-R234 PolarHBondContact OH-NH1 2.92Å; R232-R234 PolarHBondContact O-N 3.01Å; R234-V236 PolarHBondContact O-N 3.23Å
235Q91.1Very high93Very high155 Ų155105.7 Ų105.772%0.72457%0.57SS**SBendtrans-65.3-29.4173.6-65.9179.86.600111.5G231 R232G231-Q235 WeakPolarHBondContact O-CG 3.4Å; R232-Q235 WeakPolarHBondContact O-CG 3.46Å; R232-Q235 PolarHBondContact O-N 3.38Å
236V89.9Confident93.2Very high85 Ų85106 Ų10652%0.51557%0.567SS.*SBendtrans-107.4125.2180-1780000108.9R234 H239R234-V236 PolarHBondContact O-N 3.23Å; V236-H239 WeakPolarHBondContact CG1-CE1 3.33Å; V236-H239 WeakPolarHBondContact CG1-ND1 3.36Å
237L92.7Very high93.5Very high141 Ų141102 Ų10274%0.73856%0.556SS**  trans-74.9158.9175.2-68.2174.7000110.8H239L237-H239 PolarHBondContact O-N 3.46Å; L237-H239 VanDerWaalsContact O-N 3.13Å; L237-H239 PolarHBondContact O-ND1 3.44Å
238P96.2Very high93.8Very high135 Ų135100.7 Ų100.788%0.87755%0.546SS*.SBendtrans-53.5120.1172.3-25.234.7000111.2
239H94.1Very high94.1Very high103 Ų103100.6 Ų100.648%0.47753%0.534SS..  trans-150.2164.5-177.874-75.2000111.1V236 L237 E247V236-H239 WeakPolarHBondContact CG1-CE1 3.33Å; V236-H239 WeakPolarHBondContact CG1-ND1 3.36Å; L237-H239 PolarHBondContact O-N 3.46Å; L237-H239 VanDerWaalsContact O-N 3.13Å; L237-H239 PolarHBondContact O-ND1 3.44Å; H239-E247 IonicContact CE1-OE2 3.36Å; H239-E247 PolarHBondContact CE1-OE2 2.86Å; H239-E247 IonicContact NE2-OE2 3.46Å; H239-E247 PolarHBondContact NE2-OE2 3.23Å
240F96.7Very high94.4Very high204 Ų204102.8 Ų102.890%0.89554%0.537SS*.PPolyproline II helixtrans-91.3125.4169.6-70.3-78.3000109.5P242F240-P242 WeakPolarHBondContact O-CD 3.18Å
241A96.1Very high94.7Very high29 Ų29102 Ų10224%0.2454%0.543CS..PPolyproline II helixtrans-61.8124.617600000110.5E247 F248A241-E247 HydrophobicContact CB-CB 4.08Å; A241-F248 HydrophobicContact CB-CB 3.92Å; A241-F248 HydrophobicContact CB-CD2 4.38Å; A241-F248 VanDerWaalsContact O-CD2 3.3Å; A241-F248 WeakPolarHBondContact O-CD2 3.28Å
242P95.7Very high95Very high70 Ų70103.3 Ų103.346%0.45554%0.538SS..PPolyproline II helixtrans-66.4143.5177-20.932.3000112.1F240 G244 T245 F248F240-P242 WeakPolarHBondContact O-CD 3.18Å; P242-G244 PolarHBondContact O-N 2.89Å; P242-T245 HydrophobicContact CB-CG2 4Å; P242-T245 HydrophobicContact CG-CG2 4.22Å; P242-T245 WeakPolarHBondContact O-CB 3.2Å; P242-T245 WeakPolarHBondContact O-CG2 3Å; P242-T245 PolarHBondContact O-N 2.97Å; P242-T245 PolarHBondContact O-OG1 2.89Å; P242-F248 VanDerWaalsContact O-CB 3.27Å; P242-F248 WeakPolarHBondContact O-CB 3.41Å
243P96.6Very high95.3Very high109 Ų109102.7 Ų102.771%0.70854%0.536SS*.THydrogen-bonded Turntrans-55.6137174.2-24.434.2000112F248P243-F248 HydrophobicContact CG-CE2 4.44Å
244G95.2Very high95.6Very high71 Ų71102.2 Ų102.273%0.73253%0.528SS*.THydrogen-bonded Turntrans87.30.7-177.600000115.1P242P242-G244 PolarHBondContact O-N 2.89Å
245T96.6Very high95.9Very high48 Ų48102.7 Ų102.729%0.29453%0.533SS..SBendtrans-87.6152.5171.262.10000111.8P242 E247 F248 D249P242-T245 HydrophobicContact CB-CG2 4Å; P242-T245 HydrophobicContact CG-CG2 4.22Å; P242-T245 WeakPolarHBondContact O-CB 3.2Å; P242-T245 WeakPolarHBondContact O-CG2 3Å; P242-T245 PolarHBondContact O-N 2.97Å; P242-T245 PolarHBondContact O-OG1 2.89Å; T245-E247 PolarHBondContact O-N 2.74Å; T245-F248 WeakPolarHBondContact O-CB 3.44Å; T245-F248 PolarHBondContact O-N 3Å; T245-F248 VanDerWaalsContact O-N 3.09Å; T245-F248 WeakPolarHBondContact OG1-CB 3.38Å; T245-F248 PolarHBondContact OG1-N 3.29Å; T245-D249 PolarHBondContact O-N 2.75Å; T245-D249 VanDerWaalsContact O-N 3.09Å
246F96Very high96.2Very high148 Ų148101.3 Ų101.365%0.64953%0.527SS*.Hα-helixtrans-54-41173.6174.5-90.7000112.2F248 D249 F250F246-F248 VanDerWaalsContact C-N 3.35Å; F246-F248 PolarHBondContact O-N 2.76Å; F246-D249 PolarHBondContact O-N 3.48Å; F246-F250 HydrophobicContact CD1-CD2 4.21Å; F246-F250 AromaticContact CD2-CD2 3.93Å; F246-F250 HydrophobicContact CD2-CD2 3.93Å; F246-F250 AromaticContact CD2-CE2 3.83Å; F246-F250 HydrophobicContact CD2-CE2 3.83Å; F246-F250 AromaticContact CE1-CD2 3.83Å; F246-F250 HydrophobicContact CE1-CD2 3.83Å; F246-F250 HydrophobicContact CE1-CE2 4.14Å; F246-F250 HydrophobicContact CE1-CG 4.41Å; F246-F250 AromaticContact CE2-CD2 3.55Å; F246-F250 HydrophobicContact CE2-CD2 3.55Å; F246-F250 AromaticContact CE2-CE2 3.13Å; F246-F250 HydrophobicContact CE2-CE2 3.13Å; F246-F250 HydrophobicContact CE2-CZ 4.02Å; F246-F250 HydrophobicContact CG-CD2 4.26Å; F246-F250 AromaticContact CZ-CD2 3.48Å; F246-F250 HydrophobicContact CZ-CD2 3.48Å; F246-F250 VanDerWaalsContact CZ-CD2 3.48Å; F246-F250 AromaticContact CZ-CE2 3.31Å; F246-F250 HydrophobicContact CZ-CE2 3.31Å; F246-F250 HydrophobicContact CZ-CG 4.28Å; F246-F250 AromaticContact CZ-CZ 3.96Å; F246-F250 HydrophobicContact CZ-CZ 3.96Å; F246-F250 PolarHBondContact O-N 3.05Å
247E95.9Very high96.6Very high102 Ų102101.9 Ų101.948%0.47753%0.526SS..Hα-helixtrans-64.6-38.6178.5-63.3-177.2-17700112.1H239 A241 T245 G251H239-E247 IonicContact CE1-OE2 3.36Å; H239-E247 PolarHBondContact CE1-OE2 2.86Å; H239-E247 IonicContact NE2-OE2 3.46Å; H239-E247 PolarHBondContact NE2-OE2 3.23Å; A241-E247 HydrophobicContact CB-CB 4.08Å; T245-E247 PolarHBondContact O-N 2.74Å; E247-G251 WeakPolarHBondContact O-CA 3.33Å; E247-G251 PolarHBondContact O-N 2.87Å
248F97.8Very high96.8Very high63 Ų63101.3 Ų101.328%0.27652%0.515SS..Hα-helixtrans-65.6-45.5175.5-176.4-92.4000111.3A241 P242 P243 T245 F246 F250 G251 Q252A241-F248 HydrophobicContact CB-CB 3.92Å; A241-F248 HydrophobicContact CB-CD2 4.38Å; A241-F248 VanDerWaalsContact O-CD2 3.3Å; A241-F248 WeakPolarHBondContact O-CD2 3.28Å; P242-F248 VanDerWaalsContact O-CB 3.27Å; P242-F248 WeakPolarHBondContact O-CB 3.41Å; P243-F248 HydrophobicContact CG-CE2 4.44Å; T245-F248 WeakPolarHBondContact O-CB 3.44Å; T245-F248 PolarHBondContact O-N 3Å; T245-F248 VanDerWaalsContact O-N 3.09Å; T245-F248 WeakPolarHBondContact OG1-CB 3.38Å; T245-F248 PolarHBondContact OG1-N 3.29Å; F246-F248 VanDerWaalsContact C-N 3.35Å; F246-F248 PolarHBondContact O-N 2.76Å; F248-F250 PolarHBondContact O-N 2.83Å; F248-G251 PolarHBondContact O-N 3.47Å; F248-Q252 HydrophobicContact CD1-CG 4.06Å; F248-Q252 HydrophobicContact CE1-CG 3.74Å; F248-Q252 HydrophobicContact CZ-CG 4.04Å; F248-Q252 VanDerWaalsContact CZ-NE2 3.31Å; F248-Q252 VanDerWaalsContact O-CG 3.31Å; F248-Q252 WeakPolarHBondContact O-CG 3.48Å; F248-Q252 PolarHBondContact O-N 2.78Å
249D97.6Very high96.9Very high83 Ų8399.1 Ų99.144%0.44449%0.493SS..Hα-helixtrans-62.5-45.6-179.5-71.1-13.1000112T245 F246 Q252 R253T245-D249 PolarHBondContact O-N 2.75Å; T245-D249 VanDerWaalsContact O-N 3.09Å; F246-D249 PolarHBondContact O-N 3.48Å; D249-Q252 PolarHBondContact O-N 2.76Å; D249-R253 WeakPolarHBondContact O-CG 3.11Å; D249-R253 PolarHBondContact O-N 2.82Å; D249-R253 VanDerWaalsContact O-N 3.16Å
250F97.8Very high97.1Very high84 Ų8497.2 Ų97.237%0.36849%0.489SS..Hα-helixtrans-69.6-38.9174.9-87.3-93000112F246 F248 Q252 R253 W254F246-F250 HydrophobicContact CD1-CD2 4.21Å; F246-F250 AromaticContact CD2-CD2 3.93Å; F246-F250 HydrophobicContact CD2-CD2 3.93Å; F246-F250 AromaticContact CD2-CE2 3.83Å; F246-F250 HydrophobicContact CD2-CE2 3.83Å; F246-F250 AromaticContact CE1-CD2 3.83Å; F246-F250 HydrophobicContact CE1-CD2 3.83Å; F246-F250 HydrophobicContact CE1-CE2 4.14Å; F246-F250 HydrophobicContact CE1-CG 4.41Å; F246-F250 AromaticContact CE2-CD2 3.55Å; F246-F250 HydrophobicContact CE2-CD2 3.55Å; F246-F250 AromaticContact CE2-CE2 3.13Å; F246-F250 HydrophobicContact CE2-CE2 3.13Å; F246-F250 HydrophobicContact CE2-CZ 4.02Å; F246-F250 HydrophobicContact CG-CD2 4.26Å; F246-F250 AromaticContact CZ-CD2 3.48Å; F246-F250 HydrophobicContact CZ-CD2 3.48Å; F246-F250 VanDerWaalsContact CZ-CD2 3.48Å; F246-F250 AromaticContact CZ-CE2 3.31Å; F246-F250 HydrophobicContact CZ-CE2 3.31Å; F246-F250 HydrophobicContact CZ-CG 4.28Å; F246-F250 AromaticContact CZ-CZ 3.96Å; F246-F250 HydrophobicContact CZ-CZ 3.96Å; F246-F250 PolarHBondContact O-N 3.05Å; F248-F250 PolarHBondContact O-N 2.83Å; F250-Q252 VanDerWaalsContact C-N 3.26Å; F250-Q252 PolarHBondContact O-N 3.02Å; F250-R253 PolarHBondContact O-N 2.83Å; F250-R253 VanDerWaalsContact O-N 3.12Å; F250-W254 PolarHBondContact O-N 2.96Å
251G97.2Very high97.1Very high31 Ų3191.3 Ų91.332%0.3246%0.464SS..Hα-helixtrans-57.8-38.8173.900000112.5E247 F248 W254 K255E247-G251 WeakPolarHBondContact O-CA 3.33Å; E247-G251 PolarHBondContact O-N 2.87Å; F248-G251 PolarHBondContact O-N 3.47Å; G251-W254 PolarHBondContact O-N 2.67Å; G251-K255 WeakPolarHBondContact O-CG 3.2Å; G251-K255 PolarHBondContact O-N 2.72Å
252Q97.4Very high97.2Very high69 Ų6995.1 Ų95.132%0.32248%0.475SS..Hα-helixtrans-66.8-42.3173.5-71.4-64.1-20.100112.1F248 D249 F250 W254 K255 Q256F248-Q252 HydrophobicContact CD1-CG 4.06Å; F248-Q252 HydrophobicContact CE1-CG 3.74Å; F248-Q252 HydrophobicContact CZ-CG 4.04Å; F248-Q252 VanDerWaalsContact CZ-NE2 3.31Å; F248-Q252 VanDerWaalsContact O-CG 3.31Å; F248-Q252 WeakPolarHBondContact O-CG 3.48Å; F248-Q252 PolarHBondContact O-N 2.78Å; D249-Q252 PolarHBondContact O-N 2.76Å; F250-Q252 VanDerWaalsContact C-N 3.26Å; F250-Q252 PolarHBondContact O-N 3.02Å; Q252-W254 VanDerWaalsContact C-N 3.34Å; Q252-W254 PolarHBondContact O-N 2.84Å; Q252-K255 WeakPolarHBondContact O-CB 3.44Å; Q252-K255 PolarHBondContact O-N 3.34Å; Q252-Q256 WeakPolarHBondContact O-CG 3.44Å; Q252-Q256 PolarHBondContact O-N 2.76Å
253R97.8Very high97.3Very high153 Ų15396.8 Ų96.858%0.57748%0.477SS*.Hα-helixtrans-62.4-39.6174.5-67.5177-172.5-172.32.3112.3D249 F250 Q256 L257D249-R253 WeakPolarHBondContact O-CG 3.11Å; D249-R253 PolarHBondContact O-N 2.82Å; D249-R253 VanDerWaalsContact O-N 3.16Å; F250-R253 PolarHBondContact O-N 2.83Å; F250-R253 VanDerWaalsContact O-N 3.12Å; R253-Q256 WeakPolarHBondContact O-CB 3.26Å; R253-Q256 PolarHBondContact O-N 2.92Å; R253-L257 PolarHBondContact O-N 3.31Å
254W98.2Very high97.3Very high139 Ų13998.7 Ų98.753%0.52747%0.474SS..Hα-helixtrans-62.4-43172.8-83.9104.8000112F250 G251 Q252 Q256 L257 Y258F250-W254 PolarHBondContact O-N 2.96Å; G251-W254 PolarHBondContact O-N 2.67Å; Q252-W254 VanDerWaalsContact C-N 3.34Å; Q252-W254 PolarHBondContact O-N 2.84Å; W254-Q256 VanDerWaalsContact C-N 3.35Å; W254-Q256 PolarHBondContact O-N 3.32Å; W254-L257 HydrophobicContact CE3-CD2 4.15Å; W254-L257 HydrophobicContact CZ3-CD2 4.14Å; W254-L257 WeakPolarHBondContact O-CB 3.38Å; W254-L257 PolarHBondContact O-N 3.47Å; W254-L257 VanDerWaalsContact O-N 3.17Å; W254-Y258 HydrophobicContact CB-CE2 4.4Å; W254-Y258 HydrophobicContact CE3-CE1 4.01Å; W254-Y258 AromaticContact CE3-CZ 3.86Å; W254-Y258 HydrophobicContact CZ3-CE1 4.41Å; W254-Y258 WeakPolarHBondContact O-CD2 3.47Å; W254-Y258 PolarHBondContact O-N 3.24Å
255K97.7Very high97.4Very high134 Ų134102.9 Ų102.958%0.58347%0.468SS*.Hα-helixtrans-60.7-42.4173.7-75.4-179.5177.2-177.40112.3G251 Q252 L257 Y258 E259G251-K255 WeakPolarHBondContact O-CG 3.2Å; G251-K255 PolarHBondContact O-N 2.72Å; Q252-K255 WeakPolarHBondContact O-CB 3.44Å; Q252-K255 PolarHBondContact O-N 3.34Å; K255-L257 VanDerWaalsContact C-N 3.3Å; K255-L257 PolarHBondContact O-N 3.47Å; K255-Y258 PolarHBondContact O-N 2.98Å; K255-E259 PolarHBondContact O-N 3.41Å
256Q97.5Very high97.4Very high126 Ų126104.9 Ų104.959%0.58947%0.474SS*.Hα-helixtrans-60.4-40.7174.2-70.2169.75.900111.4Q252 R253 W254 E259 V260Q252-Q256 WeakPolarHBondContact O-CG 3.44Å; Q252-Q256 PolarHBondContact O-N 2.76Å; R253-Q256 WeakPolarHBondContact O-CB 3.26Å; R253-Q256 PolarHBondContact O-N 2.92Å; W254-Q256 VanDerWaalsContact C-N 3.35Å; W254-Q256 PolarHBondContact O-N 3.32Å; Q256-E259 PolarHBondContact O-N 3.43Å; Q256-V260 WeakPolarHBondContact O-CG2 3.38Å; Q256-V260 PolarHBondContact O-N 3.36Å
257L97.8Very high97.5Very high97 Ų97102.4 Ų102.451%0.50846%0.464SS..Hα-helixtrans-63.6-43.9176.2-176.963.8000112.2R253 W254 K255 E259 V260 E261R253-L257 PolarHBondContact O-N 3.31Å; W254-L257 HydrophobicContact CE3-CD2 4.15Å; W254-L257 HydrophobicContact CZ3-CD2 4.14Å; W254-L257 WeakPolarHBondContact O-CB 3.38Å; W254-L257 PolarHBondContact O-N 3.47Å; W254-L257 VanDerWaalsContact O-N 3.17Å; K255-L257 VanDerWaalsContact C-N 3.3Å; K255-L257 PolarHBondContact O-N 3.47Å; L257-E259 VanDerWaalsContact C-N 3.3Å; L257-E259 PolarHBondContact O-N 2.95Å; L257-V260 PolarHBondContact O-N 2.99Å; L257-E261 WeakPolarHBondContact O-CB 3.4Å; L257-E261 PolarHBondContact O-N 2.91Å
258Y97.7Very high97.5Very high129 Ų129101.9 Ų101.951%0.50647%0.465SS..Hα-helixtrans-63-36.3176.4-62.1-35.5000112.6W254 K255 E261 K262W254-Y258 HydrophobicContact CB-CE2 4.4Å; W254-Y258 HydrophobicContact CE3-CE1 4.01Å; W254-Y258 AromaticContact CE3-CZ 3.86Å; W254-Y258 HydrophobicContact CZ3-CE1 4.41Å; W254-Y258 WeakPolarHBondContact O-CD2 3.47Å; W254-Y258 PolarHBondContact O-N 3.24Å; K255-Y258 PolarHBondContact O-N 2.98Å; Y258-E261 PolarHBondContact O-N 3.39Å; Y258-K262 WeakPolarHBondContact O-CB 3.47Å; Y258-K262 PolarHBondContact O-N 3.41Å
259E97.7Very high97.4Very high89 Ų89104 Ų10442%0.41648%0.479SS..Hα-helixtrans-66.5-44175.7-173.655.5-145.800111.2K255 Q256 L257 E261 K262 Q263K255-E259 PolarHBondContact O-N 3.41Å; Q256-E259 PolarHBondContact O-N 3.43Å; L257-E259 VanDerWaalsContact C-N 3.3Å; L257-E259 PolarHBondContact O-N 2.95Å; E259-E261 VanDerWaalsContact C-N 3.33Å; E259-E261 PolarHBondContact O-N 3.32Å; E259-K262 PolarHBondContact O-N 3.01Å; E259-Q263 VanDerWaalsContact O-CG 3.29Å; E259-Q263 WeakPolarHBondContact O-CG 3.48Å; E259-Q263 PolarHBondContact O-N 3.4Å; E259-Q263 PolarHBondContact OE1-NE2 3.42Å; E259-Q263 VanDerWaalsContact OE1-NE2 3.09Å
260V97.5Very high97.3Very high63 Ų63105.7 Ų105.738%0.38248%0.482SS..Hα-helixtrans-62-41.1173.8172.10000111.5Q256 L257 Q263 K264Q256-V260 WeakPolarHBondContact O-CG2 3.38Å; Q256-V260 PolarHBondContact O-N 3.36Å; L257-V260 PolarHBondContact O-N 2.99Å; V260-Q263 PolarHBondContact O-N 3.24Å; V260-K264 HydrophobicContact CG1-CD 4.23Å; V260-K264 WeakPolarHBondContact O-CB 3.42Å; V260-K264 WeakPolarHBondContact O-CG 3.4Å; V260-K264 PolarHBondContact O-N 2.79Å
261E97.5Very high97.3Very high81 Ų81106.4 Ų106.438%0.37949%0.486SS..Hα-helixtrans-61.6-46.8176.3-179.3178-168.800111.5L257 Y258 E259 K264 R265L257-E261 WeakPolarHBondContact O-CB 3.4Å; L257-E261 PolarHBondContact O-N 2.91Å; Y258-E261 PolarHBondContact O-N 3.39Å; E259-E261 VanDerWaalsContact C-N 3.33Å; E259-E261 PolarHBondContact O-N 3.32Å; E261-K264 PolarHBondContact O-N 3.24Å; E261-R265 WeakPolarHBondContact O-CG 3.08Å; E261-R265 PolarHBondContact O-N 2.84Å; E261-R265 IonicContact OE1-CZ 3.66Å; E261-R265 VanDerWaalsContact OE1-CZ 3.23Å; E261-R265 IonicContact OE1-NE 3.56Å; E261-R265 PolarHBondContact OE1-NE 2.86Å; E261-R265 IonicContact OE1-NH2 2.87Å; E261-R265 PolarHBondContact OE1-NH2 2.76Å
262K97.7Very high97.1Very high108 Ų108108.4 Ų108.447%0.4749%0.49SS..Hα-helixtrans-58.9-49.2176.7-178.7-176.5170.5-167.80111.2Y258 E259 K264 R265 E266Y258-K262 WeakPolarHBondContact O-CB 3.47Å; Y258-K262 PolarHBondContact O-N 3.41Å; E259-K262 PolarHBondContact O-N 3.01Å; K262-K264 VanDerWaalsContact C-N 3.35Å; K262-K264 PolarHBondContact O-N 2.73Å; K262-R265 PolarHBondContact O-N 2.86Å; K262-E266 WeakPolarHBondContact CE-OE1 3.4Å; K262-E266 WeakPolarHBondContact O-CG 2.97Å; K262-E266 PolarHBondContact O-N 3.37Å
263Q97.4Very high96.9Very high105 Ų105107.4 Ų107.449%0.49149%0.493SS..Hα-helixtrans-59.1-43.9178.3-72.4173.19.400112.2E259 V260 E266 Q267E259-Q263 VanDerWaalsContact O-CG 3.29Å; E259-Q263 WeakPolarHBondContact O-CG 3.48Å; E259-Q263 PolarHBondContact O-N 3.4Å; E259-Q263 PolarHBondContact OE1-NE2 3.42Å; E259-Q263 VanDerWaalsContact OE1-NE2 3.09Å; V260-Q263 PolarHBondContact O-N 3.24Å; Q263-E266 PolarHBondContact O-N 3Å; Q263-Q267 VanDerWaalsContact O-CB 3.28Å; Q263-Q267 WeakPolarHBondContact O-CB 3.35Å; Q263-Q267 PolarHBondContact O-N 2.7Å
264K97.6Very high96.8Very high150 Ų150106.3 Ų106.365%0.65249%0.494SS*.Hα-helixtrans-65.1-40.4177.4-75.7-178.1178.2-1780112.8V260 E261 K262 L268V260-K264 HydrophobicContact CG1-CD 4.23Å; V260-K264 WeakPolarHBondContact O-CB 3.42Å; V260-K264 WeakPolarHBondContact O-CG 3.4Å; V260-K264 PolarHBondContact O-N 2.79Å; E261-K264 PolarHBondContact O-N 3.24Å; K262-K264 VanDerWaalsContact C-N 3.35Å; K262-K264 PolarHBondContact O-N 2.73Å; K264-L268 WeakPolarHBondContact O-CB 3.43Å; K264-L268 PolarHBondContact O-N 2.86Å
265R96.8Very high96.7Very high158 Ų158102.6 Ų102.660%0.59649%0.493SS*.Hα-helixtrans-64.7-46.3176.2-73179.4-177.9-164.72.8111.4E261 K262 Q267 L268 D269E261-R265 WeakPolarHBondContact O-CG 3.08Å; E261-R265 PolarHBondContact O-N 2.84Å; E261-R265 IonicContact OE1-CZ 3.66Å; E261-R265 VanDerWaalsContact OE1-CZ 3.23Å; E261-R265 IonicContact OE1-NE 3.56Å; E261-R265 PolarHBondContact OE1-NE 2.86Å; E261-R265 IonicContact OE1-NH2 2.87Å; E261-R265 PolarHBondContact OE1-NH2 2.76Å; K262-R265 PolarHBondContact O-N 2.86Å; R265-Q267 VanDerWaalsContact C-N 3.34Å; R265-Q267 PolarHBondContact O-N 3.22Å; R265-L268 PolarHBondContact O-N 3Å; R265-D269 WeakPolarHBondContact O-CB 3.29Å; R265-D269 PolarHBondContact O-N 2.64Å
266E96.7Very high96.3Very high90 Ų90101.1 Ų101.142%0.42148%0.484SS..Hα-helixtrans-63-39.9177.2-72.1176.8-177.100112.3K262 Q263 D269 K270K262-E266 WeakPolarHBondContact CE-OE1 3.4Å; K262-E266 WeakPolarHBondContact O-CG 2.97Å; K262-E266 PolarHBondContact O-N 3.37Å; Q263-E266 PolarHBondContact O-N 3Å; E266-D269 PolarHBondContact O-N 3.36Å; E266-K270 WeakPolarHBondContact O-CG 3.28Å; E266-K270 PolarHBondContact O-N 3.32Å
267Q97.3Very high96Very high96 Ų96100.2 Ų100.245%0.44948%0.481SS..Hα-helixtrans-62.8-47.9174.8-17959.729.100111.3Q263 R265 D269 K270 E271Q263-Q267 VanDerWaalsContact O-CB 3.28Å; Q263-Q267 WeakPolarHBondContact O-CB 3.35Å; Q263-Q267 PolarHBondContact O-N 2.7Å; R265-Q267 VanDerWaalsContact C-N 3.34Å; R265-Q267 PolarHBondContact O-N 3.22Å; Q267-D269 VanDerWaalsContact C-N 3.33Å; Q267-D269 PolarHBondContact O-N 2.91Å; Q267-K270 WeakPolarHBondContact O-CB 3.38Å; Q267-K270 PolarHBondContact O-N 3.4Å; Q267-E271 WeakPolarHBondContact CG-OE1 3.14Å; Q267-E271 PolarHBondContact NE2-OE1 3.43Å; Q267-E271 WeakPolarHBondContact O-CG 3.03Å; Q267-E271 PolarHBondContact O-N 2.88Å
268L97.2Very high95.9Very high92 Ų9298.3 Ų98.348%0.48248%0.475SS..Hα-helixtrans-62.1-40.4177.2-177.763.9000111.9K264 R265 K270 E271 L272K264-L268 WeakPolarHBondContact O-CB 3.43Å; K264-L268 PolarHBondContact O-N 2.86Å; R265-L268 PolarHBondContact O-N 3Å; L268-K270 VanDerWaalsContact C-N 3.32Å; L268-K270 PolarHBondContact O-N 3.45Å; L268-E271 PolarHBondContact O-N 2.94Å; L268-L272 HydrophobicContact CD1-CD1 4.33Å; L268-L272 HydrophobicContact CD1-CG 4.29Å; L268-L272 HydrophobicContact CG-CD1 4.04Å; L268-L272 HydrophobicContact CG-CG 4.41Å; L268-L272 WeakPolarHBondContact O-CB 3.46Å; L268-L272 VanDerWaalsContact O-CG 3.25Å; L268-L272 WeakPolarHBondContact O-CG 3.31Å; L268-L272 PolarHBondContact O-N 3.35Å
269D95.1Very high95.7Very high107 Ų10797.6 Ų97.657%0.57248%0.48SS*.Hα-helixtrans-63.4-37.8177.1-79.1-26.9000112R265 E266 Q267 A273R265-D269 WeakPolarHBondContact O-CB 3.29Å; R265-D269 PolarHBondContact O-N 2.64Å; E266-D269 PolarHBondContact O-N 3.36Å; Q267-D269 VanDerWaalsContact C-N 3.33Å; Q267-D269 PolarHBondContact O-N 2.91Å; D269-A273 VanDerWaalsContact O-CB 3.29Å; D269-A273 WeakPolarHBondContact O-CB 3.23Å; D269-A273 PolarHBondContact O-N 2.92Å
270K96.1Very high95.3Very high119 Ų11996.1 Ų96.152%0.51747%0.473SS..Hα-helixtrans-64.9-49.8173.5-71.8170.6-173173.50111.6E266 Q267 L268 L272 A273 E274E266-K270 WeakPolarHBondContact O-CG 3.28Å; E266-K270 PolarHBondContact O-N 3.32Å; Q267-K270 WeakPolarHBondContact O-CB 3.38Å; Q267-K270 PolarHBondContact O-N 3.4Å; L268-K270 VanDerWaalsContact C-N 3.32Å; L268-K270 PolarHBondContact O-N 3.45Å; K270-L272 VanDerWaalsContact C-N 3.31Å; K270-L272 PolarHBondContact O-N 3.09Å; K270-A273 WeakPolarHBondContact O-CB 3.46Å; K270-A273 PolarHBondContact O-N 2.68Å; K270-E274 WeakPolarHBondContact O-CG 3.41Å; K270-E274 PolarHBondContact O-N 3.11Å
271E97.4Very high95Very high98 Ų9897.7 Ų97.746%0.45848%0.479SS..Hα-helixtrans-57.8-43.8178-72.3171.5-16600111.6Q267 L268 A273 E274 A275Q267-E271 WeakPolarHBondContact CG-OE1 3.14Å; Q267-E271 PolarHBondContact NE2-OE1 3.43Å; Q267-E271 WeakPolarHBondContact O-CG 3.03Å; Q267-E271 PolarHBondContact O-N 2.88Å; L268-E271 PolarHBondContact O-N 2.94Å; E271-A273 VanDerWaalsContact C-N 3.35Å; E271-A273 PolarHBondContact O-N 3.47Å; E271-E274 PolarHBondContact O-N 3.28Å; E271-A275 WeakPolarHBondContact O-CB 2.79Å; E271-A275 PolarHBondContact O-N 3.04Å
272L94.1Very high94.9Very high74 Ų7499 Ų9939%0.38749%0.485SS..Hα-helixtrans-68-32.7176.3-69.5175.4000112.8L268 K270 R276L268-L272 HydrophobicContact CD1-CD1 4.33Å; L268-L272 HydrophobicContact CD1-CG 4.29Å; L268-L272 HydrophobicContact CG-CD1 4.04Å; L268-L272 HydrophobicContact CG-CG 4.41Å; L268-L272 WeakPolarHBondContact O-CB 3.46Å; L268-L272 VanDerWaalsContact O-CG 3.25Å; L268-L272 WeakPolarHBondContact O-CG 3.31Å; L268-L272 PolarHBondContact O-N 3.35Å; K270-L272 VanDerWaalsContact C-N 3.31Å; K270-L272 PolarHBondContact O-N 3.09Å; L272-R276 WeakPolarHBondContact O-CB 3.22Å; L272-R276 WeakPolarHBondContact O-CD 3.4Å; L272-R276 WeakPolarHBondContact O-CG 3.08Å; L272-R276 PolarHBondContact O-N 3.44Å; L272-R276 VanDerWaalsContact O-N 3.14Å
273A92.1Very high94.6Very high47 Ų4796.8 Ų96.839%0.38848%0.477SS..Hα-helixtrans-70.1-43.2175.400000111.8D269 K270 E271 R276 M277D269-A273 VanDerWaalsContact O-CB 3.29Å; D269-A273 WeakPolarHBondContact O-CB 3.23Å; D269-A273 PolarHBondContact O-N 2.92Å; K270-A273 WeakPolarHBondContact O-CB 3.46Å; K270-A273 PolarHBondContact O-N 2.68Å; E271-A273 VanDerWaalsContact C-N 3.35Å; E271-A273 PolarHBondContact O-N 3.47Å; A273-R276 PolarHBondContact O-N 2.8Å; A273-M277 WeakPolarHBondContact O-CB 2.8Å; A273-M277 PolarHBondContact O-N 2.9Å
274E95.3Very high94.2Very high131 Ų13195 Ų9561%0.61247%0.469SS*.Hα-helixtrans-62.6-46.8175.4-72.2173.2-169.800111.4K270 E271 R276 M277 S278K270-E274 WeakPolarHBondContact O-CG 3.41Å; K270-E274 PolarHBondContact O-N 3.11Å; E271-E274 PolarHBondContact O-N 3.28Å; E274-R276 VanDerWaalsContact C-N 3.32Å; E274-R276 PolarHBondContact O-N 2.81Å; E274-M277 PolarHBondContact O-N 3Å; E274-M277 VanDerWaalsContact O-N 3.14Å; E274-S278 PolarHBondContact O-N 2.76Å
275A95.8Very high94.1Very high60 Ų6092.2 Ų92.250%0.49646%0.46SS..Hα-helixtrans-60-40.9176.600000112.4E271 S278 L279E271-A275 WeakPolarHBondContact O-CB 2.79Å; E271-A275 PolarHBondContact O-N 3.04Å; A275-S278 PolarHBondContact O-N 2.79Å; A275-L279 PolarHBondContact O-N 3.24Å; A275-L279 VanDerWaalsContact O-N 3.12Å
276R90.7Very high93.9Very high103 Ų10387.1 Ų87.139%0.38945%0.452SS..Hα-helixtrans-63.6-44.1173.9-76.5171.2-175.9154.311.5111.7R7 L272 A273 E274 S278 L279 E280R7-R276 VanDerWaalsContact NH1-NH1 3.15Å; L272-R276 WeakPolarHBondContact O-CB 3.22Å; L272-R276 WeakPolarHBondContact O-CD 3.4Å; L272-R276 WeakPolarHBondContact O-CG 3.08Å; L272-R276 PolarHBondContact O-N 3.44Å; L272-R276 VanDerWaalsContact O-N 3.14Å; A273-R276 PolarHBondContact O-N 2.8Å; E274-R276 VanDerWaalsContact C-N 3.32Å; E274-R276 PolarHBondContact O-N 2.81Å; R276-S278 VanDerWaalsContact C-N 3.34Å; R276-L279 PolarHBondContact O-N 3.47Å; R276-E280 WeakPolarHBondContact O-CB 3.27Å; R276-E280 WeakPolarHBondContact O-CG 3.04Å; R276-E280 PolarHBondContact O-N 2.97Å
277M90.2Very high93.6Very high108 Ų10887.4 Ų87.453%0.53245%0.449SS..Hα-helixtrans-63.9-40.4179.3-165.1-175.1-4500111.7A273 E274 E280 N281A273-M277 WeakPolarHBondContact O-CB 2.8Å; A273-M277 PolarHBondContact O-N 2.9Å; E274-M277 PolarHBondContact O-N 3Å; E274-M277 VanDerWaalsContact O-N 3.14Å; M277-E280 PolarHBondContact O-N 2.8Å; M277-N281 VanDerWaalsContact O-CG 3.29Å; M277-N281 PolarHBondContact O-N 3.11Å; M277-N281 PolarHBondContact O-ND2 2.82Å
278S95.4Very high93.4Very high56 Ų5688 Ų8839%0.39245%0.452SS..Hα-helixtrans-58.4-51.1173.7-166.90000111.4E274 A275 R276 E280 N281 E282E274-S278 PolarHBondContact O-N 2.76Å; A275-S278 PolarHBondContact O-N 2.79Å; R276-S278 VanDerWaalsContact C-N 3.34Å; S278-E280 VanDerWaalsContact C-N 3.28Å; S278-E280 PolarHBondContact O-N 2.98Å; S278-N281 PolarHBondContact O-N 2.87Å; S278-N281 VanDerWaalsContact O-N 3.13Å; S278-E282 WeakPolarHBondContact O-CG 3.06Å; S278-E282 PolarHBondContact O-N 2.73Å; S278-E282 PolarHBondContact OG-OE1 3.19Å
279L93.3Very high93.2Very high115 Ų11589.1 Ų89.160%0.60246%0.455SS*.Hα-helixtrans-63.4-34.8-179.4-173.862.9000112.6A275 R276 M283A275-L279 PolarHBondContact O-N 3.24Å; A275-L279 VanDerWaalsContact O-N 3.12Å; R276-L279 PolarHBondContact O-N 3.47Å; L279-M283 VanDerWaalsContact O-CB 3.27Å; L279-M283 WeakPolarHBondContact O-CB 3.43Å; L279-M283 PolarHBondContact O-N 3.46Å
280E89.5Confident93.1Very high57 Ų5791.1 Ų91.127%0.26646%0.456SS..Hα-helixtrans-65.4-41.2174.9-70.6164-167.600112.3R203 R276 M277 S278 E284R203-E280 VanDerWaalsContact CZ-CG 3.49Å; R203-E280 IonicContact CZ-OE1 3.24Å; R203-E280 IonicContact CZ-OE2 3.51Å; R203-E280 IonicContact NE-OE1 3.41Å; R203-E280 PolarHBondContact NE-OE1 2.76Å; R203-E280 IonicContact NH1-OE1 3.83Å; R203-E280 PolarHBondContact NH1-OE1 3.43Å; R203-E280 IonicContact NH1-OE2 2.64Å; R203-E280 IonicContact NH2-OE1 3.58Å; R203-E280 PolarHBondContact NH2-OE1 3.13Å; R203-E280 IonicContact NH2-OE2 3.23Å; R203-E280 PolarHBondContact NH2-OE2 2Å; R276-E280 WeakPolarHBondContact O-CB 3.27Å; R276-E280 WeakPolarHBondContact O-CG 3.04Å; R276-E280 PolarHBondContact O-N 2.97Å; M277-E280 PolarHBondContact O-N 2.8Å; S278-E280 VanDerWaalsContact C-N 3.28Å; S278-E280 PolarHBondContact O-N 2.98Å; E280-E284 PolarHBondContact O-N 2.84Å
281N92.9Very high92.9Very high96 Ų9691 Ų9151%0.51345%0.452SS..Hα-helixtrans-68.1-45.4176.5-69.9-20.4000111M277 S278 M283 E284 I285M277-N281 VanDerWaalsContact O-CG 3.29Å; M277-N281 PolarHBondContact O-N 3.11Å; M277-N281 PolarHBondContact O-ND2 2.82Å; S278-N281 PolarHBondContact O-N 2.87Å; S278-N281 VanDerWaalsContact O-N 3.13Å; N281-M283 VanDerWaalsContact C-N 3.3Å; N281-M283 PolarHBondContact O-N 2.82Å; N281-E284 PolarHBondContact O-N 2.97Å; N281-I285 VanDerWaalsContact O-CG1 3.29Å; N281-I285 WeakPolarHBondContact O-CG1 3.38Å; N281-I285 PolarHBondContact O-N 2.87Å
282E95.3Very high92.6Very high108 Ų10887.4 Ų87.451%0.50544%0.439SS..Hα-helixtrans-56.6-44.3174.6-73.5167.6-138.900111.6S278 I285 A286S278-E282 WeakPolarHBondContact O-CG 3.06Å; S278-E282 PolarHBondContact O-N 2.73Å; S278-E282 PolarHBondContact OG-OE1 3.19Å; E282-I285 PolarHBondContact O-N 2.69Å; E282-A286 VanDerWaalsContact O-CB 3.32Å; E282-A286 WeakPolarHBondContact O-CB 3.35Å; E282-A286 PolarHBondContact O-N 2.72Å
283M90.5Very high92.7Very high62 Ų6288.7 Ų88.731%0.30545%0.445SS..Hα-helixtrans-65.1-41177.1-178.3-161.466.800112.4S201 L279 N281 A286 R287S201-M283 WeakPolarHBondContact O-CE 3.39Å; L279-M283 VanDerWaalsContact O-CB 3.27Å; L279-M283 WeakPolarHBondContact O-CB 3.43Å; L279-M283 PolarHBondContact O-N 3.46Å; N281-M283 VanDerWaalsContact C-N 3.3Å; N281-M283 PolarHBondContact O-N 2.82Å; M283-A286 PolarHBondContact O-N 3.24Å; M283-R287 VanDerWaalsContact O-CB 3.27Å; M283-R287 WeakPolarHBondContact O-CB 3.28Å; M283-R287 PolarHBondContact O-N 2.82Å
284E89.8Confident92.5Very high67 Ų6791.2 Ų91.231%0.31345%0.45SS..Hα-helixtrans-68.7-40.7178.9-164.164.1-155.200111.3E280 N281 R287 E288E280-E284 PolarHBondContact O-N 2.84Å; N281-E284 PolarHBondContact O-N 2.97Å; E284-R287 WeakPolarHBondContact O-CB 3.32Å; E284-R287 PolarHBondContact O-N 2.98Å; E284-R287 IonicContact OE1-NH1 3.67Å; E284-R287 IonicContact OE2-NH1 3.91Å; E284-E288 WeakPolarHBondContact O-CG 3.34Å; E284-E288 PolarHBondContact O-N 2.91Å
285I93.8Very high92.4Very high92 Ų9289.7 Ų89.747%0.47245%0.445SS..Hα-helixtrans-58.5-51.4172.5-66.9165.2000110.1N281 E282 R287 E288 E289N281-I285 VanDerWaalsContact O-CG1 3.29Å; N281-I285 WeakPolarHBondContact O-CG1 3.38Å; N281-I285 PolarHBondContact O-N 2.87Å; E282-I285 PolarHBondContact O-N 2.69Å; I285-R287 PolarHBondContact O-N 2.88Å; I285-E288 PolarHBondContact O-N 3.08Å; I285-E288 VanDerWaalsContact O-N 3.11Å; I285-E289 HydrophobicContact CG2-CG 4.42Å; I285-E289 WeakPolarHBondContact O-CG 3.36Å; I285-E289 PolarHBondContact O-N 3.4Å
286A94Very high92.3Very high51 Ų5192.7 Ų92.742%0.42144%0.444SS..Hα-helixtrans-60.9-33.7178.800000112.5E282 M283 Y290E282-A286 VanDerWaalsContact O-CB 3.32Å; E282-A286 WeakPolarHBondContact O-CB 3.35Å; E282-A286 PolarHBondContact O-N 2.72Å; M283-A286 PolarHBondContact O-N 3.24Å; A286-Y290 VanDerWaalsContact O-CB 3.31Å; A286-Y290 WeakPolarHBondContact O-CB 3.19Å; A286-Y290 PolarHBondContact O-N 3.48Å
287R90.6Very high92.4Very high97 Ų9790.4 Ų90.437%0.36644%0.438SS..Hα-helixtrans-67.9-41.1175.6-174.1-174.2-171.6-170.55.3111.9M283 E284 I285 R291M283-R287 VanDerWaalsContact O-CB 3.27Å; M283-R287 WeakPolarHBondContact O-CB 3.28Å; M283-R287 PolarHBondContact O-N 2.82Å; E284-R287 WeakPolarHBondContact O-CB 3.32Å; E284-R287 PolarHBondContact O-N 2.98Å; E284-R287 IonicContact OE1-NH1 3.67Å; E284-R287 IonicContact OE2-NH1 3.91Å; I285-R287 PolarHBondContact O-N 2.88Å; R287-R291 WeakPolarHBondContact O-CB 3.48Å; R287-R291 VanDerWaalsContact O-CG 3.25Å; R287-R291 WeakPolarHBondContact O-CG 3.45Å; R287-R291 PolarHBondContact O-N 3.31Å
288E91.4Very high92.5Very high107 Ų10788.2 Ų88.250%0.543%0.428SS..Hα-helixtrans-66.2-43.9174.7-71.3-179.1173.400111.5E284 I285 Y290 R291 A292E284-E288 WeakPolarHBondContact O-CG 3.34Å; E284-E288 PolarHBondContact O-N 2.91Å; I285-E288 PolarHBondContact O-N 3.08Å; I285-E288 VanDerWaalsContact O-N 3.11Å; E288-Y290 PolarHBondContact O-N 2.96Å; E288-R291 WeakPolarHBondContact O-CB 3.31Å; E288-R291 PolarHBondContact O-N 3.17Å; E288-A292 WeakPolarHBondContact O-CB 3.19Å; E288-A292 PolarHBondContact O-N 3.45Å
289E93.8Very high92.3Very high116 Ų11688.2 Ų88.254%0.54242%0.423SS..Hα-helixtrans-58.9-47.8174.2-72.7178.8170.100111.5I285 R291 A292 I293I285-E289 HydrophobicContact CG2-CG 4.42Å; I285-E289 WeakPolarHBondContact O-CG 3.36Å; I285-E289 PolarHBondContact O-N 3.4Å; E289-R291 VanDerWaalsContact C-N 3.34Å; E289-R291 PolarHBondContact O-N 2.96Å; E289-A292 PolarHBondContact O-N 3.47Å; E289-A292 VanDerWaalsContact O-N 3.16Å; E289-I293 VanDerWaalsContact O-CG1 3.3Å; E289-I293 WeakPolarHBondContact O-CG1 3.49Å; E289-I293 PolarHBondContact O-N 2.91Å
290Y93.6Very high92.2Very high150 Ų15088.7 Ų88.759%0.58842%0.417SS*.Hα-helixtrans-59.2-44.6176.4178.7-100.7000112A286 E288 A292 I293 M294A286-Y290 VanDerWaalsContact O-CB 3.31Å; A286-Y290 WeakPolarHBondContact O-CB 3.19Å; A286-Y290 PolarHBondContact O-N 3.48Å; E288-Y290 PolarHBondContact O-N 2.96Å; Y290-A292 VanDerWaalsContact C-N 3.33Å; Y290-A292 PolarHBondContact O-N 3.32Å; Y290-I293 PolarHBondContact O-N 2.99Å; Y290-M294 HydrophobicContact CD1-CG 4.32Å; Y290-M294 HydrophobicContact CE1-CG 3.89Å; Y290-M294 HydrophobicContact CE2-CG 4.21Å; Y290-M294 HydrophobicContact CE2-SD 4.29Å; Y290-M294 VanDerWaalsContact O-CG 3.32Å; Y290-M294 WeakPolarHBondContact O-CG 3.3Å; Y290-M294 PolarHBondContact O-N 2.88Å
291R91.2Very high92.2Very high116 Ų11693.3 Ų93.344%0.43843%0.432SS..Hα-helixtrans-60.2-42.9175.2-75.8166.9170.7165.7-6111.7R287 E288 E289 M294 L295R287-R291 WeakPolarHBondContact O-CB 3.48Å; R287-R291 VanDerWaalsContact O-CG 3.25Å; R287-R291 WeakPolarHBondContact O-CG 3.45Å; R287-R291 PolarHBondContact O-N 3.31Å; E288-R291 WeakPolarHBondContact O-CB 3.31Å; E288-R291 PolarHBondContact O-N 3.17Å; E289-R291 VanDerWaalsContact C-N 3.34Å; E289-R291 PolarHBondContact O-N 2.96Å; R291-M294 PolarHBondContact O-N 3.04Å; R291-L295 WeakPolarHBondContact O-CG 3.49Å; R291-L295 PolarHBondContact O-N 3.32Å; R291-L295 VanDerWaalsContact O-N 3.08Å
292A92.1Very high92Very high22 Ų2294.7 Ų94.718%0.18243%0.43CS..Hα-helixtrans-64.9-42.9178.200000111.8E288 E289 Y290 M294 L295 R296E288-A292 WeakPolarHBondContact O-CB 3.19Å; E288-A292 PolarHBondContact O-N 3.45Å; E289-A292 PolarHBondContact O-N 3.47Å; E289-A292 VanDerWaalsContact O-N 3.16Å; Y290-A292 VanDerWaalsContact C-N 3.33Å; Y290-A292 PolarHBondContact O-N 3.32Å; A292-M294 PolarHBondContact O-N 3.16Å; A292-L295 PolarHBondContact O-N 3.32Å; A292-R296 WeakPolarHBondContact O-CG 3.17Å; A292-R296 PolarHBondContact O-N 3.33Å
293I94.5Very high91.7Very high101 Ų10192.5 Ų92.552%0.51842%0.42SS..Hα-helixtrans-59.6-46.6176-69.3165.2000110.6E289 Y290 L295 R296 E297E289-I293 VanDerWaalsContact O-CG1 3.3Å; E289-I293 WeakPolarHBondContact O-CG1 3.49Å; E289-I293 PolarHBondContact O-N 2.91Å; Y290-I293 PolarHBondContact O-N 2.99Å; I293-L295 VanDerWaalsContact C-N 3.34Å; I293-L295 PolarHBondContact O-N 3.22Å; I293-R296 PolarHBondContact O-N 3.46Å; I293-E297 PolarHBondContact O-N 3.46Å
294M89.1Confident91.8Very high100 Ų10093.2 Ų93.249%0.49342%0.422SS..Hα-helixtrans-61.2-41.2178.7-70.2-59.4-61.900112.3Y290 R291 A292 D298Y290-M294 HydrophobicContact CD1-CG 4.32Å; Y290-M294 HydrophobicContact CE1-CG 3.89Å; Y290-M294 HydrophobicContact CE2-CG 4.21Å; Y290-M294 HydrophobicContact CE2-SD 4.29Å; Y290-M294 VanDerWaalsContact O-CG 3.32Å; Y290-M294 WeakPolarHBondContact O-CG 3.3Å; Y290-M294 PolarHBondContact O-N 2.88Å; R291-M294 PolarHBondContact O-N 3.04Å; A292-M294 PolarHBondContact O-N 3.16Å; M294-D298 WeakPolarHBondContact O-CB 3.48Å; M294-D298 PolarHBondContact O-N 2.64Å; M294-D298 VanDerWaalsContact O-N 3.11Å
295L93.8Very high91.7Very high99 Ų9995.8 Ų95.852%0.51844%0.435SS..Hα-helixtrans-67.3-40.8176.2-72.9170.8000112.4R291 A292 I293 E297 D298 L299R291-L295 WeakPolarHBondContact O-CG 3.49Å; R291-L295 PolarHBondContact O-N 3.32Å; R291-L295 VanDerWaalsContact O-N 3.08Å; A292-L295 PolarHBondContact O-N 3.32Å; I293-L295 VanDerWaalsContact C-N 3.34Å; I293-L295 PolarHBondContact O-N 3.22Å; L295-E297 VanDerWaalsContact C-N 3.34Å; L295-E297 PolarHBondContact O-N 3.39Å; L295-D298 PolarHBondContact O-N 2.95Å; L295-L299 WeakPolarHBondContact O-CB 3.3Å; L295-L299 WeakPolarHBondContact O-CG 3.41Å; L295-L299 PolarHBondContact O-N 3.36Å
296R92Very high91.5Very high124 Ų12496.3 Ų96.347%0.46844%0.438SS..Hα-helixtrans-62.5-42.2177.1-73.6177.7-169.1171.86.7111.7A292 I293 L299 R300 F357A292-R296 WeakPolarHBondContact O-CG 3.17Å; A292-R296 PolarHBondContact O-N 3.33Å; I293-R296 PolarHBondContact O-N 3.46Å; R296-L299 PolarHBondContact O-N 3.31Å; R296-R300 WeakPolarHBondContact O-CB 3.5Å; R296-R300 PolarHBondContact O-N 3.37Å; R296-F357 PolarHBondContact NH2-O 3.4Å
297E92.7Very high91.4Very high55 Ų55100 Ų10026%0.25745%0.446SS..Hα-helixtrans-65.6-41.6177.8-177.158.6-156.500112I293 L295 R300 R301I293-E297 PolarHBondContact O-N 3.46Å; L295-E297 VanDerWaalsContact C-N 3.34Å; L295-E297 PolarHBondContact O-N 3.39Å; E297-R300 PolarHBondContact O-N 2.81Å; E297-R300 IonicContact OE1-CZ 2.76Å; E297-R300 IonicContact OE1-NE 3.66Å; E297-R300 IonicContact OE1-NH2 2.92Å; E297-R300 PolarHBondContact OE1-NH2 3.48Å; E297-R300 IonicContact OE2-CZ 3.92Å; E297-R300 IonicContact OE2-NE 3.27Å; E297-R300 PolarHBondContact OE2-NE 3.17Å; E297-R300 IonicContact OE2-NH1 2.85Å; E297-R300 IonicContact OE2-NH2 3.1Å; E297-R300 PolarHBondContact OE2-NH2 2.92Å; E297-R301 WeakPolarHBondContact O-CG 3.5Å; E297-R301 PolarHBondContact O-N 3.06Å; E297-R301 IonicContact OE1-CZ 3.87Å; E297-R301 IonicContact OE1-NE 3.65Å; E297-R301 PolarHBondContact OE1-NE 3.16Å; E297-R301 IonicContact OE1-NH2 3.92Å
298D92.4Very high91.4Very high62 Ų62104 Ų10433%0.33246%0.461SS..Hα-helixtrans-66-40.9176.3-170.844.9000112M294 L295 R301 R302M294-D298 WeakPolarHBondContact O-CB 3.48Å; M294-D298 PolarHBondContact O-N 2.64Å; M294-D298 VanDerWaalsContact O-N 3.11Å; L295-D298 PolarHBondContact O-N 2.95Å; D298-R301 PolarHBondContact O-N 3.36Å; D298-R302 PolarHBondContact O-N 3.18Å; D298-R302 VanDerWaalsContact O-N 3.14Å; D298-R302 IonicContact OD1-CZ 2.76Å; D298-R302 IonicContact OD1-NH1 3.52Å; D298-R302 IonicContact OD1-NH2 3.74Å; D298-R302 PolarHBondContact OD1-NH2 3.16Å; D298-R302 IonicContact OD2-CZ 2.73Å; D298-R302 IonicContact OD2-NH1 3.81Å; D298-R302 PolarHBondContact OD2-NH1 3.3Å; D298-R302 IonicContact OD2-NH2 3.58Å; D298-R302 PolarHBondContact OD2-NH2 3.34Å
299L91.6Very high91.3Very high56 Ų56104.1 Ų104.129%0.29347%0.465SS..Hα-helixtrans-62.7-44.8172.8-75.5171.9000111.9L295 R296 R301 R302 Q303L295-L299 WeakPolarHBondContact O-CB 3.3Å; L295-L299 WeakPolarHBondContact O-CG 3.41Å; L295-L299 PolarHBondContact O-N 3.36Å; R296-L299 PolarHBondContact O-N 3.31Å; L299-R301 VanDerWaalsContact C-N 3.33Å; L299-R301 PolarHBondContact O-N 3.48Å; L299-R302 PolarHBondContact O-N 2.93Å; L299-Q303 WeakPolarHBondContact O-CG 3.43Å; L299-Q303 PolarHBondContact O-N 3.12Å
300R90.8Very high91Very high125 Ų125103.5 Ų103.547%0.47246%0.462SS..Hα-helixtrans-57.7-45.7177.1-173.5-177.770.5169.13.2111.4R296 E297 R302 Q303 E304R296-R300 WeakPolarHBondContact O-CB 3.5Å; R296-R300 PolarHBondContact O-N 3.37Å; E297-R300 PolarHBondContact O-N 2.81Å; E297-R300 IonicContact OE1-CZ 2.76Å; E297-R300 IonicContact OE1-NE 3.66Å; E297-R300 IonicContact OE1-NH2 2.92Å; E297-R300 PolarHBondContact OE1-NH2 3.48Å; E297-R300 IonicContact OE2-CZ 3.92Å; E297-R300 IonicContact OE2-NE 3.27Å; E297-R300 PolarHBondContact OE2-NE 3.17Å; E297-R300 IonicContact OE2-NH1 2.85Å; E297-R300 IonicContact OE2-NH2 3.1Å; E297-R300 PolarHBondContact OE2-NH2 2.92Å; R300-R302 PolarHBondContact O-N 3.16Å; R300-Q303 PolarHBondContact O-N 3.33Å; R300-E304 IonicContact NE-OE1 2.6Å; R300-E304 WeakPolarHBondContact O-CG 3.42Å; R300-E304 PolarHBondContact O-N 3.3Å
301R90.3Very high90.8Very high153 Ų15398.6 Ų98.658%0.57745%0.452SS*.Hα-helixtrans-60.9-43.2177.4-72.1173.7-174.1-161.70.4112.5E297 D298 L299 E304 E305E297-R301 WeakPolarHBondContact O-CG 3.5Å; E297-R301 PolarHBondContact O-N 3.06Å; E297-R301 IonicContact OE1-CZ 3.87Å; E297-R301 IonicContact OE1-NE 3.65Å; E297-R301 PolarHBondContact OE1-NE 3.16Å; E297-R301 IonicContact OE1-NH2 3.92Å; D298-R301 PolarHBondContact O-N 3.36Å; L299-R301 VanDerWaalsContact C-N 3.33Å; L299-R301 PolarHBondContact O-N 3.48Å; R301-E304 PolarHBondContact O-N 2.9Å; R301-E305 WeakPolarHBondContact O-CB 3.48Å; R301-E305 PolarHBondContact O-N 3.07Å
302R89.1Confident90.7Very high126 Ų12695.6 Ų95.648%0.47545%0.452SS..Hα-helixtrans-66.6-36.8176.9-70.9-171.3-174.1106.315.2112.3D298 L299 R300 E305 L306D298-R302 PolarHBondContact O-N 3.18Å; D298-R302 VanDerWaalsContact O-N 3.14Å; D298-R302 IonicContact OD1-CZ 2.76Å; D298-R302 IonicContact OD1-NH1 3.52Å; D298-R302 IonicContact OD1-NH2 3.74Å; D298-R302 PolarHBondContact OD1-NH2 3.16Å; D298-R302 IonicContact OD2-CZ 2.73Å; D298-R302 IonicContact OD2-NH1 3.81Å; D298-R302 PolarHBondContact OD2-NH1 3.3Å; D298-R302 IonicContact OD2-NH2 3.58Å; D298-R302 PolarHBondContact OD2-NH2 3.34Å; L299-R302 PolarHBondContact O-N 2.93Å; R300-R302 PolarHBondContact O-N 3.16Å; R302-E305 PolarHBondContact O-N 2.96Å; R302-L306 WeakPolarHBondContact O-CB 3.43Å; R302-L306 VanDerWaalsContact O-CG 3.27Å; R302-L306 WeakPolarHBondContact O-CG 3.45Å; R302-L306 PolarHBondContact O-N 3.5Å
303Q88.3Confident90.4Very high61 Ų6198.9 Ų98.929%0.28546%0.46SS..Hα-helixtrans-64.2-48.5175.3-74.9176.4-34.200111.4L299 R300 E305 L306 E307L299-Q303 WeakPolarHBondContact O-CG 3.43Å; L299-Q303 PolarHBondContact O-N 3.12Å; R300-Q303 PolarHBondContact O-N 3.33Å; Q303-E305 VanDerWaalsContact C-N 3.28Å; Q303-E305 PolarHBondContact O-N 3.03Å; Q303-L306 PolarHBondContact O-N 3.02Å; Q303-E307 WeakPolarHBondContact O-CG 3.4Å; Q303-E307 PolarHBondContact O-N 3.46Å
304E91.8Very high90Very high77 Ų77103 Ų10336%0.3647%0.469SS..Hα-helixtrans-59.5-38175.9-70.9174.3-165.200112.3R300 R301 R308R300-E304 IonicContact NE-OE1 2.6Å; R300-E304 WeakPolarHBondContact O-CG 3.42Å; R300-E304 PolarHBondContact O-N 3.3Å; R301-E304 PolarHBondContact O-N 2.9Å; E304-R308 WeakPolarHBondContact O-CB 3.39Å; E304-R308 VanDerWaalsContact O-CG 3.27Å; E304-R308 WeakPolarHBondContact O-CG 3.28Å; E304-R308 PolarHBondContact O-N 3.27Å
305E89.3Confident89.8Confident122 Ų122104.5 Ų104.557%0.5748%0.475SS*.Hα-helixtrans-66.6-44.8176.1-173.1175.2-16800112.1R301 R302 Q303 R308 L309R301-E305 WeakPolarHBondContact O-CB 3.48Å; R301-E305 PolarHBondContact O-N 3.07Å; R302-E305 PolarHBondContact O-N 2.96Å; Q303-E305 VanDerWaalsContact C-N 3.28Å; Q303-E305 PolarHBondContact O-N 3.03Å; E305-R308 PolarHBondContact O-N 3.34Å; E305-L309 HydrophobicContact CG-CD1 4.35Å; E305-L309 WeakPolarHBondContact O-CG 3.17Å; E305-L309 PolarHBondContact O-N 3.48Å
306L88.6Confident89.2Confident102 Ų102107.8 Ų107.853%0.53448%0.48SS..Hα-helixtrans-61.7-45175.3-73.4166.7000111.3R302 Q303 R308 L309 E310R302-L306 WeakPolarHBondContact O-CB 3.43Å; R302-L306 VanDerWaalsContact O-CG 3.27Å; R302-L306 WeakPolarHBondContact O-CG 3.45Å; R302-L306 PolarHBondContact O-N 3.5Å; Q303-L306 PolarHBondContact O-N 3.02Å; L306-R308 PolarHBondContact O-N 3.14Å; L306-L309 PolarHBondContact O-N 2.83Å; L306-E310 WeakPolarHBondContact O-CB 3.31Å; L306-E310 WeakPolarHBondContact O-CG 3.26Å; L306-E310 PolarHBondContact O-N 2.96Å
307E91.6Very high88.6Confident130 Ų130105.7 Ų105.761%0.60747%0.473SS*.Hα-helixtrans-61.1-41.6177-74.9178.8178.100112.2Q303 E310 A311Q303-E307 WeakPolarHBondContact O-CG 3.4Å; Q303-E307 PolarHBondContact O-N 3.46Å; E307-E310 PolarHBondContact O-N 3.2Å; E307-A311 VanDerWaalsContact O-CB 3.28Å; E307-A311 WeakPolarHBondContact O-CB 3.27Å; E307-A311 PolarHBondContact O-N 3.27Å
308R90.6Very high88.2Confident179 Ų179104.6 Ų104.668%0.67548%0.476SS*.Hα-helixtrans-62.5-43.5174.7-75.6175.4-169.7173.68.5112.1E304 E305 L306 A311 A312E304-R308 WeakPolarHBondContact O-CB 3.39Å; E304-R308 VanDerWaalsContact O-CG 3.27Å; E304-R308 WeakPolarHBondContact O-CG 3.28Å; E304-R308 PolarHBondContact O-N 3.27Å; E305-R308 PolarHBondContact O-N 3.34Å; L306-R308 PolarHBondContact O-N 3.14Å; R308-A311 PolarHBondContact O-N 3.04Å; R308-A312 WeakPolarHBondContact O-CB 3.49Å; R308-A312 PolarHBondContact O-N 3.35Å
309L89.2Confident87.5Confident111 Ų111108 Ų10858%0.58149%0.492SS*.Hα-helixtrans-67.1-40178.3-72.5171.8000111.7E305 L306 R313E305-L309 HydrophobicContact CG-CD1 4.35Å; E305-L309 WeakPolarHBondContact O-CG 3.17Å; E305-L309 PolarHBondContact O-N 3.48Å; L306-L309 PolarHBondContact O-N 2.83Å; L309-R313 VanDerWaalsContact O-CB 3.23Å; L309-R313 WeakPolarHBondContact O-CB 3.24Å; L309-R313 PolarHBondContact O-N 3.19Å
310E87.6Confident86.6Confident103 Ų103109.2 Ų109.248%0.48150%0.497SS..Hα-helixtrans-66.8-40.3175.3-74.2-174.7179.400112.3L306 E307 R313 R314L306-E310 WeakPolarHBondContact O-CB 3.31Å; L306-E310 WeakPolarHBondContact O-CG 3.26Å; L306-E310 PolarHBondContact O-N 2.96Å; E307-E310 PolarHBondContact O-N 3.2Å; E310-R313 PolarHBondContact O-N 3.43Å; E310-R314 WeakPolarHBondContact O-CB 3.43Å; E310-R314 PolarHBondContact O-N 2.85Å
311A89.2Confident85.7Confident46 Ų46110.2 Ų110.238%0.3851%0.507SS..Hα-helixtrans-62.7-49174.100000111.5E307 R308 R313 R314 E315E307-A311 VanDerWaalsContact O-CB 3.28Å; E307-A311 WeakPolarHBondContact O-CB 3.27Å; E307-A311 PolarHBondContact O-N 3.27Å; R308-A311 PolarHBondContact O-N 3.04Å; A311-R313 VanDerWaalsContact C-N 3.31Å; A311-R313 PolarHBondContact O-N 2.8Å; A311-R314 WeakPolarHBondContact O-CB 3.43Å; A311-R314 PolarHBondContact O-N 3.27Å; A311-R314 VanDerWaalsContact O-N 3.11Å; A311-E315 WeakPolarHBondContact O-CG 3.48Å; A311-E315 PolarHBondContact O-N 3.12Å
312A89.9Confident84.6Confident53 Ų53110.8 Ų110.844%0.43852%0.516SS..Hα-helixtrans-61.4-38.9175.600000112.1R308 R316R308-A312 WeakPolarHBondContact O-CB 3.49Å; R308-A312 PolarHBondContact O-N 3.35Å; A312-R316 WeakPolarHBondContact O-CB 3.44Å; A312-R316 PolarHBondContact O-N 3.49Å
313R85.9Confident83.4Confident91 Ų91115.2 Ų115.234%0.34353%0.533SS..Hα-helixtrans-61.2-47.2172.7-175.4176.9-174.2-167.8-1.8110.4L309 E310 A311 R316 Y317 G340L309-R313 VanDerWaalsContact O-CB 3.23Å; L309-R313 WeakPolarHBondContact O-CB 3.24Å; L309-R313 PolarHBondContact O-N 3.19Å; E310-R313 PolarHBondContact O-N 3.43Å; A311-R313 VanDerWaalsContact C-N 3.31Å; A311-R313 PolarHBondContact O-N 2.8Å; R313-R316 PolarHBondContact O-N 3.09Å; R313-Y317 HydrophobicContact CG-CD2 3.85Å; R313-Y317 HydrophobicContact CG-CE2 3.6Å; R313-Y317 PolarHBondContact NH2-OH 3.5Å; R313-Y317 WeakPolarHBondContact O-CD2 2.94Å; R313-Y317 PolarHBondContact O-N 2.92Å; R313-G340 PolarHBondContact NH2-O 3.07Å
314R85.6Confident82Confident189 Ų189116.8 Ų116.871%0.71354%0.543SS*.Hα-helixtrans-62.1-43.1179.4-172.8179.5-71.4161.30.5112E310 A311 Y317 G318E310-R314 WeakPolarHBondContact O-CB 3.43Å; E310-R314 PolarHBondContact O-N 2.85Å; A311-R314 WeakPolarHBondContact O-CB 3.43Å; A311-R314 PolarHBondContact O-N 3.27Å; A311-R314 VanDerWaalsContact O-N 3.11Å; R314-Y317 PolarHBondContact O-N 3.31Å; R314-G318 PolarHBondContact O-N 3.5Å
315E85.5Confident80.4Confident130 Ų130116.7 Ų116.761%0.60756%0.563SS**Hα-helixtrans-62-44.2174.3-72.9179.5178.400112A311 Y317 G318 M319A311-E315 WeakPolarHBondContact O-CG 3.48Å; A311-E315 PolarHBondContact O-N 3.12Å; E315-Y317 VanDerWaalsContact C-N 3.33Å; E315-Y317 PolarHBondContact O-N 3.05Å; E315-G318 PolarHBondContact O-N 3.36Å; E315-G318 VanDerWaalsContact O-N 3.15Å; E315-M319 WeakPolarHBondContact O-CG 3.43Å; E315-M319 PolarHBondContact O-N 3.27Å
316R82Confident78.6Confident168 Ų168114.1 Ų114.163%0.63457%0.57SS**Hα-helixtrans-62-39.8177.5-163.8-179-166.5-147.34112.2A312 R313 M320A312-R316 WeakPolarHBondContact O-CB 3.44Å; A312-R316 PolarHBondContact O-N 3.49Å; R313-R316 PolarHBondContact O-N 3.09Å; R316-M320 HydrophobicContact CG-CE 4.28Å; R316-M320 PolarHBondContact O-N 3.45Å; R316-M320 VanDerWaalsContact O-N 3.09Å
317Y79.6Confident76.7Confident81 Ų81119.4 Ų119.432%0.31858%0.582SS.*Hα-helixtrans-66.6-41.1172.7-82.9-74.8000112.1R313 R314 E315 M320 Q321 M339R313-Y317 HydrophobicContact CG-CD2 3.85Å; R313-Y317 HydrophobicContact CG-CE2 3.6Å; R313-Y317 PolarHBondContact NH2-OH 3.5Å; R313-Y317 WeakPolarHBondContact O-CD2 2.94Å; R313-Y317 PolarHBondContact O-N 2.92Å; R314-Y317 PolarHBondContact O-N 3.31Å; E315-Y317 VanDerWaalsContact C-N 3.33Å; E315-Y317 PolarHBondContact O-N 3.05Å; Y317-M320 PolarHBondContact O-N 3.45Å; Y317-Q321 WeakPolarHBondContact O-CG 3.35Å; Y317-Q321 PolarHBondContact O-N 3.44Å; Y317-M339 HydrophobicContact CE1-SD 3.71Å; Y317-M339 HydrophobicContact CE2-SD 4.26Å; Y317-M339 PolarHBondContact OH-SD 2.83Å
318G83.2Confident74.4Confident31 Ų31116.8 Ų116.832%0.3259%0.59SS.*Hα-helixtrans-62.7-45.1176.800000112.8R314 E315 M320 Q321 Q322R314-G318 PolarHBondContact O-N 3.5Å; E315-G318 PolarHBondContact O-N 3.36Å; E315-G318 VanDerWaalsContact O-N 3.15Å; G318-M320 PolarHBondContact O-N 2.85Å; G318-Q321 PolarHBondContact O-N 3.34Å; G318-Q322 PolarHBondContact O-N 2.8Å
319M78.9Confident72.3Confident135 Ų135115.5 Ų115.567%0.66560%0.597SS**Hα-helixtrans-63.5-39.3175.2-73-172.8179.700112.1E315 R323E315-M319 WeakPolarHBondContact O-CG 3.43Å; E315-M319 PolarHBondContact O-N 3.27Å; M319-R323 WeakPolarHBondContact O-CB 3.44Å; M319-R323 PolarHBondContact O-N 3.1Å
320M72.2Confident70.4Confident80 Ų80121.3 Ų121.339%0.39461%0.611SS.*Hα-helixtrans-65.2-41.4175-88.3-159.4-103.800112.5R316 Y317 G318 R323 N324 M339R316-M320 HydrophobicContact CG-CE 4.28Å; R316-M320 PolarHBondContact O-N 3.45Å; R316-M320 VanDerWaalsContact O-N 3.09Å; Y317-M320 PolarHBondContact O-N 3.45Å; G318-M320 PolarHBondContact O-N 2.85Å; M320-R323 PolarHBondContact O-N 3.47Å; M320-N324 WeakPolarHBondContact O-CB 3.45Å; M320-N324 PolarHBondContact O-N 2.95Å; M320-M339 HydrophobicContact CE-CE 3.83Å
321Q70.6Confident68.6Low146 Ų146123.9 Ų123.968%0.68263%0.625SS**Hα-helixtrans-64.8-41.4177.6-75.4-175.235.200112.2Y317 G318 R323 N324 G325Y317-Q321 WeakPolarHBondContact O-CG 3.35Å; Y317-Q321 PolarHBondContact O-N 3.44Å; G318-Q321 PolarHBondContact O-N 3.34Å; Q321-R323 VanDerWaalsContact C-N 3.34Å; Q321-R323 PolarHBondContact O-N 3.36Å; Q321-N324 PolarHBondContact O-N 3.45Å; Q321-G325 PolarHBondContact O-N 2.92Å
322Q68.9Low66.6Low166 Ų166125.3 Ų125.378%0.77663%0.632SS**Hα-helixtrans-64.1-38.6175-73.2-179.814.700112.1G318G318-Q322 PolarHBondContact O-N 2.8Å
323R63Low64.9Low218 Ų218126.5 Ų126.582%0.82364%0.642SS**Hα-helixtrans-69.5-33.7177.7-128.7175.6168.3-179.4-4.4113M319 M320 Q321M319-R323 WeakPolarHBondContact O-CB 3.44Å; M319-R323 PolarHBondContact O-N 3.1Å; M320-R323 PolarHBondContact O-N 3.47Å; Q321-R323 VanDerWaalsContact C-N 3.34Å; Q321-R323 PolarHBondContact O-N 3.36Å
324N60Low63.4Low94 Ų94127.6 Ų127.650%0.50366%0.655SS.*Hα-helixtrans-87-16.4179.9-125.923.1000113.4M320 Q321 G326 R327M320-N324 WeakPolarHBondContact O-CB 3.45Å; M320-N324 PolarHBondContact O-N 2.95Å; Q321-N324 PolarHBondContact O-N 3.45Å; N324-G326 PolarHBondContact O-N 2.99Å; N324-G326 VanDerWaalsContact O-N 3.1Å; N324-R327 PolarHBondContact O-N 3.49Å
325G56.3Low61.8Low75 Ų75123.9 Ų123.977%0.77365%0.648SS**THydrogen-bonded Turntrans-66.9-2.8175.200000115.3Q321Q321-G325 PolarHBondContact O-N 2.92Å
326G52.3Low60.2Low69 Ų69126.3 Ų126.371%0.71166%0.657SS**THydrogen-bonded Turntrans-1172.617700000115.4N324N324-G326 PolarHBondContact O-N 2.99Å; N324-G326 VanDerWaalsContact O-N 3.1Å
327R49Very low58.8Low213 Ų213125.6 Ų125.680%0.80467%0.665SS**  trans-131.693.7175.6-77.6-174.9178.4179.1-1.9109.5N324N324-R327 PolarHBondContact O-N 3.49Å
328G42.5Very low57.4Low75 Ų75129.3 Ų129.377%0.77369%0.686SS**  trans-55.9148.4166.600000111.3
329D46.3Very low55.7Low151 Ų151131.2 Ų131.281%0.80769%0.687SS**SBendtrans69.5122165.7-88.9-15000119.7
330R51Low54.3Low233 Ų233127 Ų12788%0.87968%0.678SS**  trans73.478163.1-53.4178-157.5175.34.8116.5
331M48.2Very low53.5Low158 Ų158128.8 Ų128.878%0.77870%0.696SS**  trans-121.7121.9144.6-86.8-161.517300110.9
332S48.3Very low52.5Low76 Ų76125.6 Ų125.653%0.53169%0.688SS.*  trans-49.3144-173.5-172.80000113.4D334 L335S332-D334 PolarHBondContact O-N 2.72Å; S332-D334 PolarHBondContact OG-N 3.44Å; S332-D334 PolarHBondContact OG-OD2 3.2Å; S332-L335 PolarHBondContact O-N 3.33Å
333A54.3Low51.6Low78 Ų78122.9 Ų122.965%0.64569%0.685SS**G310 helixtrans-54.7-11168.400000113.5L335 K336A333-L335 VanDerWaalsContact C-N 3.33Å; A333-L335 PolarHBondContact O-N 3.48Å; A333-K336 PolarHBondContact O-N 3.37Å
334D53.1Low50.8Low114 Ų114114.8 Ų114.861%0.6167%0.669SS**G310 helixtrans-69.2-20.2178.7-65.2-46.1000115.1S332S332-D334 PolarHBondContact O-N 2.72Å; S332-D334 PolarHBondContact OG-N 3.44Å; S332-D334 PolarHBondContact OG-OD2 3.2Å
335L52.9Low50.1Low110 Ų110119.2 Ų119.258%0.57669%0.686SS**G310 helixtrans-84-18.1175.4-129.980.9000113.3S332 A333 N337S332-L335 PolarHBondContact O-N 3.33Å; A333-L335 VanDerWaalsContact C-N 3.33Å; A333-L335 PolarHBondContact O-N 3.48Å; L335-N337 VanDerWaalsContact C-N 3.28Å
336K52.6Low49.6Very low182 Ų182122.6 Ų122.679%0.79168%0.684SS**THydrogen-bonded Turntrans-74.7-18.5175-84.5176.5173.6176.70112.6A333A333-K336 PolarHBondContact O-N 3.37Å
337N51.6Low49.4Very low152 Ų152123.4 Ų123.481%0.81368%0.675SS**THydrogen-bonded Turntrans-91-6.4175.5-99.30.4000114.7L335L335-N337 VanDerWaalsContact C-N 3.28Å
338Q50.8Low49.3Very low159 Ų159121 Ų12174%0.74367%0.672SS**SBendtrans-94.5-2.3175-69.6-171.827.100113.7
339M46.5Very low49.4Very low71 Ų71119.3 Ų119.335%0.3566%0.655SS.*SBendtrans-11685172.9-61.9-148.8178.800108.4Y317 M320Y317-M339 HydrophobicContact CE1-SD 3.71Å; Y317-M339 HydrophobicContact CE2-SD 4.26Å; Y317-M339 PolarHBondContact OH-SD 2.83Å; M320-M339 HydrophobicContact CE-CE 3.83Å
340G49.6Very low49.7Very low47 Ų47114.3 Ų114.349%0.48563%0.63SS.*PPolyproline II helixtrans-50.2151.9175.300000111.9R313R313-G340 PolarHBondContact NH2-O 3.07Å
341P55.7Low49.5Very low117 Ų117109.5 Ų109.576%0.7662%0.617SS**PPolyproline II helixtrans-53143.7179.623.2-32.2000109.4
342P50.6Low49.4Very low79 Ų79108.4 Ų108.451%0.51361%0.61SS.*PPolyproline II helixtrans-52.1142.9166.125.9-32000107.7G344P342-G344 PolarHBondContact O-N 2.71Å
343P49.7Very low49.5Very low109 Ų109109.2 Ų109.271%0.70861%0.608SS**  trans-66.579.617227.2-31.3000108.7H345P343-H345 PolarHBondContact O-N 3.31Å
344G46.2Very low49.3Very low48 Ų48107.6 Ų107.650%0.49559%0.588SS.*  trans-76.619.5-177.400000113.7P342P342-G344 PolarHBondContact O-N 2.71Å
345H45.2Very low49.1Very low188 Ų188108.3 Ų108.387%0.8759%0.588SS**SBendtrans-129.140.5-179.8-66.4-18.8000110.9P343P343-H345 PolarHBondContact O-N 3.31Å
346M45Very low49.3Very low146 Ų146108.8 Ų108.872%0.71959%0.59SS**SBendtrans-135.6-21.2165.2-71-162.3170.100113.7H348 G349 V350M346-H348 PolarHBondContact O-N 3.32Å; M346-G349 PolarHBondContact O-N 3.18Å; M346-V350 WeakPolarHBondContact O-CG2 3.48Å; M346-V350 PolarHBondContact O-N 3.25Å
347T49.2Very low49.1Very low85 Ų85104 Ų10452%0.52157%0.569SS.*Hα-helixtrans-69.7-31.1-174.2530000114.4
348H45.9Very low49Very low163 Ų163103.2 Ų103.276%0.75556%0.561SS**Hα-helixtrans-71.8-32.5176.1-81.9-53.8000113.4M346 E352M346-H348 PolarHBondContact O-N 3.32Å; H348-E352 PolarHBondContact O-N 3.24Å
349G45.6Very low48.5Very low39 Ų3998.6 Ų98.640%0.40255%0.549SS..Hα-helixtrans-74.8-27.3178.500000114M346 L353M346-G349 PolarHBondContact O-N 3.18Å; G349-L353 WeakPolarHBondContact O-CG 3.37Å; G349-L353 PolarHBondContact O-N 3.22Å
350V51.2Low48.3Very low46 Ų46100.4 Ų100.428%0.27957%0.567SS.*Hα-helixtrans-75.9-34.2179.3-1420000111.7M346 L354M346-V350 WeakPolarHBondContact O-CG2 3.48Å; M346-V350 PolarHBondContact O-N 3.25Å; V350-L354 HydrophobicContact CG1-CD1 4.27Å; V350-L354 WeakPolarHBondContact O-CD1 3.36Å; V350-L354 PolarHBondContact O-N 3.28Å; V350-L354 VanDerWaalsContact O-N 3.14Å
351H46.3Very low48.3Very low133 Ų133108.4 Ų108.462%0.61658%0.582SS**Hα-helixtrans-72.4-37.1179.6-144.3-80.8000111.9L354 E355H351-L354 PolarHBondContact O-N 3.23Å; H351-E355 PolarHBondContact O-N 3.46Å
352E46.4Very low47.6Very low134 Ų134111.2 Ų111.263%0.62659%0.585SS**Hα-helixtrans-70.8-34.3177.9-156.9171.4-162.300112.1H348 I356H348-E352 PolarHBondContact O-N 3.24Å; E352-I356 WeakPolarHBondContact O-CG1 3.27Å; E352-I356 PolarHBondContact O-N 3.09Å
353L51.6Low46.8Very low93 Ų93111.4 Ų111.449%0.48760%0.602SS.*Hα-helixtrans-69.6-35.9171.2-74.2170.1000112.3G349 E355 I356 F357G349-L353 WeakPolarHBondContact O-CG 3.37Å; G349-L353 PolarHBondContact O-N 3.22Å; L353-E355 PolarHBondContact O-N 2.76Å; L353-I356 PolarHBondContact O-N 2.71Å; L353-F357 WeakPolarHBondContact O-CD2 3.3Å; L353-F357 PolarHBondContact O-N 3.4Å; L353-F357 VanDerWaalsContact O-N 3.11Å
354L49.7Very low46.1Very low45 Ų45109.5 Ų109.524%0.23660%0.601CS.*Hα-helixtrans-64.7-37.9176.4-10095.7000112.5V350 H351 F357 Q358V350-L354 HydrophobicContact CG1-CD1 4.27Å; V350-L354 WeakPolarHBondContact O-CD1 3.36Å; V350-L354 PolarHBondContact O-N 3.28Å; V350-L354 VanDerWaalsContact O-N 3.14Å; H351-L354 PolarHBondContact O-N 3.23Å; L354-F357 CarbonylContact O-C 3.6Å; L354-F357 PolarHBondContact O-N 2.7Å; L354-Q358 VanDerWaalsContact O-CB 3.26Å; L354-Q358 WeakPolarHBondContact O-CB 3.36Å; L354-Q358 WeakPolarHBondContact O-CG 3.4Å; L354-Q358 PolarHBondContact O-N 3.4Å
355E49.4Very low45.4Very low128 Ų128116.3 Ų116.360%0.59862%0.62SS**Hα-helixtrans-66.3-37.8176.3-75.7-174.317300112.5H351 L353 F357 Q358H351-E355 PolarHBondContact O-N 3.46Å; L353-E355 PolarHBondContact O-N 2.76Å; E355-F357 VanDerWaalsContact C-N 3.3Å; E355-F357 PolarHBondContact O-N 3.4Å; E355-Q358 PolarHBondContact O-N 3.49Å
356I56.1Low45Very low121 Ų121112.9 Ų112.962%0.62161%0.608SS**Hα-helixtrans-65.3-34.9175.1-65.3167.7000111.3E352 L353E352-I356 WeakPolarHBondContact O-CG1 3.27Å; E352-I356 PolarHBondContact O-N 3.09Å; L353-I356 PolarHBondContact O-N 2.71Å
357F48.5Very low44.2Very low80 Ų80111.8 Ų111.835%0.35161%0.613SS.*Hα-helixtrans-87.7-16.2179-78.7-72.7000114.1R296 L353 L354 E355R296-F357 PolarHBondContact NH2-O 3.4Å; L353-F357 WeakPolarHBondContact O-CD2 3.3Å; L353-F357 PolarHBondContact O-N 3.4Å; L353-F357 VanDerWaalsContact O-N 3.11Å; L354-F357 CarbonylContact O-C 3.6Å; L354-F357 PolarHBondContact O-N 2.7Å; E355-F357 VanDerWaalsContact C-N 3.3Å; E355-F357 PolarHBondContact O-N 3.4Å
358Q49.1Very low43.6Very low137 Ų137116.2 Ų116.264%0.6463%0.625SS**Hα-helixtrans-89.9-11.2-179.9-79.1177.8-4.600114.4L354 E355 P360L354-Q358 VanDerWaalsContact O-CB 3.26Å; L354-Q358 WeakPolarHBondContact O-CB 3.36Å; L354-Q358 WeakPolarHBondContact O-CG 3.4Å; L354-Q358 PolarHBondContact O-N 3.4Å; E355-Q358 PolarHBondContact O-N 3.49Å; Q358-P360 WeakPolarHBondContact O-CD 3.39Å
359A41.9Very low42.6Very low61 Ų61114.7 Ų114.750%0.50463%0.632SS.*SBendtrans-65.9123.7175.800000111.3R361A359-R361 PolarHBondContact O-N 3.03Å; A359-R361 VanDerWaalsContact O-N 3.12Å
360P41Very low42.1Very low110 Ų110117.4 Ų117.471%0.71465%0.651SS**  trans-64.7114.8171.425.6-30.3000108.3Q358 Q362Q358-P360 WeakPolarHBondContact O-CD 3.39Å; P360-Q362 VanDerWaalsContact C-N 3.26Å; P360-Q362 PolarHBondContact O-N 3.46Å
361R49.6Very low41Very low215 Ų215130.4 Ų130.481%0.81170%0.695SS**  trans-7087.8171.4-72.5-161.7177.3-162.30.9108.5A359 G363A359-R361 PolarHBondContact O-N 3.03Å; A359-R361 VanDerWaalsContact O-N 3.12Å; R361-G363 PolarHBondContact O-N 3.13Å
362Q40.8Very low40.8Very low175 Ų175130.3 Ų130.382%0.81870%0.699SS**  trans-60.8131.1161.9-64.8-172.17.900107.5P360P360-Q362 VanDerWaalsContact C-N 3.26Å; P360-Q362 PolarHBondContact O-N 3.46Å
363G34.1Very low40.5Very low84 Ų84130.1 Ų130.187%0.86670%0.702SS**SBendtrans-55.9154.6-168.300000114.8R361R361-G363 PolarHBondContact O-N 3.13Å
364G35.1Very low39.8Very low68 Ų68132.2 Ų132.270%0.70171%0.714SS**SBendtrans120.7109.2170.500000113.2
365Q32.1Very low39.3Very low191 Ų191137.3 Ų137.389%0.89374%0.743SS**  trans35102.9152.5-73.3172.8-32.500117.9
366L35.5Very low38.6Very low117 Ų117137.9 Ų137.961%0.61375%0.752SS**  trans-108.794.8155.4-87.3158.7000109.5F368L366-F368 HydrophobicContact CB-CD2 4.24Å; L366-F368 HydrophobicContact CB-CE2 4.01Å; L366-F368 HydrophobicContact CD1-CE2 4.36Å; L366-F368 HydrophobicContact CD2-CE2 3.86Å; L366-F368 HydrophobicContact CD2-CZ 4.18Å; L366-F368 HydrophobicContact CG-CE2 4.3Å
367C28.6Very low37.5Very low122 Ų122139 Ų13982%0.82476%0.76SS**  trans-69.2118.7155.7-75.20000108.2
368F36.3Very low36.7Very low178 Ų178143.2 Ų143.278%0.78179%0.79SS**  trans-101.3109.2164.1-86.1-84.4000109.3L366L366-F368 HydrophobicContact CB-CD2 4.24Å; L366-F368 HydrophobicContact CB-CE2 4.01Å; L366-F368 HydrophobicContact CD1-CE2 4.36Å; L366-F368 HydrophobicContact CD2-CE2 3.86Å; L366-F368 HydrophobicContact CD2-CZ 4.18Å; L366-F368 HydrophobicContact CG-CE2 4.3Å
369C25.8Very low35.7Very low131 Ų131143.7 Ų143.789%0.88580%0.801SS**  trans-82.8117.4162.1-157.40000106.9
370A36.2Very low35.2Very low97 Ų97150.6 Ų150.680%0.80283%0.826SS**  trans-82131.2173.400000109.6
371R27.5Very low34.7Very low319 Ų319154.3 Ų154.3100%1.20484%0.836SS**  trans-80.40157-91.3-173.5-175.4-177.12109.9

Retrieved 371 of 371 residues in 84.3 ms (Link to these results)