A0A060WQ79_ONCMY Loading...

Coiled-coil domain-containing protein 137

AlphaFold DB , UniProt , Accession A0A060WQ79, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene ccdc137, Length 270 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
1M36.9Very low43.5Very low246 Ų246160.5 Ų160.5100%1.21285%0.849SS**  0123.80-81.3-74-93.800109.5
2G41.2Very low43.2Very low70 Ų70154.8 Ų154.872%0.72284%0.842SS**  trans94.2104153.500000120.4
3K44.6Very low42.4Very low207 Ų207154.7 Ų154.790%0.983%0.829SS**  trans72.3104139.5-52179.8-173.3178.50119.4
4N45.3Very low42.2Very low172 Ų172156.2 Ų156.292%0.9282%0.824SS**  trans-99.7144.1150.1-84.7-14.6000111.2
5K51.7Low42.1Very low193 Ų193157.3 Ų157.384%0.83982%0.823SS**  trans-98.6-163.1174-70.7175.9172.7174.60110
6Q48.2Very low41.5Very low173 Ų173152.6 Ų152.681%0.80883%0.825SS**  trans85.5140173.1-41.9-80.611.800112.3
7T42.4Very low41.2Very low120 Ų120149.1 Ų149.174%0.73682%0.821SS**  cis-162.4163.3-5.74.50000111
8K43.8Very low40.9Very low196 Ų196147.3 Ų147.385%0.85282%0.815SS**  trans-96.1157.6150.3-62.6-179.5179.2179.20108.3
9P49.2Very low40.7Very low119 Ų119146.8 Ų146.877%0.77382%0.817SS**  -145.3158.296.935.6-16.3000113.5
10A39.7Very low40.3Very low89 Ų89143.6 Ų143.674%0.73682%0.818SS**  66.1152.310500000115.1
11E35.4Very low40.2Very low180 Ų180145.3 Ų145.384%0.84182%0.82SS**  cis-166.6162.820.2-152.7164.8-142.700112.4
12A40Very low40.1Very low92 Ų92144.9 Ų144.976%0.7681%0.806SS**  trans49.5165.8150.800000123.1
13F32.7Very low40.4Very low154 Ų154147.3 Ų147.368%0.67581%0.809SS**  cis-171.8-178.8-36.5-172.2-109.5000108.5
14K39.5Very low40.2Very low176 Ų176142.4 Ų142.477%0.76580%0.801SS**  trans77.3113.1175.1-40.8-85.7-179.11650114
15Q40.8Very low40.3Very low172 Ų172144.3 Ų144.380%0.80480%0.801SS**  cis76.9125.849.6-65.5-168.5-10.500115.7
16G32.2Very low40.2Very low83 Ų83143.6 Ų143.686%0.85680%0.798SS**  trans176.4148.1171.700000114.8
17A36.6Very low40Very low92 Ų92141.4 Ų141.476%0.7680%0.799SS**  trans-148.6175.4-179.100000108.7
18T36Very low40.2Very low117 Ų117144.7 Ų144.772%0.71880%0.803SS**  cis-156.2157.818.8-32.70000110.1
19T36.4Very low40.2Very low138 Ų138146.7 Ų146.785%0.84781%0.805SS**  trans49.3129.3154.644.70000121.8
20G33.4Very low40.3Very low82 Ų82148.3 Ų148.385%0.84581%0.807SS**  trans-163.8120.715500000111.8
21Q38Very low40.8Very low180 Ų180146.6 Ų146.684%0.84180%0.798SS**  trans-110.7132.6176.4-66.8-173.37.300111
22Y34.8Very low41.5Very low238 Ų238147.8 Ų147.893%0.93380%0.8SS**  trans-150.3134.4148.2-80.6-68.2000110.4
23P47.3Very low42Very low120 Ų120147.6 Ų147.678%0.77979%0.791SS**  trans-97.7122.4-174.834.8-31.4000113.3
24S40.5Very low43Very low104 Ų104149.7 Ų149.773%0.72779%0.794SS**  trans-89.6111.816552.60000111K26S24-K26 PolarHBondContact O-N 3.27Å
25K47.8Very low43.8Very low212 Ų212148.8 Ų148.892%0.92279%0.793SS**  trans-66.7114.8174.2-67.6176.6-178.6173.60109.4
26K48.9Very low44.6Very low179 Ų179148.2 Ų148.278%0.77879%0.788SS**  trans-101.4135.4164.1-66.8-173.1179.6-177.50109.3S24 K28S24-K26 PolarHBondContact O-N 3.27Å; K26-K28 PolarHBondContact O-N 3Å
27P45.3Very low45.8Very low127 Ų127148.3 Ų148.383%0.82577%0.769SS**  trans-64132.617826-33.2000110.3R29P27-R29 PolarHBondContact O-N 2.86Å; P27-R29 VanDerWaalsContact O-N 3.08Å
28K46.1Very low47.3Very low189 Ų189150.2 Ų150.282%0.82276%0.762SS**  trans-69.2103.9172.7-72.5-179.8178.8175.80109K26 D30K26-K28 PolarHBondContact O-N 3Å; K28-D30 PolarHBondContact O-N 3.23Å
29R43.5Very low48.9Very low237 Ų237147 Ų14789%0.89474%0.74SS**  trans-82.893.6160.8-171.6173.1-177.31680.8107.8P27 G31P27-R29 PolarHBondContact O-N 2.86Å; P27-R29 VanDerWaalsContact O-N 3.08Å; R29-G31 VanDerWaalsContact C-N 3.29Å; R29-G31 PolarHBondContact O-N 3.04Å
30D51.7Low50.7Low154 Ų154147 Ų14782%0.82473%0.73SS**  trans-67.991.5171.9-79.1-52.2000109.6K28K28-D30 PolarHBondContact O-N 3.23Å
31G49.7Very low53Low52 Ų52151.4 Ų151.454%0.53673%0.729SS.*  trans-157.861.8-174.700000110.4R29 P33R29-G31 VanDerWaalsContact C-N 3.29Å; R29-G31 PolarHBondContact O-N 3.04Å; G31-P33 WeakPolarHBondContact O-CD 3.48Å
32K49.8Very low55.1Low206 Ų206145 Ų14590%0.89670%0.7SS**  trans-64113164.8-71.9176.7-178.6170.50107.3
33P52.1Low57.8Low87 Ų87138.2 Ų138.257%0.56569%0.685SS**  trans-60.2144.5170.727.3-33.8000108.4G31 Q35G31-P33 WeakPolarHBondContact O-CD 3.48Å; P33-Q35 VanDerWaalsContact C-N 3.29Å; P33-Q35 PolarHBondContact O-N 3.36Å
34R52Low59.6Low198 Ų198139.3 Ų139.375%0.74768%0.678SS**  trans-68.289.4176.7-69.9-177.3177.4-163.61.2108.7K36 D37R34-K36 PolarHBondContact O-N 2.82Å; R34-D37 WeakPolarHBondContact CB-OD2 3.36Å; R34-D37 PolarHBondContact O-N 3.12Å; R34-D37 VanDerWaalsContact O-N 3.14Å
35Q56.2Low62Low157 Ų157143.9 Ų143.973%0.73468%0.679SS**Hα-helixtrans-58.1-10.1-176-70-175.2-30.600114.8P33P33-Q35 VanDerWaalsContact C-N 3.29Å; P33-Q35 PolarHBondContact O-N 3.36Å
36K57.6Low63.9Low160 Ų160138.2 Ų138.270%0.69666%0.658SS**Hα-helixtrans-74.6-40.1178.8-60.5-177.9180-1780111.3R34 H38 L39 E40R34-K36 PolarHBondContact O-N 2.82Å; K36-H38 PolarHBondContact O-N 3.12Å; K36-L39 WeakPolarHBondContact O-CB 3.39Å; K36-L39 PolarHBondContact O-N 2.94Å; K36-L39 VanDerWaalsContact O-N 3.15Å; K36-E40 PolarHBondContact O-N 3.05Å
37D57.9Low65.8Low86 Ų86132.4 Ų132.446%0.4663%0.632SS.*Hα-helixtrans-66.3-42.9-167.6-48.71.1000111R34 L39 E40R34-D37 WeakPolarHBondContact CB-OD2 3.36Å; R34-D37 PolarHBondContact O-N 3.12Å; R34-D37 VanDerWaalsContact O-N 3.14Å; D37-L39 VanDerWaalsContact C-N 3.34Å; D37-L39 PolarHBondContact O-N 2.79Å; D37-E40 PolarHBondContact O-N 2.91Å; D37-E40 VanDerWaalsContact O-N 3.15Å
38H67.4Low67.9Low131 Ų131131.2 Ų131.261%0.60662%0.615SS**Hα-helixtrans-67.7-29.8176.8-55.2-52.3000113.9K36 E40 Q41 I42K36-H38 PolarHBondContact O-N 3.12Å; H38-E40 PolarHBondContact O-N 2.88Å; H38-Q41 PolarHBondContact O-N 3.39Å; H38-I42 WeakPolarHBondContact O-CG1 3.32Å
39L69.8Low70Confident50 Ų50126.3 Ų126.326%0.26260%0.597SS.*Hα-helixtrans-69.8-25.2175.4-70.9170.8000111.5K36 D37 I42 R47K36-L39 WeakPolarHBondContact O-CB 3.39Å; K36-L39 PolarHBondContact O-N 2.94Å; K36-L39 VanDerWaalsContact O-N 3.15Å; D37-L39 VanDerWaalsContact C-N 3.34Å; D37-L39 PolarHBondContact O-N 2.79Å; L39-I42 HydrophobicContact CD2-CD1 4.41Å; L39-I42 PolarHBondContact O-N 3.14Å; L39-R47 WeakPolarHBondContact O-CD 3.31Å; L39-R47 PolarHBondContact O-NE 3.36Å; L39-R47 PolarHBondContact O-NH2 3.17Å
40E75.9Confident72.1Confident137 Ų137118.5 Ų118.564%0.6457%0.571SS**Hα-helixtrans-78.9-24.1179.5-69.9-179.2-167.400113.4K36 D37 H38 R47K36-E40 PolarHBondContact O-N 3.05Å; D37-E40 PolarHBondContact O-N 2.91Å; D37-E40 VanDerWaalsContact O-N 3.15Å; H38-E40 PolarHBondContact O-N 2.88Å; E40-R47 PolarHBondContact O-NH2 2.96Å
41Q81.2Confident73.8Confident176 Ų176115.7 Ų115.782%0.82255%0.552SS**Hα-helixtrans-72-26.2170.5-154.593.116.200113.1H38H38-Q41 PolarHBondContact O-N 3.39Å
42I81.5Confident75.5Confident46 Ų46115.8 Ų115.824%0.23654%0.544CS..SBendtrans-78.7136-174.3-66.6170.3000110.8H38 L39 F44 L46 R47H38-I42 WeakPolarHBondContact O-CG1 3.32Å; L39-I42 HydrophobicContact CD2-CD1 4.41Å; L39-I42 PolarHBondContact O-N 3.14Å; I42-F44 PolarHBondContact O-N 2.73Å; I42-L46 HydrophobicContact CG2-CB 3.96Å; I42-L46 HydrophobicContact CG2-CD2 3.98Å; I42-L46 HydrophobicContact CG2-CG 3.97Å; I42-R47 HydrophobicContact CG2-CB 4.37Å; I42-R47 PolarHBondContact O-NE 3.16Å; I42-R47 PolarHBondContact O-NH2 3.27Å
43P92.5Very high77.3Confident95 Ų95113.4 Ų113.462%0.61753%0.534SS*.  trans-49.6135.4176.5-30.235.9000113.5R45 L46 R47P43-R45 VanDerWaalsContact C-N 3.3Å; P43-R45 PolarHBondContact O-N 3.24Å; P43-R45 VanDerWaalsContact O-N 3.12Å; P43-L46 PolarHBondContact O-N 3.2Å; P43-R47 PolarHBondContact O-N 3Å
44F85.1Confident78.7Confident143 Ų143114.3 Ų114.363%0.62753%0.531SS*.Hα-helixtrans-47.9-47.4-170.5177-90.7000113.7I42 L46 R47 E48I42-F44 PolarHBondContact O-N 2.73Å; F44-L46 VanDerWaalsContact C-N 3.34Å; F44-L46 PolarHBondContact O-N 2.82Å; F44-R47 WeakPolarHBondContact O-CB 3.3Å; F44-R47 PolarHBondContact O-N 3.01Å; F44-E48 WeakPolarHBondContact CE1-OE2 3.5Å; F44-E48 WeakPolarHBondContact O-CB 3.49Å; F44-E48 PolarHBondContact O-N 3.34Å
45R90Very high80.1Confident200 Ų200110.5 Ų110.576%0.75552%0.516SS*.Hα-helixtrans-65.1-36-176.9-162.9165-175.2148.4-0.5112.7P43 I49P43-R45 VanDerWaalsContact C-N 3.3Å; P43-R45 PolarHBondContact O-N 3.24Å; P43-R45 VanDerWaalsContact O-N 3.12Å; R45-I49 HydrophobicContact CG-CD1 4.4Å; R45-I49 WeakPolarHBondContact O-CD1 3.48Å; R45-I49 WeakPolarHBondContact O-CG1 3.31Å; R45-I49 PolarHBondContact O-N 2.8Å; R45-I49 VanDerWaalsContact O-N 3.15Å
46L87.2Confident81.1Confident92 Ų92110.4 Ų110.448%0.48252%0.518SS..Hα-helixtrans-73.2-41.6175.3-177.157.6000111.2I42 P43 F44 E48 I49 M50I42-L46 HydrophobicContact CG2-CB 3.96Å; I42-L46 HydrophobicContact CG2-CD2 3.98Å; I42-L46 HydrophobicContact CG2-CG 3.97Å; P43-L46 PolarHBondContact O-N 3.2Å; F44-L46 VanDerWaalsContact C-N 3.34Å; F44-L46 PolarHBondContact O-N 2.82Å; L46-E48 VanDerWaalsContact C-N 3.29Å; L46-E48 PolarHBondContact O-N 3.16Å; L46-I49 PolarHBondContact O-N 2.71Å; L46-M50 HydrophobicContact CD1-CG 4.4Å; L46-M50 HydrophobicContact CG-SD 4.31Å; L46-M50 WeakPolarHBondContact O-CG 3.44Å; L46-M50 PolarHBondContact O-N 3.04Å
47R90.3Very high82.4Confident58 Ų58112 Ų11222%0.21952%0.524CS..Hα-helixtrans-55.9-42.5173.4-171.3-164.8-49.1-163.6-1.9111.8L39 E40 I42 P43 F44 K51L39-R47 WeakPolarHBondContact O-CD 3.31Å; L39-R47 PolarHBondContact O-NE 3.36Å; L39-R47 PolarHBondContact O-NH2 3.17Å; E40-R47 PolarHBondContact O-NH2 2.96Å; I42-R47 HydrophobicContact CG2-CB 4.37Å; I42-R47 PolarHBondContact O-NE 3.16Å; I42-R47 PolarHBondContact O-NH2 3.27Å; P43-R47 PolarHBondContact O-N 3Å; F44-R47 WeakPolarHBondContact O-CB 3.3Å; F44-R47 PolarHBondContact O-N 3.01Å; R47-K51 WeakPolarHBondContact O-CB 3.29Å; R47-K51 WeakPolarHBondContact O-CG 3.41Å; R47-K51 PolarHBondContact O-N 3.42Å; R47-K51 VanDerWaalsContact O-N 3.08Å
48E88.3Confident83.2Confident101 Ų101113.2 Ų113.247%0.47253%0.529SS..Hα-helixtrans-68.8-43.8177.8-175.8169.7-148.800112.5F44 L46 M50 K51 S52F44-E48 WeakPolarHBondContact CE1-OE2 3.5Å; F44-E48 WeakPolarHBondContact O-CB 3.49Å; F44-E48 PolarHBondContact O-N 3.34Å; L46-E48 VanDerWaalsContact C-N 3.29Å; L46-E48 PolarHBondContact O-N 3.16Å; E48-M50 PolarHBondContact O-N 2.81Å; E48-K51 PolarHBondContact O-N 3.02Å; E48-S52 WeakPolarHBondContact O-CB 3.19Å; E48-S52 PolarHBondContact O-N 3.06Å
49I90.9Very high83.3Confident87 Ų87108 Ų10845%0.44651%0.511SS..Hα-helixtrans-61.4-43.8175.8-69.8164.2000111.1R45 L46 S52 K53R45-I49 HydrophobicContact CG-CD1 4.4Å; R45-I49 WeakPolarHBondContact O-CD1 3.48Å; R45-I49 WeakPolarHBondContact O-CG1 3.31Å; R45-I49 PolarHBondContact O-N 2.8Å; R45-I49 VanDerWaalsContact O-N 3.15Å; L46-I49 PolarHBondContact O-N 2.71Å; I49-S52 WeakPolarHBondContact O-CB 3.35Å; I49-S52 PolarHBondContact O-N 3.41Å; I49-S52 VanDerWaalsContact O-N 3.16Å; I49-K53 PolarHBondContact O-N 2.98Å
50M87.8Confident83Confident73 Ų73110.8 Ų110.836%0.3653%0.532SS..Hα-helixtrans-61.5-50.6176.5-72.1179.370.100111.5L46 E48 S52 K53 E54L46-M50 HydrophobicContact CD1-CG 4.4Å; L46-M50 HydrophobicContact CG-SD 4.31Å; L46-M50 WeakPolarHBondContact O-CG 3.44Å; L46-M50 PolarHBondContact O-N 3.04Å; E48-M50 PolarHBondContact O-N 2.81Å; M50-S52 PolarHBondContact O-N 2.97Å; M50-K53 PolarHBondContact O-N 3.34Å; M50-K53 VanDerWaalsContact O-N 3.14Å; M50-E54 WeakPolarHBondContact O-CG 3.35Å; M50-E54 PolarHBondContact O-N 2.81Å
51K86.6Confident82.4Confident94 Ų94108.6 Ų108.641%0.40953%0.531SS..Hα-helixtrans-56.5-34173.1-74.6-179.3177.6-173.90112.2R47 E48 R55R47-K51 WeakPolarHBondContact O-CB 3.29Å; R47-K51 WeakPolarHBondContact O-CG 3.41Å; R47-K51 PolarHBondContact O-N 3.42Å; R47-K51 VanDerWaalsContact O-N 3.08Å; E48-K51 PolarHBondContact O-N 3.02Å; K51-R55 VanDerWaalsContact O-CG 3.26Å; K51-R55 WeakPolarHBondContact O-CG 3Å; K51-R55 PolarHBondContact O-N 3.17Å; K51-R55 PolarHBondContact O-NE 3.37Å
52S84.9Confident81.5Confident55 Ų55106 Ų10639%0.38552%0.518SS..Hα-helixtrans-68.9-47.6175.9-146.90000112.5E48 I49 M50 E54 R55 M56E48-S52 WeakPolarHBondContact O-CB 3.19Å; E48-S52 PolarHBondContact O-N 3.06Å; I49-S52 WeakPolarHBondContact O-CB 3.35Å; I49-S52 PolarHBondContact O-N 3.41Å; I49-S52 VanDerWaalsContact O-N 3.16Å; M50-S52 PolarHBondContact O-N 2.97Å; S52-E54 VanDerWaalsContact C-N 3.31Å; S52-E54 PolarHBondContact O-N 3.28Å; S52-R55 PolarHBondContact O-N 3.2Å; S52-M56 WeakPolarHBondContact O-CG 3.48Å; S52-M56 PolarHBondContact O-N 3.13Å
53K87.2Confident80.7Confident156 Ų156105.1 Ų105.168%0.67852%0.517SS*.Hα-helixtrans-59.9-39.5174.7-75.6-171.6172.9-174.60112.1I49 M50 M56 K57I49-K53 PolarHBondContact O-N 2.98Å; M50-K53 PolarHBondContact O-N 3.34Å; M50-K53 VanDerWaalsContact O-N 3.14Å; K53-M56 PolarHBondContact O-N 2.81Å; K53-K57 WeakPolarHBondContact O-CB 3.44Å; K53-K57 PolarHBondContact O-N 3.19Å
54E83.4Confident79.3Confident105 Ų105108.1 Ų108.149%0.49152%0.52SS..Hα-helixtrans-63.1-44.5174-73.1172.6-17900112.5M50 S52 M56 K57 M58M50-E54 WeakPolarHBondContact O-CG 3.35Å; M50-E54 PolarHBondContact O-N 2.81Å; S52-E54 VanDerWaalsContact C-N 3.31Å; S52-E54 PolarHBondContact O-N 3.28Å; E54-M56 VanDerWaalsContact C-N 3.3Å; E54-M56 PolarHBondContact O-N 3.34Å; E54-K57 PolarHBondContact O-N 2.84Å; E54-M58 WeakPolarHBondContact O-CB 3.34Å; E54-M58 VanDerWaalsContact O-CG 3.31Å; E54-M58 WeakPolarHBondContact O-CG 3.48Å; E54-M58 PolarHBondContact O-N 3.04Å
55R81.1Confident78.3Confident119 Ų119109.2 Ų109.245%0.44953%0.525SS..Hα-helixtrans-60.2-39175-74.6177.6-62.4-1274112.3K51 S52K51-R55 VanDerWaalsContact O-CG 3.26Å; K51-R55 WeakPolarHBondContact O-CG 3Å; K51-R55 PolarHBondContact O-N 3.17Å; K51-R55 PolarHBondContact O-NE 3.37Å; S52-R55 PolarHBondContact O-N 3.2Å
56M77.5Confident77Confident155 Ų155105.7 Ų105.776%0.76452%0.519SS*.Hα-helixtrans-66.7-43.1173.8-65.3-62.2-74.300111.7S52 K53 E54 M58 G59S52-M56 WeakPolarHBondContact O-CG 3.48Å; S52-M56 PolarHBondContact O-N 3.13Å; K53-M56 PolarHBondContact O-N 2.81Å; E54-M56 VanDerWaalsContact C-N 3.3Å; E54-M56 PolarHBondContact O-N 3.34Å; M56-M58 VanDerWaalsContact C-N 3.33Å; M56-M58 PolarHBondContact O-N 3.15Å; M56-G59 PolarHBondContact O-N 3.06Å
57K84.6Confident75.8Confident192 Ų192110.4 Ų110.484%0.83553%0.53SS*.Hα-helixtrans-65.7-31.1178.7-170.7177.2-178.5179.50113.5K53 E54 G59K53-K57 WeakPolarHBondContact O-CB 3.44Å; K53-K57 PolarHBondContact O-N 3.19Å; E54-K57 PolarHBondContact O-N 2.84Å; K57-G59 VanDerWaalsContact C-N 3.33Å
58M74Confident74.3Confident112 Ų112115 Ų11555%0.55255%0.551SS**THydrogen-bonded Turntrans-82.5-6-177.4-73.2-66.9-128.700114.7E54 M56 K62E54-M58 WeakPolarHBondContact O-CB 3.34Å; E54-M58 VanDerWaalsContact O-CG 3.31Å; E54-M58 WeakPolarHBondContact O-CG 3.48Å; E54-M58 PolarHBondContact O-N 3.04Å; M56-M58 VanDerWaalsContact C-N 3.33Å; M56-M58 PolarHBondContact O-N 3.15Å; M58-K62 HydrophobicContact CB-CB 4.31Å; M58-K62 HydrophobicContact SD-CD 4.31Å
59G69.1Low72.8Confident22 Ų22112.9 Ų112.923%0.22755%0.551CS.*Hα-helixtrans74.9161.8176.700000115M56 K57 S61 K62 A63M56-G59 PolarHBondContact O-N 3.06Å; K57-G59 VanDerWaalsContact C-N 3.33Å; G59-S61 VanDerWaalsContact C-N 3.28Å; G59-S61 PolarHBondContact O-N 2.93Å; G59-K62 PolarHBondContact O-N 3.46Å; G59-A63 WeakPolarHBondContact O-CB 3.37Å; G59-A63 PolarHBondContact O-N 3.09Å; G59-A63 VanDerWaalsContact O-N 3.14Å
60P64.4Low71.1Confident109 Ų109113 Ų11371%0.70855%0.553SS**Hα-helixtrans-65.6-27.2-169.925.2-34.6000113.8K64P60-K64 WeakPolarHBondContact O-CB 3.32Å; P60-K64 PolarHBondContact O-N 3.14Å
61S62.2Low69.6Low90 Ų90112.1 Ų112.163%0.62956%0.557SS**Hα-helixtrans-69.6-44.9-179.756.70000112.7G59 K65G59-S61 VanDerWaalsContact C-N 3.28Å; G59-S61 PolarHBondContact O-N 2.93Å; S61-K65 PolarHBondContact O-N 3.43Å
62K62.7Low68Low122 Ų122114.2 Ų114.253%0.5357%0.571SS.*Hα-helixtrans-75.3-36.3176.8-63.6-175.4-179.4177.30111.5M58 G59 K64 K65 M66M58-K62 HydrophobicContact CB-CB 4.31Å; M58-K62 HydrophobicContact SD-CD 4.31Å; G59-K62 PolarHBondContact O-N 3.46Å; K62-K64 PolarHBondContact O-N 2.94Å; K62-K65 PolarHBondContact O-N 3.03Å; K62-K65 VanDerWaalsContact O-N 3.11Å; K62-M66 PolarHBondContact O-N 3.29Å
63A63.9Low66.5Low27 Ų27115.6 Ų115.622%0.22359%0.587CS.*Hα-helixtrans-60.9-42.6174.300000112.7G59 K65 R67G59-A63 WeakPolarHBondContact O-CB 3.37Å; G59-A63 PolarHBondContact O-N 3.09Å; G59-A63 VanDerWaalsContact O-N 3.14Å; A63-K65 VanDerWaalsContact C-N 3.31Å; A63-K65 PolarHBondContact O-N 3.28Å; A63-R67 WeakPolarHBondContact O-CB 3.46Å; A63-R67 PolarHBondContact O-N 2.86Å
64K63.2Low64.9Low159 Ų159115.3 Ų115.369%0.69159%0.591SS**Hα-helixtrans-62.7-35.6171.9-84.4-177.6174.4178.20112.6P60 K62 K68P60-K64 WeakPolarHBondContact O-CB 3.32Å; P60-K64 PolarHBondContact O-N 3.14Å; K62-K64 PolarHBondContact O-N 2.94Å; K64-K68 PolarHBondContact O-N 3.18Å
65K64.3Low62.8Low166 Ų166112.8 Ų112.872%0.72259%0.589SS**Hα-helixtrans-70.9-41.4-179.9-147.4172.8-172.1179.40111.9S61 K62 A63 K68 A69S61-K65 PolarHBondContact O-N 3.43Å; K62-K65 PolarHBondContact O-N 3.03Å; K62-K65 VanDerWaalsContact O-N 3.11Å; A63-K65 VanDerWaalsContact C-N 3.31Å; A63-K65 PolarHBondContact O-N 3.28Å; K65-K68 PolarHBondContact O-N 3.45Å; K65-A69 PolarHBondContact O-N 3.06Å; K65-A69 VanDerWaalsContact O-N 3.09Å
66M62.8Low61.1Low126 Ų126112.9 Ų112.962%0.62161%0.605SS**Hα-helixtrans-69.5-42.7172.3-63.3-162.583.700111.8K62 K68 A69 D70K62-M66 PolarHBondContact O-N 3.29Å; M66-K68 PolarHBondContact O-N 3.25Å; M66-A69 CarbonylContact O-C 3.55Å; M66-A69 WeakPolarHBondContact O-CA 3.44Å; M66-A69 PolarHBondContact O-N 3.12Å; M66-D70 WeakPolarHBondContact O-CB 3.44Å; M66-D70 VanDerWaalsContact O-CG 3.24Å; M66-D70 PolarHBondContact O-N 3.43Å
67R62.9Low59.7Low190 Ų190114.3 Ų114.372%0.71761%0.607SS**Hα-helixtrans-58.7-31.7172-79.1-168.6177.1-166.70.6113.3A63 A71A63-R67 WeakPolarHBondContact O-CB 3.46Å; A63-R67 PolarHBondContact O-N 2.86Å; R67-A71 WeakPolarHBondContact O-CB 3.5Å; R67-A71 PolarHBondContact O-N 2.92Å
68K58.6Low57.6Low155 Ų155110.8 Ų110.867%0.67460%0.604SS**Hα-helixtrans-69.5-39.5170.1-83.2-169.4172.7-169.80112.6K64 K65 M66 A71 I72K64-K68 PolarHBondContact O-N 3.18Å; K65-K68 PolarHBondContact O-N 3.45Å; M66-K68 PolarHBondContact O-N 3.25Å; K68-A71 CarbonylContact O-C 3.57Å; K68-I72 WeakPolarHBondContact O-CB 3.43Å; K68-I72 WeakPolarHBondContact O-CD1 3.41Å; K68-I72 WeakPolarHBondContact O-CG1 3.38Å; K68-I72 PolarHBondContact O-N 2.88Å
69A56.2Low56.3Low57 Ų57115.2 Ų115.247%0.47162%0.62SS.*Hα-helixtrans-67.9-45.6175.600000112K65 M66 A71 I72 A73K65-A69 PolarHBondContact O-N 3.06Å; K65-A69 VanDerWaalsContact O-N 3.09Å; M66-A69 CarbonylContact O-C 3.55Å; M66-A69 WeakPolarHBondContact O-CA 3.44Å; M66-A69 PolarHBondContact O-N 3.12Å; A69-A71 VanDerWaalsContact C-N 3.33Å; A69-A71 PolarHBondContact O-N 3.08Å; A69-I72 PolarHBondContact O-N 2.97Å; A69-A73 PolarHBondContact O-N 3.21Å
70D56.2Low54.9Low89 Ų89118.7 Ų118.748%0.47664%0.638SS.*Hα-helixtrans-63.5-38.4174.8-59.9-28.2000110.7M66 I72 A73 L74M66-D70 WeakPolarHBondContact O-CB 3.44Å; M66-D70 VanDerWaalsContact O-CG 3.24Å; M66-D70 PolarHBondContact O-N 3.43Å; D70-I72 VanDerWaalsContact C-N 3.33Å; D70-A73 CarbonylContact O-C 3.58Å; D70-A73 PolarHBondContact O-N 2.8Å; D70-L74 WeakPolarHBondContact O-CB 3.29Å; D70-L74 VanDerWaalsContact O-CD1 3.31Å; D70-L74 WeakPolarHBondContact O-CD1 3.47Å; D70-L74 PolarHBondContact O-N 2.82Å
71A54.9Low53.9Low55 Ų55117.1 Ų117.146%0.45564%0.642SS.*Hα-helixtrans-76.1-13.5172.500000114R67 K68 A69 A75R67-A71 WeakPolarHBondContact O-CB 3.5Å; R67-A71 PolarHBondContact O-N 2.92Å; K68-A71 CarbonylContact O-C 3.57Å; A69-A71 VanDerWaalsContact C-N 3.33Å; A69-A71 PolarHBondContact O-N 3.08Å; A71-A75 WeakPolarHBondContact O-CA 3.49Å; A71-A75 WeakPolarHBondContact O-CB 3.45Å; A71-A75 PolarHBondContact O-N 2.96Å
72I54Low52.9Low137 Ų137120.8 Ų120.870%0.70365%0.654SS**Hα-helixtrans-82.4-28.3166.4-73.9160.8000110K68 A69 D70K68-I72 WeakPolarHBondContact O-CB 3.43Å; K68-I72 WeakPolarHBondContact O-CD1 3.41Å; K68-I72 WeakPolarHBondContact O-CG1 3.38Å; K68-I72 PolarHBondContact O-N 2.88Å; A69-I72 PolarHBondContact O-N 2.97Å; D70-I72 VanDerWaalsContact C-N 3.33Å
73A53.4Low52.1Low85 Ų85118.1 Ų118.170%0.70266%0.655SS**Hα-helixtrans-79.6-27.717100000113.7A69 D70A69-A73 PolarHBondContact O-N 3.21Å; D70-A73 CarbonylContact O-C 3.58Å; D70-A73 PolarHBondContact O-N 2.8Å
74L52.8Low51.4Low149 Ų149121.5 Ų121.578%0.7867%0.673SS**SBendtrans-102-5.9175-87.695.6000114.4D70D70-L74 WeakPolarHBondContact O-CB 3.29Å; D70-L74 VanDerWaalsContact O-CD1 3.31Å; D70-L74 WeakPolarHBondContact O-CD1 3.47Å; D70-L74 PolarHBondContact O-N 2.82Å
75A40.9Very low50.8Low53 Ų53122.5 Ų122.544%0.43868%0.684SS.*SBendtrans-64.8129.9173.300000109.1A71 K77A71-A75 WeakPolarHBondContact O-CA 3.49Å; A71-A75 WeakPolarHBondContact O-CB 3.45Å; A71-A75 PolarHBondContact O-N 2.96Å; A75-K77 PolarHBondContact O-N 3.43Å
76P43.6Very low50.5Low120 Ų120119 Ų11978%0.77968%0.677SS**PPolyproline II helixtrans-58.9129.2158.47.61.5000107
77K49.2Very low51Low185 Ų185117.6 Ų117.680%0.80467%0.672SS**PPolyproline II helixtrans-52.6140167.4-66-123.2-179.81750108A75 K79A75-K77 PolarHBondContact O-N 3.43Å; K77-K79 PolarHBondContact O-N 2.97Å; K77-K79 VanDerWaalsContact O-N 3.12Å
78P41Very low51.9Low119 Ų119109.8 Ų109.877%0.77364%0.644SS**PPolyproline II helixtrans-56.1124.4176.325.4-33.7000107.7P80P78-P80 WeakPolarHBondContact O-CD 3.34Å; P78-P80 VanDerWaalsContact O-N 3.07Å
79K46.1Very low52.9Low204 Ų204107 Ų10789%0.88764%0.642SS**  trans-54.6113.7-177-69.6-178.4176.1-176.70109.6K77K77-K79 PolarHBondContact O-N 2.97Å; K77-K79 VanDerWaalsContact O-N 3.12Å
80P40.1Very low54.3Low96 Ų96110 Ų11062%0.62365%0.654SS**  trans-74.3129.9149.99.99.9000106.3P78 D82P78-P80 WeakPolarHBondContact O-CD 3.34Å; P78-P80 VanDerWaalsContact O-N 3.07Å; P80-D82 PolarHBondContact O-N 2.93Å
81G42.5Very low55.7Low76 Ų76107.5 Ų107.578%0.78464%0.642SS**SBendtrans-63.6128.6161.600000108.3A83G81-A83 PolarHBondContact O-N 3.37Å
82D42.7Very low57.3Low166 Ų166112.5 Ų112.589%0.88866%0.656SS**SBendtrans31.869173.9-69.6-25000117P80P80-D82 PolarHBondContact O-N 2.93Å
83A45.5Very low58.9Low67 Ų67110 Ų11055%0.55464%0.64SS**  trans-115.689.2146.700000107.7G81 I85G81-A83 PolarHBondContact O-N 3.37Å; A83-I85 PolarHBondContact O-N 3.24Å
84T48Very low60.8Low97 Ų97115.6 Ų115.660%0.59564%0.643SS**  trans-52.4139.8160.349.30000107.7V86 D87T84-V86 PolarHBondContact O-N 3.05Å; T84-D87 PolarHBondContact O-N 3.01Å; T84-D87 VanDerWaalsContact O-N 3.11Å
85I51.8Low62.7Low180 Ų180115.8 Ų115.892%0.92363%0.634SS**THydrogen-bonded Turntrans-59.8-7.2-169.3-66.3164.3000113.2A83A83-I85 PolarHBondContact O-N 3.24Å
86V57.9Low65.1Low93 Ų93119.4 Ų119.456%0.56464%0.639SS**THydrogen-bonded Turntrans-94.5-18.7-174.7-160.90000113T84 Q122 R125T84-V86 PolarHBondContact O-N 3.05Å; V86-Q122 PolarHBondContact O-NE2 2.92Å; V86-R125 PolarHBondContact O-NH2 3.46Å
87D72.8Confident67.3Low96 Ų96124.4 Ų124.451%0.51365%0.649SS.*PPolyproline II helixtrans-102140.5-170.2-145.115.6000116T84 R125T84-D87 PolarHBondContact O-N 3.01Å; T84-D87 VanDerWaalsContact O-N 3.11Å; D87-R125 IonicContact OD1-CZ 3.85Å; D87-R125 IonicContact OD1-NH1 3.25Å; D87-R125 PolarHBondContact OD1-NH1 3.16Å; D87-R125 VanDerWaalsContact OD1-NH1 3.09Å; D87-R125 IonicContact OD1-NH2 3.32Å; D87-R125 PolarHBondContact OD1-NH2 2.92Å
88I80.8Confident69.4Low26 Ų26125.8 Ų125.813%0.13366%0.655CS.*PPolyproline II helixtrans-84.8126-175.2-72.7161.7000109.2V90 V115 L118 T119 Q122I88-V90 PolarHBondContact O-N 2.82Å; I88-V115 HydrophobicContact CG2-CG1 4.1Å; I88-V115 HydrophobicContact CG2-CG2 4.2Å; I88-L118 HydrophobicContact CD1-CB 3.58Å; I88-L118 HydrophobicContact CG1-CB 3.77Å; I88-L118 HydrophobicContact CG1-CD1 4.37Å; I88-L118 HydrophobicContact CG2-CD1 4.25Å; I88-T119 VanDerWaalsContact CD1-N 3.27Å; I88-T119 WeakPolarHBondContact CD1-OG1 3.27Å; I88-Q122 HydrophobicContact CD1-CG 4.13Å
89P81.2Confident71.8Confident98 Ų98121.7 Ų121.764%0.63663%0.625SS**PPolyproline II helixtrans-65.7122.5177.927.2-34.2000110.5P91P89-P91 VanDerWaalsContact O-CD 3.25Å; P89-P91 WeakPolarHBondContact O-CD 3.48Å
90V84.5Confident74.2Confident118 Ų118115.3 Ų115.372%0.71561%0.606SS**PPolyproline II helixtrans-71.6116.3177.1-178.90000109.8I88I88-V90 PolarHBondContact O-N 2.82Å
91P87.1Confident76.7Confident37 Ų37116.6 Ų116.624%0.2460%0.604CS.*PPolyproline II helixtrans-73.3140.2-179.5-17.132.3000112.2P89 F93 E111 V115P89-P91 VanDerWaalsContact O-CD 3.25Å; P89-P91 WeakPolarHBondContact O-CD 3.48Å; P91-F93 HydrophobicContact CB-CD1 4.49Å; P91-F93 HydrophobicContact CB-CE1 3.85Å; P91-F93 HydrophobicContact CB-CZ 3.92Å; P91-F93 HydrophobicContact CG-CZ 4.26Å; P91-E111 HydrophobicContact CB-CB 4.39Å; P91-E111 HydrophobicContact CG-CB 4.49Å; P91-V115 HydrophobicContact CG-CG2 3.45Å; P91-V115 VanDerWaalsContact CG-CG2 3.45Å
92H87.3Confident79.2Confident160 Ų160121.6 Ų121.674%0.74160%0.604SS**  trans-93.9100.5174.6-66.6-51.9000111.6R94H92-R94 VanDerWaalsContact C-N 3.34Å; H92-R94 PolarHBondContact O-N 2.7Å
93F88.7Confident81.7Confident84 Ų84115.9 Ų115.937%0.36858%0.575SS.*  trans-7580.8178-56.9-52.3000112.3P91 Y104 M108 E111 A112P91-F93 HydrophobicContact CB-CD1 4.49Å; P91-F93 HydrophobicContact CB-CE1 3.85Å; P91-F93 HydrophobicContact CB-CZ 3.92Å; P91-F93 HydrophobicContact CG-CZ 4.26Å; F93-Y104 PolarHBondContact O-OH 3.24Å; F93-M108 HydrophobicContact CB-CG 4.41Å; F93-M108 HydrophobicContact CD1-CB 4.08Å; F93-M108 HydrophobicContact CD1-CG 3.63Å; F93-M108 HydrophobicContact CD2-CG 4.45Å; F93-M108 HydrophobicContact CE1-CB 4.37Å; F93-M108 HydrophobicContact CE1-CG 3.93Å; F93-M108 HydrophobicContact CG-CG 3.91Å; F93-M108 HydrophobicContact CZ-CG 4.47Å; F93-E111 HydrophobicContact CE1-CB 3.73Å; F93-E111 WeakPolarHBondContact CE1-OE2 3Å; F93-E111 HydrophobicContact CZ-CB 4.38Å; F93-A112 HydrophobicContact CZ-CB 4.32Å
94R92.1Very high84.1Confident204 Ų204114.6 Ų114.677%0.7756%0.557SS**  trans-121.7135.5168.8-59.7-174.573.6179.94.3110.1H92 R107H92-R94 VanDerWaalsContact C-N 3.34Å; H92-R94 PolarHBondContact O-N 2.7Å; R94-R107 PolarHBondContact O-NH2 2.94Å
95R92.9Very high86.3Confident153 Ų153114 Ų11458%0.57755%0.549SS*.  trans-70.1130.9174.8-173.3168.977.3-173.45.7110.1E99 Y104R95-E99 HydrophobicContact CG-CB 4.28Å; R95-E99 HydrophobicContact CG-CG 4.47Å; R95-Y104 HydrophobicContact CB-CD2 3.81Å; R95-Y104 HydrophobicContact CB-CE2 4.2Å; R95-Y104 HydrophobicContact CB-CG 4Å; R95-Y104 HydrophobicContact CG-CD2 4.28Å; R95-Y104 HydrophobicContact CG-CG 4.12Å
96K91.3Very high88.4Confident128 Ų128113.1 Ų113.156%0.55753%0.534SS*.  trans-79.7154-179.2-59.8170.9-177.3173.80110.9K98 E99K96-K98 PolarHBondContact O-N 3.38Å; K96-E99 HydrophobicContact CB-CB 3.87Å; K96-E99 PolarHBondContact N-OE2 2.91Å; K96-E99 WeakPolarHBondContact O-CB 3.29Å; K96-E99 PolarHBondContact O-N 3.41Å
97K90.5Very high90.1Very high225 Ų225110.7 Ų110.798%0.97852%0.515SS*.THydrogen-bonded Turntrans-55.7-22.9-174.7-68-173.6176.2-175.40115.7
98K91.9Very high91.2Very high214 Ų214109.1 Ų109.193%0.9351%0.506SS*.THydrogen-bonded Turntrans-119.716.8179.3-61.2-172.9176.7-173.80113K96K96-K98 PolarHBondContact O-N 3.38Å
99E92.8Very high91.9Very high33 Ų33109.1 Ų109.115%0.15451%0.512CS..  trans-100124.5-176.7-177.8174.6-133.600109.8R95 K96 T103 R107R95-E99 HydrophobicContact CG-CB 4.28Å; R95-E99 HydrophobicContact CG-CG 4.47Å; K96-E99 HydrophobicContact CB-CB 3.87Å; K96-E99 PolarHBondContact N-OE2 2.91Å; K96-E99 WeakPolarHBondContact O-CB 3.29Å; K96-E99 PolarHBondContact O-N 3.41Å; E99-T103 WeakPolarHBondContact CG-OG1 3.36Å; E99-R107 IonicContact OE1-CZ 3.05Å; E99-R107 IonicContact OE1-NE 3.43Å; E99-R107 PolarHBondContact OE1-NE 3.17Å; E99-R107 IonicContact OE1-NH2 2.79Å; E99-R107 PolarHBondContact OE1-NH2 3.38Å; E99-R107 IonicContact OE2-CZ 2.95Å; E99-R107 IonicContact OE2-NE 3.94Å; E99-R107 IonicContact OE2-NH2 2.75Å; E99-R107 PolarHBondContact OE2-NH2 3.33Å
100S95.2Very high92.5Very high70 Ų70108.9 Ų108.949%0.4951%0.505SS..  trans-72.7154.8173.8680000110.7K102 T103 Y104S100-K102 VanDerWaalsContact C-N 3.32Å; S100-K102 PolarHBondContact O-N 3.48Å; S100-T103 PolarHBondContact N-OG1 2.85Å; S100-T103 VanDerWaalsContact N-OG1 3.07Å; S100-T103 PolarHBondContact O-N 3.19Å; S100-T103 PolarHBondContact O-OG1 2.78Å; S100-T103 PolarHBondContact OG-OG1 3.48Å; S100-Y104 PolarHBondContact O-N 3.03Å
101E93.4Very high92.9Very high123 Ų123105.9 Ų105.958%0.57548%0.483SS*.Hα-helixtrans-56.5-43.3-177.6-172.2174.8170.200113.4T103 Y104 L105E101-T103 VanDerWaalsContact C-N 3.29Å; E101-T103 PolarHBondContact O-N 2.88Å; E101-Y104 WeakPolarHBondContact O-CB 3.22Å; E101-Y104 PolarHBondContact O-N 2.89Å; E101-L105 HydrophobicContact CG-CD1 4.26Å; E101-L105 WeakPolarHBondContact O-CG 3.37Å; E101-L105 PolarHBondContact O-N 2.98Å
102K94.9Very high93.2Very high181 Ų181106.2 Ų106.279%0.78749%0.489SS*.Hα-helixtrans-61.2-35.3175.5-64.3-175179.1-178.10112.8S100 R106S100-K102 VanDerWaalsContact C-N 3.32Å; S100-K102 PolarHBondContact O-N 3.48Å; K102-R106 WeakPolarHBondContact O-CB 3.49Å; K102-R106 PolarHBondContact O-N 3.03Å
103T95.1Very high93.5Very high46 Ų46105.1 Ų105.128%0.28249%0.485SS..Hα-helixtrans-76.5-34.7176.949.10000112.3E99 S100 E101 R107E99-T103 WeakPolarHBondContact CG-OG1 3.36Å; S100-T103 PolarHBondContact N-OG1 2.85Å; S100-T103 VanDerWaalsContact N-OG1 3.07Å; S100-T103 PolarHBondContact O-N 3.19Å; S100-T103 PolarHBondContact O-OG1 2.78Å; S100-T103 PolarHBondContact OG-OG1 3.48Å; E101-T103 VanDerWaalsContact C-N 3.29Å; E101-T103 PolarHBondContact O-N 2.88Å; T103-R107 WeakPolarHBondContact O-CB 3.34Å; T103-R107 PolarHBondContact O-N 2.89Å
104Y95.3Very high93.6Very high41 Ų41106.3 Ų106.316%0.16149%0.491CS..Hα-helixtrans-60.9-52.5170.7170.4-106.6000112.4F93 R95 S100 E101 R106 R107 M108F93-Y104 PolarHBondContact O-OH 3.24Å; R95-Y104 HydrophobicContact CB-CD2 3.81Å; R95-Y104 HydrophobicContact CB-CE2 4.2Å; R95-Y104 HydrophobicContact CB-CG 4Å; R95-Y104 HydrophobicContact CG-CD2 4.28Å; R95-Y104 HydrophobicContact CG-CG 4.12Å; S100-Y104 PolarHBondContact O-N 3.03Å; E101-Y104 WeakPolarHBondContact O-CB 3.22Å; E101-Y104 PolarHBondContact O-N 2.89Å; Y104-R106 VanDerWaalsContact C-N 3.31Å; Y104-R106 PolarHBondContact O-N 3.29Å; Y104-R107 PolarHBondContact O-N 3.22Å; Y104-R107 VanDerWaalsContact O-N 3.12Å; Y104-M108 HydrophobicContact CE1-SD 4.17Å; Y104-M108 WeakPolarHBondContact O-CB 3.49Å; Y104-M108 PolarHBondContact O-N 3.41Å
105L95.4Very high93.6Very high84 Ų8498.4 Ų98.444%0.4447%0.465SS..Hα-helixtrans-59.6-41180-69.4172.5000111.9E101 M108 G109E101-L105 HydrophobicContact CG-CD1 4.26Å; E101-L105 WeakPolarHBondContact O-CG 3.37Å; E101-L105 PolarHBondContact O-N 2.98Å; L105-M108 HydrophobicContact CD2-CE 3.95Å; L105-G109 PolarHBondContact O-N 2.91Å
106R95.3Very high93.5Very high161 Ų16195.5 Ų95.561%0.60846%0.461SS*.Hα-helixtrans-63-44174.5-172.5179.869.1-155.72.6112.2K102 Y104 G109 N110K102-R106 WeakPolarHBondContact O-CB 3.49Å; K102-R106 PolarHBondContact O-N 3.03Å; Y104-R106 VanDerWaalsContact C-N 3.31Å; Y104-R106 PolarHBondContact O-N 3.29Å; R106-G109 PolarHBondContact O-N 3.41Å; R106-N110 WeakPolarHBondContact O-CB 3.48Å; R106-N110 PolarHBondContact O-N 2.98Å; R106-N110 PolarHBondContact O-OD1 2.83Å
107R94.8Very high93.5Very high42 Ų4295.1 Ų95.116%0.15846%0.459CS..Hα-helixtrans-65-47.1178.2177.9173.362.777.5-0.4111.4R94 E99 T103 Y104 G109 N110 E111R94-R107 PolarHBondContact O-NH2 2.94Å; E99-R107 IonicContact OE1-CZ 3.05Å; E99-R107 IonicContact OE1-NE 3.43Å; E99-R107 PolarHBondContact OE1-NE 3.17Å; E99-R107 IonicContact OE1-NH2 2.79Å; E99-R107 PolarHBondContact OE1-NH2 3.38Å; E99-R107 IonicContact OE2-CZ 2.95Å; E99-R107 IonicContact OE2-NE 3.94Å; E99-R107 IonicContact OE2-NH2 2.75Å; E99-R107 PolarHBondContact OE2-NH2 3.33Å; T103-R107 WeakPolarHBondContact O-CB 3.34Å; T103-R107 PolarHBondContact O-N 2.89Å; Y104-R107 PolarHBondContact O-N 3.22Å; Y104-R107 VanDerWaalsContact O-N 3.12Å; R107-G109 VanDerWaalsContact C-N 3.34Å; R107-G109 PolarHBondContact O-N 3.01Å; R107-N110 PolarHBondContact O-N 3.31Å; R107-E111 WeakPolarHBondContact CD-OE1 3.49Å; R107-E111 HydrophobicContact CG-CG 4.31Å; R107-E111 WeakPolarHBondContact CG-OE1 3.31Å; R107-E111 IonicContact CZ-OE1 3.69Å; R107-E111 IonicContact NE-OE1 3.34Å; R107-E111 IonicContact NH1-OE1 3.24Å; R107-E111 PolarHBondContact NH1-OE1 3.37Å; R107-E111 IonicContact NH1-OE2 3.79Å; R107-E111 PolarHBondContact NH1-OE2 3.41Å; R107-E111 WeakPolarHBondContact O-CB 3.39Å; R107-E111 WeakPolarHBondContact O-CG 3.26Å; R107-E111 PolarHBondContact O-N 3.23Å
108M94.7Very high93.5Very high64 Ų6486.9 Ų86.932%0.31543%0.426SS..Hα-helixtrans-56.1-46.8175.4-178.3-168.881.600111.3F93 Y104 L105 E111 A112F93-M108 HydrophobicContact CB-CG 4.41Å; F93-M108 HydrophobicContact CD1-CB 4.08Å; F93-M108 HydrophobicContact CD1-CG 3.63Å; F93-M108 HydrophobicContact CD2-CG 4.45Å; F93-M108 HydrophobicContact CE1-CB 4.37Å; F93-M108 HydrophobicContact CE1-CG 3.93Å; F93-M108 HydrophobicContact CG-CG 3.91Å; F93-M108 HydrophobicContact CZ-CG 4.47Å; Y104-M108 HydrophobicContact CE1-SD 4.17Å; Y104-M108 WeakPolarHBondContact O-CB 3.49Å; Y104-M108 PolarHBondContact O-N 3.41Å; L105-M108 HydrophobicContact CD2-CE 3.95Å; M108-E111 PolarHBondContact O-N 3.36Å; M108-A112 VanDerWaalsContact O-CB 3.31Å; M108-A112 WeakPolarHBondContact O-CB 3.39Å; M108-A112 PolarHBondContact O-N 3.18Å
109G94.9Very high93.2Very high26 Ų2680 Ų8027%0.26840%0.402SS..Hα-helixtrans-60.9-46.3176.300000113.1L105 R106 R107 A112 Q113L105-G109 PolarHBondContact O-N 2.91Å; R106-G109 PolarHBondContact O-N 3.41Å; R107-G109 VanDerWaalsContact C-N 3.34Å; R107-G109 PolarHBondContact O-N 3.01Å; G109-A112 PolarHBondContact O-N 3.09Å; G109-Q113 WeakPolarHBondContact O-CB 3.41Å; G109-Q113 WeakPolarHBondContact O-CG 3.38Å; G109-Q113 PolarHBondContact O-N 3.03Å
110N94.3Very high92.9Very high92 Ų9286 Ų8649%0.49243%0.428SS..Hα-helixtrans-64.2-43.9177.8-68.25.2000112.2R106 R107 Q113 H114R106-N110 WeakPolarHBondContact O-CB 3.48Å; R106-N110 PolarHBondContact O-N 2.98Å; R106-N110 PolarHBondContact O-OD1 2.83Å; R107-N110 PolarHBondContact O-N 3.31Å; N110-Q113 PolarHBondContact O-N 2.87Å; N110-H114 WeakPolarHBondContact O-CB 3.48Å; N110-H114 PolarHBondContact O-N 3.45Å
111E93.6Very high92.3Very high56 Ų5687.8 Ų87.826%0.26243%0.431SS..Hα-helixtrans-63-42.6176.9-77.6169.8-163.600111P91 F93 R107 M108 H114 V115P91-E111 HydrophobicContact CB-CB 4.39Å; P91-E111 HydrophobicContact CG-CB 4.49Å; F93-E111 HydrophobicContact CE1-CB 3.73Å; F93-E111 WeakPolarHBondContact CE1-OE2 3Å; F93-E111 HydrophobicContact CZ-CB 4.38Å; R107-E111 WeakPolarHBondContact CD-OE1 3.49Å; R107-E111 HydrophobicContact CG-CG 4.31Å; R107-E111 WeakPolarHBondContact CG-OE1 3.31Å; R107-E111 IonicContact CZ-OE1 3.69Å; R107-E111 IonicContact NE-OE1 3.34Å; R107-E111 IonicContact NH1-OE1 3.24Å; R107-E111 PolarHBondContact NH1-OE1 3.37Å; R107-E111 IonicContact NH1-OE2 3.79Å; R107-E111 PolarHBondContact NH1-OE2 3.41Å; R107-E111 WeakPolarHBondContact O-CB 3.39Å; R107-E111 WeakPolarHBondContact O-CG 3.26Å; R107-E111 PolarHBondContact O-N 3.23Å; M108-E111 PolarHBondContact O-N 3.36Å; E111-H114 PolarHBondContact O-N 3.07Å; E111-V115 WeakPolarHBondContact O-CG2 3.38Å; E111-V115 PolarHBondContact O-N 2.95Å
112A93.3Very high91.6Very high44 Ų4485 Ų8536%0.36442%0.418SS..Hα-helixtrans-66.1-43176.100000113.1F93 M108 G109 H114 V115 L116F93-A112 HydrophobicContact CZ-CB 4.32Å; M108-A112 VanDerWaalsContact O-CB 3.31Å; M108-A112 WeakPolarHBondContact O-CB 3.39Å; M108-A112 PolarHBondContact O-N 3.18Å; G109-A112 PolarHBondContact O-N 3.09Å; A112-H114 VanDerWaalsContact C-N 3.28Å; A112-H114 PolarHBondContact O-N 3.36Å; A112-V115 PolarHBondContact O-N 2.84Å; A112-L116 WeakPolarHBondContact O-CB 3.41Å; A112-L116 PolarHBondContact O-N 3.43Å
113Q93.8Very high90.5Very high137 Ų13783.8 Ų83.864%0.6442%0.419SS*.Hα-helixtrans-60.5-38.8172.8-75.6176.7-6.200111.8G109 N110 L116 F117G109-Q113 WeakPolarHBondContact O-CB 3.41Å; G109-Q113 WeakPolarHBondContact O-CG 3.38Å; G109-Q113 PolarHBondContact O-N 3.03Å; N110-Q113 PolarHBondContact O-N 2.87Å; Q113-L116 PolarHBondContact O-N 3.27Å; Q113-F117 WeakPolarHBondContact O-CB 3.23Å; Q113-F117 PolarHBondContact O-N 2.93Å
114H91.3Very high89.3Confident108 Ų10888.3 Ų88.350%0.544%0.437SS..Hα-helixtrans-68.3-44178.5-174.851000112.4N110 E111 A112 F117 L118N110-H114 WeakPolarHBondContact O-CB 3.48Å; N110-H114 PolarHBondContact O-N 3.45Å; E111-H114 PolarHBondContact O-N 3.07Å; A112-H114 VanDerWaalsContact C-N 3.28Å; A112-H114 PolarHBondContact O-N 3.36Å; H114-F117 WeakPolarHBondContact O-CB 3.3Å; H114-F117 PolarHBondContact O-N 3.43Å; H114-L118 WeakPolarHBondContact O-CG 3.38Å; H114-L118 PolarHBondContact O-N 2.7Å
115V91.4Very high88.1Confident38 Ų3892.6 Ų92.623%0.2345%0.453CS..Hα-helixtrans-58.2-49.3172.51670000110.7I88 P91 E111 A112 F117 L118 T119I88-V115 HydrophobicContact CG2-CG1 4.1Å; I88-V115 HydrophobicContact CG2-CG2 4.2Å; P91-V115 HydrophobicContact CG-CG2 3.45Å; P91-V115 VanDerWaalsContact CG-CG2 3.45Å; E111-V115 WeakPolarHBondContact O-CG2 3.38Å; E111-V115 PolarHBondContact O-N 2.95Å; A112-V115 PolarHBondContact O-N 2.84Å; V115-F117 VanDerWaalsContact C-N 3.28Å; V115-F117 PolarHBondContact O-N 2.99Å; V115-L118 PolarHBondContact O-N 2.9Å; V115-L118 VanDerWaalsContact O-N 3.08Å; V115-T119 PolarHBondContact O-N 3.14Å; V115-T119 PolarHBondContact O-OG1 3.38Å
116L90.6Very high86.6Confident93 Ų9394.8 Ų94.849%0.48746%0.455SS..Hα-helixtrans-59.2-38.9177.9-179.363000112.3A112 Q113 K120A112-L116 WeakPolarHBondContact O-CB 3.41Å; A112-L116 PolarHBondContact O-N 3.43Å; Q113-L116 PolarHBondContact O-N 3.27Å; L116-K120 HydrophobicContact CG-CD 4.44Å; L116-K120 VanDerWaalsContact O-CG 3.32Å; L116-K120 WeakPolarHBondContact O-CG 3.3Å; L116-K120 PolarHBondContact O-N 3.49Å; L116-K120 VanDerWaalsContact O-N 3.07Å
117F91.8Very high85.1Confident119 Ų11991.2 Ų91.252%0.52245%0.453SS..Hα-helixtrans-63.1-47.4173.2171.9-93.7000111.5Q113 H114 V115 T119 K120 N121Q113-F117 WeakPolarHBondContact O-CB 3.23Å; Q113-F117 PolarHBondContact O-N 2.93Å; H114-F117 WeakPolarHBondContact O-CB 3.3Å; H114-F117 PolarHBondContact O-N 3.43Å; V115-F117 VanDerWaalsContact C-N 3.28Å; V115-F117 PolarHBondContact O-N 2.99Å; F117-T119 VanDerWaalsContact C-N 3.35Å; F117-T119 PolarHBondContact O-N 2.99Å; F117-K120 PolarHBondContact O-N 2.98Å; F117-N121 VanDerWaalsContact CE2-ND2 3.31Å; F117-N121 WeakPolarHBondContact CE2-ND2 3.42Å; F117-N121 VanDerWaalsContact CZ-ND2 3.32Å; F117-N121 WeakPolarHBondContact CZ-ND2 3.27Å; F117-N121 PolarHBondContact O-N 3.28Å; F117-N121 PolarHBondContact O-ND2 3.05Å
118L89.4Confident83.8Confident53 Ų5397.2 Ų97.228%0.27748%0.483SS..Hα-helixtrans-61.1-43.8177.4-66.7174.2000111.3I88 H114 V115 K120 N121 Q122I88-L118 HydrophobicContact CD1-CB 3.58Å; I88-L118 HydrophobicContact CG1-CB 3.77Å; I88-L118 HydrophobicContact CG1-CD1 4.37Å; I88-L118 HydrophobicContact CG2-CD1 4.25Å; H114-L118 WeakPolarHBondContact O-CG 3.38Å; H114-L118 PolarHBondContact O-N 2.7Å; V115-L118 PolarHBondContact O-N 2.9Å; V115-L118 VanDerWaalsContact O-N 3.08Å; L118-K120 VanDerWaalsContact C-N 3.35Å; L118-K120 PolarHBondContact O-N 2.66Å; L118-N121 CarbonylContact O-C 3.57Å; L118-N121 PolarHBondContact O-N 3.41Å; L118-Q122 PolarHBondContact O-N 3.48Å
119T85.6Confident82Confident70 Ų70101 Ų10143%0.42949%0.493SS..Hα-helixtrans-60.1-43.3178.9-530000111.5I88 V115 F117 N121 Q122I88-T119 VanDerWaalsContact CD1-N 3.27Å; I88-T119 WeakPolarHBondContact CD1-OG1 3.27Å; V115-T119 PolarHBondContact O-N 3.14Å; V115-T119 PolarHBondContact O-OG1 3.38Å; F117-T119 VanDerWaalsContact C-N 3.35Å; F117-T119 PolarHBondContact O-N 2.99Å; T119-N121 PolarHBondContact O-N 3.31Å; T119-Q122 PolarHBondContact O-N 2.93Å
120K87.1Confident80Confident159 Ų159105.5 Ų105.569%0.69151%0.507SS*.Hα-helixtrans-65.3-19.9176.5-74.6176.7177.7-174.20114.3L116 F117 L118L116-K120 HydrophobicContact CG-CD 4.44Å; L116-K120 VanDerWaalsContact O-CG 3.32Å; L116-K120 WeakPolarHBondContact O-CG 3.3Å; L116-K120 PolarHBondContact O-N 3.49Å; L116-K120 VanDerWaalsContact O-N 3.07Å; F117-K120 PolarHBondContact O-N 2.98Å; L118-K120 VanDerWaalsContact C-N 3.35Å; L118-K120 PolarHBondContact O-N 2.66Å
121N83.2Confident78.1Confident107 Ų107106.8 Ų106.857%0.57251%0.514SS*.THydrogen-bonded Turntrans-100.82.4177.7-70.5-74.7000112.9F117 L118 T119F117-N121 VanDerWaalsContact CE2-ND2 3.31Å; F117-N121 WeakPolarHBondContact CE2-ND2 3.42Å; F117-N121 VanDerWaalsContact CZ-ND2 3.32Å; F117-N121 WeakPolarHBondContact CZ-ND2 3.27Å; F117-N121 PolarHBondContact O-N 3.28Å; F117-N121 PolarHBondContact O-ND2 3.05Å; L118-N121 CarbonylContact O-C 3.57Å; L118-N121 PolarHBondContact O-N 3.41Å; T119-N121 PolarHBondContact O-N 3.31Å
122Q78.3Confident76Confident64 Ų64111.4 Ų111.430%0.29954%0.535SS..SBendtrans-80.4141.4170-76.1179.9-3300110.6V86 I88 L118 T119V86-Q122 PolarHBondContact O-NE2 2.92Å; I88-Q122 HydrophobicContact CD1-CG 4.13Å; L118-Q122 PolarHBondContact O-N 3.48Å; T119-Q122 PolarHBondContact O-N 2.93Å
123I70.8Confident74.1Confident155 Ų155115.3 Ų115.380%0.79555%0.546SS*.  trans-67.2140165.4-58.4169.4000107.6R125I123-R125 PolarHBondContact O-N 3.37Å
124E71.8Confident71.9Confident142 Ų142115.2 Ų115.266%0.66455%0.546SS*.  trans-50.3113.8172.2-71.7-177.917200110.4R126E124-R126 PolarHBondContact O-N 2.9Å; E124-R126 VanDerWaalsContact O-N 3.16Å; E124-R126 IonicContact OE2-CZ 3.25Å; E124-R126 IonicContact OE2-NE 2.99Å; E124-R126 PolarHBondContact OE2-NE 3.35Å; E124-R126 IonicContact OE2-NH2 2.66Å; E124-R126 PolarHBondContact OE2-NH2 3.09Å
125R69.8Low70.1Confident130 Ų130118.6 Ų118.649%0.49156%0.561SS.*  trans-70.4114172.2-61.9-174-165.4143.4-0.7108.2V86 D87 I123 P127V86-R125 PolarHBondContact O-NH2 3.46Å; D87-R125 IonicContact OD1-CZ 3.85Å; D87-R125 IonicContact OD1-NH1 3.25Å; D87-R125 PolarHBondContact OD1-NH1 3.16Å; D87-R125 VanDerWaalsContact OD1-NH1 3.09Å; D87-R125 IonicContact OD1-NH2 3.32Å; D87-R125 PolarHBondContact OD1-NH2 2.92Å; I123-R125 PolarHBondContact O-N 3.37Å; R125-P127 WeakPolarHBondContact O-CD 3.46Å
126R63.9Low68.2Low130 Ų130124.7 Ų124.749%0.49159%0.585SS.*  trans-107.475.1170.8-63.1-174.6-175.6-163.10.5108.3E124 E128 R129 E130E124-R126 PolarHBondContact O-N 2.9Å; E124-R126 VanDerWaalsContact O-N 3.16Å; E124-R126 IonicContact OE2-CZ 3.25Å; E124-R126 IonicContact OE2-NE 2.99Å; E124-R126 PolarHBondContact OE2-NE 3.35Å; E124-R126 IonicContact OE2-NH2 2.66Å; E124-R126 PolarHBondContact OE2-NH2 3.09Å; R126-E128 PolarHBondContact O-N 3.07Å; R126-E128 VanDerWaalsContact O-N 3.11Å; R126-R129 HydrophobicContact CB-CB 4.19Å; R126-R129 PolarHBondContact O-N 2.99Å; R126-E130 PolarHBondContact O-N 3.38Å
127P63.8Low66Low86 Ų86125.9 Ų125.956%0.55860%0.598SS**Hα-helixtrans-58.3-27.5-175.225-35.1000112.5R125 R129 E130R125-P127 WeakPolarHBondContact O-CD 3.46Å; P127-R129 PolarHBondContact O-N 2.92Å; P127-E130 PolarHBondContact O-N 3.49Å
128E66.9Low63.8Low169 Ų169125.4 Ų125.479%0.7962%0.616SS**Hα-helixtrans-67.6-30.5176-61.7176.3174.700113.1R126R126-E128 PolarHBondContact O-N 3.07Å; R126-E128 VanDerWaalsContact O-N 3.11Å
129R57.1Low61.5Low143 Ų143125.6 Ų125.654%0.5463%0.631SS.*Hα-helixtrans-72.8-35.1172.8-94.6-169.8176.2177.3-3.4112.6R126 P127 L131 E132 E133R126-R129 HydrophobicContact CB-CB 4.19Å; R126-R129 PolarHBondContact O-N 2.99Å; P127-R129 PolarHBondContact O-N 2.92Å; R129-L131 PolarHBondContact O-N 3.15Å; R129-E132 PolarHBondContact O-N 2.9Å; R129-E133 PolarHBondContact O-N 3.37Å
130E52.8Low59.6Low120 Ų120129.7 Ų129.756%0.56166%0.656SS**Hα-helixtrans-65.9-21.7178.7-83.6-175.6162.800112.6R126 P127 Q134R126-E130 PolarHBondContact O-N 3.38Å; P127-E130 PolarHBondContact O-N 3.49Å; E130-Q134 WeakPolarHBondContact O-CB 3.44Å; E130-Q134 WeakPolarHBondContact O-CG 3.39Å; E130-Q134 PolarHBondContact O-N 3.42Å; E130-Q134 PolarHBondContact O-NE2 3.12Å
131L53.9Low57.8Low119 Ų119124.9 Ų124.962%0.62365%0.652SS**Hα-helixtrans-70.2-42.3172.1-68.5173.2000112R129 E133R129-L131 PolarHBondContact O-N 3.15Å; L131-E133 VanDerWaalsContact C-N 3.33Å
132E50.3Low56.4Low154 Ų154126.7 Ų126.772%0.7266%0.655SS**Hα-helixtrans-71.4-28.9177.4-162.7176-164.300112.2R129R129-E132 PolarHBondContact O-N 2.9Å
133E51.8Low55.3Low126 Ų126127.1 Ų127.159%0.58966%0.664SS**Hα-helixtrans-86.7-26.5175.3-67.8-178.3-170.200113.5R129 L131 E135 K136R129-E133 PolarHBondContact O-N 3.37Å; L131-E133 VanDerWaalsContact C-N 3.33Å; E133-E135 VanDerWaalsContact C-N 3.29Å; E133-E135 PolarHBondContact O-N 2.75Å; E133-K136 CarbonylContact O-C 3.51Å; E133-K136 VanDerWaalsContact O-C 3.27Å; E133-K136 WeakPolarHBondContact O-CA 3.27Å; E133-K136 PolarHBondContact O-N 2.94Å
134Q48.5Very low54.9Low135 Ų135129.3 Ų129.363%0.63167%0.668SS**Hα-helixtrans-67-25.1176.3-87.8175.759.100113.7E130 K136E130-Q134 WeakPolarHBondContact O-CB 3.44Å; E130-Q134 WeakPolarHBondContact O-CG 3.39Å; E130-Q134 PolarHBondContact O-N 3.42Å; E130-Q134 PolarHBondContact O-NE2 3.12Å; Q134-K136 PolarHBondContact O-N 3.28Å
135E52.8Low55Low178 Ų178125.4 Ų125.483%0.83266%0.656SS**THydrogen-bonded Turntrans-68.2-13.7169.5-63.7-153.5146.200113E133 P137E133-E135 VanDerWaalsContact C-N 3.29Å; E133-E135 PolarHBondContact O-N 2.75Å; E135-P137 WeakPolarHBondContact O-CD 3.44Å
136K51.4Low55.5Low166 Ų166122 Ų12272%0.72265%0.648SS**SBendtrans-119.882174.9-69.3173.9-174.9159.10110.4E133 Q134 A138E133-K136 CarbonylContact O-C 3.51Å; E133-K136 VanDerWaalsContact O-C 3.27Å; E133-K136 WeakPolarHBondContact O-CA 3.27Å; E133-K136 PolarHBondContact O-N 2.94Å; Q134-K136 PolarHBondContact O-N 3.28Å; K136-A138 PolarHBondContact O-N 3.36Å
137P45.3Very low56.5Low119 Ų119123 Ų12377%0.77366%0.656SS**  trans-65.889.1-177.727.1-35.5000112.6E135 G139E135-P137 WeakPolarHBondContact O-CD 3.44Å; P137-G139 PolarHBondContact O-N 3.25Å
138A44.8Very low57.8Low108 Ų108124.2 Ų124.289%0.89365%0.652SS**  trans-86.37617100000109.8K136K136-A138 PolarHBondContact O-N 3.36Å
139G41.6Very low58.8Low58 Ų58122.5 Ų122.560%0.59864%0.642SS**SBendtrans-16766.6-17100000116.4P137P137-G139 PolarHBondContact O-N 3.25Å
140T46.6Very low60.5Low155 Ų155120.3 Ų120.395%0.95164%0.638SS**SBendtrans43.784.4155.454.20000118
141G47.6Very low62.4Low59 Ų59121.4 Ų121.461%0.60864%0.638SS**  trans134.7102163.600000111.4C143G141-C143 PolarHBondContact O-N 2.94Å
142K54.7Low64.3Low144 Ų144118.2 Ų118.263%0.62662%0.622SS**  trans-56.8105.9169.2-72.5-163.1172.3-168.20107.3E150K142-E150 IonicContact NZ-OE1 3.79Å; K142-E150 PolarHBondContact NZ-OE1 3.45Å; K142-E150 IonicContact NZ-OE2 2.74Å; K142-E150 PolarHBondContact NZ-OE2 3.37Å
143C55.8Low66.5Low73 Ų73117.8 Ų117.849%0.49362%0.617SS.*  trans-62.7152.5176-75.90000107.9G141 S145 D146 K147G141-C143 PolarHBondContact O-N 2.94Å; C143-S145 VanDerWaalsContact CB-OG 3.23Å; C143-S145 WeakPolarHBondContact CB-OG 3.31Å; C143-S145 PolarHBondContact O-N 3Å; C143-D146 WeakPolarHBondContact CB-OD2 3.42Å; C143-D146 PolarHBondContact N-OD2 3.2Å; C143-D146 VanDerWaalsContact N-OD2 3.09Å; C143-D146 PolarHBondContact O-N 3.31Å; C143-K147 PolarHBondContact O-N 3.05Å
144K62.1Low68.6Low202 Ų202113.8 Ų113.888%0.87860%0.604SS**Hα-helixtrans-56.6-27.8-177.8-69.2177.2179.1175.20111.6K148K144-K148 PolarHBondContact O-N 3.49Å
145S73.9Confident70.9Confident59 Ų59114.5 Ų114.541%0.41360%0.6SS.*Hα-helixtrans-56.4-43.116949.40000114.2C143 K148 K149C143-S145 VanDerWaalsContact CB-OG 3.23Å; C143-S145 WeakPolarHBondContact CB-OG 3.31Å; C143-S145 PolarHBondContact O-N 3Å; S145-K148 WeakPolarHBondContact O-CB 3.5Å; S145-K148 PolarHBondContact O-N 3.32Å; S145-K149 WeakPolarHBondContact O-CG 3.35Å; S145-K149 PolarHBondContact O-N 3.04Å
146D79.8Confident73Confident60 Ų60110.8 Ų110.832%0.32159%0.586SS.*Hα-helixtrans-80.7-37.4-168-48.3-34.7000110.4C143 K148 K149 E150C143-D146 WeakPolarHBondContact CB-OD2 3.42Å; C143-D146 PolarHBondContact N-OD2 3.2Å; C143-D146 VanDerWaalsContact N-OD2 3.09Å; C143-D146 PolarHBondContact O-N 3.31Å; D146-K148 PolarHBondContact O-N 3Å; D146-K149 PolarHBondContact O-N 3.41Å; D146-E150 VanDerWaalsContact O-CB 3.27Å; D146-E150 WeakPolarHBondContact O-CB 3.47Å; D146-E150 PolarHBondContact O-N 3.03Å
147K86Confident75.1Confident149 Ų149107.1 Ų107.165%0.64857%0.574SS**Hα-helixtrans-61.7-32.3168.8-169.8174-177177.30111.9C143 Y151C143-K147 PolarHBondContact O-N 3.05Å; K147-Y151 WeakPolarHBondContact O-CB 3.47Å; K147-Y151 PolarHBondContact O-N 2.9Å
148K89.6Confident77.6Confident112 Ų112109.8 Ų109.849%0.48757%0.569SS.*Hα-helixtrans-71.4-47174.1176.954.6173.9149.80111.3K144 S145 D146 E150 Y151 D152K144-K148 PolarHBondContact O-N 3.49Å; S145-K148 WeakPolarHBondContact O-CB 3.5Å; S145-K148 PolarHBondContact O-N 3.32Å; D146-K148 PolarHBondContact O-N 3Å; K148-E150 VanDerWaalsContact C-N 3.34Å; K148-E150 PolarHBondContact O-N 3.42Å; K148-Y151 PolarHBondContact O-N 3.3Å; K148-D152 VanDerWaalsContact CD-OD2 3.29Å; K148-D152 WeakPolarHBondContact CD-OD2 3.35Å; K148-D152 WeakPolarHBondContact CE-OD2 3.22Å; K148-D152 IonicContact NZ-OD1 3.09Å; K148-D152 PolarHBondContact NZ-OD1 3.25Å; K148-D152 IonicContact NZ-OD2 2.69Å; K148-D152 PolarHBondContact NZ-OD2 3.39Å; K148-D152 PolarHBondContact O-N 2.78Å
149K88.9Confident80.1Confident133 Ų133109.4 Ų109.458%0.57855%0.551SS**Hα-helixtrans-56.1-44.7172.2-70.4170.6179.8175.60112.1S145 D146 D152 K153S145-K149 WeakPolarHBondContact O-CG 3.35Å; S145-K149 PolarHBondContact O-N 3.04Å; D146-K149 PolarHBondContact O-N 3.41Å; K149-D152 PolarHBondContact O-N 2.86Å; K149-K153 WeakPolarHBondContact O-CB 3.47Å; K149-K153 WeakPolarHBondContact O-CG 3.43Å; K149-K153 PolarHBondContact O-N 3.43Å
150E92.1Very high82.7Confident98 Ų98112.7 Ų112.746%0.45855%0.551SS.*Hα-helixtrans-63.8-41.5177.4-173.4176.7-159.900111.9K142 D146 K148 S154K142-E150 IonicContact NZ-OE1 3.79Å; K142-E150 PolarHBondContact NZ-OE1 3.45Å; K142-E150 IonicContact NZ-OE2 2.74Å; K142-E150 PolarHBondContact NZ-OE2 3.37Å; D146-E150 VanDerWaalsContact O-CB 3.27Å; D146-E150 WeakPolarHBondContact O-CB 3.47Å; D146-E150 PolarHBondContact O-N 3.03Å; K148-E150 VanDerWaalsContact C-N 3.34Å; K148-E150 PolarHBondContact O-N 3.42Å; E150-S154 WeakPolarHBondContact O-CB 3.48Å; E150-S154 PolarHBondContact O-N 3.07Å
151Y93.2Very high85.2Confident143 Ų143111.7 Ų111.756%0.56153%0.533SS*.Hα-helixtrans-64.9-44.5174.1178.9-90.7000112.6K147 K148 S154 R155K147-Y151 WeakPolarHBondContact O-CB 3.47Å; K147-Y151 PolarHBondContact O-N 2.9Å; K148-Y151 PolarHBondContact O-N 3.3Å; Y151-S154 PolarHBondContact O-N 3.39Å; Y151-R155 WeakPolarHBondContact O-CB 3.49Å; Y151-R155 PolarHBondContact O-N 2.75Å
152D94.4Very high87.5Confident52 Ų52115.8 Ų115.828%0.27853%0.534SS..Hα-helixtrans-68.4-38-178.5-68.7-31.6000111.8K148 K149 R155 L156K148-D152 VanDerWaalsContact CD-OD2 3.29Å; K148-D152 WeakPolarHBondContact CD-OD2 3.35Å; K148-D152 WeakPolarHBondContact CE-OD2 3.22Å; K148-D152 IonicContact NZ-OD1 3.09Å; K148-D152 PolarHBondContact NZ-OD1 3.25Å; K148-D152 IonicContact NZ-OD2 2.69Å; K148-D152 PolarHBondContact NZ-OD2 3.39Å; K148-D152 PolarHBondContact O-N 2.78Å; K149-D152 PolarHBondContact O-N 2.86Å; D152-R155 PolarHBondContact O-N 3.3Å; D152-L156 WeakPolarHBondContact O-CG 3.38Å; D152-L156 PolarHBondContact O-N 3.2Å
153K95.8Very high89.6Confident144 Ų144116.9 Ų116.963%0.62654%0.539SS*.Hα-helixtrans-59-54168.1-72.9-179.8179.2-168.70111.5K149 R155 L156 D157K149-K153 WeakPolarHBondContact O-CB 3.47Å; K149-K153 WeakPolarHBondContact O-CG 3.43Å; K149-K153 PolarHBondContact O-N 3.43Å; K153-R155 PolarHBondContact O-N 3.02Å; K153-R155 VanDerWaalsContact O-N 3.16Å; K153-L156 WeakPolarHBondContact O-CB 3.48Å; K153-L156 PolarHBondContact O-N 2.88Å; K153-D157 VanDerWaalsContact O-CG 3.27Å; K153-D157 PolarHBondContact O-N 3.5Å
154S95.1Very high91.5Very high43 Ų43117.9 Ų117.930%0.30154%0.539SS..Hα-helixtrans-60-30.6179.1-171.10000113.1E150 Y151 R158E150-S154 WeakPolarHBondContact O-CB 3.48Å; E150-S154 PolarHBondContact O-N 3.07Å; Y151-S154 PolarHBondContact O-N 3.39Å; S154-R158 WeakPolarHBondContact O-CD 3.47Å; S154-R158 VanDerWaalsContact O-CG 3.22Å; S154-R158 WeakPolarHBondContact O-CG 3.46Å; S154-R158 PolarHBondContact O-N 3Å
155R97.3Very high93.1Very high150 Ų150112 Ų11257%0.56652%0.517SS*.Hα-helixtrans-69-43.2173.9-176.5-178.8177.2-156.3-0.8111.7Y151 D152 K153 R158 L159Y151-R155 WeakPolarHBondContact O-CB 3.49Å; Y151-R155 PolarHBondContact O-N 2.75Å; D152-R155 PolarHBondContact O-N 3.3Å; K153-R155 PolarHBondContact O-N 3.02Å; K153-R155 VanDerWaalsContact O-N 3.16Å; R155-R158 PolarHBondContact O-N 3.16Å; R155-L159 WeakPolarHBondContact O-CG 3.44Å; R155-L159 PolarHBondContact O-N 2.91Å
156L97.3Very high94.2Very high99 Ų99116.9 Ų116.952%0.51853%0.526SS..Hα-helixtrans-62.3-47.6174.1-73.4167.7000111D152 K153 R158 L159 H160D152-L156 WeakPolarHBondContact O-CG 3.38Å; D152-L156 PolarHBondContact O-N 3.2Å; K153-L156 WeakPolarHBondContact O-CB 3.48Å; K153-L156 PolarHBondContact O-N 2.88Å; L156-R158 VanDerWaalsContact C-N 3.26Å; L156-R158 PolarHBondContact O-N 2.9Å; L156-L159 WeakPolarHBondContact O-CA 3.37Å; L156-L159 WeakPolarHBondContact O-CB 3.39Å; L156-L159 PolarHBondContact O-N 3.27Å; L156-H160 PolarHBondContact O-CD2 3.33Å; L156-H160 PolarHBondContact O-N 3.08Å
157D96.4Very high95Very high90 Ų90123 Ų12348%0.48155%0.545SS..Hα-helixtrans-56.2-40.8179.1-59.9-29.4000112.1K153 H160 K161K153-D157 VanDerWaalsContact O-CG 3.27Å; K153-D157 PolarHBondContact O-N 3.5Å; D157-H160 PolarHBondContact O-N 3.27Å; D157-K161 WeakPolarHBondContact O-CB 3.41Å; D157-K161 WeakPolarHBondContact O-CG 3.49Å; D157-K161 PolarHBondContact O-N 3.48Å
158R97.1Very high95.5Very high174 Ų174121.2 Ų121.266%0.65754%0.539SS*.Hα-helixtrans-65.8-36175.6-71.5169.6-163.7-150.11.7113.1S154 R155 L156 K162S154-R158 WeakPolarHBondContact O-CD 3.47Å; S154-R158 VanDerWaalsContact O-CG 3.22Å; S154-R158 WeakPolarHBondContact O-CG 3.46Å; S154-R158 PolarHBondContact O-N 3Å; R155-R158 PolarHBondContact O-N 3.16Å; L156-R158 VanDerWaalsContact C-N 3.26Å; L156-R158 PolarHBondContact O-N 2.9Å; R158-K162 VanDerWaalsContact O-CB 3.29Å; R158-K162 WeakPolarHBondContact O-CB 3.09Å; R158-K162 PolarHBondContact O-N 3.02Å
159L97.3Very high95.7Very high101 Ų101121 Ų12153%0.52954%0.54SS..Hα-helixtrans-71.2-39176.5-70.2172.4000111.4R155 L156 K163R155-L159 WeakPolarHBondContact O-CG 3.44Å; R155-L159 PolarHBondContact O-N 2.91Å; L156-L159 WeakPolarHBondContact O-CA 3.37Å; L156-L159 WeakPolarHBondContact O-CB 3.39Å; L156-L159 PolarHBondContact O-N 3.27Å; L159-K163 WeakPolarHBondContact O-CB 3.11Å; L159-K163 PolarHBondContact O-N 3.41Å; L159-K163 VanDerWaalsContact O-N 3.08Å
160H96.9Very high96Very high126 Ų126120.6 Ų120.658%0.58354%0.538SS*.Hα-helixtrans-63.1-49.2173-84-86.4000111.6L156 D157 K163 L164L156-H160 PolarHBondContact O-CD2 3.33Å; L156-H160 PolarHBondContact O-N 3.08Å; D157-H160 PolarHBondContact O-N 3.27Å; H160-K163 WeakPolarHBondContact O-CB 3.08Å; H160-K163 PolarHBondContact O-N 2.81Å; H160-K163 VanDerWaalsContact O-N 3.12Å; H160-L164 PolarHBondContact O-N 3.44Å
161K97.1Very high96.1Very high135 Ų135118.4 Ų118.459%0.58754%0.537SS*.Hα-helixtrans-56.6-54.7175.2-72.9179.4179.5-168.20111.5D157 K163 L164 D165D157-K161 WeakPolarHBondContact O-CB 3.41Å; D157-K161 WeakPolarHBondContact O-CG 3.49Å; D157-K161 PolarHBondContact O-N 3.48Å; K161-K163 PolarHBondContact O-N 3.5Å; K161-L164 CarbonylContact O-C 3.27Å; K161-L164 WeakPolarHBondContact O-CA 3.49Å; K161-L164 WeakPolarHBondContact O-CB 3.43Å; K161-L164 PolarHBondContact O-N 3.4Å; K161-D165 VanDerWaalsContact C-OD2 3.31Å; K161-D165 PolarHBondContact O-N 3.28Å; K161-D165 VanDerWaalsContact O-OD1 3.04Å
162K97.3Very high96.1Very high144 Ų144117 Ų11763%0.62654%0.535SS*.Hα-helixtrans-55.3-27.3176.9-172.1173.4-176.8178.90114R158 D165 R166R158-K162 VanDerWaalsContact O-CB 3.29Å; R158-K162 WeakPolarHBondContact O-CB 3.09Å; R158-K162 PolarHBondContact O-N 3.02Å; K162-D165 WeakPolarHBondContact CA-OD2 3.37Å; K162-D165 PolarHBondContact N-OD2 3.19Å; K162-R166 WeakPolarHBondContact O-CB 3.46Å; K162-R166 PolarHBondContact O-N 3.12Å; K162-R166 VanDerWaalsContact O-N 3.17Å
163K97.6Very high96Very high167 Ų167119.3 Ų119.373%0.72655%0.548SS*.Hα-helixtrans-78.1-33.6174.6-171-179.7178.9-175.80112.6L159 H160 K161 R167L159-K163 WeakPolarHBondContact O-CB 3.11Å; L159-K163 PolarHBondContact O-N 3.41Å; L159-K163 VanDerWaalsContact O-N 3.08Å; H160-K163 WeakPolarHBondContact O-CB 3.08Å; H160-K163 PolarHBondContact O-N 2.81Å; H160-K163 VanDerWaalsContact O-N 3.12Å; K161-K163 PolarHBondContact O-N 3.5Å; K163-R167 WeakPolarHBondContact O-CB 3.49Å; K163-R167 PolarHBondContact O-N 2.79Å
164L97.1Very high95.8Very high95 Ų95117.7 Ų117.750%0.49755%0.546SS..Hα-helixtrans-71.7-52.2171.3-64.4176.7000110.5H160 K161 R166 R167 E168H160-L164 PolarHBondContact O-N 3.44Å; K161-L164 CarbonylContact O-C 3.27Å; K161-L164 WeakPolarHBondContact O-CA 3.49Å; K161-L164 WeakPolarHBondContact O-CB 3.43Å; K161-L164 PolarHBondContact O-N 3.4Å; L164-R166 VanDerWaalsContact C-N 3.26Å; L164-R166 PolarHBondContact O-N 3.25Å; L164-R167 CarbonylContact O-C 3.54Å; L164-R167 WeakPolarHBondContact O-CA 3.43Å; L164-R167 VanDerWaalsContact O-CB 3.31Å; L164-R167 WeakPolarHBondContact O-CB 2.98Å; L164-R167 PolarHBondContact O-N 2.82Å; L164-E168 PolarHBondContact O-N 2.85Å
165D95.9Very high95.6Very high77 Ų77122.7 Ų122.741%0.41257%0.566SS.*Hα-helixtrans-50.9-47.1176.7-45.2-22.6000110.5K161 K162 R167 E168 E169K161-D165 VanDerWaalsContact C-OD2 3.31Å; K161-D165 PolarHBondContact O-N 3.28Å; K161-D165 VanDerWaalsContact O-OD1 3.04Å; K162-D165 WeakPolarHBondContact CA-OD2 3.37Å; K162-D165 PolarHBondContact N-OD2 3.19Å; D165-R167 VanDerWaalsContact C-N 3.3Å; D165-R167 PolarHBondContact O-N 2.93Å; D165-E168 PolarHBondContact O-N 2.78Å; D165-E169 WeakPolarHBondContact O-CB 3.34Å; D165-E169 WeakPolarHBondContact O-CG 3.42Å; D165-E169 PolarHBondContact O-N 3.46Å
166R97Very high95Very high162 Ų162123.3 Ų123.361%0.61157%0.573SS**Hα-helixtrans-70.9-19.3177.7-166.3178-172.7-165.42.6114.4K162 L164 K170K162-R166 WeakPolarHBondContact O-CB 3.46Å; K162-R166 PolarHBondContact O-N 3.12Å; K162-R166 VanDerWaalsContact O-N 3.17Å; L164-R166 VanDerWaalsContact C-N 3.26Å; L164-R166 PolarHBondContact O-N 3.25Å; R166-K170 WeakPolarHBondContact O-CG 3.34Å; R166-K170 PolarHBondContact O-N 2.99Å
167R95.8Very high94.4Very high188 Ų188124 Ų12471%0.70958%0.576SS**Hα-helixtrans-80.5-38.7172.1-174.7-176.8-177.7-174.6-1.2110.3K163 L164 D165 K170 A171K163-R167 WeakPolarHBondContact O-CB 3.49Å; K163-R167 PolarHBondContact O-N 2.79Å; L164-R167 CarbonylContact O-C 3.54Å; L164-R167 WeakPolarHBondContact O-CA 3.43Å; L164-R167 VanDerWaalsContact O-CB 3.31Å; L164-R167 WeakPolarHBondContact O-CB 2.98Å; L164-R167 PolarHBondContact O-N 2.82Å; D165-R167 VanDerWaalsContact C-N 3.3Å; D165-R167 PolarHBondContact O-N 2.93Å; R167-K170 PolarHBondContact O-N 3.34Å; R167-A171 PolarHBondContact O-N 3.42Å
168E95.6Very high93.9Very high112 Ų112126.3 Ų126.352%0.52359%0.588SS.*Hα-helixtrans-64.8-52.5173.4-69.4164.1-163.100110.1L164 D165 K170 A171 E172L164-E168 PolarHBondContact O-N 2.85Å; D165-E168 PolarHBondContact O-N 2.78Å; E168-K170 PolarHBondContact O-N 2.91Å; E168-K170 VanDerWaalsContact O-N 3.13Å; E168-A171 PolarHBondContact O-N 3.21Å; E168-E172 WeakPolarHBondContact O-CG 3.39Å; E168-E172 PolarHBondContact O-N 3.26Å
169E95.2Very high93.3Very high108 Ų108127.7 Ų127.751%0.50560%0.602SS.*Hα-helixtrans-49.9-41.2172.3-75.3173.3173.300112.2D165 N173D165-E169 WeakPolarHBondContact O-CB 3.34Å; D165-E169 WeakPolarHBondContact O-CG 3.42Å; D165-E169 PolarHBondContact O-N 3.46Å; E169-N173 WeakPolarHBondContact O-CB 3.17Å; E169-N173 VanDerWaalsContact O-CG 3.29Å; E169-N173 PolarHBondContact O-N 2.86Å; E169-N173 PolarHBondContact O-ND2 3.35Å
170K95.1Very high92.5Very high125 Ų125126.3 Ų126.354%0.54360%0.598SS.*Hα-helixtrans-68.3-49.2177-83.3-176.6167-145.60112.1R166 R167 E168 E172 N173 D174R166-K170 WeakPolarHBondContact O-CG 3.34Å; R166-K170 PolarHBondContact O-N 2.99Å; R167-K170 PolarHBondContact O-N 3.34Å; E168-K170 PolarHBondContact O-N 2.91Å; E168-K170 VanDerWaalsContact O-N 3.13Å; K170-E172 VanDerWaalsContact C-N 3.26Å; K170-E172 PolarHBondContact O-N 2.89Å; K170-N173 PolarHBondContact O-N 2.92Å; K170-N173 VanDerWaalsContact O-N 3.16Å; K170-D174 WeakPolarHBondContact O-CB 3.44Å; K170-D174 PolarHBondContact O-N 2.97Å
171A94.6Very high91.9Very high52 Ų52123.1 Ų123.143%0.4359%0.593SS.*Hα-helixtrans-60.7-37.5178.500000112R167 E168 M175R167-A171 PolarHBondContact O-N 3.42Å; E168-A171 PolarHBondContact O-N 3.21Å; A171-M175 VanDerWaalsContact O-CG 3.29Å; A171-M175 WeakPolarHBondContact O-CG 3.43Å; A171-M175 PolarHBondContact O-N 3.47Å
172E93.1Very high90.9Very high113 Ų113127.1 Ų127.153%0.52861%0.611SS.*Hα-helixtrans-63.6-49.6171.8-71.4178.1-179.600111.5E168 K170 D174 M175 F176E168-E172 WeakPolarHBondContact O-CG 3.39Å; E168-E172 PolarHBondContact O-N 3.26Å; K170-E172 VanDerWaalsContact C-N 3.26Å; K170-E172 PolarHBondContact O-N 2.89Å; E172-D174 VanDerWaalsContact C-N 3.33Å; E172-D174 PolarHBondContact O-N 3.22Å; E172-M175 WeakPolarHBondContact O-CB 3.24Å; E172-M175 PolarHBondContact O-N 2.86Å; E172-M175 VanDerWaalsContact O-N 3.16Å; E172-F176 WeakPolarHBondContact O-CD2 3.47Å; E172-F176 PolarHBondContact O-N 3.5Å
173N91.5Very high89.8Confident101 Ų101123.7 Ų123.754%0.5462%0.617SS.*Hα-helixtrans-59.7-43.5176.3-75.7-58.7000111.7E169 K170 M175 F176 I177E169-N173 WeakPolarHBondContact O-CB 3.17Å; E169-N173 VanDerWaalsContact O-CG 3.29Å; E169-N173 PolarHBondContact O-N 2.86Å; E169-N173 PolarHBondContact O-ND2 3.35Å; K170-N173 PolarHBondContact O-N 2.92Å; K170-N173 VanDerWaalsContact O-N 3.16Å; N173-M175 PolarHBondContact O-N 3.24Å; N173-F176 CarbonylContact O-C 3.49Å; N173-F176 PolarHBondContact O-N 3.47Å; N173-I177 WeakPolarHBondContact O-CG1 3.28Å; N173-I177 PolarHBondContact O-N 3.44Å; N173-I177 VanDerWaalsContact O-N 3.17Å
174D91.4Very high88.9Confident109 Ų109122.8 Ų122.858%0.58362%0.615SS**Hα-helixtrans-63-30.5178.2-61.9-19.8000111.4K170 E172 F176K170-D174 WeakPolarHBondContact O-CB 3.44Å; K170-D174 PolarHBondContact O-N 2.97Å; E172-D174 VanDerWaalsContact C-N 3.33Å; E172-D174 PolarHBondContact O-N 3.22Å; D174-F176 VanDerWaalsContact C-N 3.32Å
175M90.6Very high88Confident148 Ų148122.2 Ų122.273%0.72962%0.615SS**Hα-helixtrans-72.5-17.3171-76172.350.700114.6A171 E172 N173A171-M175 VanDerWaalsContact O-CG 3.29Å; A171-M175 WeakPolarHBondContact O-CG 3.43Å; A171-M175 PolarHBondContact O-N 3.47Å; E172-M175 WeakPolarHBondContact O-CB 3.24Å; E172-M175 PolarHBondContact O-N 2.86Å; E172-M175 VanDerWaalsContact O-N 3.16Å; N173-M175 PolarHBondContact O-N 3.24Å
176F84.8Confident86.8Confident164 Ų164123.2 Ų123.272%0.71964%0.635SS**THydrogen-bonded Turntrans-108.58.9178.9-64.2-61.6000113.1E172 N173 D174E172-F176 WeakPolarHBondContact O-CD2 3.47Å; E172-F176 PolarHBondContact O-N 3.5Å; N173-F176 CarbonylContact O-C 3.49Å; N173-F176 PolarHBondContact O-N 3.47Å; D174-F176 VanDerWaalsContact C-N 3.32Å
177I86Confident85.8Confident113 Ų113122.9 Ų122.958%0.57964%0.642SS**  trans-95.8100.1170.9-68.7164.4000107.9N173N173-I177 WeakPolarHBondContact O-CG1 3.28Å; N173-I177 PolarHBondContact O-N 3.44Å; N173-I177 VanDerWaalsContact O-N 3.17Å
178D84.4Confident85Confident138 Ų138118.1 Ų118.174%0.73864%0.643SS**  trans-73.6131168.3-72.6-28.7000110V180D178-V180 HydrophobicContact CB-CG2 4.05Å; D178-V180 PolarHBondContact O-N 3.15Å
179E84.6Confident84.3Confident203 Ų203118 Ų11895%0.94965%0.651SS**  trans-75.187172.6-68.7-170.617100110.4
180V81Confident83.6Confident73 Ų73118.9 Ų118.944%0.44267%0.667SS.*  trans-96.3138.1178-178.20000110.9D178 E184 V185D178-V180 HydrophobicContact CB-CG2 4.05Å; D178-V180 PolarHBondContact O-N 3.15Å; V180-E184 HydrophobicContact CG1-CB 3.73Å; V180-V185 HydrophobicContact CB-CG2 3.93Å; V180-V185 HydrophobicContact CG1-CG2 3.75Å
181A84.9Confident82.9Confident58 Ų58119 Ų11948%0.47968%0.678SS.*  trans-64.6143.3-178.800000112.5G183 E184A181-G183 PolarHBondContact O-N 3.34Å; A181-E184 PolarHBondContact O-N 3.4Å; A181-E184 VanDerWaalsContact O-N 3.14Å
182F74.7Confident81.9Confident219 Ų219123.9 Ų123.996%0.96170%0.696SS**THydrogen-bonded Turntrans-62.8111.2178.8178.7-96.6000110.8
183G76.3Confident81Confident73 Ų73123.8 Ų123.875%0.75371%0.708SS**THydrogen-bonded Turntrans127.3-26.4-176.400000113.7A181A181-G183 PolarHBondContact O-N 3.34Å
184E77.2Confident80.3Confident147 Ų147125.3 Ų125.369%0.68772%0.715SS**THydrogen-bonded Turntrans-87.6-21.1177.8-64.5178.7163.900112.6V180 A181 A186V180-E184 HydrophobicContact CG1-CB 3.73Å; A181-E184 PolarHBondContact O-N 3.4Å; A181-E184 VanDerWaalsContact O-N 3.14Å; E184-A186 PolarHBondContact O-N 3.01Å
185V79.4Confident79.3Confident83 Ų83128 Ų12850%0.50372%0.721SS.*  trans-7091.2175.1-175.60000110.4V180 M187V180-V185 HydrophobicContact CB-CG2 3.93Å; V180-V185 HydrophobicContact CG1-CG2 3.75Å; V185-M187 VanDerWaalsContact C-N 3.29Å; V185-M187 HydrophobicContact CG1-CG 4.42Å; V185-M187 HydrophobicContact CG1-SD 4.08Å; V185-M187 PolarHBondContact O-N 3.35Å
186A70.2Confident78.9Confident99 Ų99125.4 Ų125.482%0.81872%0.716SS**  trans-67.486.7167.100000110.1E184 A188E184-A186 PolarHBondContact O-N 3.01Å; A186-A188 PolarHBondContact O-N 3.19Å
187M76.2Confident78.4Confident155 Ų155130.1 Ų130.176%0.76473%0.729SS**PPolyproline II helixtrans-53.5134.5171.9-71.7-64.7-71.600110V185V185-M187 VanDerWaalsContact C-N 3.29Å; V185-M187 HydrophobicContact CG1-CG 4.42Å; V185-M187 HydrophobicContact CG1-SD 4.08Å; V185-M187 PolarHBondContact O-N 3.35Å
188A77.8Confident77.7Confident88 Ų88134.6 Ų134.673%0.72774%0.744SS**PPolyproline II helixtrans-52.3128.2174.100000109.2A186A186-A188 PolarHBondContact O-N 3.19Å
189P81.7Confident76.8Confident108 Ų108130.8 Ų130.870%0.70173%0.732SS**PPolyproline II helixtrans-58.1136.9-171.821.7-32.9000110T191P189-T191 PolarHBondContact O-N 3.4Å
190P80.7Confident75.9Confident127 Ų127128 Ų12883%0.82572%0.722SS**PPolyproline II helixtrans-58.8117-17322.7-33.4000110L192P190-L192 PolarHBondContact O-N 3.06Å
191T79.8Confident75Confident128 Ų128130.6 Ų130.679%0.78573%0.732SS**PPolyproline II helixtrans-72.2124.9-178.952.60000109.6P189 S193P189-T191 PolarHBondContact O-N 3.4Å; T191-S193 VanDerWaalsContact C-N 3.3Å; T191-S193 PolarHBondContact O-N 2.92Å
192L74.9Confident74.2Confident154 Ų154135.5 Ų135.581%0.80674%0.743SS**  trans-68.687.5176.7-71171000109.9P190 I194P190-L192 PolarHBondContact O-N 3.06Å; L192-I194 HydrophobicContact CD2-CD1 4.35Å; L192-I194 PolarHBondContact O-N 3.14Å; L192-I194 VanDerWaalsContact O-N 3.12Å
193S72.6Confident73.6Confident111 Ų111130.4 Ų130.478%0.77673%0.732SS**  trans-71.63.8175.363.10000113.8T191 K195T191-S193 VanDerWaalsContact C-N 3.3Å; T191-S193 PolarHBondContact O-N 2.92Å; S193-K195 PolarHBondContact O-N 2.91Å; S193-K195 VanDerWaalsContact O-N 3.12Å
194I77.8Confident72.8Confident133 Ų133136.1 Ų136.168%0.68274%0.739SS**  trans-67.8107.5178.4-57.9176.3000109.1L192 P196L192-I194 HydrophobicContact CD2-CD1 4.35Å; L192-I194 PolarHBondContact O-N 3.14Å; L192-I194 VanDerWaalsContact O-N 3.12Å; I194-P196 WeakPolarHBondContact O-CD 3Å
195K71.1Confident71.9Confident166 Ų166132 Ų13272%0.72274%0.736SS**  trans-61.7123.6170.8-63.8176.9-176174.20108.8S193 R197S193-K195 PolarHBondContact O-N 2.91Å; S193-K195 VanDerWaalsContact O-N 3.12Å; K195-R197 PolarHBondContact O-N 3.11Å
196P80.3Confident70.7Confident94 Ų94134 Ų13461%0.6175%0.748SS**  trans-62.3126.4-179.321.3-31000110.8I194 K198 A199I194-P196 WeakPolarHBondContact O-CD 3Å; P196-K198 PolarHBondContact O-N 3.42Å; P196-A199 HydrophobicContact CG-CB 3.83Å; P196-A199 PolarHBondContact O-N 2.95Å
197R75.3Confident70Confident263 Ų263133.5 Ų133.599%0.99274%0.737SS**THydrogen-bonded Turntrans-52.8-17.9-171.6-81-175.8171.9-175.1-2.4116.1K195K195-R197 PolarHBondContact O-N 3.11Å
198K70.6Confident69.5Low207 Ų207135 Ų13590%0.974%0.74SS**THydrogen-bonded Turntrans-115.95.9-178.4-66.6-167.9176.3-174.90114.7P196 L200P196-K198 PolarHBondContact O-N 3.42Å; K198-L200 PolarHBondContact O-N 2.77Å
199A66.3Low69.1Low58 Ų58132.4 Ų132.448%0.47972%0.722SS.*  trans-72.3115.2173.400000110.4P196 I201P196-A199 HydrophobicContact CG-CB 3.83Å; P196-A199 PolarHBondContact O-N 2.95Å; A199-I201 PolarHBondContact O-N 3.49Å
200L65.9Low68.9Low143 Ų143133.5 Ų133.575%0.74972%0.721SS**  trans-63.5100.1167.1179.368000108.4K198 K202K198-L200 PolarHBondContact O-N 2.77Å; L200-K202 HydrophobicContact CD2-CG 4.15Å; L200-K202 HydrophobicContact CG-CG 4.24Å; L200-K202 PolarHBondContact O-N 3.11Å
201I62.5Low68.8Low128 Ų128133.7 Ų133.766%0.65671%0.714SS**  trans-6982.2171.2-50.6176.5000107.4A199A199-I201 PolarHBondContact O-N 3.49Å
202K66.9Low68.8Low162 Ų162132.9 Ų132.970%0.70470%0.704SS**  trans-57.2124.5160.8-68.6-179.2179.9177.40105.9L200 Q204L200-K202 HydrophobicContact CD2-CG 4.15Å; L200-K202 HydrophobicContact CG-CG 4.24Å; L200-K202 PolarHBondContact O-N 3.11Å; K202-Q204 PolarHBondContact O-N 3.25Å
203P62.1Low68.9Low112 Ų112127.5 Ų127.573%0.72768%0.676SS**  trans-57.5130.4173.924.8-32.7000107.5G205P203-G205 PolarHBondContact O-N 3.06Å
204Q59.9Low69.1Low193 Ų193126.8 Ų126.890%0.90267%0.672SS**SBendtrans-72.669.3176.5-171.3167.9-11.100108.6K202K202-Q204 PolarHBondContact O-N 3.25Å
205G57.8Low69.5Low61 Ų61126.9 Ų126.963%0.62967%0.673SS**  trans-144.82.2-163.900000114.1P203P203-G205 PolarHBondContact O-N 3.06Å
206V54.8Low70.1Confident124 Ų124123.6 Ų123.675%0.75266%0.663SS**  trans-119.167.5158-167.20000108.1K208V206-K208 HydrophobicContact CG1-CG 4.11Å; V206-K208 PolarHBondContact O-N 3.46Å
207C56.2Low70Confident88 Ų88122 Ų12260%0.59566%0.664SS**  trans-65.280.9162.4-65.30000108.3G209C207-G209 PolarHBondContact O-N 3.46Å
208K65.1Low69.9Low187 Ų187114.4 Ų114.481%0.81364%0.639SS**  trans-54.1113.5158.3-62.7-173.4-179-175.50105.2V206V206-K208 HydrophobicContact CG1-CG 4.11Å; V206-K208 PolarHBondContact O-N 3.46Å
209G68.7Low69.5Low34 Ų34110.5 Ų110.535%0.35163%0.633SS.*  trans-55.8153.2-179.400000110.4C207 L211C207-G209 PolarHBondContact O-N 3.46Å; G209-L211 PolarHBondContact O-N 3.03Å
210L77.5Confident69.2Low130 Ų130113.5 Ų113.568%0.68164%0.637SS**  trans-46.8131.6174.7-62.3176.5000108.9L212 N213L210-L212 PolarHBondContact O-N 2.96Å; L210-N213 VanDerWaalsContact O-CB 3.3Å; L210-N213 WeakPolarHBondContact O-CB 3.31Å; L210-N213 PolarHBondContact O-N 3.17Å
211L78.8Confident68.8Low131 Ų131114.7 Ų114.769%0.68664%0.636SS**Hα-helixtrans-52.1-36.4-175.2179.463.4000111.7G209 N213 S214 L215G209-L211 PolarHBondContact O-N 3.03Å; L211-N213 VanDerWaalsContact C-N 3.28Å; L211-N213 PolarHBondContact O-N 3.34Å; L211-S214 WeakPolarHBondContact O-CA 3.42Å; L211-S214 VanDerWaalsContact O-CB 3.31Å; L211-S214 WeakPolarHBondContact O-CB 3.26Å; L211-S214 PolarHBondContact O-N 3.3Å; L211-L215 HydrophobicContact CG-CD1 4.19Å; L211-L215 WeakPolarHBondContact O-CG 3.46Å; L211-L215 PolarHBondContact O-N 3.36Å
212L78.9Confident68.7Low111 Ų111113 Ų11358%0.58164%0.636SS**Hα-helixtrans-51.9-41.5173.3-16380.1000113.3L210 S214 L215 L216L210-L212 PolarHBondContact O-N 2.96Å; L212-S214 VanDerWaalsContact C-N 3.3Å; L212-S214 PolarHBondContact O-N 3.08Å; L212-L215 PolarHBondContact O-N 3.23Å; L212-L216 HydrophobicContact CD2-CD1 3.98Å; L212-L216 HydrophobicContact CG-CD1 3.76Å; L212-L216 HydrophobicContact CG-CG 4.37Å; L212-L216 WeakPolarHBondContact O-CB 3.36Å; L212-L216 VanDerWaalsContact O-CG 3.32Å; L212-L216 WeakPolarHBondContact O-CG 3.47Å; L212-L216 PolarHBondContact O-N 3.04Å
213N77.6Confident68.3Low41 Ų41112.5 Ų112.522%0.21965%0.647CS.*Hα-helixtrans-67-33.8179.4-63.817.6000111.4L210 L211 G217 Q218L210-N213 VanDerWaalsContact O-CB 3.3Å; L210-N213 WeakPolarHBondContact O-CB 3.31Å; L210-N213 PolarHBondContact O-N 3.17Å; L211-N213 VanDerWaalsContact C-N 3.28Å; L211-N213 PolarHBondContact O-N 3.34Å; N213-G217 PolarHBondContact O-N 2.93Å; N213-Q218 WeakPolarHBondContact CB-O 3.5Å; N213-Q218 PolarHBondContact O-N 3.17Å
214S76.9Confident68.8Low97 Ų97110.3 Ų110.368%0.67864%0.638SS**Hα-helixtrans-69.9-35.3173.3-166.90000112.1L211 L212L211-S214 WeakPolarHBondContact O-CA 3.42Å; L211-S214 VanDerWaalsContact O-CB 3.31Å; L211-S214 WeakPolarHBondContact O-CB 3.26Å; L211-S214 PolarHBondContact O-N 3.3Å; L212-S214 VanDerWaalsContact C-N 3.3Å; L212-S214 PolarHBondContact O-N 3.08Å
215L85.8Confident69.7Low134 Ų134110.7 Ų110.770%0.70264%0.637SS**Hα-helixtrans-75.9-36.5178.6-66.1170.3000112.3L211 L212 G217L211-L215 HydrophobicContact CG-CD1 4.19Å; L211-L215 WeakPolarHBondContact O-CG 3.46Å; L211-L215 PolarHBondContact O-N 3.36Å; L212-L215 PolarHBondContact O-N 3.23Å; L215-G217 VanDerWaalsContact C-N 3.27Å; L215-G217 PolarHBondContact O-N 3.1Å
216L85.2Confident70.8Confident98 Ų98110.4 Ų110.451%0.51362%0.623SS.*THydrogen-bonded Turntrans-80.5-2.5177.2-68.7170000113.6L212 Q218L212-L216 HydrophobicContact CD2-CD1 3.98Å; L212-L216 HydrophobicContact CG-CD1 3.76Å; L212-L216 HydrophobicContact CG-CG 4.37Å; L212-L216 WeakPolarHBondContact O-CB 3.36Å; L212-L216 VanDerWaalsContact O-CG 3.32Å; L212-L216 WeakPolarHBondContact O-CG 3.47Å; L212-L216 PolarHBondContact O-N 3.04Å; L216-Q218 HydrophobicContact CB-CB 4.34Å; L216-Q218 HydrophobicContact CB-CG 3.94Å; L216-Q218 PolarHBondContact O-N 2.89Å; L216-Q218 VanDerWaalsContact O-N 3.14Å
217G77.2Confident72.4Confident61 Ų61108.2 Ų108.263%0.62961%0.614SS**THydrogen-bonded Turntrans64.311.7-172.800000114.3N213 L215 T219N213-G217 PolarHBondContact O-N 2.93Å; L215-G217 VanDerWaalsContact C-N 3.27Å; L215-G217 PolarHBondContact O-N 3.1Å; G217-T219 PolarHBondContact O-N 3.06Å; G217-T219 VanDerWaalsContact O-N 3.09Å
218Q73.1Confident74Confident103 Ų103109.5 Ų109.548%0.48161%0.613SS.*  trans-8485.8-176.7-70.8179.3-100109.8N213 L216 Q220N213-Q218 WeakPolarHBondContact CB-O 3.5Å; N213-Q218 PolarHBondContact O-N 3.17Å; L216-Q218 HydrophobicContact CB-CB 4.34Å; L216-Q218 HydrophobicContact CB-CG 3.94Å; L216-Q218 PolarHBondContact O-N 2.89Å; L216-Q218 VanDerWaalsContact O-N 3.14Å; Q218-Q220 PolarHBondContact O-N 2.76Å
219T62.3Low75.3Confident124 Ų124103.7 Ų103.776%0.76160%0.599SS**  trans-55.1139.4165.450.10000109.3G217 F221G217-T219 PolarHBondContact O-N 3.06Å; G217-T219 VanDerWaalsContact O-N 3.09Å; T219-F221 PolarHBondContact O-N 2.95Å
220Q60.5Low76.2Confident121 Ų121107.8 Ų107.857%0.56560%0.604SS**  trans-61.2108.9-171.8-64.6-179.9-11.100109.9Q218 S222Q218-Q220 PolarHBondContact O-N 2.76Å; Q220-S222 PolarHBondContact O-N 3.09Å
221F57.3Low76.8Confident168 Ų168105 Ų10574%0.73759%0.588SS**  trans-56.4118.3163.9-67.4-74.1000107.1T219 T223T219-F221 PolarHBondContact O-N 2.95Å; F221-T223 PolarHBondContact O-N 3.38Å
222S59.5Low77.6Confident94 Ų94106.9 Ų106.966%0.65759%0.586SS**  trans-48.8126.2-175.9-178.80000110.4Q220 A224Q220-S222 PolarHBondContact O-N 3.09Å; S222-A224 PolarHBondContact O-N 2.95Å; S222-A224 VanDerWaalsContact O-N 3.15Å; S222-A224 WeakPolarHBondContact OG-CB 3.43Å; S222-A224 PolarHBondContact OG-N 3.21Å
223T59.4Low78.1Confident151 Ų151107 Ų10793%0.92658%0.584SS**SBendtrans-69.7-3.9175.952.90000112.4F221F221-T223 PolarHBondContact O-N 3.38Å
224A73.4Confident78.9Confident65 Ų65109.3 Ų109.354%0.53760%0.595SS.*SBendtrans-63.5135.1167.600000110.7S222S222-A224 PolarHBondContact O-N 2.95Å; S222-A224 VanDerWaalsContact O-N 3.15Å; S222-A224 WeakPolarHBondContact OG-CB 3.43Å; S222-A224 PolarHBondContact OG-N 3.21Å
225K77.9Confident79.7Confident202 Ų202108.8 Ų108.888%0.87858%0.582SS**PPolyproline II helixtrans-53.8129.2173.3-61.5-179.4-179-179.70109
226P81.8Confident80.1Confident54 Ų54107 Ų10735%0.35157%0.57SS.*PPolyproline II helixtrans-61152.6179.525.9-34.1000110.6R230 Q231P226-R230 HydrophobicContact CB-CB 4.18Å; P226-R230 HydrophobicContact CB-CG 4.16Å; P226-Q231 HydrophobicContact CG-CB 4.38Å
227S87.3Confident80.6Confident79 Ų79108 Ų10855%0.55257%0.572SS**PPolyproline II helixtrans-59.2149.817468.60000110.8A229 R230 Q231S227-A229 PolarHBondContact O-N 3.46Å; S227-R230 WeakPolarHBondContact O-CA 3.48Å; S227-R230 PolarHBondContact O-N 2.9Å; S227-R230 PolarHBondContact OG-N 2.96Å; S227-Q231 PolarHBondContact O-N 3.11Å
228M90.6Very high81.6Confident115 Ų115113.9 Ų113.957%0.56758%0.575SS**Hα-helixtrans-52.1-33.1-179.2-74.9-57-48.200113.7R232M228-R232 VanDerWaalsContact O-CG 3.31Å; M228-R232 WeakPolarHBondContact O-CG 3.45Å; M228-R232 PolarHBondContact O-N 3.14Å
229A90.8Very high82.7Confident64 Ų64114.7 Ų114.753%0.52958%0.579SS.*Hα-helixtrans-68.1-45.3174.900000112.2S227 R232 M233S227-A229 PolarHBondContact O-N 3.46Å; A229-R232 PolarHBondContact O-N 3.15Å; A229-M233 PolarHBondContact O-N 2.87Å
230R87.7Confident84.4Confident121 Ų121116.3 Ų116.346%0.45757%0.571SS.*Hα-helixtrans-67.3-37177.2-174.6173.2-172.7-94.3-2.2112P226 S227 M233 M234P226-R230 HydrophobicContact CB-CB 4.18Å; P226-R230 HydrophobicContact CB-CG 4.16Å; S227-R230 WeakPolarHBondContact O-CA 3.48Å; S227-R230 PolarHBondContact O-N 2.9Å; S227-R230 PolarHBondContact OG-N 2.96Å; R230-M233 PolarHBondContact O-N 3.14Å; R230-M234 HydrophobicContact CG-SD 4.32Å; R230-M234 WeakPolarHBondContact O-CG 3.48Å; R230-M234 PolarHBondContact O-N 3.31Å; R230-M234 VanDerWaalsContact O-N 3.07Å
231Q91.1Very high86.2Confident72 Ų72115.3 Ų115.334%0.33657%0.573SS.*Hα-helixtrans-59.6-47.4173.7-178.3174.1-11.200111.2P226 S227 M233 M234 E235P226-Q231 HydrophobicContact CG-CB 4.38Å; S227-Q231 PolarHBondContact O-N 3.11Å; Q231-M233 PolarHBondContact O-N 3.4Å; Q231-M234 PolarHBondContact O-N 3.03Å; Q231-E235 HydrophobicContact CG-CG 4.39Å; Q231-E235 VanDerWaalsContact CG-OE1 3.26Å; Q231-E235 WeakPolarHBondContact CG-OE1 3.42Å; Q231-E235 PolarHBondContact NE2-OE1 3.49Å; Q231-E235 WeakPolarHBondContact O-CB 3.48Å; Q231-E235 WeakPolarHBondContact O-CG 3.28Å; Q231-E235 PolarHBondContact O-N 2.92Å
232R94.6Very high88.1Confident170 Ų170110.3 Ų110.364%0.64256%0.556SS**Hα-helixtrans-58.6-43176.6-73.1170.5-177.2178.80.5112.9M228 A229 E235 E236M228-R232 VanDerWaalsContact O-CG 3.31Å; M228-R232 WeakPolarHBondContact O-CG 3.45Å; M228-R232 PolarHBondContact O-N 3.14Å; A229-R232 PolarHBondContact O-N 3.15Å; R232-E235 PolarHBondContact O-N 3.4Å; R232-E236 WeakPolarHBondContact O-CB 3.42Å; R232-E236 PolarHBondContact O-N 3.43Å
233M91.1Very high89.9Confident112 Ų112111 Ų11155%0.55255%0.549SS*.Hα-helixtrans-59.2-49.4175.4-70.6164.851.200111.7A229 R230 Q231 E235 E236 E237A229-M233 PolarHBondContact O-N 2.87Å; R230-M233 PolarHBondContact O-N 3.14Å; Q231-M233 PolarHBondContact O-N 3.4Å; M233-E235 VanDerWaalsContact C-N 3.31Å; M233-E235 PolarHBondContact O-N 3.18Å; M233-E236 PolarHBondContact O-N 3.23Å; M233-E237 WeakPolarHBondContact O-CG 3.4Å; M233-E237 PolarHBondContact O-N 3.22Å
234M93.1Very high91.7Very high91 Ų91106.8 Ų106.845%0.44853%0.529SS..Hα-helixtrans-64.3-35.3179.6-68.2178.467.700112.5R230 Q231 R238R230-M234 HydrophobicContact CG-SD 4.32Å; R230-M234 WeakPolarHBondContact O-CG 3.48Å; R230-M234 PolarHBondContact O-N 3.31Å; R230-M234 VanDerWaalsContact O-N 3.07Å; Q231-M234 PolarHBondContact O-N 3.03Å; M234-R238 VanDerWaalsContact O-CB 3.3Å; M234-R238 WeakPolarHBondContact O-CB 3.12Å; M234-R238 PolarHBondContact O-N 3.44Å
235E93.5Very high92.9Very high85 Ų85110.2 Ų110.240%0.39753%0.529SS..Hα-helixtrans-68.9-40.6175.3-75.1170.4-178.400112Q231 R232 M233 R238 Q239Q231-E235 HydrophobicContact CG-CG 4.39Å; Q231-E235 VanDerWaalsContact CG-OE1 3.26Å; Q231-E235 WeakPolarHBondContact CG-OE1 3.42Å; Q231-E235 PolarHBondContact NE2-OE1 3.49Å; Q231-E235 WeakPolarHBondContact O-CB 3.48Å; Q231-E235 WeakPolarHBondContact O-CG 3.28Å; Q231-E235 PolarHBondContact O-N 2.92Å; R232-E235 PolarHBondContact O-N 3.4Å; M233-E235 VanDerWaalsContact C-N 3.31Å; M233-E235 PolarHBondContact O-N 3.18Å; E235-R238 PolarHBondContact O-N 3.24Å; E235-Q239 VanDerWaalsContact O-CG 3.3Å; E235-Q239 WeakPolarHBondContact O-CG 3.15Å; E235-Q239 PolarHBondContact O-N 3.16Å
236E95.8Very high93.9Very high96 Ų96108.7 Ų108.745%0.44952%0.518SS..Hα-helixtrans-65-46.3175.2-165.8-167.9147.400111.5R232 M233 R238 Q239 R240R232-E236 WeakPolarHBondContact O-CB 3.42Å; R232-E236 PolarHBondContact O-N 3.43Å; M233-E236 PolarHBondContact O-N 3.23Å; E236-R238 VanDerWaalsContact C-N 3.33Å; E236-R238 PolarHBondContact O-N 2.69Å; E236-Q239 PolarHBondContact O-N 3.09Å; E236-Q239 VanDerWaalsContact O-N 3.14Å; E236-R240 WeakPolarHBondContact O-CG 3.46Å; E236-R240 PolarHBondContact O-N 2.82Å; E236-R240 IonicContact OE1-CZ 2.87Å; E236-R240 VanDerWaalsContact OE1-CZ 3.25Å; E236-R240 IonicContact OE1-NE 3.5Å; E236-R240 PolarHBondContact OE1-NE 2.79Å; E236-R240 IonicContact OE1-NH2 3.78Å; E236-R240 PolarHBondContact OE1-NH2 3.02Å
237E95.6Very high94.6Very high119 Ų119111.9 Ų111.956%0.55653%0.528SS*.Hα-helixtrans-57-46.7174.4-74.4174.8174.400111.3M233 Q239 R240 V241M233-E237 WeakPolarHBondContact O-CG 3.4Å; M233-E237 PolarHBondContact O-N 3.22Å; E237-Q239 VanDerWaalsContact C-N 3.33Å; E237-Q239 PolarHBondContact O-N 2.81Å; E237-R240 PolarHBondContact O-N 2.98Å; E237-V241 WeakPolarHBondContact O-CG2 3.31Å; E237-V241 PolarHBondContact O-N 3.06Å
238R97.1Very high95Very high186 Ų186112.2 Ų112.270%0.70252%0.523SS*.Hα-helixtrans-58.5-43.5175-177.5-176.6177.4-158.8-0.2111.7M234 E235 E236 V241 V242M234-R238 VanDerWaalsContact O-CB 3.3Å; M234-R238 WeakPolarHBondContact O-CB 3.12Å; M234-R238 PolarHBondContact O-N 3.44Å; E235-R238 PolarHBondContact O-N 3.24Å; E236-R238 VanDerWaalsContact C-N 3.33Å; E236-R238 PolarHBondContact O-N 2.69Å; R238-V241 PolarHBondContact O-N 3.41Å; R238-V242 WeakPolarHBondContact O-CB 3.43Å; R238-V242 VanDerWaalsContact O-CG2 3.27Å; R238-V242 WeakPolarHBondContact O-CG2 3.33Å; R238-V242 PolarHBondContact O-N 3.45Å
239Q97.3Very high95.4Very high119 Ų119111.8 Ų111.856%0.55652%0.518SS*.Hα-helixtrans-63.7-45.5177.4-74.1176.71900111.8E235 E236 E237 V241 V242 Q243E235-Q239 VanDerWaalsContact O-CG 3.3Å; E235-Q239 WeakPolarHBondContact O-CG 3.15Å; E235-Q239 PolarHBondContact O-N 3.16Å; E236-Q239 PolarHBondContact O-N 3.09Å; E236-Q239 VanDerWaalsContact O-N 3.14Å; E237-Q239 VanDerWaalsContact C-N 3.33Å; E237-Q239 PolarHBondContact O-N 2.81Å; Q239-V241 PolarHBondContact O-N 2.74Å; Q239-V242 PolarHBondContact O-N 3.49Å; Q239-Q243 WeakPolarHBondContact O-CB 3.44Å; Q239-Q243 VanDerWaalsContact O-CG 3.31Å; Q239-Q243 WeakPolarHBondContact O-CG 3.38Å; Q239-Q243 PolarHBondContact O-N 2.91Å
240R97.3Very high95.6Very high158 Ų158115 Ų11560%0.59652%0.52SS*.Hα-helixtrans-58-46.7176.1-69.9179.5-175.8-149.36.1111.7E236 E237 Q243 A244E236-R240 WeakPolarHBondContact O-CG 3.46Å; E236-R240 PolarHBondContact O-N 2.82Å; E236-R240 IonicContact OE1-CZ 2.87Å; E236-R240 VanDerWaalsContact OE1-CZ 3.25Å; E236-R240 IonicContact OE1-NE 3.5Å; E236-R240 PolarHBondContact OE1-NE 2.79Å; E236-R240 IonicContact OE1-NH2 3.78Å; E236-R240 PolarHBondContact OE1-NH2 3.02Å; E237-R240 PolarHBondContact O-N 2.98Å; R240-Q243 PolarHBondContact O-N 3.25Å; R240-A244 WeakPolarHBondContact O-CB 3.47Å; R240-A244 PolarHBondContact O-N 3.17Å
241V97.6Very high96Very high101 Ų101115.1 Ų115.161%0.61253%0.526SS*.Hα-helixtrans-63.2-44.3178172.40000111.7E237 R238 Q239 Q243 A244 Y245E237-V241 WeakPolarHBondContact O-CG2 3.31Å; E237-V241 PolarHBondContact O-N 3.06Å; R238-V241 PolarHBondContact O-N 3.41Å; Q239-V241 PolarHBondContact O-N 2.74Å; V241-Q243 PolarHBondContact O-N 3.18Å; V241-A244 PolarHBondContact O-N 3.24Å; V241-Y245 WeakPolarHBondContact O-CB 3.46Å; V241-Y245 PolarHBondContact O-N 2.99Å
242V97.9Very high96.1Very high62 Ų62117.6 Ų117.638%0.37654%0.535SS..Hα-helixtrans-63.9-40.8177.7168.70000111.6R238 Q239 R246R238-V242 WeakPolarHBondContact O-CB 3.43Å; R238-V242 VanDerWaalsContact O-CG2 3.27Å; R238-V242 WeakPolarHBondContact O-CG2 3.33Å; R238-V242 PolarHBondContact O-N 3.45Å; Q239-V242 PolarHBondContact O-N 3.49Å; V242-R246 WeakPolarHBondContact O-CB 3.25Å; V242-R246 VanDerWaalsContact O-CG 3.27Å; V242-R246 WeakPolarHBondContact O-CG 3.48Å; V242-R246 PolarHBondContact O-N 3.32Å
243Q97.4Very high96.1Very high109 Ų109114 Ų11451%0.50953%0.526SS..Hα-helixtrans-63.2-50.1174.7-72.7173.12.300111Q239 R240 V241 Y245 R246 H247Q239-Q243 WeakPolarHBondContact O-CB 3.44Å; Q239-Q243 VanDerWaalsContact O-CG 3.31Å; Q239-Q243 WeakPolarHBondContact O-CG 3.38Å; Q239-Q243 PolarHBondContact O-N 2.91Å; R240-Q243 PolarHBondContact O-N 3.25Å; V241-Q243 PolarHBondContact O-N 3.18Å; Q243-Y245 VanDerWaalsContact C-N 3.32Å; Q243-Y245 PolarHBondContact O-N 3.43Å; Q243-R246 WeakPolarHBondContact O-CB 3.44Å; Q243-R246 PolarHBondContact O-N 3.08Å; Q243-R246 VanDerWaalsContact O-N 3.07Å; Q243-H247 PolarHBondContact O-CD2 3.42Å; Q243-H247 PolarHBondContact O-N 2.87Å
244A97.7Very high96.1Very high62 Ų62114.3 Ų114.351%0.51253%0.526SS..Hα-helixtrans-56.2-44.7177.400000112.2R240 V241 R246 H247 L248R240-A244 WeakPolarHBondContact O-CB 3.47Å; R240-A244 PolarHBondContact O-N 3.17Å; V241-A244 PolarHBondContact O-N 3.24Å; A244-R246 PolarHBondContact O-N 3.37Å; A244-H247 PolarHBondContact O-N 3.46Å; A244-L248 WeakPolarHBondContact O-CB 3.32Å; A244-L248 PolarHBondContact O-N 3Å
245Y98Very high95.9Very high137 Ų137115.4 Ų115.454%0.53753%0.53SS..Hα-helixtrans-61.9-41.9174.7178.3-95000112.6V241 Q243 L248 K249V241-Y245 WeakPolarHBondContact O-CB 3.46Å; V241-Y245 PolarHBondContact O-N 2.99Å; Q243-Y245 VanDerWaalsContact C-N 3.32Å; Q243-Y245 PolarHBondContact O-N 3.43Å; Y245-L248 PolarHBondContact O-N 3.07Å; Y245-K249 HydrophobicContact CE1-CD 3.96Å; Y245-K249 WeakPolarHBondContact O-CB 3.38Å; Y245-K249 PolarHBondContact O-N 2.99Å
246R97.7Very high95.8Very high171 Ų171117.8 Ų117.865%0.64554%0.541SS*.Hα-helixtrans-62.1-42.9175.2-74.7173.1179.2-147.3-0.9111.9V242 Q243 A244 K249 K250V242-R246 WeakPolarHBondContact O-CB 3.25Å; V242-R246 VanDerWaalsContact O-CG 3.27Å; V242-R246 WeakPolarHBondContact O-CG 3.48Å; V242-R246 PolarHBondContact O-N 3.32Å; Q243-R246 WeakPolarHBondContact O-CB 3.44Å; Q243-R246 PolarHBondContact O-N 3.08Å; Q243-R246 VanDerWaalsContact O-N 3.07Å; A244-R246 PolarHBondContact O-N 3.37Å; R246-K249 PolarHBondContact O-N 3.32Å; R246-K250 WeakPolarHBondContact O-CG 3.37Å; R246-K250 PolarHBondContact O-N 3.42Å
247H97.2Very high95.5Very high121 Ų121118.1 Ų118.156%0.5654%0.543SS*.Hα-helixtrans-63.4-46.9176.1-74.6-72.2000111.8Q243 A244 K249 K250 Q251Q243-H247 PolarHBondContact O-CD2 3.42Å; Q243-H247 PolarHBondContact O-N 2.87Å; A244-H247 PolarHBondContact O-N 3.46Å; H247-K249 VanDerWaalsContact C-N 3.3Å; H247-K249 PolarHBondContact O-N 2.89Å; H247-K250 PolarHBondContact O-N 2.87Å; H247-Q251 WeakPolarHBondContact O-CG 3.39Å; H247-Q251 PolarHBondContact O-N 2.87Å
248L96.9Very high95.1Very high85 Ų85115.5 Ų115.545%0.44554%0.541SS..Hα-helixtrans-57.9-42.5175.2-170.183.2000111.7A244 Y245 Q251 K252A244-L248 WeakPolarHBondContact O-CB 3.32Å; A244-L248 PolarHBondContact O-N 3Å; Y245-L248 PolarHBondContact O-N 3.07Å; L248-Q251 PolarHBondContact O-N 2.95Å; L248-K252 WeakPolarHBondContact O-CG 3.19Å; L248-K252 PolarHBondContact O-N 3.41Å
249K97.1Very high94.6Very high106 Ų106113.4 Ų113.446%0.46154%0.537SS..Hα-helixtrans-67.2-42-179.8-166.8164.1-175.3171.50112.1Y245 R246 H247 K252 Q253Y245-K249 HydrophobicContact CE1-CD 3.96Å; Y245-K249 WeakPolarHBondContact O-CB 3.38Å; Y245-K249 PolarHBondContact O-N 2.99Å; R246-K249 PolarHBondContact O-N 3.32Å; H247-K249 VanDerWaalsContact C-N 3.3Å; H247-K249 PolarHBondContact O-N 2.89Å; K249-K252 PolarHBondContact O-N 2.98Å; K249-Q253 WeakPolarHBondContact O-CG 3.32Å; K249-Q253 PolarHBondContact O-N 2.92Å
250K96.6Very high94.2Very high131 Ų131110 Ų11057%0.5753%0.53SS*.Hα-helixtrans-59.9-45.1172.3-75.6-174.8172.5-1660112.4R246 H247 K252 Q253 H254R246-K250 WeakPolarHBondContact O-CG 3.37Å; R246-K250 PolarHBondContact O-N 3.42Å; H247-K250 PolarHBondContact O-N 2.87Å; K250-K252 VanDerWaalsContact C-N 3.33Å; K250-K252 PolarHBondContact O-N 3.31Å; K250-Q253 PolarHBondContact O-N 2.92Å; K250-H254 PolarHBondContact O-N 3.25Å
251Q94.7Very high93.6Very high124 Ų124105.7 Ų105.758%0.57952%0.521SS*.Hα-helixtrans-60.5-41.7176.5-74.1178.9-11.500112.1H247 L248 Q253 H254 Q255H247-Q251 WeakPolarHBondContact O-CG 3.39Å; H247-Q251 PolarHBondContact O-N 2.87Å; L248-Q251 PolarHBondContact O-N 2.95Å; Q251-Q253 VanDerWaalsContact C-N 3.35Å; Q251-Q253 PolarHBondContact O-N 2.96Å; Q251-H254 PolarHBondContact O-N 2.75Å; Q251-Q255 WeakPolarHBondContact O-CG 3.43Å; Q251-Q255 PolarHBondContact O-N 2.75Å
252K94.9Very high93Very high124 Ų124102.3 Ų102.354%0.53951%0.507SS..Hα-helixtrans-63.9-37.2175.4-73.7-174.1178.3-170.10112.9L248 K249 K250 Q255 Q256L248-K252 WeakPolarHBondContact O-CG 3.19Å; L248-K252 PolarHBondContact O-N 3.41Å; K249-K252 PolarHBondContact O-N 2.98Å; K250-K252 VanDerWaalsContact C-N 3.33Å; K250-K252 PolarHBondContact O-N 3.31Å; K252-Q255 PolarHBondContact O-N 2.9Å; K252-Q256 WeakPolarHBondContact O-CG 3.36Å; K252-Q256 PolarHBondContact O-N 3.26Å
253Q93.4Very high92.2Very high96 Ų96103.9 Ų103.945%0.44951%0.512SS..Hα-helixtrans-64.4-50.3174.9-71.9175.5-63.400111.4K249 K250 Q251 Q255 Q256 E257K249-Q253 WeakPolarHBondContact O-CG 3.32Å; K249-Q253 PolarHBondContact O-N 2.92Å; K250-Q253 PolarHBondContact O-N 2.92Å; Q251-Q253 VanDerWaalsContact C-N 3.35Å; Q251-Q253 PolarHBondContact O-N 2.96Å; Q253-Q255 VanDerWaalsContact C-N 3.27Å; Q253-Q255 PolarHBondContact O-N 2.88Å; Q253-Q256 WeakPolarHBondContact O-CA 3.38Å; Q253-Q256 WeakPolarHBondContact O-CB 3.47Å; Q253-Q256 PolarHBondContact O-N 3.45Å; Q253-E257 WeakPolarHBondContact O-CG 3.4Å; Q253-E257 PolarHBondContact O-N 3.28Å
254H90.9Very high91.4Very high118 Ų118104.1 Ų104.155%0.54651%0.513SS..Hα-helixtrans-60.5-34.2175.9-68.7-40.4000113.4K250 Q251 Q256 E257 A258K250-H254 PolarHBondContact O-N 3.25Å; Q251-H254 PolarHBondContact O-N 2.75Å; H254-Q256 VanDerWaalsContact C-N 3.33Å; H254-E257 WeakPolarHBondContact CA-OE2 3.31Å; H254-E257 IonicContact CE1-OE2 2.82Å; H254-E257 IonicContact CG-OE2 2.7Å; H254-E257 IonicContact ND1-OE2 2.7Å; H254-E257 PolarHBondContact ND1-OE2 3.28Å; H254-A258 VanDerWaalsContact O-CB 3.24Å; H254-A258 WeakPolarHBondContact O-CB 3.43Å; H254-A258 PolarHBondContact O-N 2.9Å
255Q90.2Very high90.6Very high114 Ų114108.1 Ų108.153%0.53352%0.519SS..Hα-helixtrans-67.1-31.3171.9-74.1178.39.100113.1Q251 K252 Q253 K259Q251-Q255 WeakPolarHBondContact O-CG 3.43Å; Q251-Q255 PolarHBondContact O-N 2.75Å; K252-Q255 PolarHBondContact O-N 2.9Å; Q253-Q255 VanDerWaalsContact C-N 3.27Å; Q253-Q255 PolarHBondContact O-N 2.88Å; Q255-K259 WeakPolarHBondContact O-CB 3.02Å; Q255-K259 WeakPolarHBondContact O-CD 3.39Å; Q255-K259 WeakPolarHBondContact O-CG 3.22Å; Q255-K259 PolarHBondContact O-N 2.91Å
256Q89.6Confident89.5Confident135 Ų135107.5 Ų107.563%0.63152%0.524SS*.Hα-helixtrans-74.3-43.5174.4-73.8173.4-26.500111.2K252 Q253 H254 K259 A260K252-Q256 WeakPolarHBondContact O-CG 3.36Å; K252-Q256 PolarHBondContact O-N 3.26Å; Q253-Q256 WeakPolarHBondContact O-CA 3.38Å; Q253-Q256 WeakPolarHBondContact O-CB 3.47Å; Q253-Q256 PolarHBondContact O-N 3.45Å; H254-Q256 VanDerWaalsContact C-N 3.33Å; Q256-K259 PolarHBondContact O-N 3.36Å; Q256-A260 WeakPolarHBondContact O-CB 3.45Å; Q256-A260 PolarHBondContact O-N 3.21Å
257E90.4Very high88.4Confident103 Ų103106.1 Ų106.148%0.48152%0.523SS..Hα-helixtrans-59.6-45.7174.3-68.1160.5-175.500111.7Q253 H254 K259 A260 T261Q253-E257 WeakPolarHBondContact O-CG 3.4Å; Q253-E257 PolarHBondContact O-N 3.28Å; H254-E257 WeakPolarHBondContact CA-OE2 3.31Å; H254-E257 IonicContact CE1-OE2 2.82Å; H254-E257 IonicContact CG-OE2 2.7Å; H254-E257 IonicContact ND1-OE2 2.7Å; H254-E257 PolarHBondContact ND1-OE2 3.28Å; E257-K259 VanDerWaalsContact C-N 3.32Å; E257-K259 PolarHBondContact O-N 2.83Å; E257-A260 PolarHBondContact O-N 2.99Å; E257-T261 WeakPolarHBondContact O-CB 3.31Å; E257-T261 WeakPolarHBondContact O-CG2 3.32Å; E257-T261 PolarHBondContact O-N 2.92Å; E257-T261 PolarHBondContact O-OG1 3.07Å
258A87Confident87.2Confident64 Ų64106.8 Ų106.853%0.52953%0.53SS..Hα-helixtrans-63.9-35176.200000112.7H254 T261 G262H254-A258 VanDerWaalsContact O-CB 3.24Å; H254-A258 WeakPolarHBondContact O-CB 3.43Å; H254-A258 PolarHBondContact O-N 2.9Å; A258-T261 WeakPolarHBondContact CA-OG1 3.5Å; A258-T261 PolarHBondContact O-OG1 3.02Å; A258-G262 PolarHBondContact O-N 3.46Å
259K87.4Confident85.7Confident141 Ų141109.5 Ų109.561%0.61355%0.545SS*.Hα-helixtrans-71.4-43.8174.5-75.7171.7-175.5-173.90111.9Q255 Q256 E257 G262 I263Q255-K259 WeakPolarHBondContact O-CB 3.02Å; Q255-K259 WeakPolarHBondContact O-CD 3.39Å; Q255-K259 WeakPolarHBondContact O-CG 3.22Å; Q255-K259 PolarHBondContact O-N 2.91Å; Q256-K259 PolarHBondContact O-N 3.36Å; E257-K259 VanDerWaalsContact C-N 3.32Å; E257-K259 PolarHBondContact O-N 2.83Å; K259-G262 PolarHBondContact O-N 2.85Å; K259-I263 WeakPolarHBondContact O-CD1 3.49Å; K259-I263 VanDerWaalsContact O-CG1 3.28Å; K259-I263 WeakPolarHBondContact O-CG1 3.35Å; K259-I263 PolarHBondContact O-N 3.12Å
260A87.2Confident83.6Confident48 Ų48115.5 Ų115.540%0.39757%0.574SS.*Hα-helixtrans-61.1-51.8177.700000111.3Q256 E257 G262 I263 E264Q256-A260 WeakPolarHBondContact O-CB 3.45Å; Q256-A260 PolarHBondContact O-N 3.21Å; E257-A260 PolarHBondContact O-N 2.99Å; A260-G262 VanDerWaalsContact C-N 3.29Å; A260-G262 PolarHBondContact O-N 3.48Å; A260-I263 PolarHBondContact O-N 3.29Å; A260-I263 VanDerWaalsContact O-N 3.1Å; A260-E264 PolarHBondContact O-N 3.49Å
261T85.3Confident82.9Confident68 Ų68114.8 Ų114.842%0.41758%0.575SS.*Hα-helixtrans-63.9-31.817752.90000113E257 A258 K265E257-T261 WeakPolarHBondContact O-CB 3.31Å; E257-T261 WeakPolarHBondContact O-CG2 3.32Å; E257-T261 PolarHBondContact O-N 2.92Å; E257-T261 PolarHBondContact O-OG1 3.07Å; A258-T261 WeakPolarHBondContact CA-OG1 3.5Å; A258-T261 PolarHBondContact O-OG1 3.02Å; T261-K265 VanDerWaalsContact O-CG 3.28Å; T261-K265 WeakPolarHBondContact O-CG 3.44Å; T261-K265 PolarHBondContact O-N 3.42Å
262G84.9Confident82.3Confident30 Ų30114.3 Ų114.331%0.30957%0.574SS.*Hα-helixtrans-64.6-42.8170.700000113A258 K259 A260 K265 L266A258-G262 PolarHBondContact O-N 3.46Å; K259-G262 PolarHBondContact O-N 2.85Å; A260-G262 VanDerWaalsContact C-N 3.29Å; A260-G262 PolarHBondContact O-N 3.48Å; G262-K265 PolarHBondContact O-N 3.33Å; G262-L266 WeakPolarHBondContact O-CG 3.32Å; G262-L266 PolarHBondContact O-N 2.9Å; G262-L266 VanDerWaalsContact O-N 3.17Å
263I81.4Confident81.6Confident94 Ų94113.7 Ų113.748%0.48258%0.576SS.*Hα-helixtrans-66.4-41.6176.5-68.9162.3000111K259 A260 L266 K267K259-I263 WeakPolarHBondContact O-CD1 3.49Å; K259-I263 VanDerWaalsContact O-CG1 3.28Å; K259-I263 WeakPolarHBondContact O-CG1 3.35Å; K259-I263 PolarHBondContact O-N 3.12Å; A260-I263 PolarHBondContact O-N 3.29Å; A260-I263 VanDerWaalsContact O-N 3.1Å; I263-L266 PolarHBondContact O-N 3.16Å; I263-K267 HydrophobicContact CG2-CD 4.47Å; I263-K267 WeakPolarHBondContact O-CG 3.45Å; I263-K267 PolarHBondContact O-N 3.02Å; I263-K267 VanDerWaalsContact O-N 3.08Å
264E80.9Confident80.9Confident115 Ų115114.8 Ų114.854%0.53758%0.584SS.*Hα-helixtrans-62.2-43.6175.7-72.3175.6169.200112.1A260 L266 K267 N268A260-E264 PolarHBondContact O-N 3.49Å; E264-L266 VanDerWaalsContact C-N 3.3Å; E264-L266 PolarHBondContact O-N 2.93Å; E264-K267 PolarHBondContact O-N 2.9Å; E264-K267 VanDerWaalsContact O-N 3.17Å; E264-N268 VanDerWaalsContact O-CG 3.25Å; E264-N268 PolarHBondContact O-N 3.31Å; E264-N268 PolarHBondContact O-ND2 3.08Å
265K80.2Confident80.3Confident146 Ų146114.6 Ų114.664%0.63559%0.586SS**Hα-helixtrans-60-38.2175.3-75.2173.7-178.8-177.50112.8T261 G262 N268 L269T261-K265 VanDerWaalsContact O-CG 3.28Å; T261-K265 WeakPolarHBondContact O-CG 3.44Å; T261-K265 PolarHBondContact O-N 3.42Å; G262-K265 PolarHBondContact O-N 3.33Å; K265-N268 PolarHBondContact O-N 3.26Å; K265-L269 WeakPolarHBondContact O-CD1 3.48Å; K265-L269 WeakPolarHBondContact O-CG 3.42Å
266L74.9Confident79.6Confident124 Ų124114.6 Ų114.665%0.64959%0.59SS**Hα-helixtrans-69.4-34.4176.4-71171.1000112.6G262 I263 E264G262-L266 WeakPolarHBondContact O-CG 3.32Å; G262-L266 PolarHBondContact O-N 2.9Å; G262-L266 VanDerWaalsContact O-N 3.17Å; I263-L266 PolarHBondContact O-N 3.16Å; E264-L266 VanDerWaalsContact C-N 3.3Å; E264-L266 PolarHBondContact O-N 2.93Å
267K74.4Confident78.9Confident142 Ų142113.1 Ų113.162%0.61759%0.587SS**Hα-helixtrans-69.4-32.2174.5-71.9178.2177.2-174.70113.1I263 E264 L269I263-K267 HydrophobicContact CG2-CD 4.47Å; I263-K267 WeakPolarHBondContact O-CG 3.45Å; I263-K267 PolarHBondContact O-N 3.02Å; I263-K267 VanDerWaalsContact O-N 3.08Å; E264-K267 PolarHBondContact O-N 2.9Å; E264-K267 VanDerWaalsContact O-N 3.17Å; K267-L269 PolarHBondContact O-N 3.23Å
268N72.5Confident78.1Confident134 Ų134113.9 Ų113.972%0.71760%0.595SS**THydrogen-bonded Turntrans-8610.2-179.4-61.5-14.1000113.6E264 K265E264-N268 VanDerWaalsContact O-CG 3.25Å; E264-N268 PolarHBondContact O-N 3.31Å; E264-N268 PolarHBondContact O-ND2 3.08Å; K265-N268 PolarHBondContact O-N 3.26Å
269L66.4Low77.3Confident143 Ų143118.1 Ų118.175%0.74960%0.601SS**THydrogen-bonded Turntrans-113.18.5176.9-76168.2000112.6K265 K267K265-L269 WeakPolarHBondContact O-CD1 3.48Å; K265-L269 WeakPolarHBondContact O-CG 3.42Å; K267-L269 PolarHBondContact O-N 3.23Å
270Q52.1Low76.4Confident232 Ų232116 Ų116100%1.08460%0.599SS**  trans-109.80169.6-66.8-170.9-51.100109.7

Retrieved 270 of 270 residues in 188.5 ms (Link to these results)