A0A087YM51_POEFO Loading...

Zgc:101716

AlphaFold DB , UniProt , Accession A0A087YM51, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 324 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
1M37.9Very low52.9Low241 Ų241140 Ų140100%1.18775%0.754SS**  088.50-157.1174.4-133.600105.1
2E38Very low54.4Low171 Ų171138 Ų13880%0.79975%0.749SS**  trans-83.7118.1-177.2-73177.516700107.7F4E2-F4 PolarHBondContact O-N 3.18Å; E2-F4 VanDerWaalsContact O-N 3.13Å
3I44.8Very low56.2Low163 Ų163137.2 Ų137.284%0.83674%0.735SS**  trans-72.4103.1172.1-62171.6000104.9G5I3-G5 PolarHBondContact O-N 2.98Å
4F42.5Very low57.6Low204 Ų204135.7 Ų135.790%0.89574%0.74SS**  trans-67.273.4162.7-80.2-85.6000108.2E2E2-F4 PolarHBondContact O-N 3.18Å; E2-F4 VanDerWaalsContact O-N 3.13Å
5G49.4Very low58.7Low44 Ų44139.2 Ų139.245%0.45475%0.75SS.*  trans-96129.816900000108.1I3 T7I3-G5 PolarHBondContact O-N 2.98Å; G5-T7 VanDerWaalsContact C-N 3.32Å; G5-T7 PolarHBondContact O-N 3.31Å
6S52.9Low59.4Low107 Ų107136.8 Ų136.875%0.74875%0.754SS**  trans-55.593169.453.90000109.8F8S6-F8 VanDerWaalsContact C-N 3.28Å; S6-F8 PolarHBondContact O-N 3.02Å
7T52.8Low60.3Low137 Ų137142.5 Ų142.584%0.8476%0.762SS**  trans-69.497.4162.249.90000105.6G5 D9G5-T7 VanDerWaalsContact C-N 3.32Å; G5-T7 PolarHBondContact O-N 3.31Å; T7-D9 PolarHBondContact O-N 3.37Å
8F57.9Low60.8Low158 Ų158145.1 Ų145.169%0.69377%0.769SS**  trans-59.2123.5171.1-117.3-98.4000107.2S6 D10 F13S6-F8 VanDerWaalsContact C-N 3.28Å; S6-F8 PolarHBondContact O-N 3.02Å; F8-D10 PolarHBondContact O-N 3.44Å; F8-D10 VanDerWaalsContact O-N 3.16Å; F8-F13 HydrophobicContact CD1-CE2 4.11Å; F8-F13 HydrophobicContact CD1-CZ 4.29Å; F8-F13 HydrophobicContact CE1-CZ 4.3Å
9D67.9Low61.2Low98 Ų98150.3 Ų150.352%0.52478%0.777SS.*  trans-76.3101.7177-175-2.4000108.1T7 S11 V12T7-D9 PolarHBondContact O-N 3.37Å; D9-S11 PolarHBondContact O-N 3.5Å; D9-S11 VanDerWaalsContact O-N 3.11Å; D9-S11 WeakPolarHBondContact OD1-CB 3.45Å; D9-S11 PolarHBondContact OD1-N 2.68Å; D9-S11 PolarHBondContact OD1-OG 3.17Å; D9-S11 PolarHBondContact OD2-OG 3.46Å; D9-V12 HydrophobicContact CB-CG2 4.21Å; D9-V12 WeakPolarHBondContact O-CG2 3.28Å; D9-V12 PolarHBondContact O-N 3.22Å
10D67Low61.7Low124 Ų124148.4 Ų148.466%0.66377%0.772SS**G310 helixtrans-63.8-12.3179.4-84.6-17.9000112.7F8 V12 F13F8-D10 PolarHBondContact O-N 3.44Å; F8-D10 VanDerWaalsContact O-N 3.16Å; D10-V12 PolarHBondContact O-N 2.81Å; D10-F13 PolarHBondContact O-N 2.91Å
11S70.6Confident61.8Low93 Ų93147.6 Ų147.665%0.6578%0.778SS**G310 helixtrans-69.2-12.2176.375.60000114.1D9 F13D9-S11 PolarHBondContact O-N 3.5Å; D9-S11 VanDerWaalsContact O-N 3.11Å; D9-S11 WeakPolarHBondContact OD1-CB 3.45Å; D9-S11 PolarHBondContact OD1-N 2.68Å; D9-S11 PolarHBondContact OD1-OG 3.17Å; D9-S11 PolarHBondContact OD2-OG 3.46Å; S11-F13 VanDerWaalsContact C-N 3.32Å
12V71Confident63.5Low116 Ų116143.4 Ų143.470%0.70376%0.755SS**G310 helixtrans-79.8-17.8175.7-164.10000111.6D9 D10D9-V12 HydrophobicContact CB-CG2 4.21Å; D9-V12 WeakPolarHBondContact O-CG2 3.28Å; D9-V12 PolarHBondContact O-N 3.22Å; D10-V12 PolarHBondContact O-N 2.81Å
13F78.4Confident65.3Low128 Ų128140.8 Ų140.856%0.56176%0.756SS**SBendtrans-88.3134.5175.7-60.6-80.4000110.5F8 D10 S11F8-F13 HydrophobicContact CD1-CE2 4.11Å; F8-F13 HydrophobicContact CD1-CZ 4.29Å; F8-F13 HydrophobicContact CE1-CZ 4.3Å; D10-F13 PolarHBondContact O-N 2.91Å; S11-F13 VanDerWaalsContact C-N 3.32Å
14S75.4Confident66.5Low116 Ų116141 Ų14181%0.81176%0.758SS**PPolyproline II helixtrans-62.5148.3170.6-48.60000110.4A16S14-A16 PolarHBondContact O-N 3.44Å
15E74.6Confident68.2Low188 Ų188136.4 Ų136.488%0.87975%0.751SS**PPolyproline II helixtrans-50.1135.3172.4-74.6-179165.100110.5R17E15-R17 PolarHBondContact O-N 3.29Å; E15-R17 VanDerWaalsContact O-N 3.07Å
16A69Low69.6Low100 Ų100139.3 Ų139.383%0.82676%0.764SS**PPolyproline II helixtrans-56.1119.6178.600000108.9S14 E18S14-A16 PolarHBondContact O-N 3.44Å; A16-E18 PolarHBondContact O-N 2.9Å
17R74.6Confident70.9Confident235 Ų235143.5 Ų143.589%0.88777%0.765SS**PPolyproline II helixtrans-53.2131.7173.4-69.8-176.5175.6-177.2-1.2108.7E15 R19E15-R17 PolarHBondContact O-N 3.29Å; E15-R17 VanDerWaalsContact O-N 3.07Å; R17-R19 PolarHBondContact O-N 2.96Å
18E70.5Confident72.1Confident189 Ų189143.7 Ų143.788%0.88376%0.761SS**  trans-51.7111.4172.2-79.5-172.7158.300108.4A16 V20A16-E18 PolarHBondContact O-N 2.9Å; E18-V20 PolarHBondContact O-N 3.41Å
19R67.1Low73.1Confident243 Ų243139.2 Ų139.292%0.91775%0.753SS**  trans-71.6104.6175.4-67.3-176.7-174.6168.32.2106.2R17 C21R17-R19 PolarHBondContact O-N 2.96Å; R19-C21 PolarHBondContact O-N 3.46Å
20V71.8Confident73.6Confident112 Ų112141.1 Ų141.168%0.67976%0.757SS**  trans-55.2118168-174.70000106.4E18 E22E18-V20 PolarHBondContact O-N 3.41Å; V20-E22 HydrophobicContact CB-CG 4.24Å; V20-E22 HydrophobicContact CG1-CG 3.66Å; V20-E22 PolarHBondContact O-N 2.93Å
21C64.6Low74.2Confident133 Ų133143.1 Ų143.190%0.89977%0.767SS**  trans-73.576.5174.1-1690000107.5R19R19-C21 PolarHBondContact O-N 3.46Å
22E73.6Confident74.7Confident152 Ų152142.1 Ų142.171%0.7176%0.759SS**  trans-78131.6169.9-67.4-171.816600108.4V20 L24V20-E22 HydrophobicContact CB-CG 4.24Å; V20-E22 HydrophobicContact CG1-CG 3.66Å; V20-E22 PolarHBondContact O-N 2.93Å; E22-L24 PolarHBondContact O-N 3.4Å
23S73.9Confident75.6Confident117 Ų117143 Ų14382%0.81876%0.755SS**  trans-61.4107.3168.654.20000108.1S25S23-S25 PolarHBondContact O-N 3.33Å; S23-S25 VanDerWaalsContact O-N 3.16Å
24L71.8Confident76.2Confident168 Ų168142.3 Ų142.388%0.8876%0.763SS**  trans-55.9122.8175.6-67.5171000108.5E22 S26E22-L24 PolarHBondContact O-N 3.4Å; L24-S26 PolarHBondContact O-N 2.99Å
25S77.3Confident77Confident106 Ų106142.1 Ų142.174%0.74175%0.75SS**  trans-56140.9170.454.90000109.1S23 Y27S23-S25 PolarHBondContact O-N 3.33Å; S23-S25 VanDerWaalsContact O-N 3.16Å; S25-Y27 PolarHBondContact O-N 3.42Å
26S79.8Confident77.9Confident105 Ų105136 Ų13673%0.73472%0.718SS**  trans-53.7110.5175.256.70000110.1L24 N28L24-S26 PolarHBondContact O-N 2.99Å; S26-N28 PolarHBondContact O-N 2.88Å
27Y79.8Confident79Confident196 Ų196132.5 Ų132.577%0.76969%0.685SS**  trans-83.5112.6178.5175.9-103.6000109.3S25 A29S25-Y27 PolarHBondContact O-N 3.42Å; Y27-A29 HydrophobicContact CE1-CB 3.78Å
28N77.8Confident79.9Confident140 Ų140124.2 Ų124.275%0.74966%0.662SS**  trans-93.5110.1168.2-69.6-53.3000108S26 K30S26-N28 PolarHBondContact O-N 2.88Å; N28-K30 PolarHBondContact O-N 3.27Å
29A79.4Confident80.9Confident64 Ų64120.5 Ų120.553%0.52965%0.645SS.*  trans-60.6133.3174.300000109.6Y27 L31Y27-A29 HydrophobicContact CE1-CB 3.78Å; A29-L31 PolarHBondContact O-N 3.18Å
30K78.1Confident81.9Confident139 Ų139113.7 Ų113.760%0.60464%0.635SS**  trans-67.8122.2172-66.7-177.1179177.90108.3N28 E50N28-K30 PolarHBondContact O-N 3.27Å; K30-E50 VanDerWaalsContact NZ-CD 3.26Å; K30-E50 IonicContact NZ-OE1 3.73Å; K30-E50 IonicContact NZ-OE2 2.71Å; K30-E50 PolarHBondContact NZ-OE2 3.31Å
31L78.6Confident82.8Confident166 Ų166111 Ų11187%0.86962%0.621SS**  trans-86.2113.6167.7-69.8168.1000107.3A29A29-L31 PolarHBondContact O-N 3.18Å
32C81.9Confident83.9Confident72 Ų72105.4 Ų105.449%0.48658%0.584SS.*  trans-109.1116.7179.8-63.50000109.2W36C32-W36 HydrophobicContact CB-CD2 4.4Å; C32-W36 HydrophobicContact CB-CG 3.9Å
33E89.6Confident84.8Confident134 Ų134100.4 Ų100.463%0.62656%0.562SS**  trans-65.6158.2173.7-67.5-57141.800111.4E35 W36E33-E35 PolarHBondContact O-N 2.94Å; E33-W36 WeakPolarHBondContact O-CB 3.46Å; E33-W36 VanDerWaalsContact O-CD1 3.31Å; E33-W36 PolarHBondContact O-N 3.35Å; E33-W36 VanDerWaalsContact O-N 3.1Å
34P91.2Very high85.6Confident113 Ų113101.2 Ų101.273%0.73456%0.557SS**THydrogen-bonded Turntrans-51134.3172.1-25.935.1000111.2W36P34-W36 PolarHBondContact O-N 3.3Å; P34-W36 VanDerWaalsContact O-N 3.12Å
35E92.7Very high86.4Confident112 Ų11295.5 Ų95.552%0.52353%0.529SS..THydrogen-bonded Turntrans57.621.3-179.4-57.6-176.5-176.700115.4E33 F37 C38E33-E35 PolarHBondContact O-N 2.94Å; E35-F37 PolarHBondContact O-N 3.09Å; E35-C38 HydrophobicContact CB-CB 4.49Å; E35-C38 VanDerWaalsContact O-CB 3.27Å; E35-C38 WeakPolarHBondContact O-CB 3.28Å; E35-C38 PolarHBondContact O-N 3.3Å
36W92.5Very high87Confident59 Ų5998.1 Ų98.122%0.22354%0.535CS..G310 helixtrans-46.9-34.2177.568-85.7000113.8C32 E33 P34 C38 E39 A42 V54 F57C32-W36 HydrophobicContact CB-CD2 4.4Å; C32-W36 HydrophobicContact CB-CG 3.9Å; E33-W36 WeakPolarHBondContact O-CB 3.46Å; E33-W36 VanDerWaalsContact O-CD1 3.31Å; E33-W36 PolarHBondContact O-N 3.35Å; E33-W36 VanDerWaalsContact O-N 3.1Å; P34-W36 PolarHBondContact O-N 3.3Å; P34-W36 VanDerWaalsContact O-N 3.12Å; W36-C38 PolarHBondContact O-N 3.1Å; W36-E39 PolarHBondContact O-N 3.05Å; W36-A42 HydrophobicContact CE3-CB 3.98Å; W36-A42 HydrophobicContact CZ3-CB 3.99Å; W36-V54 HydrophobicContact CH2-CG2 3.76Å; W36-V54 HydrophobicContact CZ3-CG2 3.6Å; W36-F57 HydrophobicContact CZ2-CD2 4.1Å; W36-F57 HydrophobicContact CZ2-CE2 4.04Å
37F93.5Very high87.5Confident28 Ų2896.4 Ų96.412%0.12352%0.518CS..G310 helixtrans-68.2-14.1179.557.1-95.4000113.2E35 V54 F57 R58 L61E35-F37 PolarHBondContact O-N 3.09Å; F37-V54 HydrophobicContact CB-CG1 4.33Å; F37-V54 HydrophobicContact CB-CG2 4.37Å; F37-V54 WeakPolarHBondContact O-CG1 3.13Å; F37-F57 HydrophobicContact CB-CB 4.15Å; F37-F57 HydrophobicContact CB-CD2 4.39Å; F37-F57 HydrophobicContact CD1-CB 3.69Å; F37-F57 HydrophobicContact CD1-CD2 4.07Å; F37-F57 HydrophobicContact CD1-CG 4.16Å; F37-F57 HydrophobicContact CD2-CB 3.63Å; F37-F57 HydrophobicContact CE1-CB 3.93Å; F37-F57 HydrophobicContact CE1-CG 4.46Å; F37-F57 HydrophobicContact CE2-CB 3.87Å; F37-F57 HydrophobicContact CG-CB 3.54Å; F37-F57 HydrophobicContact CG-CD2 4.32Å; F37-F57 HydrophobicContact CG-CG 4.37Å; F37-F57 HydrophobicContact CZ-CB 4.02Å; F37-R58 HydrophobicContact CD2-CG 3.9Å; F37-R58 VanDerWaalsContact O-CZ 3.22Å; F37-R58 PolarHBondContact O-NE 3.08Å; F37-R58 PolarHBondContact O-NH2 3.4Å; F37-L61 HydrophobicContact CE2-CB 4.01Å; F37-L61 HydrophobicContact CE2-CD2 3.71Å; F37-L61 HydrophobicContact CE2-CG 4.49Å; F37-L61 HydrophobicContact CZ-CB 4.26Å; F37-L61 HydrophobicContact CZ-CD2 3.97Å
38C93.1Very high88.1Confident60 Ų6090 Ų9041%0.40550%0.501SS..G310 helixtrans-77.4-23.7175.3-65.80000112.5E35 W36 R58E35-C38 HydrophobicContact CB-CB 4.49Å; E35-C38 VanDerWaalsContact O-CB 3.27Å; E35-C38 WeakPolarHBondContact O-CB 3.28Å; E35-C38 PolarHBondContact O-N 3.3Å; W36-C38 PolarHBondContact O-N 3.1Å; C38-R58 PolarHBondContact O-NH2 3.27Å
39E91.2Very high88.8Confident112 Ų11287 Ų8752%0.52349%0.485SS..SBendtrans-67.7144.4178.7-59.1-175.1-174.600111.3W36 S41 A42 R58W36-E39 PolarHBondContact O-N 3.05Å; E39-S41 VanDerWaalsContact CB-OG 3.28Å; E39-S41 WeakPolarHBondContact CB-OG 3.29Å; E39-S41 PolarHBondContact O-N 3.16Å; E39-S41 PolarHBondContact OE2-OG 3.38Å; E39-S41 VanDerWaalsContact OE2-OG 3.06Å; E39-A42 VanDerWaalsContact O-CB 3.31Å; E39-A42 WeakPolarHBondContact O-CB 3.38Å; E39-A42 PolarHBondContact O-N 3.27Å; E39-R58 PolarHBondContact O-NH2 2.84Å
40S88.7Confident89.3Confident100 Ų10085.1 Ų85.170%0.69947%0.465SS*.G310 helixtrans-63.6-34.2176.153.10000111.9A42 L43S40-A42 PolarHBondContact O-N 3.01Å; S40-A42 VanDerWaalsContact O-N 3.17Å; S40-L43 PolarHBondContact O-N 2.6Å; S40-L43 VanDerWaalsContact O-N 3.12Å
41S89.6Confident90.1Very high55 Ų5580.2 Ų80.239%0.38544%0.444SS..G310 helixtrans-56.8-25.6175.853.40000113.4E39 L43 D44E39-S41 VanDerWaalsContact CB-OG 3.28Å; E39-S41 WeakPolarHBondContact CB-OG 3.29Å; E39-S41 PolarHBondContact O-N 3.16Å; E39-S41 PolarHBondContact OE2-OG 3.38Å; E39-S41 VanDerWaalsContact OE2-OG 3.06Å; S41-L43 PolarHBondContact O-N 3.08Å; S41-L43 VanDerWaalsContact O-N 3.12Å; S41-D44 WeakPolarHBondContact CA-OD2 3.44Å; S41-D44 WeakPolarHBondContact O-CB 3.49Å; S41-D44 PolarHBondContact O-N 3Å
42A88.8Confident90.9Very high16 Ų1672.8 Ų72.813%0.13240%0.404CS..G310 helixtrans-63.2-18.6178.100000113.2W36 E39 S40 V54W36-A42 HydrophobicContact CE3-CB 3.98Å; W36-A42 HydrophobicContact CZ3-CB 3.99Å; E39-A42 VanDerWaalsContact O-CB 3.31Å; E39-A42 WeakPolarHBondContact O-CB 3.38Å; E39-A42 PolarHBondContact O-N 3.27Å; S40-A42 PolarHBondContact O-N 3.01Å; S40-A42 VanDerWaalsContact O-N 3.17Å; A42-V54 HydrophobicContact CB-CG1 4.29Å; A42-V54 HydrophobicContact CB-CG2 3.82Å
43L91.1Very high91.5Very high47 Ų4772.9 Ų72.925%0.24640%0.397CS..G310 helixtrans-96.8-3.1176-64.8176.4000113.4S40 S41 T45 K51 V54 F55S40-L43 PolarHBondContact O-N 2.6Å; S40-L43 VanDerWaalsContact O-N 3.12Å; S41-L43 PolarHBondContact O-N 3.08Å; S41-L43 VanDerWaalsContact O-N 3.12Å; L43-T45 PolarHBondContact O-N 3.04Å; L43-K51 HydrophobicContact CD2-CB 4.5Å; L43-K51 HydrophobicContact CD2-CG 4.22Å; L43-V54 HydrophobicContact CD2-CB 3.99Å; L43-V54 HydrophobicContact CD2-CG1 3.66Å; L43-V54 HydrophobicContact CG-CG1 4.14Å; L43-F55 HydrophobicContact CD1-CE1 4.46Å; L43-F55 HydrophobicContact CD1-CE2 4.35Å; L43-F55 HydrophobicContact CD1-CZ 3.81Å; L43-F55 HydrophobicContact CD2-CD2 4.29Å; L43-F55 HydrophobicContact CD2-CE2 3.7Å; L43-F55 HydrophobicContact CD2-CZ 4Å
44D90.8Very high91.9Very high134 Ų13466.5 Ų66.572%0.71737%0.367SS*.  trans-7960.1-179.8-63.5-14.7000110.5S41S41-D44 WeakPolarHBondContact CA-OD2 3.44Å; S41-D44 WeakPolarHBondContact O-CB 3.49Å; S41-D44 PolarHBondContact O-N 3Å
45T88.9Confident92.2Very high48 Ų4862.6 Ų62.629%0.29434%0.338SS..SBendtrans-149.1152179.6-179.50000109.7L43 D47 E50 K51L43-T45 PolarHBondContact O-N 3.04Å; T45-D47 VanDerWaalsContact C-N 3.34Å; T45-D47 WeakPolarHBondContact OG1-CB 3.37Å; T45-D47 PolarHBondContact OG1-N 3.22Å; T45-D47 VanDerWaalsContact OG1-N 3.14Å; T45-E50 HydrophobicContact CG2-CB 3.88Å; T45-K51 HydrophobicContact CG2-CG 4.32Å; T45-K51 WeakPolarHBondContact O-CE 3.46Å; T45-K51 PolarHBondContact O-NZ 3.27Å
46D89.4Confident92.4Very high161 Ų16158.9 Ų58.986%0.86132%0.32SS*.SBendtrans-90.2-5.5171.3-68.5-37.7000112.4S48D46-S48 PolarHBondContact O-N 3.39Å
47D91.2Very high92.6Very high69 Ų6959.7 Ų59.737%0.36933%0.326SS..  trans-73.4112.1179.2-170.7-15.2000111.3T45 L49 E50 K51T45-D47 VanDerWaalsContact C-N 3.34Å; T45-D47 WeakPolarHBondContact OG1-CB 3.37Å; T45-D47 PolarHBondContact OG1-N 3.22Å; T45-D47 VanDerWaalsContact OG1-N 3.14Å; D47-L49 VanDerWaalsContact C-N 3.27Å; D47-L49 PolarHBondContact O-N 2.91Å; D47-L49 VanDerWaalsContact OD1-CB 3.31Å; D47-L49 WeakPolarHBondContact OD1-CB 3.41Å; D47-L49 PolarHBondContact OD1-N 3.5Å; D47-E50 HydrophobicContact CB-CB 4.1Å; D47-E50 HydrophobicContact CB-CG 3.88Å; D47-E50 PolarHBondContact O-N 2.94Å; D47-E50 WeakPolarHBondContact OD2-CG 3.48Å; D47-K51 PolarHBondContact O-N 3Å; D47-K51 VanDerWaalsContact O-N 3.14Å
48S92.1Very high92.8Very high61 Ų6161.2 Ų61.243%0.42733%0.331SS..Hα-helixtrans-61.7-33.717857.20000112.7D46 E50 K51 Q52D46-S48 PolarHBondContact O-N 3.39Å; S48-E50 VanDerWaalsContact C-N 3.35Å; S48-K51 PolarHBondContact O-N 3.27Å; S48-Q52 WeakPolarHBondContact O-CB 3.36Å; S48-Q52 PolarHBondContact O-N 2.87Å
49L91.8Very high93.1Very high76 Ų7658.3 Ų58.340%0.39831%0.311SS..Hα-helixtrans-68.7-36.3178.9178.361.6000111.2D47 Q52 K53D47-L49 VanDerWaalsContact C-N 3.27Å; D47-L49 PolarHBondContact O-N 2.91Å; D47-L49 VanDerWaalsContact OD1-CB 3.31Å; D47-L49 WeakPolarHBondContact OD1-CB 3.41Å; D47-L49 PolarHBondContact OD1-N 3.5Å; L49-Q52 WeakPolarHBondContact O-CB 3.16Å; L49-K53 VanDerWaalsContact O-CG 3.31Å; L49-K53 WeakPolarHBondContact O-CG 3.44Å; L49-K53 PolarHBondContact O-N 2.96Å
50E91.6Very high93.4Very high26 Ų2655 Ų5512%0.12130%0.297CS..Hα-helixtrans-70.8-42.2176.5-64.3-67.6111.300110.8K30 T45 D47 S48 Q52 K53 V54K30-E50 VanDerWaalsContact NZ-CD 3.26Å; K30-E50 IonicContact NZ-OE1 3.73Å; K30-E50 IonicContact NZ-OE2 2.71Å; K30-E50 PolarHBondContact NZ-OE2 3.31Å; T45-E50 HydrophobicContact CG2-CB 3.88Å; D47-E50 HydrophobicContact CB-CB 4.1Å; D47-E50 HydrophobicContact CB-CG 3.88Å; D47-E50 PolarHBondContact O-N 2.94Å; D47-E50 WeakPolarHBondContact OD2-CG 3.48Å; S48-E50 VanDerWaalsContact C-N 3.35Å; E50-Q52 VanDerWaalsContact C-N 3.34Å; E50-Q52 PolarHBondContact O-N 2.92Å; E50-K53 PolarHBondContact O-N 3.36Å; E50-K53 IonicContact OE1-NZ 3.43Å; E50-K53 PolarHBondContact OE1-NZ 3.25Å; E50-V54 WeakPolarHBondContact O-CG2 3.41Å; E50-V54 PolarHBondContact O-N 2.75Å
51K94.5Very high93.9Very high35 Ų3552 Ų5215%0.15227%0.273CS..Hα-helixtrans-58.3-45.7172-70.4-179.4179158.40111.9L43 T45 D47 S48 K53 V54 F55 W81L43-K51 HydrophobicContact CD2-CB 4.5Å; L43-K51 HydrophobicContact CD2-CG 4.22Å; T45-K51 HydrophobicContact CG2-CG 4.32Å; T45-K51 WeakPolarHBondContact O-CE 3.46Å; T45-K51 PolarHBondContact O-NZ 3.27Å; D47-K51 PolarHBondContact O-N 3Å; D47-K51 VanDerWaalsContact O-N 3.14Å; S48-K51 PolarHBondContact O-N 3.27Å; K51-K53 PolarHBondContact O-N 2.85Å; K51-V54 PolarHBondContact O-N 2.88Å; K51-F55 VanDerWaalsContact O-CD2 3.22Å; K51-F55 WeakPolarHBondContact O-CD2 3.39Å; K51-F55 PolarHBondContact O-N 3.15Å; K51-W81 HydrophobicContact CB-CD2 3.93Å; K51-W81 HydrophobicContact CB-CE3 4.29Å; K51-W81 HydrophobicContact CB-CG 4.09Å; K51-W81 HydrophobicContact CD-CD2 4.12Å; K51-W81 HydrophobicContact CD-CE3 4Å; K51-W81 HydrophobicContact CD-CH2 3.57Å; K51-W81 HydrophobicContact CD-CZ2 3.68Å; K51-W81 HydrophobicContact CD-CZ3 3.73Å
52Q95.9Very high94.3Very high10 Ų1049.7 Ų49.75%0.04726%0.258CS..Hα-helixtrans-54.6-50.5175-178.2-167.4-0.200111.3S48 L49 E50 V54 F55 K56 C78 W81 I82S48-Q52 WeakPolarHBondContact O-CB 3.36Å; S48-Q52 PolarHBondContact O-N 2.87Å; L49-Q52 WeakPolarHBondContact O-CB 3.16Å; E50-Q52 VanDerWaalsContact C-N 3.34Å; E50-Q52 PolarHBondContact O-N 2.92Å; Q52-V54 PolarHBondContact O-N 3.17Å; Q52-F55 PolarHBondContact O-N 2.93Å; Q52-K56 WeakPolarHBondContact O-CB 3.35Å; Q52-K56 PolarHBondContact O-N 2.97Å; Q52-C78 PolarHBondContact O-SG 3.24Å; Q52-W81 HydrophobicContact CB-CB 3.92Å; Q52-I82 HydrophobicContact CG-CG1 4.02Å
53K94.5Very high94.7Very high74 Ų7451.5 Ų51.532%0.32226%0.262SS..Hα-helixtrans-60.3-44.9179.1-72.7169.4-171.5166.10112.2L49 E50 K51 K56 F57L49-K53 VanDerWaalsContact O-CG 3.31Å; L49-K53 WeakPolarHBondContact O-CG 3.44Å; L49-K53 PolarHBondContact O-N 2.96Å; E50-K53 PolarHBondContact O-N 3.36Å; E50-K53 IonicContact OE1-NZ 3.43Å; E50-K53 PolarHBondContact OE1-NZ 3.25Å; K51-K53 PolarHBondContact O-N 2.85Å; K53-K56 PolarHBondContact O-N 2.86Å; K53-F57 HydrophobicContact CB-CE2 4.22Å; K53-F57 WeakPolarHBondContact O-CD2 3.42Å; K53-F57 WeakPolarHBondContact O-CG 3.27Å; K53-F57 PolarHBondContact O-N 3.02Å
54V96.2Very high95.1Very high0 Ų059.5 Ų59.50%029%0.289CS..Hα-helixtrans-58.9-50.9179.5169.50000110.8W36 F37 A42 L43 E50 K51 Q52 K56 F57 R58W36-V54 HydrophobicContact CH2-CG2 3.76Å; W36-V54 HydrophobicContact CZ3-CG2 3.6Å; F37-V54 HydrophobicContact CB-CG1 4.33Å; F37-V54 HydrophobicContact CB-CG2 4.37Å; F37-V54 WeakPolarHBondContact O-CG1 3.13Å; A42-V54 HydrophobicContact CB-CG1 4.29Å; A42-V54 HydrophobicContact CB-CG2 3.82Å; L43-V54 HydrophobicContact CD2-CB 3.99Å; L43-V54 HydrophobicContact CD2-CG1 3.66Å; L43-V54 HydrophobicContact CG-CG1 4.14Å; E50-V54 WeakPolarHBondContact O-CG2 3.41Å; E50-V54 PolarHBondContact O-N 2.75Å; K51-V54 PolarHBondContact O-N 2.88Å; Q52-V54 PolarHBondContact O-N 3.17Å; V54-K56 PolarHBondContact O-N 3.47Å; V54-F57 PolarHBondContact O-N 3.35Å; V54-R58 WeakPolarHBondContact O-CG 3.38Å; V54-R58 PolarHBondContact O-N 3.49Å
55F97.9Very high95.4Very high31 Ų3159.7 Ų59.714%0.13629%0.286CS..Hα-helixtrans-66.5-37.6-180-76-64.8000112.9L43 K51 Q52 R58 G59 T77 C78 W81L43-F55 HydrophobicContact CD1-CE1 4.46Å; L43-F55 HydrophobicContact CD1-CE2 4.35Å; L43-F55 HydrophobicContact CD1-CZ 3.81Å; L43-F55 HydrophobicContact CD2-CD2 4.29Å; L43-F55 HydrophobicContact CD2-CE2 3.7Å; L43-F55 HydrophobicContact CD2-CZ 4Å; K51-F55 VanDerWaalsContact O-CD2 3.22Å; K51-F55 WeakPolarHBondContact O-CD2 3.39Å; K51-F55 PolarHBondContact O-N 3.15Å; Q52-F55 PolarHBondContact O-N 2.93Å; F55-R58 PolarHBondContact O-N 2.69Å; F55-G59 PolarHBondContact O-N 3.46Å; F55-T77 HydrophobicContact CD1-CG2 3.79Å; F55-T77 HydrophobicContact CD2-CG2 3.78Å; F55-T77 HydrophobicContact CE1-CG2 3.56Å; F55-T77 HydrophobicContact CE2-CG2 3.56Å; F55-T77 HydrophobicContact CG-CG2 3.91Å; F55-T77 HydrophobicContact CZ-CG2 3.45Å; F55-T77 VanDerWaalsContact CZ-CG2 3.45Å; F55-C78 HydrophobicContact CB-CB 3.67Å; F55-W81 AromaticContact CD2-CD1 3.85Å; F55-W81 AromaticContact CD2-NE1 3.97Å; F55-W81 AromaticContact CE2-NE1 3.74Å
56K97.4Very high95.8Very high34 Ų3459 Ų5915%0.14829%0.288CS..Hα-helixtrans-57.4-51.9172.3-172.7-156.2-171.3-67.60111.2Q52 K53 V54 R58 G59 D60 D92Q52-K56 WeakPolarHBondContact O-CB 3.35Å; Q52-K56 PolarHBondContact O-N 2.97Å; K53-K56 PolarHBondContact O-N 2.86Å; V54-K56 PolarHBondContact O-N 3.47Å; K56-R58 PolarHBondContact O-N 3.3Å; K56-G59 PolarHBondContact O-N 3.22Å; K56-G59 VanDerWaalsContact O-N 3.16Å; K56-D60 IonicContact NZ-OD1 2.86Å; K56-D60 IonicContact NZ-OD2 3.74Å; K56-D60 PolarHBondContact NZ-OD2 3.41Å; K56-D60 VanDerWaalsContact O-CG 3.3Å; K56-D60 PolarHBondContact O-N 2.76Å; K56-D92 WeakPolarHBondContact CE-OD2 3.33Å; K56-D92 IonicContact NZ-OD2 2.74Å; K56-D92 PolarHBondContact NZ-OD2 2.93Å
57F97.1Very high96.3Very high76 Ų7653.9 Ų53.933%0.33326%0.261SS..Hα-helixtrans-66-36.8-178.3-67.1-38.7000112.9W36 F37 K53 V54 G59 D60 L61W36-F57 HydrophobicContact CZ2-CD2 4.1Å; W36-F57 HydrophobicContact CZ2-CE2 4.04Å; F37-F57 HydrophobicContact CB-CB 4.15Å; F37-F57 HydrophobicContact CB-CD2 4.39Å; F37-F57 HydrophobicContact CD1-CB 3.69Å; F37-F57 HydrophobicContact CD1-CD2 4.07Å; F37-F57 HydrophobicContact CD1-CG 4.16Å; F37-F57 HydrophobicContact CD2-CB 3.63Å; F37-F57 HydrophobicContact CE1-CB 3.93Å; F37-F57 HydrophobicContact CE1-CG 4.46Å; F37-F57 HydrophobicContact CE2-CB 3.87Å; F37-F57 HydrophobicContact CG-CB 3.54Å; F37-F57 HydrophobicContact CG-CD2 4.32Å; F37-F57 HydrophobicContact CG-CG 4.37Å; F37-F57 HydrophobicContact CZ-CB 4.02Å; K53-F57 HydrophobicContact CB-CE2 4.22Å; K53-F57 WeakPolarHBondContact O-CD2 3.42Å; K53-F57 WeakPolarHBondContact O-CG 3.27Å; K53-F57 PolarHBondContact O-N 3.02Å; V54-F57 PolarHBondContact O-N 3.35Å; F57-G59 VanDerWaalsContact C-N 3.33Å; F57-D60 PolarHBondContact O-N 3.39Å; F57-L61 WeakPolarHBondContact O-CB 3.45Å; F57-L61 PolarHBondContact O-N 3.03Å
58R97.9Very high96.6Very high60 Ų6053.8 Ų53.823%0.22626%0.255CS..Hα-helixtrans-60.6-43171.3-73.6-179.7179.5175.62.9111.7F37 C38 E39 V54 F55 K56 A62 A74F37-R58 HydrophobicContact CD2-CG 3.9Å; F37-R58 VanDerWaalsContact O-CZ 3.22Å; F37-R58 PolarHBondContact O-NE 3.08Å; F37-R58 PolarHBondContact O-NH2 3.4Å; C38-R58 PolarHBondContact O-NH2 3.27Å; E39-R58 PolarHBondContact O-NH2 2.84Å; V54-R58 WeakPolarHBondContact O-CG 3.38Å; V54-R58 PolarHBondContact O-N 3.49Å; F55-R58 PolarHBondContact O-N 2.69Å; K56-R58 PolarHBondContact O-N 3.3Å; R58-A62 VanDerWaalsContact O-CB 3.28Å; R58-A62 WeakPolarHBondContact O-CB 2.95Å; R58-A62 PolarHBondContact O-N 3.33Å; R58-A74 HydrophobicContact CB-CB 4.24Å
59G98.3Very high96.9Very high0 Ų054.8 Ų54.80%025%0.253CS..Hα-helixtrans-60.6-50.1174.700000112.3F55 K56 F57 L61 A62 F63 A71F55-G59 PolarHBondContact O-N 3.46Å; K56-G59 PolarHBondContact O-N 3.22Å; K56-G59 VanDerWaalsContact O-N 3.16Å; F57-G59 VanDerWaalsContact C-N 3.33Å; G59-L61 VanDerWaalsContact C-N 3.33Å; G59-L61 PolarHBondContact O-N 3.03Å; G59-A62 PolarHBondContact O-N 3.22Å; G59-F63 WeakPolarHBondContact O-CB 3.35Å; G59-F63 PolarHBondContact O-N 2.84Å; G59-A71 WeakPolarHBondContact O-CB 3.33Å
60D98.3Very high97.2Very high43 Ų4358.9 Ų58.923%0.2326%0.264CS..Hα-helixtrans-59.7-42.4178.9-66.4-16.2000111.8K56 F57 R64 Y75K56-D60 IonicContact NZ-OD1 2.86Å; K56-D60 IonicContact NZ-OD2 3.74Å; K56-D60 PolarHBondContact NZ-OD2 3.41Å; K56-D60 VanDerWaalsContact O-CG 3.3Å; K56-D60 PolarHBondContact O-N 2.76Å; F57-D60 PolarHBondContact O-N 3.39Å; D60-R64 WeakPolarHBondContact O-CG 3.49Å; D60-R64 PolarHBondContact O-N 2.81Å; D60-Y75 WeakPolarHBondContact CA-OH 3.23Å; D60-Y75 PolarHBondContact N-OH 3.33Å; D60-Y75 WeakPolarHBondContact OD1-CE1 3.38Å; D60-Y75 PolarHBondContact OD1-OH 3.43Å
61L98.1Very high97.6Very high35 Ų3557.6 Ų57.618%0.18326%0.258CS..Hα-helixtrans-67.5-47.6177.7-177.163.5000111.7F37 F57 G59 F63 R64 H65F37-L61 HydrophobicContact CE2-CB 4.01Å; F37-L61 HydrophobicContact CE2-CD2 3.71Å; F37-L61 HydrophobicContact CE2-CG 4.49Å; F37-L61 HydrophobicContact CZ-CB 4.26Å; F37-L61 HydrophobicContact CZ-CD2 3.97Å; F57-L61 WeakPolarHBondContact O-CB 3.45Å; F57-L61 PolarHBondContact O-N 3.03Å; G59-L61 VanDerWaalsContact C-N 3.33Å; G59-L61 PolarHBondContact O-N 3.03Å; L61-F63 VanDerWaalsContact C-N 3.3Å; L61-F63 PolarHBondContact O-N 3.48Å; L61-R64 PolarHBondContact O-N 3.48Å; L61-R64 VanDerWaalsContact O-N 3.15Å; L61-H65 PolarHBondContact O-N 3.22Å
62A98.4Very high97.8Very high8 Ų856.3 Ų56.37%0.06625%0.253CS..Hα-helixtrans-60.3-40.6178.200000111.6R58 G59 R64 H65 G66 D67 R70 A71R58-A62 VanDerWaalsContact O-CB 3.28Å; R58-A62 WeakPolarHBondContact O-CB 2.95Å; R58-A62 PolarHBondContact O-N 3.33Å; G59-A62 PolarHBondContact O-N 3.22Å; A62-R64 VanDerWaalsContact C-N 3.34Å; A62-R64 PolarHBondContact O-N 3.39Å; A62-H65 PolarHBondContact O-N 3.12Å; A62-H65 VanDerWaalsContact O-N 3.17Å; A62-G66 PolarHBondContact O-N 3.19Å; A62-G66 VanDerWaalsContact O-N 3.16Å; A62-D67 PolarHBondContact O-N 2.99Å; A62-R70 HydrophobicContact CB-CB 4.24Å; A62-R70 HydrophobicContact CB-CG 4.08Å; A62-A71 HydrophobicContact CB-CB 3.84Å
63F98.4Very high97.9Very high53 Ų5359.9 Ų59.923%0.23227%0.272CS..Hα-helixtrans-60.3-43.5175.2-174.3-87.7000111.7G59 L61 H65 G66 Y68 A71 R99 K103G59-F63 WeakPolarHBondContact O-CB 3.35Å; G59-F63 PolarHBondContact O-N 2.84Å; L61-F63 VanDerWaalsContact C-N 3.3Å; L61-F63 PolarHBondContact O-N 3.48Å; F63-H65 VanDerWaalsContact C-N 3.3Å; F63-H65 PolarHBondContact O-N 3.37Å; F63-G66 PolarHBondContact O-N 3.17Å; F63-G66 VanDerWaalsContact O-N 3.09Å; F63-Y68 AromaticContact CD2-CD1 3.82Å; F63-Y68 HydrophobicContact CD2-CD1 3.82Å; F63-Y68 HydrophobicContact CD2-CE1 4.07Å; F63-Y68 AromaticContact CE2-CD1 3.96Å; F63-Y68 HydrophobicContact CE2-CD1 3.96Å; F63-Y68 AromaticContact CE2-CE1 3.99Å; F63-Y68 HydrophobicContact CE2-CE1 3.99Å; F63-Y68 HydrophobicContact CZ-CE1 4.35Å; F63-A71 HydrophobicContact CB-CB 4.04Å; F63-R99 HydrophobicContact CE2-CB 3.78Å; F63-R99 HydrophobicContact CZ-CB 4.03Å; F63-K103 HydrophobicContact CE2-CG 4.47Å
64R97.6Very high98.1Very high215 Ų21556.9 Ų56.981%0.81126%0.261SS*.Hα-helixtrans-64.3-32.9176.4-73.5-174.9-174.5-157.13.6113D60 L61 A62 G66D60-R64 WeakPolarHBondContact O-CG 3.49Å; D60-R64 PolarHBondContact O-N 2.81Å; L61-R64 PolarHBondContact O-N 3.48Å; L61-R64 VanDerWaalsContact O-N 3.15Å; A62-R64 VanDerWaalsContact C-N 3.34Å; A62-R64 PolarHBondContact O-N 3.39Å; R64-G66 PolarHBondContact O-N 2.9Å
65H98Very high98.2Very high139 Ų13957.3 Ų57.364%0.64426%0.262SS*.THydrogen-bonded Turntrans-77.5-6174.2-69162.2000113.9L61 A62 F63 D67L61-H65 PolarHBondContact O-N 3.22Å; A62-H65 PolarHBondContact O-N 3.12Å; A62-H65 VanDerWaalsContact O-N 3.17Å; F63-H65 VanDerWaalsContact C-N 3.3Å; F63-H65 PolarHBondContact O-N 3.37Å; H65-D67 VanDerWaalsContact C-N 3.28Å
66G98Very high98.2Very high33 Ų3357.8 Ų57.834%0.3427%0.27SS..THydrogen-bonded Turntrans79.77.3-177.200000114.3A62 F63 R64 Y68A62-G66 PolarHBondContact O-N 3.19Å; A62-G66 VanDerWaalsContact O-N 3.16Å; F63-G66 PolarHBondContact O-N 3.17Å; F63-G66 VanDerWaalsContact O-N 3.09Å; R64-G66 PolarHBondContact O-N 2.9Å; G66-Y68 VanDerWaalsContact C-N 3.28Å; G66-Y68 VanDerWaalsContact O-CD2 3.3Å; G66-Y68 WeakPolarHBondContact O-CD2 3.48Å; G66-Y68 WeakPolarHBondContact O-CE2 3.46Å; G66-Y68 PolarHBondContact O-N 3.28Å; G66-Y68 VanDerWaalsContact O-N 3.08Å
67D98.3Very high98.2Very high54 Ų5458.2 Ų58.229%0.28928%0.275SS..  trans-85.573.3174.6-170.9-9.4000109.4A62 H65 Q69 R70 A71A62-D67 PolarHBondContact O-N 2.99Å; H65-D67 VanDerWaalsContact C-N 3.28Å; D67-Q69 VanDerWaalsContact C-N 3.31Å; D67-Q69 PolarHBondContact O-N 3.48Å; D67-R70 HydrophobicContact CB-CB 4.27Å; D67-R70 PolarHBondContact O-N 3.29Å; D67-R70 VanDerWaalsContact OD1-CB 3.25Å; D67-R70 WeakPolarHBondContact OD1-CB 3.25Å; D67-R70 PolarHBondContact OD1-N 2.91Å; D67-R70 WeakPolarHBondContact OD2-CB 3.45Å; D67-R70 WeakPolarHBondContact OD2-CD 3.4Å; D67-R70 IonicContact OD2-CZ 2.6Å; D67-R70 VanDerWaalsContact OD2-CZ 3.26Å; D67-R70 IonicContact OD2-NE 3.09Å; D67-R70 PolarHBondContact OD2-NE 2.8Å; D67-R70 IonicContact OD2-NH1 3.08Å; D67-R70 PolarHBondContact OD2-NH1 2.94Å; D67-A71 WeakPolarHBondContact O-CB 3.42Å; D67-A71 PolarHBondContact O-N 2.79Å
68Y98.6Very high98.2Very high66 Ų6654.6 Ų54.626%0.25926%0.259SS..Hα-helixtrans-68.2-28.8-170.9-54.1-58.1000113.4F63 G66 L72 K103F63-Y68 AromaticContact CD2-CD1 3.82Å; F63-Y68 HydrophobicContact CD2-CD1 3.82Å; F63-Y68 HydrophobicContact CD2-CE1 4.07Å; F63-Y68 AromaticContact CE2-CD1 3.96Å; F63-Y68 HydrophobicContact CE2-CD1 3.96Å; F63-Y68 AromaticContact CE2-CE1 3.99Å; F63-Y68 HydrophobicContact CE2-CE1 3.99Å; F63-Y68 HydrophobicContact CZ-CE1 4.35Å; G66-Y68 VanDerWaalsContact C-N 3.28Å; G66-Y68 VanDerWaalsContact O-CD2 3.3Å; G66-Y68 WeakPolarHBondContact O-CD2 3.48Å; G66-Y68 WeakPolarHBondContact O-CE2 3.46Å; G66-Y68 PolarHBondContact O-N 3.28Å; G66-Y68 VanDerWaalsContact O-N 3.08Å; Y68-L72 WeakPolarHBondContact O-CB 3.32Å; Y68-L72 PolarHBondContact O-N 3.35Å; Y68-K103 HydrophobicContact CD1-CB 3.82Å; Y68-K103 HydrophobicContact CD1-CG 4.04Å; Y68-K103 HydrophobicContact CD2-CB 3.43Å; Y68-K103 VanDerWaalsContact CD2-CB 3.43Å; Y68-K103 HydrophobicContact CD2-CG 4.3Å; Y68-K103 HydrophobicContact CE1-CB 3.93Å; Y68-K103 HydrophobicContact CE1-CD 4.49Å; Y68-K103 HydrophobicContact CE1-CG 3.76Å; Y68-K103 HydrophobicContact CE2-CB 3.54Å; Y68-K103 HydrophobicContact CE2-CD 4.33Å; Y68-K103 HydrophobicContact CE2-CG 4.02Å; Y68-K103 HydrophobicContact CG-CB 3.57Å; Y68-K103 HydrophobicContact CG-CG 4.3Å
69Q98.6Very high98.2Very high82 Ų8253.7 Ų53.738%0.38326%0.259SS..Hα-helixtrans-68.9-48.9175.7-174.260.55500110.3D67 A71 L72 D73 L104D67-Q69 VanDerWaalsContact C-N 3.31Å; D67-Q69 PolarHBondContact O-N 3.48Å; Q69-A71 VanDerWaalsContact C-N 3.26Å; Q69-A71 PolarHBondContact O-N 2.96Å; Q69-L72 WeakPolarHBondContact O-CB 3.41Å; Q69-L72 PolarHBondContact O-N 3.3Å; Q69-L72 VanDerWaalsContact O-N 3.16Å; Q69-D73 PolarHBondContact NE2-OD1 3.27Å; Q69-D73 PolarHBondContact O-N 2.97Å; Q69-L104 HydrophobicContact CB-CD2 4.44Å
70R98.4Very high98Very high162 Ų16260.8 Ų60.861%0.61129%0.292SS*.Hα-helixtrans-61.5-37.2175.5-178.5177.4-77.5153-14112A62 D67 D73 A74A62-R70 HydrophobicContact CB-CB 4.24Å; A62-R70 HydrophobicContact CB-CG 4.08Å; D67-R70 HydrophobicContact CB-CB 4.27Å; D67-R70 PolarHBondContact O-N 3.29Å; D67-R70 VanDerWaalsContact OD1-CB 3.25Å; D67-R70 WeakPolarHBondContact OD1-CB 3.25Å; D67-R70 PolarHBondContact OD1-N 2.91Å; D67-R70 WeakPolarHBondContact OD2-CB 3.45Å; D67-R70 WeakPolarHBondContact OD2-CD 3.4Å; D67-R70 IonicContact OD2-CZ 2.6Å; D67-R70 VanDerWaalsContact OD2-CZ 3.26Å; D67-R70 IonicContact OD2-NE 3.09Å; D67-R70 PolarHBondContact OD2-NE 2.8Å; D67-R70 IonicContact OD2-NH1 3.08Å; D67-R70 PolarHBondContact OD2-NH1 2.94Å; R70-D73 PolarHBondContact O-N 3.5Å; R70-A74 WeakPolarHBondContact O-CB 3.38Å; R70-A74 PolarHBondContact O-N 3.26Å
71A98.7Very high97.9Very high0 Ų063 Ų630%030%0.297CS..Hα-helixtrans-61.6-47174.900000111.4G59 A62 F63 D67 Q69 D73 A74 Y75 C100G59-A71 WeakPolarHBondContact O-CB 3.33Å; A62-A71 HydrophobicContact CB-CB 3.84Å; F63-A71 HydrophobicContact CB-CB 4.04Å; D67-A71 WeakPolarHBondContact O-CB 3.42Å; D67-A71 PolarHBondContact O-N 2.79Å; Q69-A71 VanDerWaalsContact C-N 3.26Å; Q69-A71 PolarHBondContact O-N 2.96Å; A71-D73 PolarHBondContact O-N 3.13Å; A71-A74 PolarHBondContact O-N 2.86Å; A71-Y75 HydrophobicContact CB-CE2 4.31Å; A71-Y75 WeakPolarHBondContact O-CD2 3.27Å; A71-Y75 PolarHBondContact O-N 3.33Å; A71-C100 VanDerWaalsContact CB-SG 3.56Å
72L98.6Very high97.7Very high8 Ų861.7 Ų61.74%0.04229%0.29CS..Hα-helixtrans-61.5-42.8177.5-176.259.8000112.1Y68 Q69 Y75 S76 M97 C100 L104Y68-L72 WeakPolarHBondContact O-CB 3.32Å; Y68-L72 PolarHBondContact O-N 3.35Å; Q69-L72 WeakPolarHBondContact O-CB 3.41Å; Q69-L72 PolarHBondContact O-N 3.3Å; Q69-L72 VanDerWaalsContact O-N 3.16Å; L72-Y75 PolarHBondContact O-N 2.97Å; L72-S76 VanDerWaalsContact O-CB 3.32Å; L72-S76 WeakPolarHBondContact O-CB 3.49Å; L72-S76 PolarHBondContact O-N 3.49Å; L72-S76 PolarHBondContact O-OG 3.22Å; L72-M97 HydrophobicContact CD1-CB 3.79Å; L72-M97 HydrophobicContact CD1-CE 4.1Å; L72-M97 HydrophobicContact CD1-CG 3.93Å; L72-C100 HydrophobicContact CB-CB 3.96Å; L72-C100 HydrophobicContact CD1-CB 4.33Å; L72-L104 HydrophobicContact CD2-CD1 4.03Å
73D98.5Very high97.3Very high85 Ų8563.9 Ų63.946%0.45531%0.308SS..Hα-helixtrans-64.1-42.3177.6-61.9-20.3000111.2Q69 R70 A71 S76 T77Q69-D73 PolarHBondContact NE2-OD1 3.27Å; Q69-D73 PolarHBondContact O-N 2.97Å; R70-D73 PolarHBondContact O-N 3.5Å; A71-D73 PolarHBondContact O-N 3.13Å; D73-S76 PolarHBondContact O-N 2.86Å; D73-T77 PolarHBondContact O-N 2.94Å; D73-T77 PolarHBondContact O-OG1 3.48Å
74A98.4Very high96.8Very high10 Ų1067.7 Ų67.78%0.08333%0.331CS..Hα-helixtrans-65.9-44177.100000111.9R58 R70 A71 T77 C78R58-A74 HydrophobicContact CB-CB 4.24Å; R70-A74 WeakPolarHBondContact O-CB 3.38Å; R70-A74 PolarHBondContact O-N 3.26Å; A71-A74 PolarHBondContact O-N 2.86Å; A74-T77 PolarHBondContact O-N 2.96Å; A74-C78 WeakPolarHBondContact O-CB 3.41Å; A74-C78 PolarHBondContact O-N 3.46Å
75Y98.6Very high96.3Very high9 Ų964.2 Ų64.24%0.03533%0.329CS..Hα-helixtrans-64.3-40.6174.5-72.4-47.9000112.5D60 A71 L72 T77 C78 L79 V93 M97D60-Y75 WeakPolarHBondContact CA-OH 3.23Å; D60-Y75 PolarHBondContact N-OH 3.33Å; D60-Y75 WeakPolarHBondContact OD1-CE1 3.38Å; D60-Y75 PolarHBondContact OD1-OH 3.43Å; A71-Y75 HydrophobicContact CB-CE2 4.31Å; A71-Y75 WeakPolarHBondContact O-CD2 3.27Å; A71-Y75 PolarHBondContact O-N 3.33Å; L72-Y75 PolarHBondContact O-N 2.97Å; Y75-T77 VanDerWaalsContact C-N 3.28Å; Y75-T77 PolarHBondContact O-N 3.12Å; Y75-C78 VanDerWaalsContact O-CB 3.31Å; Y75-C78 WeakPolarHBondContact O-CB 3.24Å; Y75-C78 PolarHBondContact O-N 3.46Å; Y75-C78 VanDerWaalsContact O-N 3.16Å; Y75-L79 PolarHBondContact O-N 3.22Å; Y75-V93 HydrophobicContact CD1-CG1 4.15Å; Y75-V93 HydrophobicContact CD1-CG2 4.41Å; Y75-V93 HydrophobicContact CG-CG1 4.39Å; Y75-V93 WeakPolarHBondContact O-CG1 3.32Å; Y75-M97 VanDerWaalsContact CB-CG 3.42Å; Y75-M97 HydrophobicContact CD2-CG 4.35Å; Y75-M97 HydrophobicContact CG-CG 4.18Å
76S98Very high95.9Very high42 Ų4259.8 Ų59.829%0.29431%0.31SS..Hα-helixtrans-61.5-39.2175.7-59.40000111.5L72 D73L72-S76 VanDerWaalsContact O-CB 3.32Å; L72-S76 WeakPolarHBondContact O-CB 3.49Å; L72-S76 PolarHBondContact O-N 3.49Å; L72-S76 PolarHBondContact O-OG 3.22Å; D73-S76 PolarHBondContact O-N 2.86Å
77T97.8Very high95.6Very high43 Ų4362.3 Ų62.326%0.26432%0.315SS..Hα-helixtrans-68.9-43.1173.7-51.30000111F55 D73 A74 Y75 L79 Q80F55-T77 HydrophobicContact CD1-CG2 3.79Å; F55-T77 HydrophobicContact CD2-CG2 3.78Å; F55-T77 HydrophobicContact CE1-CG2 3.56Å; F55-T77 HydrophobicContact CE2-CG2 3.56Å; F55-T77 HydrophobicContact CG-CG2 3.91Å; F55-T77 HydrophobicContact CZ-CG2 3.45Å; F55-T77 VanDerWaalsContact CZ-CG2 3.45Å; D73-T77 PolarHBondContact O-N 2.94Å; D73-T77 PolarHBondContact O-OG1 3.48Å; A74-T77 PolarHBondContact O-N 2.96Å; Y75-T77 VanDerWaalsContact C-N 3.28Å; Y75-T77 PolarHBondContact O-N 3.12Å; T77-L79 VanDerWaalsContact C-N 3.27Å; T77-L79 PolarHBondContact O-N 3.46Å; T77-Q80 WeakPolarHBondContact O-CB 3.45Å; T77-Q80 PolarHBondContact O-N 2.88Å
78C97.8Very high95.3Very high0 Ų065.1 Ų65.10%033%0.334CS..Hα-helixtrans-54.1-45.5175.7-175.40000111.4Q52 F55 A74 Y75 Q80 W81 I82 V93Q52-C78 PolarHBondContact O-SG 3.24Å; F55-C78 HydrophobicContact CB-CB 3.67Å; A74-C78 WeakPolarHBondContact O-CB 3.41Å; A74-C78 PolarHBondContact O-N 3.46Å; Y75-C78 VanDerWaalsContact O-CB 3.31Å; Y75-C78 WeakPolarHBondContact O-CB 3.24Å; Y75-C78 PolarHBondContact O-N 3.46Å; Y75-C78 VanDerWaalsContact O-N 3.16Å; C78-Q80 PolarHBondContact O-N 3.49Å; C78-Q80 VanDerWaalsContact O-N 3.15Å; C78-W81 PolarHBondContact O-N 3.5Å; C78-I82 WeakPolarHBondContact O-CG1 3.43Å; C78-I82 PolarHBondContact O-N 3.45Å; C78-V93 HydrophobicContact CB-CG1 4.44Å; C78-V93 HydrophobicContact CB-CG2 4.49Å
79L96.1Very high95Very high40 Ų4064.1 Ų64.121%0.20933%0.333CS..Hα-helixtrans-55.9-32.4-178.1-172.261.4000113.2Y75 T77 W81 I82 R90 V93 L94 M97Y75-L79 PolarHBondContact O-N 3.22Å; T77-L79 VanDerWaalsContact C-N 3.27Å; T77-L79 PolarHBondContact O-N 3.46Å; L79-W81 PolarHBondContact O-N 3Å; L79-I82 HydrophobicContact CD1-CD1 4.03Å; L79-I82 PolarHBondContact O-N 3.23Å; L79-R90 HydrophobicContact CD1-CG 3.87Å; L79-V93 HydrophobicContact CB-CG1 4.38Å; L79-L94 HydrophobicContact CD2-CD2 4.19Å; L79-M97 HydrophobicContact CD2-SD 4.32Å
80Q95.1Very high94.9Very high150 Ų15063 Ų6370%0.70133%0.325SS*.Hα-helixtrans-69.6-21.8177.6-60.2171.322.400113T77 C78T77-Q80 WeakPolarHBondContact O-CB 3.45Å; T77-Q80 PolarHBondContact O-N 2.88Å; C78-Q80 PolarHBondContact O-N 3.49Å; C78-Q80 VanDerWaalsContact O-N 3.15Å
81W95.2Very high94.8Very high88 Ų8856.4 Ų56.433%0.33330%0.3SS..THydrogen-bonded Turntrans-98-2.2179.2-60.6102.9000113.1K51 Q52 F55 C78 L79K51-W81 HydrophobicContact CB-CD2 3.93Å; K51-W81 HydrophobicContact CB-CE3 4.29Å; K51-W81 HydrophobicContact CB-CG 4.09Å; K51-W81 HydrophobicContact CD-CD2 4.12Å; K51-W81 HydrophobicContact CD-CE3 4Å; K51-W81 HydrophobicContact CD-CH2 3.57Å; K51-W81 HydrophobicContact CD-CZ2 3.68Å; K51-W81 HydrophobicContact CD-CZ3 3.73Å; Q52-W81 HydrophobicContact CB-CB 3.92Å; F55-W81 AromaticContact CD2-CD1 3.85Å; F55-W81 AromaticContact CD2-NE1 3.97Å; F55-W81 AromaticContact CE2-NE1 3.74Å; C78-W81 PolarHBondContact O-N 3.5Å; L79-W81 PolarHBondContact O-N 3Å
82I94.1Very high94.7Very high8 Ų859.7 Ų59.74%0.04132%0.318CS..SBendtrans-84.7117.9179-51.6-177.5000109.7Q52 C78 L79 N86 I89 R90 V93Q52-I82 HydrophobicContact CG-CG1 4.02Å; C78-I82 WeakPolarHBondContact O-CG1 3.43Å; C78-I82 PolarHBondContact O-N 3.45Å; L79-I82 HydrophobicContact CD1-CD1 4.03Å; L79-I82 PolarHBondContact O-N 3.23Å; I82-N86 HydrophobicContact CG2-CB 4.02Å; I82-I89 HydrophobicContact CD1-CG2 4.1Å; I82-R90 HydrophobicContact CD1-CB 4.47Å; I82-R90 HydrophobicContact CG2-CB 4.13Å; I82-R90 PolarHBondContact O-NH1 3.08Å; I82-V93 HydrophobicContact CD1-CB 4.06Å; I82-V93 HydrophobicContact CD1-CG1 4.4Å; I82-V93 HydrophobicContact CD1-CG2 3.9Å
83A91.3Very high94.6Very high54 Ų5459.3 Ų59.345%0.44632%0.316SS..  trans-58.7142.8170.600000111.7N85 N86A83-N85 VanDerWaalsContact CB-OD1 3.27Å; A83-N85 WeakPolarHBondContact CB-OD1 3.34Å; A83-N85 PolarHBondContact O-N 2.93Å; A83-N85 VanDerWaalsContact O-N 3.11Å; A83-N86 WeakPolarHBondContact O-CB 3.08Å; A83-N86 PolarHBondContact O-N 3.31Å
84D86.3Confident94.6Very high134 Ų13455.6 Ų55.672%0.71730%0.296SS*.THydrogen-bonded Turntrans-60.6-26.7-173.5-65.3-31.1000113.9N86D84-N86 VanDerWaalsContact C-N 3.35Å
85N87.2Confident94.6Very high141 Ų14157 Ų5775%0.75430%0.301SS*.THydrogen-bonded Turntrans-80-13176.765-15.1000113.8A83 L87A83-N85 VanDerWaalsContact CB-OD1 3.27Å; A83-N85 WeakPolarHBondContact CB-OD1 3.34Å; A83-N85 PolarHBondContact O-N 2.93Å; A83-N85 VanDerWaalsContact O-N 3.11Å; N85-L87 VanDerWaalsContact C-N 3.3Å; N85-L87 PolarHBondContact O-N 3.09Å; N85-L87 VanDerWaalsContact O-N 3.08Å
86N90.7Very high94.5Very high46 Ų4656.9 Ų56.925%0.24630%0.303CS..  trans-88.968-178.2-167.9-12.3000111.2I82 A83 D84 T88 I89 R90I82-N86 HydrophobicContact CG2-CB 4.02Å; A83-N86 WeakPolarHBondContact O-CB 3.08Å; A83-N86 PolarHBondContact O-N 3.31Å; D84-N86 VanDerWaalsContact C-N 3.35Å; N86-T88 VanDerWaalsContact C-N 3.28Å; N86-T88 PolarHBondContact O-N 3.01Å; N86-I89 WeakPolarHBondContact OD1-CG1 3.26Å; N86-I89 PolarHBondContact OD1-N 2.95Å; N86-R90 WeakPolarHBondContact O-CB 3.37Å; N86-R90 PolarHBondContact O-N 3.37Å; N86-R90 VanDerWaalsContact O-N 3.12Å
87L90.8Very high94.6Very high87 Ų8755.6 Ų55.646%0.45529%0.292SS..Hα-helixtrans-62.8-34.3-177.7-59.6178.3000112.4N85 R90 R91N85-L87 VanDerWaalsContact C-N 3.3Å; N85-L87 PolarHBondContact O-N 3.09Å; N85-L87 VanDerWaalsContact O-N 3.08Å; L87-R90 PolarHBondContact O-N 3.41Å; L87-R91 WeakPolarHBondContact O-CB 3.47Å; L87-R91 VanDerWaalsContact O-CG 3.23Å; L87-R91 WeakPolarHBondContact O-CG 3.41Å; L87-R91 PolarHBondContact O-N 2.95Å
88T91.8Very high94.6Very high112 Ų11253.5 Ų53.569%0.68728%0.279SS*.Hα-helixtrans-60.5-52.5-178.4-53.70000111.7N86 R91 D92N86-T88 VanDerWaalsContact C-N 3.28Å; N86-T88 PolarHBondContact O-N 3.01Å; T88-R91 PolarHBondContact O-N 3.41Å; T88-D92 PolarHBondContact O-N 3.02Å
89I94.3Very high94.7Very high46 Ų4659.1 Ų59.124%0.23630%0.3CS..Hα-helixtrans-73.2-33.6179.4-55.1-63000111.1I82 N86 R91 D92 V93I82-I89 HydrophobicContact CD1-CG2 4.1Å; N86-I89 WeakPolarHBondContact OD1-CG1 3.26Å; N86-I89 PolarHBondContact OD1-N 2.95Å; I89-R91 VanDerWaalsContact C-N 3.31Å; I89-R91 PolarHBondContact O-N 3.42Å; I89-D92 PolarHBondContact O-N 3.39Å; I89-V93 HydrophobicContact CG2-CG2 4.09Å; I89-V93 WeakPolarHBondContact O-CG2 3.4Å; I89-V93 PolarHBondContact O-N 3.45Å
90R95.2Very high94.8Very high58 Ų5857.2 Ų57.222%0.21929%0.29CS..Hα-helixtrans-57.4-46.3175.2-162.2177.5-150.185.4-0.9111.4L79 I82 N86 L87 V93 L94L79-R90 HydrophobicContact CD1-CG 3.87Å; I82-R90 HydrophobicContact CD1-CB 4.47Å; I82-R90 HydrophobicContact CG2-CB 4.13Å; I82-R90 PolarHBondContact O-NH1 3.08Å; N86-R90 WeakPolarHBondContact O-CB 3.37Å; N86-R90 PolarHBondContact O-N 3.37Å; N86-R90 VanDerWaalsContact O-N 3.12Å; L87-R90 PolarHBondContact O-N 3.41Å; R90-V93 PolarHBondContact O-N 2.9Å; R90-L94 HydrophobicContact CG-CD1 4.19Å; R90-L94 WeakPolarHBondContact O-CB 3.37Å; R90-L94 VanDerWaalsContact O-CG 3.26Å; R90-L94 WeakPolarHBondContact O-CG 3.37Å; R90-L94 PolarHBondContact O-N 2.92Å
91R95.9Very high95Very high24 Ų2450.1 Ų50.19%0.09126%0.257CS..Hα-helixtrans-62.4-46177.2-71.6176.968.778.710.6112.1L87 T88 I89 V93 L94 E95 L117 D120 S121 H126L87-R91 WeakPolarHBondContact O-CB 3.47Å; L87-R91 VanDerWaalsContact O-CG 3.23Å; L87-R91 WeakPolarHBondContact O-CG 3.41Å; L87-R91 PolarHBondContact O-N 2.95Å; T88-R91 PolarHBondContact O-N 3.41Å; I89-R91 VanDerWaalsContact C-N 3.31Å; I89-R91 PolarHBondContact O-N 3.42Å; R91-V93 VanDerWaalsContact C-N 3.34Å; R91-V93 PolarHBondContact O-N 3.48Å; R91-L94 PolarHBondContact O-N 3.37Å; R91-E95 WeakPolarHBondContact O-CB 3.31Å; R91-E95 PolarHBondContact O-N 2.93Å; R91-L117 HydrophobicContact CB-CD2 3.89Å; R91-L117 HydrophobicContact CG-CD2 3.92Å; R91-L117 PolarHBondContact NH1-O 3.1Å; R91-D120 VanDerWaalsContact NH1-C 3.27Å; R91-D120 PolarHBondContact NH1-O 3.46Å; R91-S121 PolarHBondContact NH1-OG 2.72Å; R91-H126 VanDerWaalsContact NH2-CB 3.34Å; R91-H126 PolarHBondContact NH2-O 3.48Å
92D96.3Very high95.1Very high68 Ų6846.1 Ų46.136%0.36424%0.243SC..Hα-helixtrans-58.4-45.7177.7-172.942.8000111.7K56 T88 I89 E95 G96K56-D92 WeakPolarHBondContact CE-OD2 3.33Å; K56-D92 IonicContact NZ-OD2 2.74Å; K56-D92 PolarHBondContact NZ-OD2 2.93Å; T88-D92 PolarHBondContact O-N 3.02Å; I89-D92 PolarHBondContact O-N 3.39Å; D92-E95 PolarHBondContact O-N 2.9Å; D92-G96 PolarHBondContact O-N 3.45Å
93V97.8Very high95.3Very high0 Ų050.7 Ų50.70%026%0.262CS..Hα-helixtrans-66.7-45178.4171.40000111.7Y75 C78 L79 I82 I89 R90 R91 E95 G96 M97Y75-V93 HydrophobicContact CD1-CG1 4.15Å; Y75-V93 HydrophobicContact CD1-CG2 4.41Å; Y75-V93 HydrophobicContact CG-CG1 4.39Å; Y75-V93 WeakPolarHBondContact O-CG1 3.32Å; C78-V93 HydrophobicContact CB-CG1 4.44Å; C78-V93 HydrophobicContact CB-CG2 4.49Å; L79-V93 HydrophobicContact CB-CG1 4.38Å; I82-V93 HydrophobicContact CD1-CB 4.06Å; I82-V93 HydrophobicContact CD1-CG1 4.4Å; I82-V93 HydrophobicContact CD1-CG2 3.9Å; I89-V93 HydrophobicContact CG2-CG2 4.09Å; I89-V93 WeakPolarHBondContact O-CG2 3.4Å; I89-V93 PolarHBondContact O-N 3.45Å; R90-V93 PolarHBondContact O-N 2.9Å; R91-V93 VanDerWaalsContact C-N 3.34Å; R91-V93 PolarHBondContact O-N 3.48Å; V93-E95 VanDerWaalsContact C-N 3.32Å; V93-E95 PolarHBondContact O-N 3.48Å; V93-G96 PolarHBondContact O-N 3.15Å; V93-M97 HydrophobicContact CG1-CG 4.49Å; V93-M97 HydrophobicContact CG1-SD 4.16Å; V93-M97 VanDerWaalsContact O-CG 3.27Å; V93-M97 WeakPolarHBondContact O-CG 3.19Å; V93-M97 PolarHBondContact O-N 3.17Å
94L97.8Very high95.7Very high8 Ų851 Ų514%0.04226%0.256CS..Hα-helixtrans-62.6-38.2176.9-71.9174.5000112.2L79 R90 R91 M97 A98 L113 L116 L117L79-L94 HydrophobicContact CD2-CD2 4.19Å; R90-L94 HydrophobicContact CG-CD1 4.19Å; R90-L94 WeakPolarHBondContact O-CB 3.37Å; R90-L94 VanDerWaalsContact O-CG 3.26Å; R90-L94 WeakPolarHBondContact O-CG 3.37Å; R90-L94 PolarHBondContact O-N 2.92Å; R91-L94 PolarHBondContact O-N 3.37Å; L94-M97 HydrophobicContact CD2-SD 4.24Å; L94-M97 PolarHBondContact O-N 2.75Å; L94-A98 WeakPolarHBondContact O-CB 3.22Å; L94-A98 PolarHBondContact O-N 3.21Å; L94-L113 HydrophobicContact CD2-CD2 3.78Å; L94-L116 HydrophobicContact CD1-CB 4.39Å; L94-L116 HydrophobicContact CD2-CD1 4.4Å; L94-L117 HydrophobicContact CB-CD1 4.48Å; L94-L117 HydrophobicContact CB-CD2 3.86Å; L94-L117 HydrophobicContact CB-CG 4.1Å; L94-L117 HydrophobicContact CD1-CD2 4.27Å
95E97.9Very high96.2Very high39 Ų3946.7 Ų46.718%0.18224%0.243CC..Hα-helixtrans-64.7-43.8173.1-179.8173.3157.400111.4R91 D92 V93 M97 A98 R99 L117 L133R91-E95 WeakPolarHBondContact O-CB 3.31Å; R91-E95 PolarHBondContact O-N 2.93Å; D92-E95 PolarHBondContact O-N 2.9Å; V93-E95 VanDerWaalsContact C-N 3.32Å; V93-E95 PolarHBondContact O-N 3.48Å; E95-M97 VanDerWaalsContact C-N 3.34Å; E95-M97 PolarHBondContact O-N 3.06Å; E95-A98 PolarHBondContact O-N 3.45Å; E95-R99 VanDerWaalsContact O-CG 3.3Å; E95-R99 WeakPolarHBondContact O-CG 3.5Å; E95-R99 PolarHBondContact O-N 2.98Å; E95-R99 IonicContact OE1-CZ 3.85Å; E95-R99 VanDerWaalsContact OE1-CZ 3.22Å; E95-R99 IonicContact OE1-NE 2.63Å; E95-R99 PolarHBondContact OE1-NE 2.95Å; E95-R99 VanDerWaalsContact OE1-NE 3.09Å; E95-R99 IonicContact OE1-NH2 3.73Å; E95-R99 PolarHBondContact OE1-NH2 3.35Å; E95-L117 HydrophobicContact CB-CD1 4.19Å; E95-L133 HydrophobicContact CG-CD1 4.29Å; E95-L133 HydrophobicContact CG-CD2 4.2Å
96G98.3Very high96.7Very high7 Ų743 Ų437%0.07222%0.222CC..Hα-helixtrans-56.4-46.1173.100000112.3D92 V93 R99 C100D92-G96 PolarHBondContact O-N 3.45Å; V93-G96 PolarHBondContact O-N 3.15Å; G96-R99 PolarHBondContact O-N 3.46Å; G96-C100 PolarHBondContact O-N 2.92Å; G96-C100 PolarHBondContact O-SG 3.01Å
97M98.7Very high97.1Very high14 Ų1446 Ų467%0.06923%0.23CC..Hα-helixtrans-60.1-47.2174.6-66.2172.469.400111.5L72 Y75 L79 V93 L94 E95 R99 C100 C101 L113L72-M97 HydrophobicContact CD1-CB 3.79Å; L72-M97 HydrophobicContact CD1-CE 4.1Å; L72-M97 HydrophobicContact CD1-CG 3.93Å; Y75-M97 VanDerWaalsContact CB-CG 3.42Å; Y75-M97 HydrophobicContact CD2-CG 4.35Å; Y75-M97 HydrophobicContact CG-CG 4.18Å; L79-M97 HydrophobicContact CD2-SD 4.32Å; V93-M97 HydrophobicContact CG1-CG 4.49Å; V93-M97 HydrophobicContact CG1-SD 4.16Å; V93-M97 VanDerWaalsContact O-CG 3.27Å; V93-M97 WeakPolarHBondContact O-CG 3.19Å; V93-M97 PolarHBondContact O-N 3.17Å; L94-M97 HydrophobicContact CD2-SD 4.24Å; L94-M97 PolarHBondContact O-N 2.75Å; E95-M97 VanDerWaalsContact C-N 3.34Å; E95-M97 PolarHBondContact O-N 3.06Å; M97-R99 VanDerWaalsContact C-N 3.3Å; M97-R99 PolarHBondContact O-N 3.46Å; M97-C100 WeakPolarHBondContact O-CA 3.5Å; M97-C100 WeakPolarHBondContact O-CB 3.27Å; M97-C100 PolarHBondContact O-N 3.05Å; M97-C101 PolarHBondContact O-N 3.07Å; M97-C101 PolarHBondContact O-SG 3.16Å; M97-L113 HydrophobicContact CB-CD1 3.64Å; M97-L113 HydrophobicContact CB-CD2 4.31Å; M97-L113 HydrophobicContact CE-CD2 4.15Å
98A98.8Very high97.4Very high0 Ų049.2 Ų49.20%024%0.242CC..Hα-helixtrans-61.6-39.5-179.900000111.9L94 E95 C101 T102 L113 L133L94-A98 WeakPolarHBondContact O-CB 3.22Å; L94-A98 PolarHBondContact O-N 3.21Å; E95-A98 PolarHBondContact O-N 3.45Å; A98-C101 PolarHBondContact O-N 2.67Å; A98-T102 WeakPolarHBondContact O-CB 3.46Å; A98-T102 PolarHBondContact O-N 3.27Å; A98-T102 PolarHBondContact O-OG1 3.35Å; A98-L113 HydrophobicContact CB-CB 3.88Å; A98-L113 HydrophobicContact CB-CD1 4.22Å; A98-L133 HydrophobicContact CB-CD1 4.16Å; A98-L133 HydrophobicContact CB-CD2 3.87Å; A98-L133 HydrophobicContact CB-CG 4.48Å
99R98.6Very high97.7Very high118 Ų11847.5 Ų47.545%0.44523%0.226SC..Hα-helixtrans-63.8-39.8173.3-69.2170.3177.4-134.13.2111.7F63 E95 G96 M97 T102 K103 L133F63-R99 HydrophobicContact CE2-CB 3.78Å; F63-R99 HydrophobicContact CZ-CB 4.03Å; E95-R99 VanDerWaalsContact O-CG 3.3Å; E95-R99 WeakPolarHBondContact O-CG 3.5Å; E95-R99 PolarHBondContact O-N 2.98Å; E95-R99 IonicContact OE1-CZ 3.85Å; E95-R99 VanDerWaalsContact OE1-CZ 3.22Å; E95-R99 IonicContact OE1-NE 2.63Å; E95-R99 PolarHBondContact OE1-NE 2.95Å; E95-R99 VanDerWaalsContact OE1-NE 3.09Å; E95-R99 IonicContact OE1-NH2 3.73Å; E95-R99 PolarHBondContact OE1-NH2 3.35Å; G96-R99 PolarHBondContact O-N 3.46Å; M97-R99 VanDerWaalsContact C-N 3.3Å; M97-R99 PolarHBondContact O-N 3.46Å; R99-T102 WeakPolarHBondContact O-CB 3.37Å; R99-T102 PolarHBondContact O-N 3.01Å; R99-K103 WeakPolarHBondContact O-CG 3.41Å; R99-K103 PolarHBondContact O-N 3.27Å; R99-K103 VanDerWaalsContact O-N 3.16Å; R99-L133 HydrophobicContact CG-CD1 3.87Å
100C98.8Very high97.9Very high0 Ų045.3 Ų45.30%022%0.215CC..Hα-helixtrans-63-51.9174.2-62.90000111.3A71 L72 G96 M97 T102 K103 L104A71-C100 VanDerWaalsContact CB-SG 3.56Å; L72-C100 HydrophobicContact CB-CB 3.96Å; L72-C100 HydrophobicContact CD1-CB 4.33Å; G96-C100 PolarHBondContact O-N 2.92Å; G96-C100 PolarHBondContact O-SG 3.01Å; M97-C100 WeakPolarHBondContact O-CA 3.5Å; M97-C100 WeakPolarHBondContact O-CB 3.27Å; M97-C100 PolarHBondContact O-N 3.05Å; C100-T102 PolarHBondContact O-N 3.42Å; C100-K103 PolarHBondContact O-N 3.18Å; C100-L104 WeakPolarHBondContact O-CG 3.25Å; C100-L104 PolarHBondContact O-N 2.88Å
101C98.8Very high98Very high0 Ų044.8 Ų44.80%022%0.216CC..Hα-helixtrans-56.1-40.4178.1-63.20000111.5M97 A98 K103 L104 G105 Q106 Q109 A110M97-C101 PolarHBondContact O-N 3.07Å; M97-C101 PolarHBondContact O-SG 3.16Å; A98-C101 PolarHBondContact O-N 2.67Å; C101-K103 PolarHBondContact O-N 3.22Å; C101-L104 PolarHBondContact O-N 3.12Å; C101-G105 PolarHBondContact O-N 3.38Å; C101-Q106 HydrophobicContact CB-CB 4.11Å; C101-Q106 WeakPolarHBondContact O-CB 3.43Å; C101-Q106 PolarHBondContact O-N 3.3Å; C101-Q109 HydrophobicContact CB-CB 4.41Å; C101-A110 HydrophobicContact CB-CB 3.85Å
102T98.6Very high98.1Very high5 Ų550 Ų503%0.03124%0.242CC..Hα-helixtrans-56.4-52.2174-55.30000110.9A98 R99 C100 L104 G105 I137 H140 F141A98-T102 WeakPolarHBondContact O-CB 3.46Å; A98-T102 PolarHBondContact O-N 3.27Å; A98-T102 PolarHBondContact O-OG1 3.35Å; R99-T102 WeakPolarHBondContact O-CB 3.37Å; R99-T102 PolarHBondContact O-N 3.01Å; C100-T102 PolarHBondContact O-N 3.42Å; T102-L104 VanDerWaalsContact C-N 3.27Å; T102-L104 PolarHBondContact O-N 3.33Å; T102-G105 PolarHBondContact O-N 3.27Å; T102-I137 WeakPolarHBondContact OG1-CG1 3.45Å; T102-H140 HydrophobicContact CG2-CB 3.57Å; T102-H140 PolarHBondContact O-CD2 3.32Å; T102-H140 PolarHBondContact O-NE2 3.25Å; T102-F141 HydrophobicContact CG2-CE2 4.16Å
103K98.5Very high98.2Very high103 Ų10347.4 Ų47.445%0.44823%0.228SC..Hα-helixtrans-67.7-24.9-178.9-66.3-64.6-176.6-174.30114.1F63 Y68 R99 C100 C101 G105F63-K103 HydrophobicContact CE2-CG 4.47Å; Y68-K103 HydrophobicContact CD1-CB 3.82Å; Y68-K103 HydrophobicContact CD1-CG 4.04Å; Y68-K103 HydrophobicContact CD2-CB 3.43Å; Y68-K103 VanDerWaalsContact CD2-CB 3.43Å; Y68-K103 HydrophobicContact CD2-CG 4.3Å; Y68-K103 HydrophobicContact CE1-CB 3.93Å; Y68-K103 HydrophobicContact CE1-CD 4.49Å; Y68-K103 HydrophobicContact CE1-CG 3.76Å; Y68-K103 HydrophobicContact CE2-CB 3.54Å; Y68-K103 HydrophobicContact CE2-CD 4.33Å; Y68-K103 HydrophobicContact CE2-CG 4.02Å; Y68-K103 HydrophobicContact CG-CB 3.57Å; Y68-K103 HydrophobicContact CG-CG 4.3Å; R99-K103 WeakPolarHBondContact O-CG 3.41Å; R99-K103 PolarHBondContact O-N 3.27Å; R99-K103 VanDerWaalsContact O-N 3.16Å; C100-K103 PolarHBondContact O-N 3.18Å; C101-K103 PolarHBondContact O-N 3.22Å; K103-G105 VanDerWaalsContact C-N 3.28Å
104L98.4Very high98.2Very high60 Ų6047.6 Ų47.631%0.31423%0.229SC..THydrogen-bonded Turntrans-82.2-1.9173.7-67.9169.7000113.2Q69 L72 C100 C101 T102 Q106Q69-L104 HydrophobicContact CB-CD2 4.44Å; L72-L104 HydrophobicContact CD2-CD1 4.03Å; C100-L104 WeakPolarHBondContact O-CG 3.25Å; C100-L104 PolarHBondContact O-N 2.88Å; C101-L104 PolarHBondContact O-N 3.12Å; T102-L104 VanDerWaalsContact C-N 3.27Å; T102-L104 PolarHBondContact O-N 3.33Å; L104-Q106 VanDerWaalsContact C-N 3.28Å; L104-Q106 HydrophobicContact CB-CG 4.13Å; L104-Q106 PolarHBondContact O-N 3.13Å
105G97.7Very high98.1Very high44 Ų4448.8 Ų48.845%0.45424%0.243SC..THydrogen-bonded Turntrans77.410-176.900000114.3C101 T102 K103 R107 F141C101-G105 PolarHBondContact O-N 3.38Å; T102-G105 PolarHBondContact O-N 3.27Å; K103-G105 VanDerWaalsContact C-N 3.28Å; G105-R107 PolarHBondContact O-N 3.34Å; G105-R107 VanDerWaalsContact O-N 3.12Å; G105-F141 WeakPolarHBondContact O-CE1 3.44Å
106Q97.9Very high98Very high65 Ų6550.2 Ų50.230%0.30425%0.252SS..  trans-87.375.5-177.9-64.7167.4-19.500110.7C101 L104 E108 Q109 A110C101-Q106 HydrophobicContact CB-CB 4.11Å; C101-Q106 WeakPolarHBondContact O-CB 3.43Å; C101-Q106 PolarHBondContact O-N 3.3Å; L104-Q106 VanDerWaalsContact C-N 3.28Å; L104-Q106 HydrophobicContact CB-CG 4.13Å; L104-Q106 PolarHBondContact O-N 3.13Å; Q106-E108 PolarHBondContact O-N 3.44Å; Q106-Q109 HydrophobicContact CB-CB 4.29Å; Q106-Q109 VanDerWaalsContact OE1-OE1 3.11Å; Q106-A110 PolarHBondContact O-N 3.41Å; Q106-A110 VanDerWaalsContact O-N 3.12Å
107R97.6Very high97.8Very high109 Ų10950 Ų5041%0.41125%0.249SC..Hα-helixtrans-58.4-50.3-174.2-179.6178.9166.9-176.1-2.7113.7G105 A110 L111 F141 C143G105-R107 PolarHBondContact O-N 3.34Å; G105-R107 VanDerWaalsContact O-N 3.12Å; R107-A110 PolarHBondContact O-N 3.19Å; R107-L111 HydrophobicContact CG-CD1 4.05Å; R107-L111 WeakPolarHBondContact O-CG 3.37Å; R107-L111 PolarHBondContact O-N 3.08Å; R107-L111 VanDerWaalsContact O-N 3.09Å; R107-F141 HydrophobicContact CB-CD1 4.03Å; R107-F141 HydrophobicContact CB-CD2 3.93Å; R107-F141 HydrophobicContact CB-CE1 3.8Å; R107-F141 HydrophobicContact CB-CE2 3.72Å; R107-F141 HydrophobicContact CB-CG 4.11Å; R107-F141 HydrophobicContact CB-CZ 3.65Å; R107-F141 HydrophobicContact CG-CD1 4.45Å; R107-F141 HydrophobicContact CG-CD2 3.8Å; R107-F141 HydrophobicContact CG-CE2 4.02Å; R107-F141 HydrophobicContact CG-CG 4.06Å; R107-F141 HydrophobicContact CG-CZ 4.43Å; R107-C143 PolarHBondContact NH1-SG 3.24Å; R107-C143 PolarHBondContact NH2-SG 2.97Å; R107-C143 VanDerWaalsContact NH2-SG 3.43Å
108E97.5Very high97.5Very high154 Ų15453.6 Ų53.672%0.7227%0.269SS*.Hα-helixtrans-62.9-45.9-174.5-66.9178.717400111.3Q106 A110 L111 E112Q106-E108 PolarHBondContact O-N 3.44Å; E108-A110 PolarHBondContact O-N 3.06Å; E108-L111 PolarHBondContact O-N 3.06Å; E108-L111 VanDerWaalsContact O-N 3.15Å; E108-E112 PolarHBondContact O-N 3.28Å
109Q98.1Very high97Very high76 Ų7661.7 Ų61.736%0.35530%0.304SS..Hα-helixtrans-63.8-38.8178.1-165.1176.49.400112.4C101 Q106 L111 E112 L113C101-Q109 HydrophobicContact CB-CB 4.41Å; Q106-Q109 HydrophobicContact CB-CB 4.29Å; Q106-Q109 VanDerWaalsContact OE1-OE1 3.11Å; Q109-L111 VanDerWaalsContact C-N 3.31Å; Q109-L111 PolarHBondContact O-N 3.17Å; Q109-E112 PolarHBondContact O-N 3.02Å; Q109-L113 VanDerWaalsContact O-CG 3.32Å; Q109-L113 WeakPolarHBondContact O-CG 3.18Å; Q109-L113 PolarHBondContact O-N 3.47Å
110A98.5Very high96.4Very high0 Ų059 Ų590%030%0.299CS..Hα-helixtrans-61.8-40.1174.400000111.9C101 Q106 R107 E108 A114 I137C101-A110 HydrophobicContact CB-CB 3.85Å; Q106-A110 PolarHBondContact O-N 3.41Å; Q106-A110 VanDerWaalsContact O-N 3.12Å; R107-A110 PolarHBondContact O-N 3.19Å; E108-A110 PolarHBondContact O-N 3.06Å; A110-A114 PolarHBondContact O-N 3.38Å; A110-A114 VanDerWaalsContact O-N 3.09Å; A110-I137 HydrophobicContact CB-CD1 4.12Å; A110-I137 HydrophobicContact CB-CG1 4.29Å; A110-I137 HydrophobicContact CB-CG2 4.34Å
111L97.9Very high95.8Very high46 Ų4659.9 Ų59.924%0.24131%0.305CS..Hα-helixtrans-73.4-34.4177.9-69.5173.8000112.8R107 E108 Q109 A114 G115 I137 Y138R107-L111 HydrophobicContact CG-CD1 4.05Å; R107-L111 WeakPolarHBondContact O-CG 3.37Å; R107-L111 PolarHBondContact O-N 3.08Å; R107-L111 VanDerWaalsContact O-N 3.09Å; E108-L111 PolarHBondContact O-N 3.06Å; E108-L111 VanDerWaalsContact O-N 3.15Å; Q109-L111 VanDerWaalsContact C-N 3.31Å; Q109-L111 PolarHBondContact O-N 3.17Å; L111-A114 PolarHBondContact O-N 3.28Å; L111-G115 PolarHBondContact O-N 3.29Å; L111-I137 HydrophobicContact CD2-CG2 3.92Å; L111-I137 HydrophobicContact CG-CG2 4.23Å; L111-Y138 HydrophobicContact CD1-CE1 4.17Å; L111-Y138 HydrophobicContact CD2-CE1 3.71Å
112E97.9Very high95.4Very high134 Ų13463 Ų6363%0.62633%0.327SS*.Hα-helixtrans-61.1-47.4172.9-173.3-177-17900110.9E108 Q109 A114 G115 L116E108-E112 PolarHBondContact O-N 3.28Å; Q109-E112 PolarHBondContact O-N 3.02Å; E112-A114 VanDerWaalsContact C-N 3.34Å; E112-A114 PolarHBondContact O-N 3.15Å; E112-G115 WeakPolarHBondContact O-CA 3.43Å; E112-G115 PolarHBondContact O-N 2.88Å; E112-L116 PolarHBondContact O-N 3.02Å
113L98.1Very high95Very high13 Ų1364.2 Ų64.27%0.06833%0.333CS..Hα-helixtrans-61.7-40.8176-69.9165.5000112L94 M97 A98 Q109 G115 L116 L117L94-L113 HydrophobicContact CD2-CD2 3.78Å; M97-L113 HydrophobicContact CB-CD1 3.64Å; M97-L113 HydrophobicContact CB-CD2 4.31Å; M97-L113 HydrophobicContact CE-CD2 4.15Å; A98-L113 HydrophobicContact CB-CB 3.88Å; A98-L113 HydrophobicContact CB-CD1 4.22Å; Q109-L113 VanDerWaalsContact O-CG 3.32Å; Q109-L113 WeakPolarHBondContact O-CG 3.18Å; Q109-L113 PolarHBondContact O-N 3.47Å; L113-G115 VanDerWaalsContact C-N 3.28Å; L113-G115 PolarHBondContact O-N 2.96Å; L113-L116 HydrophobicContact CD2-CD1 4.39Å; L113-L116 WeakPolarHBondContact O-CB 3.33Å; L113-L116 PolarHBondContact O-N 2.84Å; L113-L117 PolarHBondContact O-N 2.86Å; L113-L117 VanDerWaalsContact O-N 3.13Å
114A97.6Very high94.6Very high4 Ų459.4 Ų59.43%0.03331%0.312CS..Hα-helixtrans-62.4-35.8171.800000112.1A110 L111 E112 L117 N118 L130 L133 K134 I137A110-A114 PolarHBondContact O-N 3.38Å; A110-A114 VanDerWaalsContact O-N 3.09Å; L111-A114 PolarHBondContact O-N 3.28Å; E112-A114 VanDerWaalsContact C-N 3.34Å; E112-A114 PolarHBondContact O-N 3.15Å; A114-L117 PolarHBondContact O-N 3.4Å; A114-N118 PolarHBondContact O-N 3.38Å; A114-L130 HydrophobicContact CB-CD1 3.94Å; A114-L130 VanDerWaalsContact O-CD1 3.26Å; A114-L130 WeakPolarHBondContact O-CD1 3.37Å; A114-L133 HydrophobicContact CB-CD2 4.4Å; A114-K134 HydrophobicContact CB-CG 4.23Å; A114-I137 HydrophobicContact CB-CD1 4.33Å
115G96.3Very high94.3Very high33 Ų3358.9 Ų58.934%0.3431%0.313SS..Hα-helixtrans-63.2-37.7173.800000113.2L111 E112 L113 N118 K119L111-G115 PolarHBondContact O-N 3.29Å; E112-G115 WeakPolarHBondContact O-CA 3.43Å; E112-G115 PolarHBondContact O-N 2.88Å; L113-G115 VanDerWaalsContact C-N 3.28Å; L113-G115 PolarHBondContact O-N 2.96Å; G115-N118 WeakPolarHBondContact O-CB 3.29Å; G115-N118 PolarHBondContact O-N 3.08Å; G115-K119 PolarHBondContact O-N 3.32Å
116L95Very high94Very high69 Ų6959 Ų5936%0.36130%0.302SS..Hα-helixtrans-64.1-47.3172.8-63.2176.8000111.2L94 E112 L113 N118 K119 D120L94-L116 HydrophobicContact CD1-CB 4.39Å; L94-L116 HydrophobicContact CD2-CD1 4.4Å; E112-L116 PolarHBondContact O-N 3.02Å; L113-L116 HydrophobicContact CD2-CD1 4.39Å; L113-L116 WeakPolarHBondContact O-CB 3.33Å; L113-L116 PolarHBondContact O-N 2.84Å; L116-N118 PolarHBondContact O-N 2.75Å; L116-K119 PolarHBondContact O-N 3.17Å; L116-K119 VanDerWaalsContact O-N 3.16Å; L116-D120 PolarHBondContact O-N 3.47Å
117L94.9Very high93.8Very high2 Ų257.1 Ų57.11%0.0129%0.293CS..Hα-helixtrans-59.1-31.1176.9-72.6170.9000113.3R91 L94 E95 L113 A114 D120 S121 L130 L133R91-L117 HydrophobicContact CB-CD2 3.89Å; R91-L117 HydrophobicContact CG-CD2 3.92Å; R91-L117 PolarHBondContact NH1-O 3.1Å; L94-L117 HydrophobicContact CB-CD1 4.48Å; L94-L117 HydrophobicContact CB-CD2 3.86Å; L94-L117 HydrophobicContact CB-CG 4.1Å; L94-L117 HydrophobicContact CD1-CD2 4.27Å; E95-L117 HydrophobicContact CB-CD1 4.19Å; L113-L117 PolarHBondContact O-N 2.86Å; L113-L117 VanDerWaalsContact O-N 3.13Å; A114-L117 PolarHBondContact O-N 3.4Å; L117-D120 PolarHBondContact O-N 3.39Å; L117-S121 PolarHBondContact O-N 3.31Å; L117-S121 PolarHBondContact O-OG 2.94Å; L117-L130 HydrophobicContact CB-CD1 4.04Å; L117-L133 HydrophobicContact CD1-CD2 3.65Å
118N91.6Very high93.6Very high91 Ų9153 Ų5349%0.48728%0.28SS..Hα-helixtrans-65.5-44.5176.7-165.735.4000112.3A114 G115 L116 D120 S121 L130A114-N118 PolarHBondContact O-N 3.38Å; G115-N118 WeakPolarHBondContact O-CB 3.29Å; G115-N118 PolarHBondContact O-N 3.08Å; L116-N118 PolarHBondContact O-N 2.75Å; N118-D120 PolarHBondContact O-N 3.32Å; N118-S121 WeakPolarHBondContact O-CB 3.48Å; N118-S121 PolarHBondContact O-N 2.8Å; N118-S121 VanDerWaalsContact O-N 3.08Å; N118-L130 HydrophobicContact CB-CD2 3.55Å; N118-L130 WeakPolarHBondContact OD1-CD2 3.36Å
119K89.5Confident93.5Very high169 Ų16948 Ų4874%0.73526%0.262SS*.Hα-helixtrans-60.4-31.1179.2-65.7175.7-176.9175.90112.1G115 L116G115-K119 PolarHBondContact O-N 3.32Å; L116-K119 PolarHBondContact O-N 3.17Å; L116-K119 VanDerWaalsContact O-N 3.16Å
120D84.9Confident93.5Very high62 Ų6244.6 Ų44.633%0.33225%0.247SC..THydrogen-bonded Turntrans-94.810.6-179-60.2-21.5000113.3R91 L116 L117 N118 H126R91-D120 VanDerWaalsContact NH1-C 3.27Å; R91-D120 PolarHBondContact NH1-O 3.46Å; L116-D120 PolarHBondContact O-N 3.47Å; L117-D120 PolarHBondContact O-N 3.39Å; N118-D120 PolarHBondContact O-N 3.32Å; D120-H126 PolarHBondContact O-ND1 3.09Å
121S87.4Confident93.4Very high18 Ų1844.8 Ų44.813%0.12625%0.248CC..  trans-83.9119.7179.2-65.60000110.5R91 L117 N118R91-S121 PolarHBondContact NH1-OG 2.72Å; L117-S121 PolarHBondContact O-N 3.31Å; L117-S121 PolarHBondContact O-OG 2.94Å; N118-S121 WeakPolarHBondContact O-CB 3.48Å; N118-S121 PolarHBondContact O-N 2.8Å; N118-S121 VanDerWaalsContact O-N 3.08Å
122S88.6Confident93.4Very high66 Ų6646.3 Ų46.346%0.46226%0.256SS..  trans-118.7-16.6-175.257.40000113.6H126 L293S122-H126 PolarHBondContact N-ND1 3.48Å; S122-H126 PolarHBondContact OG-CE1 3.49Å; S122-H126 PolarHBondContact OG-ND1 3.37Å; S122-L293 PolarHBondContact O-N 3.5Å
123N90.7Very high93.4Very high30 Ų3040.1 Ų40.116%0.1623%0.227CC..BIsolated β-bridgetrans-139.5169.3-178.460.854.8000111.9C125 H126 L127 E291N123-C125 VanDerWaalsContact C-N 3.27Å; N123-C125 PolarHBondContact O-N 2.9Å; N123-C125 WeakPolarHBondContact OD1-CA 3.41Å; N123-C125 VanDerWaalsContact OD1-CB 3.32Å; N123-C125 WeakPolarHBondContact OD1-CB 3.33Å; N123-C125 PolarHBondContact OD1-N 3.31Å; N123-C125 VanDerWaalsContact OD1-N 3.1Å; N123-H126 PolarHBondContact ND2-CD2 3.14Å; N123-H126 PolarHBondContact ND2-CE1 3.19Å; N123-H126 PolarHBondContact ND2-NE2 2.96Å; N123-H126 VanDerWaalsContact ND2-NE2 3.15Å; N123-H126 WeakPolarHBondContact O-CB 3.3Å; N123-H126 PolarHBondContact O-N 2.95Å; N123-H126 PolarHBondContact OD1-CD2 2.98Å; N123-H126 PolarHBondContact OD1-N 3.44Å; N123-L127 PolarHBondContact O-N 3.18Å; N123-L127 VanDerWaalsContact O-N 3.16Å; N123-E291 CarbonylContact C-O 3.46Å; N123-E291 WeakPolarHBondContact CA-O 3.46Å; N123-E291 WeakPolarHBondContact CB-O 3.43Å
124T90.5Very high93.4Very high2 Ų242.1 Ų42.11%0.01224%0.235CC..Hα-helixtrans-59.7-32.5179.555.70000113.2L127 T128 L157 Q288 G290 E291 L293 V296T124-L127 PolarHBondContact O-N 3Å; T124-T128 VanDerWaalsContact O-CB 3.32Å; T124-T128 WeakPolarHBondContact O-CB 3.44Å; T124-T128 PolarHBondContact O-N 2.63Å; T124-T128 PolarHBondContact O-OG1 3.2Å; T124-L157 HydrophobicContact CG2-CD1 3.86Å; T124-Q288 PolarHBondContact OG1-O 3.15Å; T124-G290 PolarHBondContact OG1-N 3.43Å; T124-E291 HydrophobicContact CG2-CB 4.09Å; T124-E291 PolarHBondContact N-O 3.16Å; T124-E291 PolarHBondContact OG1-N 2.73Å; T124-L293 HydrophobicContact CG2-CD2 4.3Å; T124-V296 HydrophobicContact CG2-CG2 3.78Å
125C91.3Very high93.4Very high49 Ų4942.7 Ų42.733%0.33124%0.238SC..Hα-helixtrans-67.1-41.7176.1-640000112.2N123 T128 S129 G290N123-C125 VanDerWaalsContact C-N 3.27Å; N123-C125 PolarHBondContact O-N 2.9Å; N123-C125 WeakPolarHBondContact OD1-CA 3.41Å; N123-C125 VanDerWaalsContact OD1-CB 3.32Å; N123-C125 WeakPolarHBondContact OD1-CB 3.33Å; N123-C125 PolarHBondContact OD1-N 3.31Å; N123-C125 VanDerWaalsContact OD1-N 3.1Å; C125-T128 PolarHBondContact O-N 3.28Å; C125-S129 WeakPolarHBondContact O-CB 3.44Å; C125-S129 PolarHBondContact O-N 3.01Å; C125-S129 PolarHBondContact O-OG 2.95Å; C125-G290 PolarHBondContact SG-N 3.27Å
126H93.1Very high93.5Very high48 Ų4844 Ų4422%0.22224%0.242CC..Hα-helixtrans-62.2-45.7176.4-70.7-169.9000110.6R91 D120 S122 N123 S129 L130R91-H126 VanDerWaalsContact NH2-CB 3.34Å; R91-H126 PolarHBondContact NH2-O 3.48Å; D120-H126 PolarHBondContact O-ND1 3.09Å; S122-H126 PolarHBondContact N-ND1 3.48Å; S122-H126 PolarHBondContact OG-CE1 3.49Å; S122-H126 PolarHBondContact OG-ND1 3.37Å; N123-H126 PolarHBondContact ND2-CD2 3.14Å; N123-H126 PolarHBondContact ND2-CE1 3.19Å; N123-H126 PolarHBondContact ND2-NE2 2.96Å; N123-H126 VanDerWaalsContact ND2-NE2 3.15Å; N123-H126 WeakPolarHBondContact O-CB 3.3Å; N123-H126 PolarHBondContact O-N 2.95Å; N123-H126 PolarHBondContact OD1-CD2 2.98Å; N123-H126 PolarHBondContact OD1-N 3.44Å; H126-S129 PolarHBondContact O-N 2.93Å; H126-L130 WeakPolarHBondContact O-CB 3.43Å; H126-L130 PolarHBondContact O-N 2.98Å
127L92.9Very high93.7Very high24 Ų2440.7 Ų40.713%0.12623%0.225CC..Hα-helixtrans-65.8-44178.1-178.458.5000111.8N123 T124 S129 L130 L131 L157 L293 L298N123-L127 PolarHBondContact O-N 3.18Å; N123-L127 VanDerWaalsContact O-N 3.16Å; T124-L127 PolarHBondContact O-N 3Å; L127-S129 VanDerWaalsContact C-N 3.35Å; L127-S129 PolarHBondContact O-N 2.68Å; L127-L130 PolarHBondContact O-N 2.95Å; L127-L131 HydrophobicContact CD1-CD1 4.16Å; L127-L131 HydrophobicContact CD1-CG 4.14Å; L127-L131 HydrophobicContact CG-CD1 4.01Å; L127-L131 HydrophobicContact CG-CG 4.42Å; L127-L131 WeakPolarHBondContact O-CG 3.36Å; L127-L131 PolarHBondContact O-N 2.92Å; L127-L157 HydrophobicContact CB-CD2 4.28Å; L127-L157 HydrophobicContact CD2-CD1 4.47Å; L127-L157 HydrophobicContact CD2-CD2 4.04Å; L127-L157 HydrophobicContact CG-CD2 4Å; L127-L293 HydrophobicContact CB-CD1 4.41Å; L127-L293 HydrophobicContact CB-CD2 4.27Å; L127-L293 HydrophobicContact CD2-CD2 3.93Å; L127-L298 HydrophobicContact CD2-CD1 4.17Å
128T94.2Very high93.8Very high22 Ų2241.9 Ų41.914%0.13523%0.229CC..Hα-helixtrans-57.3-48.6176.6-61.20000111.1T124 C125 L130 L131 L132 L154 L157 L158T124-T128 VanDerWaalsContact O-CB 3.32Å; T124-T128 WeakPolarHBondContact O-CB 3.44Å; T124-T128 PolarHBondContact O-N 2.63Å; T124-T128 PolarHBondContact O-OG1 3.2Å; C125-T128 PolarHBondContact O-N 3.28Å; T128-L130 PolarHBondContact O-N 2.95Å; T128-L131 PolarHBondContact O-N 3.47Å; T128-L132 HydrophobicContact CG2-CD1 4.01Å; T128-L132 WeakPolarHBondContact O-CG 3.17Å; T128-L132 PolarHBondContact O-N 2.86Å; T128-L154 HydrophobicContact CG2-CD2 4Å; T128-L157 WeakPolarHBondContact OG1-CD2 3.39Å; T128-L158 HydrophobicContact CG2-CD1 3.69Å
129S95.1Very high94Very high49 Ų4943 Ų4334%0.34323%0.232SC..Hα-helixtrans-62.3-43-179.8-540000111.6C125 H126 L127 L132 L133C125-S129 WeakPolarHBondContact O-CB 3.44Å; C125-S129 PolarHBondContact O-N 3.01Å; C125-S129 PolarHBondContact O-OG 2.95Å; H126-S129 PolarHBondContact O-N 2.93Å; L127-S129 VanDerWaalsContact C-N 3.35Å; L127-S129 PolarHBondContact O-N 2.68Å; S129-L132 PolarHBondContact O-N 3.09Å; S129-L133 WeakPolarHBondContact O-CB 3.5Å; S129-L133 PolarHBondContact O-N 3.12Å
130L96.9Very high94.4Very high6 Ų639.4 Ų39.43%0.03122%0.217CC..Hα-helixtrans-61.8-45.9175.4172.263.8000112.5A114 L117 N118 H126 L127 T128 L133 K134A114-L130 HydrophobicContact CB-CD1 3.94Å; A114-L130 VanDerWaalsContact O-CD1 3.26Å; A114-L130 WeakPolarHBondContact O-CD1 3.37Å; L117-L130 HydrophobicContact CB-CD1 4.04Å; N118-L130 HydrophobicContact CB-CD2 3.55Å; N118-L130 WeakPolarHBondContact OD1-CD2 3.36Å; H126-L130 WeakPolarHBondContact O-CB 3.43Å; H126-L130 PolarHBondContact O-N 2.98Å; L127-L130 PolarHBondContact O-N 2.95Å; T128-L130 PolarHBondContact O-N 2.95Å; L130-L133 WeakPolarHBondContact O-CB 3.42Å; L130-L133 PolarHBondContact O-N 3.43Å; L130-K134 HydrophobicContact CD1-CD 4.34Å; L130-K134 HydrophobicContact CD1-CG 4.32Å; L130-K134 HydrophobicContact CG-CD 4.4Å; L130-K134 WeakPolarHBondContact O-CG 3.36Å; L130-K134 PolarHBondContact O-N 3.21Å
131L96.8Very high94.9Very high4 Ų439 Ų392%0.02121%0.213CC..Hα-helixtrans-63.9-41.8179.5-71.2171000111.3L127 T128 L133 K134 V135 C150 Q153 L154 L157L127-L131 HydrophobicContact CD1-CD1 4.16Å; L127-L131 HydrophobicContact CD1-CG 4.14Å; L127-L131 HydrophobicContact CG-CD1 4.01Å; L127-L131 HydrophobicContact CG-CG 4.42Å; L127-L131 WeakPolarHBondContact O-CG 3.36Å; L127-L131 PolarHBondContact O-N 2.92Å; T128-L131 PolarHBondContact O-N 3.47Å; L131-L133 VanDerWaalsContact C-N 3.34Å; L131-L133 PolarHBondContact O-N 3.25Å; L131-K134 PolarHBondContact O-N 3.49Å; L131-V135 WeakPolarHBondContact O-CG2 3.4Å; L131-V135 PolarHBondContact O-N 3.4Å; L131-C150 HydrophobicContact CD2-CB 4.21Å; L131-Q153 HydrophobicContact CD1-CB 3.8Å; L131-Q153 HydrophobicContact CD2-CB 4.07Å; L131-L154 HydrophobicContact CB-CD1 4.07Å; L131-L154 HydrophobicContact CB-CD2 3.75Å; L131-L154 HydrophobicContact CB-CG 3.7Å; L131-L154 HydrophobicContact CD1-CD2 4.03Å; L131-L154 HydrophobicContact CD1-CG 4.02Å; L131-L154 HydrophobicContact CG-CG 4.49Å; L131-L157 HydrophobicContact CD1-CD2 4.33Å
132L97.8Very high95.1Very high78 Ų7840.9 Ų40.941%0.40823%0.234SC..Hα-helixtrans-62-40.7174.4-71.4170.5000112.1T128 S129 V135 S136 L154T128-L132 HydrophobicContact CG2-CD1 4.01Å; T128-L132 WeakPolarHBondContact O-CG 3.17Å; T128-L132 PolarHBondContact O-N 2.86Å; S129-L132 PolarHBondContact O-N 3.09Å; L132-V135 PolarHBondContact O-N 3.06Å; L132-S136 PolarHBondContact O-N 2.94Å; L132-L154 HydrophobicContact CD2-CD1 3.79Å; L132-L154 HydrophobicContact CG-CD1 4.2Å; L132-L154 HydrophobicContact CG-CD2 4.31Å
133L98.4Very high95.3Very high4 Ų438.6 Ų38.62%0.02122%0.218CC..Hα-helixtrans-60.2-48.4173.1175.264.8000111.1E95 A98 R99 A114 L117 S129 L130 L131 V135 S136 I137E95-L133 HydrophobicContact CG-CD1 4.29Å; E95-L133 HydrophobicContact CG-CD2 4.2Å; A98-L133 HydrophobicContact CB-CD1 4.16Å; A98-L133 HydrophobicContact CB-CD2 3.87Å; A98-L133 HydrophobicContact CB-CG 4.48Å; R99-L133 HydrophobicContact CG-CD1 3.87Å; A114-L133 HydrophobicContact CB-CD2 4.4Å; L117-L133 HydrophobicContact CD1-CD2 3.65Å; S129-L133 WeakPolarHBondContact O-CB 3.5Å; S129-L133 PolarHBondContact O-N 3.12Å; L130-L133 WeakPolarHBondContact O-CB 3.42Å; L130-L133 PolarHBondContact O-N 3.43Å; L131-L133 VanDerWaalsContact C-N 3.34Å; L131-L133 PolarHBondContact O-N 3.25Å; L133-V135 PolarHBondContact O-N 3.22Å; L133-S136 WeakPolarHBondContact O-CB 3.37Å; L133-S136 PolarHBondContact O-N 3.34Å; L133-I137 HydrophobicContact CD1-CD1 4.2Å; L133-I137 HydrophobicContact CD1-CG1 4.4Å; L133-I137 HydrophobicContact CG-CD1 3.91Å; L133-I137 WeakPolarHBondContact O-CG1 3.34Å; L133-I137 PolarHBondContact O-N 3.01Å
134K98.3Very high95.3Very high54 Ų5439.1 Ų39.124%0.23522%0.223CC..Hα-helixtrans-61.2-41.3177.6-72-179.670.9-177.50112.2A114 L130 L131 S136 I137 Y138A114-K134 HydrophobicContact CB-CG 4.23Å; L130-K134 HydrophobicContact CD1-CD 4.34Å; L130-K134 HydrophobicContact CD1-CG 4.32Å; L130-K134 HydrophobicContact CG-CD 4.4Å; L130-K134 WeakPolarHBondContact O-CG 3.36Å; L130-K134 PolarHBondContact O-N 3.21Å; L131-K134 PolarHBondContact O-N 3.49Å; K134-S136 VanDerWaalsContact C-N 3.32Å; K134-S136 PolarHBondContact O-N 3.28Å; K134-I137 PolarHBondContact O-N 3.16Å; K134-Y138 HydrophobicContact CB-CD2 4.25Å; K134-Y138 HydrophobicContact CB-CE2 3.96Å; K134-Y138 WeakPolarHBondContact CE-OH 3.47Å; K134-Y138 WeakPolarHBondContact O-CB 3.25Å; K134-Y138 WeakPolarHBondContact O-CD2 3.36Å; K134-Y138 PolarHBondContact O-N 3.48Å
135V98.2Very high95.3Very high16 Ų1640.3 Ų40.310%0.09724%0.236CC..Hα-helixtrans-56.6-47.8173.5168.60000110.6L131 L132 L133 Y138 Q139 Q147 C150 L151 L154L131-V135 WeakPolarHBondContact O-CG2 3.4Å; L131-V135 PolarHBondContact O-N 3.4Å; L132-V135 PolarHBondContact O-N 3.06Å; L133-V135 PolarHBondContact O-N 3.22Å; V135-Y138 PolarHBondContact O-N 3.26Å; V135-Q139 WeakPolarHBondContact O-CB 3.45Å; V135-Q139 PolarHBondContact O-N 2.95Å; V135-Q147 HydrophobicContact CG1-CG 4.15Å; V135-C150 HydrophobicContact CG2-CB 3.6Å; V135-L151 HydrophobicContact CG1-CD2 4.23Å; V135-L151 HydrophobicContact CG1-CG 4.34Å; V135-L151 HydrophobicContact CG2-CD2 3.98Å; V135-L151 HydrophobicContact CG2-CG 3.8Å; V135-L154 HydrophobicContact CG2-CD1 4.17Å
136S98.3Very high95.4Very high61 Ų6140.1 Ų40.143%0.42723%0.234SC..Hα-helixtrans-61.7-43.5177.6-177.40000112.7L132 L133 K134 H140L132-S136 PolarHBondContact O-N 2.94Å; L133-S136 WeakPolarHBondContact O-CB 3.37Å; L133-S136 PolarHBondContact O-N 3.34Å; K134-S136 VanDerWaalsContact C-N 3.32Å; K134-S136 PolarHBondContact O-N 3.28Å; S136-H140 WeakPolarHBondContact O-CB 3.47Å; S136-H140 PolarHBondContact O-N 3.43Å
137I98.3Very high95.5Very high0 Ų038.3 Ų38.30%023%0.225CC..Hα-helixtrans-59.2-56.1175.7-67.1165000109.7T102 A110 L111 A114 L133 K134 Q139 H140 F141T102-I137 WeakPolarHBondContact OG1-CG1 3.45Å; A110-I137 HydrophobicContact CB-CD1 4.12Å; A110-I137 HydrophobicContact CB-CG1 4.29Å; A110-I137 HydrophobicContact CB-CG2 4.34Å; L111-I137 HydrophobicContact CD2-CG2 3.92Å; L111-I137 HydrophobicContact CG-CG2 4.23Å; A114-I137 HydrophobicContact CB-CD1 4.33Å; L133-I137 HydrophobicContact CD1-CD1 4.2Å; L133-I137 HydrophobicContact CD1-CG1 4.4Å; L133-I137 HydrophobicContact CG-CD1 3.91Å; L133-I137 WeakPolarHBondContact O-CG1 3.34Å; L133-I137 PolarHBondContact O-N 3.01Å; K134-I137 PolarHBondContact O-N 3.16Å; I137-Q139 VanDerWaalsContact C-N 3.34Å; I137-Q139 PolarHBondContact O-N 3.48Å; I137-H140 WeakPolarHBondContact O-CB 3.47Å; I137-H140 PolarHBondContact O-N 2.87Å; I137-H140 VanDerWaalsContact O-N 3.15Å; I137-F141 HydrophobicContact CG2-CD2 3.94Å; I137-F141 HydrophobicContact CG2-CE2 4.08Å; I137-F141 WeakPolarHBondContact O-CD2 3.28Å; I137-F141 PolarHBondContact O-N 3.09Å; I137-F141 VanDerWaalsContact O-N 3.17Å
138Y97.6Very high95.5Very high27 Ų2737.3 Ų37.311%0.10622%0.22CC..Hα-helixtrans-64.9-38.3-175.8-67.2-48.6000112.6L111 K134 V135 H140 F141 G142 C143 P146L111-Y138 HydrophobicContact CD1-CE1 4.17Å; L111-Y138 HydrophobicContact CD2-CE1 3.71Å; K134-Y138 HydrophobicContact CB-CD2 4.25Å; K134-Y138 HydrophobicContact CB-CE2 3.96Å; K134-Y138 WeakPolarHBondContact CE-OH 3.47Å; K134-Y138 WeakPolarHBondContact O-CB 3.25Å; K134-Y138 WeakPolarHBondContact O-CD2 3.36Å; K134-Y138 PolarHBondContact O-N 3.48Å; V135-Y138 PolarHBondContact O-N 3.26Å; Y138-H140 VanDerWaalsContact C-N 3.32Å; Y138-H140 PolarHBondContact O-N 3.13Å; Y138-F141 CarbonylContact O-C 3.54Å; Y138-F141 PolarHBondContact O-N 3.45Å; Y138-G142 PolarHBondContact O-N 3.33Å; Y138-C143 HydrophobicContact CD1-CB 3.74Å; Y138-C143 HydrophobicContact CG-CB 4.22Å; Y138-C143 PolarHBondContact O-N 2.75Å; Y138-P146 HydrophobicContact CD1-CB 3.77Å; Y138-P146 HydrophobicContact CD1-CG 4.48Å; Y138-P146 HydrophobicContact CD2-CB 3.67Å; Y138-P146 HydrophobicContact CE1-CB 3.6Å; Y138-P146 HydrophobicContact CE1-CG 4.29Å; Y138-P146 HydrophobicContact CE2-CB 3.49Å; Y138-P146 VanDerWaalsContact CE2-CB 3.49Å; Y138-P146 HydrophobicContact CG-CB 3.82Å; Y138-P146 VanDerWaalsContact CZ-CB 3.47Å
139Q96Very high95.5Very high115 Ų11538.2 Ų38.254%0.53723%0.227SC..Hα-helixtrans-60.1-43.3173.9-176.4-179.6-3.200111.3V135 I137 F141 G142V135-Q139 WeakPolarHBondContact O-CB 3.45Å; V135-Q139 PolarHBondContact O-N 2.95Å; I137-Q139 VanDerWaalsContact C-N 3.34Å; I137-Q139 PolarHBondContact O-N 3.48Å; Q139-F141 VanDerWaalsContact C-N 3.29Å; Q139-F141 PolarHBondContact O-N 3.03Å; Q139-G142 PolarHBondContact O-N 2.72Å
140H97.2Very high95.5Very high92 Ų9236 Ų3643%0.42621%0.212SC..Hα-helixtrans-62-37.2178.7-173.464.9000112.7T102 S136 I137 Y138T102-H140 HydrophobicContact CG2-CB 3.57Å; T102-H140 PolarHBondContact O-CD2 3.32Å; T102-H140 PolarHBondContact O-NE2 3.25Å; S136-H140 WeakPolarHBondContact O-CB 3.47Å; S136-H140 PolarHBondContact O-N 3.43Å; I137-H140 WeakPolarHBondContact O-CB 3.47Å; I137-H140 PolarHBondContact O-N 2.87Å; I137-H140 VanDerWaalsContact O-N 3.15Å; Y138-H140 VanDerWaalsContact C-N 3.32Å; Y138-H140 PolarHBondContact O-N 3.13Å
141F95.8Very high95.5Very high54 Ų5435.9 Ų35.924%0.23721%0.211CC..THydrogen-bonded Turntrans-94.911.3-179.9-65.3-70000114.1T102 G105 R107 I137 Y138 Q139 C143T102-F141 HydrophobicContact CG2-CE2 4.16Å; G105-F141 WeakPolarHBondContact O-CE1 3.44Å; R107-F141 HydrophobicContact CB-CD1 4.03Å; R107-F141 HydrophobicContact CB-CD2 3.93Å; R107-F141 HydrophobicContact CB-CE1 3.8Å; R107-F141 HydrophobicContact CB-CE2 3.72Å; R107-F141 HydrophobicContact CB-CG 4.11Å; R107-F141 HydrophobicContact CB-CZ 3.65Å; R107-F141 HydrophobicContact CG-CD1 4.45Å; R107-F141 HydrophobicContact CG-CD2 3.8Å; R107-F141 HydrophobicContact CG-CE2 4.02Å; R107-F141 HydrophobicContact CG-CG 4.06Å; R107-F141 HydrophobicContact CG-CZ 4.43Å; I137-F141 HydrophobicContact CG2-CD2 3.94Å; I137-F141 HydrophobicContact CG2-CE2 4.08Å; I137-F141 WeakPolarHBondContact O-CD2 3.28Å; I137-F141 PolarHBondContact O-N 3.09Å; I137-F141 VanDerWaalsContact O-N 3.17Å; Y138-F141 CarbonylContact O-C 3.54Å; Y138-F141 PolarHBondContact O-N 3.45Å; Q139-F141 VanDerWaalsContact C-N 3.29Å; Q139-F141 PolarHBondContact O-N 3.03Å; F141-C143 PolarHBondContact O-N 3.16Å; F141-C143 PolarHBondContact O-SG 2.85Å; F141-C143 VanDerWaalsContact O-SG 3.41Å
142G91.8Very high95.4Very high57 Ų5736.9 Ų36.959%0.58822%0.216SC*.THydrogen-bonded Turntrans62.821.9179.400000114.9Y138 Q139 V144Y138-G142 PolarHBondContact O-N 3.33Å; Q139-G142 PolarHBondContact O-N 2.72Å; G142-V144 PolarHBondContact O-N 3.35Å; G142-V144 VanDerWaalsContact O-N 3.08Å
143C91.8Very high95.2Very high18 Ų1837.3 Ų37.312%0.12222%0.216CC..  trans-86.373.1-176.4-64.70000111.3R107 Y138 F141 G145 P146 Q147R107-C143 PolarHBondContact NH1-SG 3.24Å; R107-C143 PolarHBondContact NH2-SG 2.97Å; R107-C143 VanDerWaalsContact NH2-SG 3.43Å; Y138-C143 HydrophobicContact CD1-CB 3.74Å; Y138-C143 HydrophobicContact CG-CB 4.22Å; Y138-C143 PolarHBondContact O-N 2.75Å; F141-C143 PolarHBondContact O-N 3.16Å; F141-C143 PolarHBondContact O-SG 2.85Å; F141-C143 VanDerWaalsContact O-SG 3.41Å; C143-G145 PolarHBondContact O-N 2.72Å; C143-P146 WeakPolarHBondContact O-CD 3.42Å; C143-Q147 WeakPolarHBondContact O-CB 3.4Å; C143-Q147 PolarHBondContact O-N 3.43Å; C143-Q147 VanDerWaalsContact O-N 3.13Å
144V90.7Very high95Very high41 Ų4137.1 Ų37.125%0.24822%0.215CC..Hα-helixtrans-60-43.5-169.5-177.50000113.6G142 Q147 M148 T171 L175G142-V144 PolarHBondContact O-N 3.35Å; G142-V144 VanDerWaalsContact O-N 3.08Å; V144-Q147 WeakPolarHBondContact O-CB 3.47Å; V144-Q147 PolarHBondContact O-N 3.39Å; V144-M148 HydrophobicContact CG1-CG 4.18Å; V144-M148 HydrophobicContact CG1-SD 3.87Å; V144-M148 WeakPolarHBondContact O-CG 3.41Å; V144-M148 PolarHBondContact O-N 3.01Å; V144-T171 HydrophobicContact CG1-CG2 3.85Å; V144-L175 HydrophobicContact CG1-CB 4.2Å; V144-L175 HydrophobicContact CG1-CD1 4.22Å; V144-L175 HydrophobicContact CG1-CD2 4.05Å; V144-L175 HydrophobicContact CG1-CG 4.39Å
145G90.3Very high94.8Very high28 Ų2834.6 Ų34.629%0.28920%0.204SC..Hα-helixtrans-58.1-58.7-179.100000113.3C143 Q147 M148 S149C143-G145 PolarHBondContact O-N 2.72Å; G145-Q147 VanDerWaalsContact C-N 3.28Å; G145-Q147 PolarHBondContact O-N 2.88Å; G145-M148 PolarHBondContact O-N 2.93Å; G145-M148 VanDerWaalsContact O-N 3.16Å; G145-S149 PolarHBondContact O-N 3.28Å
146P93.4Very high94.5Very high45 Ų4534.3 Ų34.329%0.29220%0.203SC..Hα-helixtrans-59.7-33.9175.2-27.536000114.1Y138 C143 S149 C150Y138-P146 HydrophobicContact CD1-CB 3.77Å; Y138-P146 HydrophobicContact CD1-CG 4.48Å; Y138-P146 HydrophobicContact CD2-CB 3.67Å; Y138-P146 HydrophobicContact CE1-CB 3.6Å; Y138-P146 HydrophobicContact CE1-CG 4.29Å; Y138-P146 HydrophobicContact CE2-CB 3.49Å; Y138-P146 VanDerWaalsContact CE2-CB 3.49Å; Y138-P146 HydrophobicContact CG-CB 3.82Å; Y138-P146 VanDerWaalsContact CZ-CB 3.47Å; C143-P146 WeakPolarHBondContact O-CD 3.42Å; P146-S149 PolarHBondContact O-N 3.17Å; P146-C150 PolarHBondContact O-N 3.05Å; P146-C150 VanDerWaalsContact O-N 3.09Å; P146-C150 PolarHBondContact O-SG 3.44Å
147Q95Very high94.1Very high9 Ų931.5 Ų31.54%0.04218%0.183CC..Hα-helixtrans-61.2-48.4173.3-174.9-173.8-11.800111.3V135 C143 V144 G145 S149 C150 L151 T171V135-Q147 HydrophobicContact CG1-CG 4.15Å; C143-Q147 WeakPolarHBondContact O-CB 3.4Å; C143-Q147 PolarHBondContact O-N 3.43Å; C143-Q147 VanDerWaalsContact O-N 3.13Å; V144-Q147 WeakPolarHBondContact O-CB 3.47Å; V144-Q147 PolarHBondContact O-N 3.39Å; G145-Q147 VanDerWaalsContact C-N 3.28Å; G145-Q147 PolarHBondContact O-N 2.88Å; Q147-S149 VanDerWaalsContact C-N 3.34Å; Q147-S149 PolarHBondContact O-N 3.01Å; Q147-C150 PolarHBondContact O-N 3.28Å; Q147-L151 HydrophobicContact CG-CD1 4.15Å; Q147-L151 WeakPolarHBondContact O-CG 3.48Å; Q147-L151 PolarHBondContact O-N 2.84Å; Q147-T171 HydrophobicContact CG-CG2 4.4Å; Q147-T171 PolarHBondContact NE2-OG1 3.45Å
148M94.1Very high93.7Very high4 Ų433.1 Ų33.12%0.0219%0.191CC..Hα-helixtrans-60.6-42.9177.3-73177.86200111.6V144 G145 C150 L151 Q152 L168 T171 L175 L211V144-M148 HydrophobicContact CG1-CG 4.18Å; V144-M148 HydrophobicContact CG1-SD 3.87Å; V144-M148 WeakPolarHBondContact O-CG 3.41Å; V144-M148 PolarHBondContact O-N 3.01Å; G145-M148 PolarHBondContact O-N 2.93Å; G145-M148 VanDerWaalsContact O-N 3.16Å; M148-C150 VanDerWaalsContact C-N 3.35Å; M148-C150 PolarHBondContact O-N 3.44Å; M148-L151 PolarHBondContact O-N 2.93Å; M148-Q152 WeakPolarHBondContact O-CG 3.17Å; M148-Q152 PolarHBondContact O-N 3.4Å; M148-L168 HydrophobicContact CB-CD1 4.18Å; M148-L168 HydrophobicContact CG-CD1 4.18Å; M148-T171 HydrophobicContact CG-CG2 3.6Å; M148-T171 HydrophobicContact SD-CG2 4.45Å; M148-L175 HydrophobicContact SD-CD2 4.14Å; M148-L211 HydrophobicContact CE-CD2 4.31Å; M148-L211 HydrophobicContact SD-CD2 4.03Å
149S93.4Very high93.4Very high41 Ų4132.3 Ų32.329%0.28719%0.189SC..Hα-helixtrans-59.4-43.9176.5179.70000112.1G145 P146 Q147 L151 Q152 Q153G145-S149 PolarHBondContact O-N 3.28Å; P146-S149 PolarHBondContact O-N 3.17Å; Q147-S149 VanDerWaalsContact C-N 3.34Å; Q147-S149 PolarHBondContact O-N 3.01Å; S149-L151 PolarHBondContact O-N 3.42Å; S149-Q152 PolarHBondContact O-N 3.47Å; S149-Q153 WeakPolarHBondContact O-CG 3.45Å; S149-Q153 PolarHBondContact O-N 3.18Å
150C95.9Very high93.1Very high2 Ų228.4 Ų28.41%0.01417%0.17CC..Hα-helixtrans-64.8-39.2176.2-640000112.2L131 V135 P146 Q147 M148 Q153 L154L131-C150 HydrophobicContact CD2-CB 4.21Å; V135-C150 HydrophobicContact CG2-CB 3.6Å; P146-C150 PolarHBondContact O-N 3.05Å; P146-C150 VanDerWaalsContact O-N 3.09Å; P146-C150 PolarHBondContact O-SG 3.44Å; Q147-C150 PolarHBondContact O-N 3.28Å; M148-C150 VanDerWaalsContact C-N 3.35Å; M148-C150 PolarHBondContact O-N 3.44Å; C150-Q153 PolarHBondContact O-N 3.47Å; C150-L154 WeakPolarHBondContact O-CG 3.05Å; C150-L154 PolarHBondContact O-N 3.43Å
151L96.9Very high92.9Very high3 Ų326.3 Ų26.32%0.01616%0.163CC..Hα-helixtrans-67-38.3176.3-75.7167.6000112.5V135 Q147 M148 S149 L154 C155 L168 T171V135-L151 HydrophobicContact CG1-CD2 4.23Å; V135-L151 HydrophobicContact CG1-CG 4.34Å; V135-L151 HydrophobicContact CG2-CD2 3.98Å; V135-L151 HydrophobicContact CG2-CG 3.8Å; Q147-L151 HydrophobicContact CG-CD1 4.15Å; Q147-L151 WeakPolarHBondContact O-CG 3.48Å; Q147-L151 PolarHBondContact O-N 2.84Å; M148-L151 PolarHBondContact O-N 2.93Å; S149-L151 PolarHBondContact O-N 3.42Å; L151-L154 HydrophobicContact CD2-CD1 4.29Å; L151-L154 WeakPolarHBondContact O-CB 3.45Å; L151-L154 PolarHBondContact O-N 3.46Å; L151-C155 PolarHBondContact O-N 3.2Å; L151-C155 PolarHBondContact O-SG 3.45Å; L151-C155 VanDerWaalsContact O-SG 3.37Å; L151-L168 HydrophobicContact CB-CB 4.08Å; L151-L168 HydrophobicContact CB-CD1 3.89Å; L151-L168 HydrophobicContact CB-CG 4.42Å; L151-L168 HydrophobicContact CD1-CB 4.46Å; L151-L168 HydrophobicContact CD1-CD1 4.42Å; L151-T171 WeakPolarHBondContact CD1-OG1 3.41Å
152Q95Very high92.8Very high26 Ų2624 Ų2412%0.12115%0.153CC..Hα-helixtrans-62.1-42.9172.9-74171.2-46.600111.5M148 S149 L154 C155 S156 L168 F301M148-Q152 WeakPolarHBondContact O-CG 3.17Å; M148-Q152 PolarHBondContact O-N 3.4Å; S149-Q152 PolarHBondContact O-N 3.47Å; Q152-L154 VanDerWaalsContact C-N 3.34Å; Q152-L154 PolarHBondContact O-N 3.17Å; Q152-C155 WeakPolarHBondContact O-CB 3.48Å; Q152-C155 PolarHBondContact O-N 2.91Å; Q152-S156 PolarHBondContact O-N 3.03Å; Q152-L168 HydrophobicContact CG-CD1 4.35Å; Q152-L168 HydrophobicContact CG-CD2 3.79Å; Q152-F301 HydrophobicContact CB-CB 4Å; Q152-F301 HydrophobicContact CB-CD1 4.44Å; Q152-F301 HydrophobicContact CB-CD2 3.94Å; Q152-F301 HydrophobicContact CB-CG 3.88Å; Q152-F301 HydrophobicContact CG-CD1 4.06Å; Q152-F301 HydrophobicContact CG-CD2 4.03Å; Q152-F301 HydrophobicContact CG-CE1 4.26Å; Q152-F301 HydrophobicContact CG-CE2 4.2Å; Q152-F301 HydrophobicContact CG-CG 3.95Å; Q152-F301 HydrophobicContact CG-CZ 4.32Å
153Q93.8Very high92.9Very high87 Ų8724.2 Ų24.241%0.40714%0.136SC..Hα-helixtrans-61.7-41.3173.9-70.4178.25100111.7L131 S149 C150 C155 S156 L157L131-Q153 HydrophobicContact CD1-CB 3.8Å; L131-Q153 HydrophobicContact CD2-CB 4.07Å; S149-Q153 WeakPolarHBondContact O-CG 3.45Å; S149-Q153 PolarHBondContact O-N 3.18Å; C150-Q153 PolarHBondContact O-N 3.47Å; Q153-C155 VanDerWaalsContact C-N 3.34Å; Q153-C155 PolarHBondContact O-N 3.25Å; Q153-S156 PolarHBondContact O-N 3.15Å; Q153-L157 VanDerWaalsContact O-CB 3.28Å; Q153-L157 WeakPolarHBondContact O-CB 3.4Å; Q153-L157 PolarHBondContact O-N 3.39Å
154L94.1Very high93.1Very high0 Ų024 Ų240%013%0.133CC..Hα-helixtrans-63-38.4173.9-77.2166.7000112.6T128 L131 L132 V135 C150 L151 Q152 L157 L158 H164T128-L154 HydrophobicContact CG2-CD2 4Å; L131-L154 HydrophobicContact CB-CD1 4.07Å; L131-L154 HydrophobicContact CB-CD2 3.75Å; L131-L154 HydrophobicContact CB-CG 3.7Å; L131-L154 HydrophobicContact CD1-CD2 4.03Å; L131-L154 HydrophobicContact CD1-CG 4.02Å; L131-L154 HydrophobicContact CG-CG 4.49Å; L132-L154 HydrophobicContact CD2-CD1 3.79Å; L132-L154 HydrophobicContact CG-CD1 4.2Å; L132-L154 HydrophobicContact CG-CD2 4.31Å; V135-L154 HydrophobicContact CG2-CD1 4.17Å; C150-L154 WeakPolarHBondContact O-CG 3.05Å; C150-L154 PolarHBondContact O-N 3.43Å; L151-L154 HydrophobicContact CD2-CD1 4.29Å; L151-L154 WeakPolarHBondContact O-CB 3.45Å; L151-L154 PolarHBondContact O-N 3.46Å; Q152-L154 VanDerWaalsContact C-N 3.34Å; Q152-L154 PolarHBondContact O-N 3.17Å; L154-L157 PolarHBondContact O-N 3.44Å; L154-L158 PolarHBondContact O-N 3.18Å; L154-H164 HydrophobicContact CB-CB 4.14Å
155C93.9Very high93.5Very high0 Ų022.1 Ų22.10%012%0.122CC..Hα-helixtrans-65.6-39.2173.9-73.60000112L151 Q152 Q153 L158 P159 W165 F301 W305L151-C155 PolarHBondContact O-N 3.2Å; L151-C155 PolarHBondContact O-SG 3.45Å; L151-C155 VanDerWaalsContact O-SG 3.37Å; Q152-C155 WeakPolarHBondContact O-CB 3.48Å; Q152-C155 PolarHBondContact O-N 2.91Å; Q153-C155 VanDerWaalsContact C-N 3.34Å; Q153-C155 PolarHBondContact O-N 3.25Å; C155-L158 CarbonylContact O-C 3.49Å; C155-P159 WeakPolarHBondContact O-CA 3.44Å; C155-W165 HydrophobicContact CB-CD2 4.11Å; C155-W165 HydrophobicContact CB-CE3 4.25Å; C155-W165 HydrophobicContact CB-CH2 3.88Å; C155-W165 HydrophobicContact CB-CZ2 3.71Å; C155-W165 HydrophobicContact CB-CZ3 4.16Å; C155-F301 HydrophobicContact CB-CD2 4.06Å; C155-F301 HydrophobicContact CB-CE2 4.08Å; C155-W305 WeakPolarHBondContact O-CH2 3.34Å
156S91.7Very high93.8Very high11 Ų1121.6 Ų21.68%0.07711%0.112CC..Hα-helixtrans-66.7-42.3173.6-770000112.9Q152 Q153 Q299 F301Q152-S156 PolarHBondContact O-N 3.03Å; Q153-S156 PolarHBondContact O-N 3.15Å; S156-Q299 PolarHBondContact OG-O 3.49Å; S156-F301 VanDerWaalsContact OG-CA 3.28Å; S156-F301 WeakPolarHBondContact OG-CA 3.46Å; S156-F301 PolarHBondContact OG-N 3.15Å
157L89.9Confident94.1Very high2 Ų221.4 Ų21.41%0.0111%0.111CC..Hα-helixtrans-71.9-37.6-178-175.560.6000112.3T124 L127 T128 L131 Q153 L154 L298T124-L157 HydrophobicContact CG2-CD1 3.86Å; L127-L157 HydrophobicContact CB-CD2 4.28Å; L127-L157 HydrophobicContact CD2-CD1 4.47Å; L127-L157 HydrophobicContact CD2-CD2 4.04Å; L127-L157 HydrophobicContact CG-CD2 4Å; T128-L157 WeakPolarHBondContact OG1-CD2 3.39Å; L131-L157 HydrophobicContact CD1-CD2 4.33Å; Q153-L157 VanDerWaalsContact O-CB 3.28Å; Q153-L157 WeakPolarHBondContact O-CB 3.4Å; Q153-L157 PolarHBondContact O-N 3.39Å; L154-L157 PolarHBondContact O-N 3.44Å; L157-L298 HydrophobicContact CD1-CD1 3.96Å; L157-L298 HydrophobicContact CD1-CD2 3.65Å; L157-L298 HydrophobicContact CD1-CG 4.44Å
158L90.3Very high94.2Very high34 Ų3421 Ų2118%0.17811%0.109CC..SBendtrans-13067.8-176.3-64.9167.4000109.6T128 L154 C155 F160 N161T128-L158 HydrophobicContact CG2-CD1 3.69Å; L154-L158 PolarHBondContact O-N 3.18Å; C155-L158 CarbonylContact O-C 3.49Å; L158-F160 PolarHBondContact O-N 3.37Å; L158-N161 HydrophobicContact CB-CB 3.97Å; L158-N161 WeakPolarHBondContact O-CB 3.25Å; L158-N161 PolarHBondContact O-N 2.89Å
159P90.6Very high94.4Very high10 Ų1020.8 Ų20.87%0.06511%0.108CC..THydrogen-bonded Turntrans-61.8-22-170.226.1-37.2000114.3C155 W165 R226 W305C155-P159 WeakPolarHBondContact O-CA 3.44Å; P159-W165 PolarHBondContact O-NE1 3.43Å; P159-R226 PolarHBondContact O-NH2 3.48Å; P159-W305 HydrophobicContact CB-CH2 3.9Å; P159-W305 HydrophobicContact CB-CZ2 3.85Å
160F90.7Very high94.6Very high32 Ų3222.3 Ų22.314%0.1411%0.111CC..THydrogen-bonded Turntrans-100.11.1-178.1-52.9-45.2000113.7L158 P162 L230 L278 M283 D286L158-F160 PolarHBondContact O-N 3.37Å; F160-P162 VanDerWaalsContact O-CD 3.25Å; F160-P162 WeakPolarHBondContact O-CD 3.44Å; F160-L230 HydrophobicContact CB-CD2 4.36Å; F160-L230 HydrophobicContact CD1-CD2 4.34Å; F160-L278 HydrophobicContact CD1-CD2 4.03Å; F160-L278 HydrophobicContact CE1-CD2 4.16Å; F160-M283 HydrophobicContact CB-CE 3.98Å; F160-M283 HydrophobicContact CD1-CE 3.92Å; F160-M283 HydrophobicContact CD1-CG 3.79Å; F160-M283 HydrophobicContact CD1-SD 4.24Å; F160-M283 HydrophobicContact CD2-CB 4.35Å; F160-M283 HydrophobicContact CD2-CG 4.14Å; F160-M283 HydrophobicContact CE1-CG 3.73Å; F160-M283 HydrophobicContact CE1-SD 4.48Å; F160-M283 HydrophobicContact CE2-CB 4.45Å; F160-M283 HydrophobicContact CE2-CG 4.08Å; F160-M283 HydrophobicContact CG-CE 4.01Å; F160-M283 HydrophobicContact CG-CG 4Å; F160-M283 HydrophobicContact CZ-CG 3.88Å; F160-D286 HydrophobicContact CE2-CB 3.9Å
161N91.1Very high94.6Very high49 Ų4922.4 Ų22.426%0.26211%0.111SC..  trans-85.3108.7175.3-174.2-35.3000110.3L158 W163 H164 W165L158-N161 HydrophobicContact CB-CB 3.97Å; L158-N161 WeakPolarHBondContact O-CB 3.25Å; L158-N161 PolarHBondContact O-N 2.89Å; N161-W163 PolarHBondContact O-N 3.22Å; N161-W163 WeakPolarHBondContact OD1-CB 3.41Å; N161-W163 PolarHBondContact OD1-N 3.24Å; N161-H164 PolarHBondContact ND2-CE1 3.13Å; N161-W165 VanDerWaalsContact O-CD1 3.24Å
162P94.1Very high94.6Very high6 Ų622.2 Ų22.24%0.03911%0.111CC..Hα-helixtrans-64.8-23.5-175.825.9-34.6000113.6F160 F166 L230 L231 L234F160-P162 VanDerWaalsContact O-CD 3.25Å; F160-P162 WeakPolarHBondContact O-CD 3.44Å; P162-F166 WeakPolarHBondContact O-CB 3.34Å; P162-F166 PolarHBondContact O-N 3.4Å; P162-L230 HydrophobicContact CB-CB 3.88Å; P162-L230 HydrophobicContact CB-CD1 4.3Å; P162-L231 HydrophobicContact CB-CD2 3.73Å; P162-L231 HydrophobicContact CB-CG 3.82Å; P162-L231 HydrophobicContact CG-CD2 3.62Å; P162-L231 HydrophobicContact CG-CG 4.28Å; P162-L234 HydrophobicContact CG-CD1 4.19Å
163W95.1Very high94.5Very high61 Ų6122.3 Ų22.323%0.23111%0.112CC..Hα-helixtrans-75.5-32.1-171.3-52.8109.9000112.8N161 S167 L231 R245 T249N161-W163 PolarHBondContact O-N 3.22Å; N161-W163 WeakPolarHBondContact OD1-CB 3.41Å; N161-W163 PolarHBondContact OD1-N 3.24Å; W163-S167 WeakPolarHBondContact O-CB 3.46Å; W163-S167 PolarHBondContact O-N 3.07Å; W163-S167 PolarHBondContact O-OG 2.8Å; W163-L231 HydrophobicContact CH2-CD2 4.38Å; W163-L231 HydrophobicContact CZ2-CD2 4.32Å; W163-R245 HydrophobicContact CH2-CG 3.7Å; W163-R245 HydrophobicContact CZ2-CG 4.38Å; W163-R245 HydrophobicContact CZ3-CG 4.28Å; W163-T249 HydrophobicContact CE3-CG2 4.45Å; W163-T249 HydrophobicContact CZ3-CG2 3.77Å; W163-T249 VanDerWaalsContact CZ3-OG1 3.27Å; W163-T249 WeakPolarHBondContact CZ3-OG1 3.27Å
164H95.9Very high94.5Very high14 Ų1423 Ų237%0.06512%0.115CC..Hα-helixtrans-69.6-43.5175.4-58.3146.6000111L154 N161 F166 S167 L168L154-H164 HydrophobicContact CB-CB 4.14Å; N161-H164 PolarHBondContact ND2-CE1 3.13Å; H164-F166 PolarHBondContact O-N 3.18Å; H164-S167 PolarHBondContact O-N 3.34Å; H164-L168 WeakPolarHBondContact O-CB 3.38Å; H164-L168 PolarHBondContact O-N 2.89Å
165W97.8Very high94.3Very high0 Ų024.2 Ų24.20%012%0.121CC..Hα-helixtrans-59-46.5172.8-67.5106.5000111.7C155 P159 N161 S167 L168 G169 M222 C223 R226 T227 L230 M274 F301 W305C155-W165 HydrophobicContact CB-CD2 4.11Å; C155-W165 HydrophobicContact CB-CE3 4.25Å; C155-W165 HydrophobicContact CB-CH2 3.88Å; C155-W165 HydrophobicContact CB-CZ2 3.71Å; C155-W165 HydrophobicContact CB-CZ3 4.16Å; P159-W165 PolarHBondContact O-NE1 3.43Å; N161-W165 VanDerWaalsContact O-CD1 3.24Å; W165-S167 VanDerWaalsContact C-N 3.34Å; W165-S167 PolarHBondContact O-N 2.97Å; W165-L168 PolarHBondContact O-N 3.01Å; W165-G169 PolarHBondContact O-N 3.05Å; W165-M222 HydrophobicContact CZ3-CE 3.97Å; W165-C223 WeakPolarHBondContact O-CB 3.42Å; W165-R226 HydrophobicContact CB-CG 4.41Å; W165-R226 HydrophobicContact CD2-CB 4.04Å; W165-R226 HydrophobicContact CD2-CG 3.45Å; W165-R226 VanDerWaalsContact CD2-CG 3.45Å; W165-R226 HydrophobicContact CE3-CB 4.11Å; W165-R226 HydrophobicContact CE3-CG 3.93Å; W165-R226 HydrophobicContact CG-CB 4.23Å; W165-R226 HydrophobicContact CG-CG 3.66Å; W165-R226 HydrophobicContact CH2-CG 4.46Å; W165-R226 HydrophobicContact CZ2-CG 4.05Å; W165-R226 HydrophobicContact CZ3-CG 4.4Å; W165-T227 WeakPolarHBondContact CB-OG1 3.28Å; W165-L230 HydrophobicContact CG-CD1 4.46Å; W165-M274 HydrophobicContact CE3-CE 4.22Å; W165-M274 HydrophobicContact CH2-CE 3.57Å; W165-M274 HydrophobicContact CZ2-CE 4.19Å; W165-M274 HydrophobicContact CZ3-CE 3.58Å; W165-F301 HydrophobicContact CE3-CE2 4.48Å; W165-F301 HydrophobicContact CH2-CD2 4.3Å; W165-F301 AromaticContact CH2-CE2 3.62Å; W165-F301 HydrophobicContact CH2-CE2 3.62Å; W165-F301 HydrophobicContact CH2-CZ 4.41Å; W165-F301 AromaticContact CZ3-CE2 3.46Å; W165-F301 HydrophobicContact CZ3-CE2 3.46Å; W165-F301 VanDerWaalsContact CZ3-CE2 3.46Å; W165-F301 AromaticContact CZ3-CZ 3.98Å; W165-F301 HydrophobicContact CZ3-CZ 3.98Å; W165-W305 AromaticContact CH2-CD2 3.77Å; W165-W305 HydrophobicContact CH2-CD2 3.77Å; W165-W305 AromaticContact CH2-CE3 3.65Å; W165-W305 HydrophobicContact CH2-CE3 3.65Å; W165-W305 HydrophobicContact CH2-CG 4.43Å; W165-W305 HydrophobicContact CH2-CH2 4.02Å; W165-W305 HydrophobicContact CH2-CZ2 4.14Å; W165-W305 AromaticContact CH2-CZ3 3.78Å; W165-W305 HydrophobicContact CH2-CZ3 3.78Å; W165-W305 HydrophobicContact CZ2-CD2 4.25Å; W165-W305 HydrophobicContact CZ2-CE3 4.17Å; W165-W305 AromaticContact CZ2-CH2 3.66Å; W165-W305 HydrophobicContact CZ2-CH2 3.66Å; W165-W305 AromaticContact CZ2-CZ2 3.74Å; W165-W305 HydrophobicContact CZ2-CZ2 3.74Å; W165-W305 AromaticContact CZ2-CZ3 3.89Å; W165-W305 HydrophobicContact CZ2-CZ3 3.89Å
166F98.3Very high94.3Very high18 Ų1825 Ų258%0.07913%0.125CC..Hα-helixtrans-59.6-46.4177.1-178.2-109.2000111.4P162 H164 L168 G169 Q170 F224 T227 T249 I252P162-F166 WeakPolarHBondContact O-CB 3.34Å; P162-F166 PolarHBondContact O-N 3.4Å; H164-F166 PolarHBondContact O-N 3.18Å; F166-L168 VanDerWaalsContact C-N 3.35Å; F166-L168 PolarHBondContact O-N 2.99Å; F166-G169 PolarHBondContact O-N 3.03Å; F166-Q170 HydrophobicContact CD1-CG 4.29Å; F166-Q170 HydrophobicContact CE1-CG 3.95Å; F166-Q170 HydrophobicContact CE2-CG 4.22Å; F166-Q170 VanDerWaalsContact CZ-CD 3.43Å; F166-Q170 HydrophobicContact CZ-CG 3.91Å; F166-Q170 WeakPolarHBondContact O-CG 3.35Å; F166-Q170 PolarHBondContact O-N 3.07Å; F166-F224 HydrophobicContact CD2-CD1 4.31Å; F166-F224 HydrophobicContact CD2-CE1 4.02Å; F166-F224 HydrophobicContact CE2-CE1 4.05Å; F166-T227 WeakPolarHBondContact CA-OG1 3.41Å; F166-T227 HydrophobicContact CB-CG2 3.75Å; F166-T227 HydrophobicContact CD2-CG2 4Å; F166-T227 HydrophobicContact CG-CG2 4.28Å; F166-T227 PolarHBondContact N-OG1 3.46Å; F166-T249 HydrophobicContact CD1-CG2 4.09Å; F166-T249 HydrophobicContact CD2-CG2 3.66Å; F166-T249 HydrophobicContact CE1-CG2 4.11Å; F166-T249 HydrophobicContact CE2-CG2 3.7Å; F166-T249 HydrophobicContact CG-CG2 3.86Å; F166-T249 HydrophobicContact CZ-CG2 3.92Å; F166-I252 HydrophobicContact CE2-CB 4.39Å; F166-I252 HydrophobicContact CE2-CG2 3.95Å; F166-I252 HydrophobicContact CZ-CB 4.38Å; F166-I252 HydrophobicContact CZ-CG2 3.84Å
167S98Very high94.1Very high41 Ų4126.6 Ų26.629%0.28713%0.133SC..Hα-helixtrans-63.8-38.8179.8-56.90000112.2W163 H164 W165 Q170 T171W163-S167 WeakPolarHBondContact O-CB 3.46Å; W163-S167 PolarHBondContact O-N 3.07Å; W163-S167 PolarHBondContact O-OG 2.8Å; H164-S167 PolarHBondContact O-N 3.34Å; W165-S167 VanDerWaalsContact C-N 3.34Å; W165-S167 PolarHBondContact O-N 2.97Å; S167-Q170 PolarHBondContact O-N 3.05Å; S167-T171 WeakPolarHBondContact O-CB 3.49Å; S167-T171 PolarHBondContact O-N 3.09Å; S167-T171 PolarHBondContact O-OG1 3.09Å
168L97.9Very high93.8Very high0 Ų030.1 Ų30.10%016%0.157CC..Hα-helixtrans-64.6-44.8174-176.354.2000111.5M148 L151 Q152 H164 W165 F166 T171 C172 C223 F301M148-L168 HydrophobicContact CB-CD1 4.18Å; M148-L168 HydrophobicContact CG-CD1 4.18Å; L151-L168 HydrophobicContact CB-CB 4.08Å; L151-L168 HydrophobicContact CB-CD1 3.89Å; L151-L168 HydrophobicContact CB-CG 4.42Å; L151-L168 HydrophobicContact CD1-CB 4.46Å; L151-L168 HydrophobicContact CD1-CD1 4.42Å; Q152-L168 HydrophobicContact CG-CD1 4.35Å; Q152-L168 HydrophobicContact CG-CD2 3.79Å; H164-L168 WeakPolarHBondContact O-CB 3.38Å; H164-L168 PolarHBondContact O-N 2.89Å; W165-L168 PolarHBondContact O-N 3.01Å; F166-L168 VanDerWaalsContact C-N 3.35Å; F166-L168 PolarHBondContact O-N 2.99Å; L168-T171 PolarHBondContact O-N 3.5Å; L168-C172 PolarHBondContact O-N 3.33Å; L168-C172 PolarHBondContact O-SG 2.96Å; L168-C223 VanDerWaalsContact CD2-SG 3.56Å; L168-C223 VanDerWaalsContact CG-SG 3.56Å; L168-F301 HydrophobicContact CD2-CE2 4.02Å; L168-F301 HydrophobicContact CD2-CZ 4.15Å
169G97.8Very high93Very high0 Ų031.5 Ų31.50%017%0.165CC..Hα-helixtrans-60.4-44.3175.500000112.8W165 F166 T171 C172 L173W165-G169 PolarHBondContact O-N 3.05Å; F166-G169 PolarHBondContact O-N 3.03Å; G169-T171 PolarHBondContact O-N 3.12Å; G169-C172 PolarHBondContact O-N 3.02Å; G169-L173 PolarHBondContact O-N 2.93Å
170Q97.3Very high91.6Very high72 Ų7234.1 Ų34.134%0.33618%0.183SC..Hα-helixtrans-62.5-41.8174.9-72.3-171.2-57.400112.5F166 S167 C172 L173 Q174 F224F166-Q170 HydrophobicContact CD1-CG 4.29Å; F166-Q170 HydrophobicContact CE1-CG 3.95Å; F166-Q170 HydrophobicContact CE2-CG 4.22Å; F166-Q170 VanDerWaalsContact CZ-CD 3.43Å; F166-Q170 HydrophobicContact CZ-CG 3.91Å; F166-Q170 WeakPolarHBondContact O-CG 3.35Å; F166-Q170 PolarHBondContact O-N 3.07Å; S167-Q170 PolarHBondContact O-N 3.05Å; Q170-C172 VanDerWaalsContact C-N 3.32Å; Q170-C172 PolarHBondContact O-N 3.39Å; Q170-L173 PolarHBondContact O-N 3.44Å; Q170-Q174 VanDerWaalsContact O-CG 3.32Å; Q170-Q174 WeakPolarHBondContact O-CG 3.42Å; Q170-Q174 PolarHBondContact O-N 3.16Å; Q170-F224 HydrophobicContact CG-CE1 4.36Å; Q170-F224 HydrophobicContact CG-CZ 4.38Å
171T96.4Very high89.9Confident4 Ų437.9 Ų37.93%0.02520%0.204CC..Hα-helixtrans-63-40.8177.3-55.50000110.8V144 Q147 M148 L151 S167 L168 G169 L175V144-T171 HydrophobicContact CG1-CG2 3.85Å; Q147-T171 HydrophobicContact CG-CG2 4.4Å; Q147-T171 PolarHBondContact NE2-OG1 3.45Å; M148-T171 HydrophobicContact CG-CG2 3.6Å; M148-T171 HydrophobicContact SD-CG2 4.45Å; L151-T171 WeakPolarHBondContact CD1-OG1 3.41Å; S167-T171 WeakPolarHBondContact O-CB 3.49Å; S167-T171 PolarHBondContact O-N 3.09Å; S167-T171 PolarHBondContact O-OG1 3.09Å; L168-T171 PolarHBondContact O-N 3.5Å; G169-T171 PolarHBondContact O-N 3.12Å; T171-L175 PolarHBondContact O-N 3.27Å; T171-L175 VanDerWaalsContact O-N 3.12Å
172C96.1Very high87.9Confident0 Ų041.8 Ų41.80%022%0.223CC..Hα-helixtrans-64-44174.5-62.70000111.5L168 G169 Q170 Q174 L175 L176 V216 A220L168-C172 PolarHBondContact O-N 3.33Å; L168-C172 PolarHBondContact O-SG 2.96Å; G169-C172 PolarHBondContact O-N 3.02Å; Q170-C172 VanDerWaalsContact C-N 3.32Å; Q170-C172 PolarHBondContact O-N 3.39Å; C172-Q174 PolarHBondContact O-N 3.34Å; C172-L175 WeakPolarHBondContact O-CB 3.41Å; C172-L175 PolarHBondContact O-N 2.89Å; C172-L176 WeakPolarHBondContact O-CG 3.46Å; C172-L176 PolarHBondContact O-N 3.46Å; C172-V216 HydrophobicContact CB-CG1 3.86Å; C172-V216 WeakPolarHBondContact O-CG1 3.5Å; C172-A220 HydrophobicContact CB-CB 3.66Å
173L94.4Very high85.6Confident28 Ų2850.3 Ų50.315%0.14726%0.262CS..Hα-helixtrans-63.4-42.5179.2-169.965.1000112G169 Q170 L175 L176 D177 F224 A256 L260G169-L173 PolarHBondContact O-N 2.93Å; Q170-L173 PolarHBondContact O-N 3.44Å; L173-L175 VanDerWaalsContact C-N 3.27Å; L173-L175 PolarHBondContact O-N 3.47Å; L173-L176 PolarHBondContact O-N 2.76Å; L173-D177 PolarHBondContact O-N 2.98Å; L173-F224 HydrophobicContact CB-CE2 4.43Å; L173-F224 HydrophobicContact CD2-CE2 4.48Å; L173-F224 HydrophobicContact CD2-CZ 4.43Å; L173-A256 HydrophobicContact CD2-CB 4.32Å; L173-L260 HydrophobicContact CD1-CD2 4Å; L173-L260 HydrophobicContact CD1-CG 4.34Å
174Q92.6Very high83.1Confident100 Ų10053.2 Ų53.247%0.46729%0.287SS..Hα-helixtrans-59-39.5173.8-74.1171.2-5.100112Q170 C172 D177 C178Q170-Q174 VanDerWaalsContact O-CG 3.32Å; Q170-Q174 WeakPolarHBondContact O-CG 3.42Å; Q170-Q174 PolarHBondContact O-N 3.16Å; C172-Q174 PolarHBondContact O-N 3.34Å; Q174-D177 PolarHBondContact O-N 3.47Å; Q174-C178 PolarHBondContact O-N 3.48Å; Q174-C178 PolarHBondContact O-SG 3.31Å
175L91.2Very high80.2Confident27 Ų2759.6 Ų59.614%0.14132%0.318CS..Hα-helixtrans-66.4-40.1177.5-176.159.4000112.2V144 M148 T171 C172 L173 D177 N179 L211 V216V144-L175 HydrophobicContact CG1-CB 4.2Å; V144-L175 HydrophobicContact CG1-CD1 4.22Å; V144-L175 HydrophobicContact CG1-CD2 4.05Å; V144-L175 HydrophobicContact CG1-CG 4.39Å; M148-L175 HydrophobicContact SD-CD2 4.14Å; T171-L175 PolarHBondContact O-N 3.27Å; T171-L175 VanDerWaalsContact O-N 3.12Å; C172-L175 WeakPolarHBondContact O-CB 3.41Å; C172-L175 PolarHBondContact O-N 2.89Å; L173-L175 VanDerWaalsContact C-N 3.27Å; L173-L175 PolarHBondContact O-N 3.47Å; L175-D177 VanDerWaalsContact C-N 3.33Å; L175-N179 VanDerWaalsContact O-CG 3.25Å; L175-N179 PolarHBondContact O-N 3.14Å; L175-N179 VanDerWaalsContact O-N 3.1Å; L175-N179 PolarHBondContact O-ND2 3.35Å; L175-L211 HydrophobicContact CD2-CD2 3.99Å; L175-V216 HydrophobicContact CB-CG1 4.23Å; L175-V216 HydrophobicContact CD2-CG1 4.01Å; L175-V216 HydrophobicContact CD2-CG2 3.8Å; L175-V216 HydrophobicContact CG-CG1 4.34Å
176L92.2Very high77.5Confident16 Ų1664.5 Ų64.58%0.08435%0.352CS..Hα-helixtrans-62.2-42.5174.3-65169.9000111.3C172 L173 N179 S180 E213 V216 W217 L260C172-L176 WeakPolarHBondContact O-CG 3.46Å; C172-L176 PolarHBondContact O-N 3.46Å; L173-L176 PolarHBondContact O-N 2.76Å; L176-N179 PolarHBondContact O-N 3.06Å; L176-S180 PolarHBondContact O-N 3.36Å; L176-E213 HydrophobicContact CD2-CG 3.66Å; L176-V216 HydrophobicContact CD1-CG1 4.44Å; L176-V216 HydrophobicContact CD2-CB 4Å; L176-V216 HydrophobicContact CD2-CG1 3.84Å; L176-V216 HydrophobicContact CG-CG1 3.81Å; L176-W217 HydrophobicContact CD1-CB 4.25Å; L176-W217 HydrophobicContact CD2-CB 4.39Å; L176-L260 HydrophobicContact CD1-CD2 3.87Å
177D89.2Confident74.4Confident45 Ų4572.6 Ų72.624%0.24139%0.387CS..Hα-helixtrans-62.8-47.8179.3-65.3-6.5000111.1L173 Q174 L175 N179 S180 D181 R259L173-D177 PolarHBondContact O-N 2.98Å; Q174-D177 PolarHBondContact O-N 3.47Å; L175-D177 VanDerWaalsContact C-N 3.33Å; D177-N179 VanDerWaalsContact C-N 3.27Å; D177-N179 PolarHBondContact O-N 2.98Å; D177-S180 PolarHBondContact O-N 2.95Å; D177-S180 VanDerWaalsContact O-N 3.16Å; D177-S180 PolarHBondContact O-OG 2.95Å; D177-D181 PolarHBondContact O-N 3.23Å; D177-R259 VanDerWaalsContact CG-NH2 3.29Å; D177-R259 IonicContact OD1-CZ 2.72Å; D177-R259 IonicContact OD1-NH1 3.26Å; D177-R259 PolarHBondContact OD1-NH1 2.96Å; D177-R259 VanDerWaalsContact OD1-NH1 3.08Å; D177-R259 IonicContact OD1-NH2 3.35Å; D177-R259 PolarHBondContact OD1-NH2 2.89Å; D177-R259 IonicContact OD2-CZ 3.59Å; D177-R259 IonicContact OD2-NH1 2.81Å; D177-R259 PolarHBondContact OD2-NH1 3.24Å; D177-R259 IonicContact OD2-NH2 3.46Å; D177-R259 PolarHBondContact OD2-NH2 3.24Å
178C83.7Confident71.1Confident75 Ų7576.4 Ų76.451%0.50741%0.413SS..Hα-helixtrans-61.5-34176.9-69.60000113.1Q174 D181 M182Q174-C178 PolarHBondContact O-N 3.48Å; Q174-C178 PolarHBondContact O-SG 3.31Å; C178-D181 PolarHBondContact O-N 3.25Å; C178-M182 PolarHBondContact O-N 3.04Å
179N72.1Confident67.9Low64 Ų6483 Ų8334%0.34245%0.452SS..Hα-helixtrans-71.8-35.5177.1-71.9-16.7000111.9L175 L176 D177 D181 M182L175-N179 VanDerWaalsContact O-CG 3.25Å; L175-N179 PolarHBondContact O-N 3.14Å; L175-N179 VanDerWaalsContact O-N 3.1Å; L175-N179 PolarHBondContact O-ND2 3.35Å; L176-N179 PolarHBondContact O-N 3.06Å; D177-N179 VanDerWaalsContact C-N 3.27Å; D177-N179 PolarHBondContact O-N 2.98Å; N179-D181 VanDerWaalsContact C-N 3.29Å; N179-D181 PolarHBondContact O-N 2.92Å; N179-M182 PolarHBondContact O-N 3.36Å
180S62.1Low64.9Low64 Ų6488.4 Ų88.445%0.44849%0.487SS..Hα-helixtrans-66.8-28.4174.562.70000113.5L176 D177L176-S180 PolarHBondContact O-N 3.36Å; D177-S180 PolarHBondContact O-N 2.95Å; D177-S180 VanDerWaalsContact O-N 3.16Å; D177-S180 PolarHBondContact O-OG 2.95Å
181D54.9Low61.6Low111 Ų11193.8 Ų93.859%0.59451%0.513SS*.Hα-helixtrans-78.9-23.7176.4-70.3-28.7000112.9D177 C178 N179 E183 T184D177-D181 PolarHBondContact O-N 3.23Å; C178-D181 PolarHBondContact O-N 3.25Å; N179-D181 VanDerWaalsContact C-N 3.29Å; N179-D181 PolarHBondContact O-N 2.92Å; D181-E183 VanDerWaalsContact C-N 3.27Å; D181-E183 PolarHBondContact O-N 3.12Å; D181-T184 PolarHBondContact O-N 2.73Å
182M49.6Very low58.8Low132 Ų132105.3 Ų105.365%0.6556%0.556SS**THydrogen-bonded Turntrans-71-16.2178.2-85.1-79-165.500113.8C178 N179 T184C178-M182 PolarHBondContact O-N 3.04Å; N179-M182 PolarHBondContact O-N 3.36Å; M182-T184 PolarHBondContact O-N 3.14Å
183E44.5Very low55.6Low184 Ų184110.8 Ų110.886%0.8659%0.594SS**THydrogen-bonded Turntrans-68.4-13.1166.9-74.7-167.3152.600112.5D181D181-E183 VanDerWaalsContact C-N 3.27Å; D181-E183 PolarHBondContact O-N 3.12Å
184T43.3Very low52.7Low123 Ų123114.9 Ų114.976%0.75563%0.625SS**THydrogen-bonded Turntrans-110.5-11.1-179-55.20000114.6D181 M182D181-T184 PolarHBondContact O-N 2.73Å; M182-T184 PolarHBondContact O-N 3.14Å
185M35Very low49.6Very low147 Ų147119.1 Ų119.172%0.72465%0.645SS**  trans-139.193.4-178.9-90.7-88.3-172.300112.1
186C40.8Very low46.8Very low104 Ų104122.4 Ų122.470%0.70368%0.676SS**  trans-68.9143.5163.7-1670000110.3
187F33.3Very low43.9Very low188 Ų188128.6 Ų128.683%0.82571%0.708SS**  trans83.1101.7175.8-62.6-85.4000117.1
188C28.9Very low41.1Very low121 Ų121136.5 Ų136.582%0.81874%0.741SS**  -179.282122-85.50000108.8P190C188-P190 WeakPolarHBondContact O-CD 3.46Å
189V31.4Very low38.6Very low138 Ų138136.4 Ų136.484%0.83675%0.752SS**  trans-87.4115160.5178.50000106E191V189-E191 PolarHBondContact O-N 2.93Å
190P33.3Very low36.7Very low113 Ų113140.8 Ų140.873%0.73477%0.77SS**  trans-68.6124.8165.4-7.224000107.1C188 R192C188-P190 WeakPolarHBondContact O-CD 3.46Å; P190-R192 PolarHBondContact O-N 3.2Å
191E28.7Very low35.7Very low186 Ų186141.6 Ų141.687%0.86978%0.776SS**  trans-46.3128.9172.9-69.6178.4146.500110.2V189 S193V189-E191 PolarHBondContact O-N 2.93Å; E191-S193 PolarHBondContact O-N 2.9Å
192R37.2Very low34.6Very low245 Ų245144.9 Ų144.993%0.92579%0.788SS**  trans-59.3102.2166.1-80.7179.3174.4-177.9-3.5107.5P190 S194P190-R192 PolarHBondContact O-N 3.2Å; R192-S194 VanDerWaalsContact C-N 3.31Å; R192-S194 PolarHBondContact O-N 3.32Å
193S28.7Very low34.1Very low116 Ų116141.7 Ų141.781%0.81178%0.783SS**  trans-64.699.7160.6520000107.5E191 E195E191-S193 PolarHBondContact O-N 2.9Å; S193-E195 PolarHBondContact O-N 3.39Å; S193-E195 VanDerWaalsContact O-N 3.09Å
194S34.2Very low34Very low114 Ų114137.9 Ų137.980%0.79777%0.768SS**  trans-62.697.5169.5153.30000109.1R192R192-S194 VanDerWaalsContact C-N 3.31Å; R192-S194 PolarHBondContact O-N 3.32Å
195E26.9Very low33.7Very low189 Ų189139.7 Ų139.788%0.88377%0.768SS**  trans-144.8111.7152.1-107.8165.5-158.700108.6S193 L197S193-E195 PolarHBondContact O-N 3.39Å; S193-E195 VanDerWaalsContact O-N 3.09Å; E195-L197 PolarHBondContact O-N 3.36Å
196A33.6Very low34Very low95 Ų95138 Ų13879%0.78576%0.758SS**  trans-74118.7-16600000112.4
197L31.3Very low34.3Very low147 Ų147134.4 Ų134.477%0.7774%0.739SS**  trans-88.598.6153.2-89138.6000107.9E195 G199E195-L197 PolarHBondContact O-N 3.36Å; L197-G199 PolarHBondContact O-N 3.39Å
198K30.3Very low34.8Very low211 Ų211129.4 Ų129.492%0.91773%0.732SS**SBendtrans-57.199.2171.3-80.6175.9173.1175.50109.8
199G30.6Very low35.9Very low73 Ų73126.8 Ų126.875%0.75372%0.719SS**  trans175.831.2173.900000112L197 S201L197-G199 PolarHBondContact O-N 3.39Å; G199-S201 PolarHBondContact O-N 2.95Å
200E32.6Very low37.4Very low155 Ų155121.3 Ų121.372%0.72469%0.685SS**  trans-80.9116.3176.5-65.1-178.9171.400108.1
201S39.8Very low39.2Very low81 Ų81119.2 Ų119.257%0.56667%0.667SS**  trans-71.8148.9173.3179.70000109.2G199 A203 D204G199-S201 PolarHBondContact O-N 2.95Å; S201-A203 PolarHBondContact O-N 3.16Å; S201-D204 PolarHBondContact O-N 2.57Å
202E32.4Very low42Very low180 Ų180113.6 Ų113.684%0.84165%0.645SS**THydrogen-bonded Turntrans-51.6-17.1177-63.5-175.5159.300113.9D204E202-D204 VanDerWaalsContact C-N 3.32Å; E202-D204 PolarHBondContact O-N 2.64Å
203A40.2Very low44.4Very low65 Ų65107.8 Ų107.854%0.53763%0.629SS.*Hα-helixtrans-63.8-25.6173.700000115.2S201S201-A203 PolarHBondContact O-N 3.16Å
204D40.9Very low47.3Very low104 Ų104108.5 Ų108.556%0.55662%0.624SS**Hα-helixtrans-82.5-19.9-174.3-74.5-36.2000113.5S201 E202S201-D204 PolarHBondContact O-N 2.57Å; E202-D204 VanDerWaalsContact C-N 3.32Å; E202-D204 PolarHBondContact O-N 2.64Å
205Q37.3Very low50Low162 Ų162106.9 Ų106.976%0.75760%0.6SS**Hα-helixtrans-84.2-26177.7-69.5-177.315.100112.8
206E41.4Very low53.1Low110 Ų11097.9 Ų97.951%0.51456%0.558SS.*Hα-helixtrans-82.7-16.8-179.5-158.8152-172.300113.2R302E206-R302 IonicContact OE1-CZ 3.87Å; E206-R302 VanDerWaalsContact OE1-CZ 3.3Å; E206-R302 IonicContact OE1-NH1 2.81Å; E206-R302 PolarHBondContact OE1-NH1 3.36Å; E206-R302 IonicContact OE1-NH2 3.13Å; E206-R302 PolarHBondContact OE1-NH2 3.11Å
207G46.3Very low56.1Low30 Ų3096.6 Ų96.631%0.30953%0.533SS..SBendtrans-71.7-27.1-179.900000115.6A209 E210 L211G207-A209 PolarHBondContact O-N 3.09Å; G207-E210 PolarHBondContact O-N 2.97Å; G207-L211 WeakPolarHBondContact O-CG 3.47Å
208A45.5Very low59.1Low82 Ų8290.2 Ų90.268%0.67850%0.499SS*.G310 helixtrans-71.5-31.8-17400000113.7E210A208-E210 VanDerWaalsContact C-N 3.31Å
209A51.1Low62.1Low66 Ų6680.2 Ų80.255%0.54546%0.456SS..G310 helixtrans-81.9-9.5174.400000113.1G207 R215G207-A209 PolarHBondContact O-N 3.09Å; A209-R215 PolarHBondContact O-NH1 3.48Å
210E62.1Low65.3Low23 Ų2376.8 Ų76.811%0.10742%0.42CS..G310 helixtrans-94.71.5-178.9-74.6-159.9173.500114.7G207 A208 R219 R302G207-E210 PolarHBondContact O-N 2.97Å; A208-E210 VanDerWaalsContact C-N 3.31Å; E210-R219 PolarHBondContact O-NH1 2.79Å; E210-R219 IonicContact OE2-CZ 2.89Å; E210-R219 IonicContact OE2-NH2 3.3Å; E210-R219 PolarHBondContact OE2-NH2 2.98Å; E210-R302 IonicContact OE1-CZ 2.76Å; E210-R302 IonicContact OE1-NE 3.22Å; E210-R302 PolarHBondContact OE1-NE 3.28Å; E210-R302 IonicContact OE1-NH2 2.64Å; E210-R302 PolarHBondContact OE1-NH2 3.44Å
211L72.7Confident68.4Low70 Ų7069.4 Ų69.437%0.36639%0.386SS..  trans-107.317.3-177.8-64.2173.7000113.7M148 L175 G207 V216M148-L211 HydrophobicContact CE-CD2 4.31Å; M148-L211 HydrophobicContact SD-CD2 4.03Å; L175-L211 HydrophobicContact CD2-CD2 3.99Å; G207-L211 WeakPolarHBondContact O-CG 3.47Å; L211-V216 HydrophobicContact CD2-CG2 4.42Å
212T86.1Confident71.1Confident67 Ų6765.5 Ų65.541%0.41136%0.359SS..SBendtrans-63.2147.7169.666.30000110.1D214 R215 V216T212-D214 VanDerWaalsContact C-N 3.32Å; T212-D214 PolarHBondContact O-N 2.9Å; T212-R215 PolarHBondContact O-N 2.97Å; T212-R215 WeakPolarHBondContact OG1-CB 3.14Å; T212-R215 VanDerWaalsContact OG1-CG 3.25Å; T212-R215 WeakPolarHBondContact OG1-CG 3.34Å; T212-V216 WeakPolarHBondContact O-CG2 3.36Å; T212-V216 PolarHBondContact O-N 3.37Å
213E88.1Confident74.2Confident123 Ų12357 Ų5758%0.57532%0.319SS*.Hα-helixtrans-53.7-47.6-176.3-166.7178164.300112.2L176 R215 V216 W217L176-E213 HydrophobicContact CD2-CG 3.66Å; E213-R215 VanDerWaalsContact C-N 3.3Å; E213-R215 PolarHBondContact O-N 3.49Å; E213-V216 PolarHBondContact O-N 2.86Å; E213-V216 VanDerWaalsContact O-N 3.17Å; E213-W217 WeakPolarHBondContact O-CB 3.36Å; E213-W217 PolarHBondContact O-N 3.3Å
214D89.6Confident77Confident132 Ų13254 Ų5471%0.70629%0.294SS*.Hα-helixtrans-57.5-39.3176.3-65.9-26.1000113.2T212 L218T212-D214 VanDerWaalsContact C-N 3.32Å; T212-D214 PolarHBondContact O-N 2.9Å; D214-L218 VanDerWaalsContact O-CB 3.27Å; D214-L218 WeakPolarHBondContact O-CB 3.37Å; D214-L218 PolarHBondContact O-N 3.46Å
215R91.1Very high79.7Confident80 Ų8049 Ų4930%0.30227%0.267SS..Hα-helixtrans-73.3-39179.1-73.8-177-179.9-150.1-0.2111.2A209 T212 E213 L218 R219 W306A209-R215 PolarHBondContact O-NH1 3.48Å; T212-R215 PolarHBondContact O-N 2.97Å; T212-R215 WeakPolarHBondContact OG1-CB 3.14Å; T212-R215 VanDerWaalsContact OG1-CG 3.25Å; T212-R215 WeakPolarHBondContact OG1-CG 3.34Å; E213-R215 VanDerWaalsContact C-N 3.3Å; E213-R215 PolarHBondContact O-N 3.49Å; R215-L218 PolarHBondContact O-N 3Å; R215-R219 VanDerWaalsContact O-CB 3.24Å; R215-R219 WeakPolarHBondContact O-CB 3.5Å; R215-R219 PolarHBondContact O-N 3Å; R215-W306 HydrophobicContact CB-CH2 4.43Å; R215-W306 HydrophobicContact CB-CZ2 4.17Å; R215-W306 HydrophobicContact CG-CZ2 4.28Å; R215-W306 WeakPolarHBondContact O-CH2 3.43Å
216V92.6Very high82.6Confident0 Ų041.3 Ų41.30%023%0.231CC..Hα-helixtrans-66-42.4175.6177.70000110.1C172 L175 L176 L211 T212 E213 R219 A220C172-V216 HydrophobicContact CB-CG1 3.86Å; C172-V216 WeakPolarHBondContact O-CG1 3.5Å; L175-V216 HydrophobicContact CB-CG1 4.23Å; L175-V216 HydrophobicContact CD2-CG1 4.01Å; L175-V216 HydrophobicContact CD2-CG2 3.8Å; L175-V216 HydrophobicContact CG-CG1 4.34Å; L176-V216 HydrophobicContact CD1-CG1 4.44Å; L176-V216 HydrophobicContact CD2-CB 4Å; L176-V216 HydrophobicContact CD2-CG1 3.84Å; L176-V216 HydrophobicContact CG-CG1 3.81Å; L211-V216 HydrophobicContact CD2-CG2 4.42Å; T212-V216 WeakPolarHBondContact O-CG2 3.36Å; T212-V216 PolarHBondContact O-N 3.37Å; E213-V216 PolarHBondContact O-N 2.86Å; E213-V216 VanDerWaalsContact O-N 3.17Å; V216-R219 PolarHBondContact O-N 3.21Å; V216-A220 WeakPolarHBondContact O-CB 3.09Å; V216-A220 PolarHBondContact O-N 3.23Å
217W95.3Very high85.3Confident67 Ų6736 Ų3625%0.25421%0.207SC..Hα-helixtrans-59.2-50.2173.6177.392.4000111.8L176 E213 R219 A220 C221 L260 P262 T266L176-W217 HydrophobicContact CD1-CB 4.25Å; L176-W217 HydrophobicContact CD2-CB 4.39Å; E213-W217 WeakPolarHBondContact O-CB 3.36Å; E213-W217 PolarHBondContact O-N 3.3Å; W217-R219 VanDerWaalsContact C-N 3.27Å; W217-R219 PolarHBondContact O-N 3.23Å; W217-A220 WeakPolarHBondContact O-CB 3.49Å; W217-A220 PolarHBondContact O-N 2.94Å; W217-A220 VanDerWaalsContact O-N 3.13Å; W217-C221 PolarHBondContact O-N 3.25Å; W217-C221 PolarHBondContact O-SG 2.93Å; W217-L260 HydrophobicContact CG-CD2 4.42Å; W217-L260 PolarHBondContact NE1-O 2.69Å; W217-P262 HydrophobicContact CH2-CB 3.79Å; W217-P262 HydrophobicContact CZ2-CB 3.77Å; W217-T266 HydrophobicContact CH2-CG2 4.11Å; W217-T266 HydrophobicContact CZ3-CG2 4.25Å
218L94.7Very high87.7Confident13 Ų1336.1 Ų36.17%0.06820%0.197CC..Hα-helixtrans-61.5-39.6179.3-170.963.9000111.4D214 R215 C221 M222 T266 L270 W306 I309 L310 A313D214-L218 VanDerWaalsContact O-CB 3.27Å; D214-L218 WeakPolarHBondContact O-CB 3.37Å; D214-L218 PolarHBondContact O-N 3.46Å; R215-L218 PolarHBondContact O-N 3Å; L218-C221 PolarHBondContact O-N 2.88Å; L218-M222 PolarHBondContact O-N 3.12Å; L218-T266 HydrophobicContact CD1-CG2 4.41Å; L218-L270 HydrophobicContact CD1-CD1 4.1Å; L218-L270 HydrophobicContact CD1-CD2 4.05Å; L218-L270 HydrophobicContact CD1-CG 4.49Å; L218-W306 HydrophobicContact CB-CH2 4.32Å; L218-W306 HydrophobicContact CD2-CH2 4.3Å; L218-W306 HydrophobicContact CG-CH2 4.46Å; L218-W306 HydrophobicContact CG-CZ3 4.46Å; L218-I309 HydrophobicContact CD1-CG2 4.21Å; L218-I309 HydrophobicContact CD2-CG2 3.56Å; L218-I309 HydrophobicContact CG-CG2 3.74Å; L218-L310 HydrophobicContact CD2-CD2 4.33Å; L218-A313 HydrophobicContact CD2-CB 3.94Å
219R94.6Very high90.1Very high2 Ų233.7 Ų33.71%0.00817%0.173CC..Hα-helixtrans-64.6-42175.1-168.1173.6-71.6137-13.6112E210 R215 V216 W217 M222 C223 W306E210-R219 PolarHBondContact O-NH1 2.79Å; E210-R219 IonicContact OE2-CZ 2.89Å; E210-R219 IonicContact OE2-NH2 3.3Å; E210-R219 PolarHBondContact OE2-NH2 2.98Å; R215-R219 VanDerWaalsContact O-CB 3.24Å; R215-R219 WeakPolarHBondContact O-CB 3.5Å; R215-R219 PolarHBondContact O-N 3Å; V216-R219 PolarHBondContact O-N 3.21Å; W217-R219 VanDerWaalsContact C-N 3.27Å; W217-R219 PolarHBondContact O-N 3.23Å; R219-M222 HydrophobicContact CG-SD 4.49Å; R219-M222 WeakPolarHBondContact O-CG 3.48Å; R219-C223 WeakPolarHBondContact O-CB 3.34Å; R219-C223 PolarHBondContact O-N 3.1Å; R219-C223 VanDerWaalsContact O-N 3.09Å; R219-C223 PolarHBondContact O-SG 3.5Å; R219-W306 HydrophobicContact CB-CH2 4.05Å; R219-W306 HydrophobicContact CB-CZ3 3.97Å; R219-W306 HydrophobicContact CG-CZ3 4.41Å
220A97Very high92.1Very high0 Ų030.5 Ų30.50%015%0.147CC..Hα-helixtrans-59.6-49.8174.600000110.8C172 V216 W217 M222 C223 F224 L260C172-A220 HydrophobicContact CB-CB 3.66Å; V216-A220 WeakPolarHBondContact O-CB 3.09Å; V216-A220 PolarHBondContact O-N 3.23Å; W217-A220 WeakPolarHBondContact O-CB 3.49Å; W217-A220 PolarHBondContact O-N 2.94Å; W217-A220 VanDerWaalsContact O-N 3.13Å; A220-M222 PolarHBondContact O-N 2.91Å; A220-C223 PolarHBondContact O-N 2.79Å; A220-F224 HydrophobicContact CB-CE2 4.39Å; A220-F224 WeakPolarHBondContact O-CD2 3.39Å; A220-F224 PolarHBondContact O-N 3.01Å; A220-L260 HydrophobicContact CB-CD1 3.85Å; A220-L260 HydrophobicContact CB-CD2 4.22Å
221C97.6Very high93.6Very high0 Ų029.5 Ų29.50%014%0.142CC..Hα-helixtrans-55.6-53.5178.2-73.40000112W217 L218 C223 F224 I225 L270W217-C221 PolarHBondContact O-N 3.25Å; W217-C221 PolarHBondContact O-SG 2.93Å; L218-C221 PolarHBondContact O-N 2.88Å; C221-C223 VanDerWaalsContact C-N 3.28Å; C221-C223 PolarHBondContact O-N 3.34Å; C221-F224 PolarHBondContact O-N 3.48Å; C221-I225 WeakPolarHBondContact O-CB 3.37Å; C221-I225 WeakPolarHBondContact O-CD1 3.5Å; C221-I225 VanDerWaalsContact O-CG1 3.23Å; C221-I225 WeakPolarHBondContact O-CG1 3.5Å; C221-I225 PolarHBondContact O-N 2.74Å; C221-L270 HydrophobicContact CB-CD1 3.63Å
222M96.4Very high94.5Very high0 Ų032.4 Ų32.40%015%0.148CC..Hα-helixtrans-60.9-37.318066.8170.2-65.200112.4W165 L218 R219 A220 I225 R226 L270 M274 F301 W305 W306 I309W165-M222 HydrophobicContact CZ3-CE 3.97Å; L218-M222 PolarHBondContact O-N 3.12Å; R219-M222 HydrophobicContact CG-SD 4.49Å; R219-M222 WeakPolarHBondContact O-CG 3.48Å; A220-M222 PolarHBondContact O-N 2.91Å; M222-I225 PolarHBondContact O-N 3.46Å; M222-R226 VanDerWaalsContact O-CB 3.31Å; M222-R226 WeakPolarHBondContact O-CB 3.33Å; M222-R226 PolarHBondContact O-N 3.02Å; M222-L270 HydrophobicContact CB-CD2 4.26Å; M222-M274 HydrophobicContact CB-CG 4.18Å; M222-M274 HydrophobicContact CB-SD 4.31Å; M222-M274 HydrophobicContact CE-CE 3.68Å; M222-M274 HydrophobicContact CE-SD 3.57Å; M222-M274 VanDerWaalsContact CE-SD 3.57Å; M222-F301 HydrophobicContact CE-CE1 4.19Å; M222-F301 HydrophobicContact CE-CE2 4.39Å; M222-F301 HydrophobicContact CE-CZ 3.6Å; M222-F301 HydrophobicContact SD-CE1 4.31Å; M222-F301 HydrophobicContact SD-CZ 4.01Å; M222-W305 HydrophobicContact CE-CB 4Å; M222-W306 HydrophobicContact SD-CE3 3.62Å; M222-W306 HydrophobicContact SD-CZ3 3.7Å; M222-I309 HydrophobicContact CB-CD1 3.7Å; M222-I309 HydrophobicContact CE-CD1 3.31Å; M222-I309 HydrophobicContact CG-CD1 4.07Å; M222-I309 HydrophobicContact SD-CD1 3.36Å; M222-I309 WeakPolarHBondContact SD-CD1 3.46Å
223C98.1Very high94.6Very high0 Ų031.8 Ų31.80%014%0.142CC..Hα-helixtrans-68.9-43.6-178.2-72.50000111.6W165 L168 R219 A220 C221 R226 T227W165-C223 WeakPolarHBondContact O-CB 3.42Å; L168-C223 VanDerWaalsContact CD2-SG 3.56Å; L168-C223 VanDerWaalsContact CG-SG 3.56Å; R219-C223 WeakPolarHBondContact O-CB 3.34Å; R219-C223 PolarHBondContact O-N 3.1Å; R219-C223 VanDerWaalsContact O-N 3.09Å; R219-C223 PolarHBondContact O-SG 3.5Å; A220-C223 PolarHBondContact O-N 2.79Å; C221-C223 VanDerWaalsContact C-N 3.28Å; C221-C223 PolarHBondContact O-N 3.34Å; C223-R226 PolarHBondContact O-N 2.8Å; C223-T227 WeakPolarHBondContact O-CB 3.44Å; C223-T227 PolarHBondContact O-N 3.45Å; C223-T227 PolarHBondContact O-OG1 2.86Å
224F98.5Very high94.4Very high2 Ų227.8 Ų27.81%0.00912%0.124CC..Hα-helixtrans-68.3-39.1175.9-73.7-53.3000112.1F166 Q170 L173 A220 C221 T227 R228 T253 A256 L257 L260F166-F224 HydrophobicContact CD2-CD1 4.31Å; F166-F224 HydrophobicContact CD2-CE1 4.02Å; F166-F224 HydrophobicContact CE2-CE1 4.05Å; Q170-F224 HydrophobicContact CG-CE1 4.36Å; Q170-F224 HydrophobicContact CG-CZ 4.38Å; L173-F224 HydrophobicContact CB-CE2 4.43Å; L173-F224 HydrophobicContact CD2-CE2 4.48Å; L173-F224 HydrophobicContact CD2-CZ 4.43Å; A220-F224 HydrophobicContact CB-CE2 4.39Å; A220-F224 WeakPolarHBondContact O-CD2 3.39Å; A220-F224 PolarHBondContact O-N 3.01Å; C221-F224 PolarHBondContact O-N 3.48Å; F224-T227 PolarHBondContact O-N 2.92Å; F224-R228 WeakPolarHBondContact O-CB 3.17Å; F224-R228 PolarHBondContact O-N 3.04Å; F224-T253 HydrophobicContact CB-CG2 3.87Å; F224-T253 HydrophobicContact CD1-CG2 4.03Å; F224-T253 HydrophobicContact CG-CG2 4.37Å; F224-T253 WeakPolarHBondContact O-CG2 3.44Å; F224-A256 HydrophobicContact CD1-CB 4.23Å; F224-A256 HydrophobicContact CD2-CB 3.9Å; F224-A256 HydrophobicContact CE1-CB 3.99Å; F224-A256 HydrophobicContact CE2-CB 3.65Å; F224-A256 HydrophobicContact CG-CB 4.2Å; F224-A256 HydrophobicContact CZ-CB 3.69Å; F224-L257 HydrophobicContact CB-CD1 4.3Å; F224-L257 HydrophobicContact CB-CD2 3.76Å; F224-L257 HydrophobicContact CB-CG 3.84Å; F224-L260 HydrophobicContact CD2-CD1 3.73Å; F224-L260 HydrophobicContact CE2-CD1 4.04Å
225I98.1Very high94Very high0 Ų027.8 Ų27.80%011%0.114CC..Hα-helixtrans-59.8-49.2173-69.9164.1000110.5C221 M222 T227 R228 L229 L257 L267 L270 M274C221-I225 WeakPolarHBondContact O-CB 3.37Å; C221-I225 WeakPolarHBondContact O-CD1 3.5Å; C221-I225 VanDerWaalsContact O-CG1 3.23Å; C221-I225 WeakPolarHBondContact O-CG1 3.5Å; C221-I225 PolarHBondContact O-N 2.74Å; M222-I225 PolarHBondContact O-N 3.46Å; I225-T227 PolarHBondContact O-N 2.85Å; I225-R228 WeakPolarHBondContact O-CB 3.42Å; I225-R228 PolarHBondContact O-N 2.73Å; I225-L229 HydrophobicContact CG2-CD1 3.98Å; I225-L229 HydrophobicContact CG2-CG 4.44Å; I225-L229 WeakPolarHBondContact O-CG 3.34Å; I225-L229 PolarHBondContact O-N 2.88Å; I225-L257 HydrophobicContact CG1-CD1 4.31Å; I225-L257 HydrophobicContact CG1-CD2 4.04Å; I225-L267 HydrophobicContact CD1-CD1 3.66Å; I225-L267 HydrophobicContact CG1-CD1 3.93Å; I225-L270 HydrophobicContact CD1-CB 3.46Å; I225-L270 VanDerWaalsContact CD1-CB 3.46Å; I225-L270 HydrophobicContact CD1-CD1 3.76Å; I225-L270 HydrophobicContact CD1-CG 4.28Å; I225-M274 HydrophobicContact CG2-CB 4.26Å
226R97.6Very high93Very high0 Ų033 Ų330%014%0.142CC..Hα-helixtrans-61.8-42.9178.5-175.255.2168.9-150.6-3.2112.5P159 W165 M222 C223 R228 L229 L230 M274 D277 L278P159-R226 PolarHBondContact O-NH2 3.48Å; W165-R226 HydrophobicContact CB-CG 4.41Å; W165-R226 HydrophobicContact CD2-CB 4.04Å; W165-R226 HydrophobicContact CD2-CG 3.45Å; W165-R226 VanDerWaalsContact CD2-CG 3.45Å; W165-R226 HydrophobicContact CE3-CB 4.11Å; W165-R226 HydrophobicContact CE3-CG 3.93Å; W165-R226 HydrophobicContact CG-CB 4.23Å; W165-R226 HydrophobicContact CG-CG 3.66Å; W165-R226 HydrophobicContact CH2-CG 4.46Å; W165-R226 HydrophobicContact CZ2-CG 4.05Å; W165-R226 HydrophobicContact CZ3-CG 4.4Å; M222-R226 VanDerWaalsContact O-CB 3.31Å; M222-R226 WeakPolarHBondContact O-CB 3.33Å; M222-R226 PolarHBondContact O-N 3.02Å; C223-R226 PolarHBondContact O-N 2.8Å; R226-R228 VanDerWaalsContact C-N 3.34Å; R226-R228 PolarHBondContact O-N 3.07Å; R226-L229 PolarHBondContact O-N 3.01Å; R226-L230 HydrophobicContact CG-CD1 4.04Å; R226-L230 WeakPolarHBondContact O-CB 3.33Å; R226-L230 WeakPolarHBondContact O-CG 3.28Å; R226-L230 PolarHBondContact O-N 3.43Å; R226-M274 HydrophobicContact CB-CB 4.33Å; R226-M274 HydrophobicContact CB-CE 3.48Å; R226-M274 VanDerWaalsContact CB-CE 3.48Å; R226-M274 HydrophobicContact CB-CG 4.46Å; R226-M274 WeakPolarHBondContact CD-O 3.43Å; R226-M274 HydrophobicContact CG-CE 3.53Å; R226-M274 PolarHBondContact NH1-O 3.02Å; R226-D277 IonicContact CZ-OD1 3.78Å; R226-D277 IonicContact CZ-OD2 2.79Å; R226-D277 IonicContact NH1-OD1 3.09Å; R226-D277 PolarHBondContact NH1-OD1 3.15Å; R226-D277 VanDerWaalsContact NH2-CG 3.29Å; R226-D277 IonicContact NH2-OD1 2.76Å; R226-D277 PolarHBondContact NH2-OD1 3.23Å; R226-D277 IonicContact NH2-OD2 3.86Å; R226-D277 PolarHBondContact NH2-OD2 2.99Å; R226-L278 VanDerWaalsContact NH1-CD2 3.32Å; R226-L278 VanDerWaalsContact NH1-CG 3.26Å
227T98.1Very high92Very high0 Ų037.8 Ų37.80%016%0.164CC..Hα-helixtrans-56-49.4173.8-59.10000111W165 F166 C223 F224 I225 L230 L231 T249W165-T227 WeakPolarHBondContact CB-OG1 3.28Å; F166-T227 WeakPolarHBondContact CA-OG1 3.41Å; F166-T227 HydrophobicContact CB-CG2 3.75Å; F166-T227 HydrophobicContact CD2-CG2 4Å; F166-T227 HydrophobicContact CG-CG2 4.28Å; F166-T227 PolarHBondContact N-OG1 3.46Å; C223-T227 WeakPolarHBondContact O-CB 3.44Å; C223-T227 PolarHBondContact O-N 3.45Å; C223-T227 PolarHBondContact O-OG1 2.86Å; F224-T227 PolarHBondContact O-N 2.92Å; I225-T227 PolarHBondContact O-N 2.85Å; T227-L230 PolarHBondContact O-N 3.15Å; T227-L231 HydrophobicContact CG2-CD1 3.87Å; T227-L231 HydrophobicContact CG2-CG 4.39Å; T227-L231 WeakPolarHBondContact O-CB 3.28Å; T227-L231 WeakPolarHBondContact O-CG 3.46Å; T227-L231 PolarHBondContact O-N 3.43Å; T227-T249 HydrophobicContact CG2-CG2 4.5Å
228R97.2Very high90.8Very high31 Ų3136.7 Ų36.712%0.11716%0.162CC..Hα-helixtrans-59.7-47.3179.1176.817768.1172.14112.1F224 I225 R226 R232 L250 T253 E254F224-R228 WeakPolarHBondContact O-CB 3.17Å; F224-R228 PolarHBondContact O-N 3.04Å; I225-R228 WeakPolarHBondContact O-CB 3.42Å; I225-R228 PolarHBondContact O-N 2.73Å; R226-R228 VanDerWaalsContact C-N 3.34Å; R226-R228 PolarHBondContact O-N 3.07Å; R228-R232 WeakPolarHBondContact O-CB 3.3Å; R228-R232 VanDerWaalsContact O-CG 3.25Å; R228-R232 WeakPolarHBondContact O-CG 3.49Å; R228-R232 PolarHBondContact O-N 3.39Å; R228-L250 HydrophobicContact CB-CD2 4.39Å; R228-L250 HydrophobicContact CG-CD2 4.14Å; R228-T253 HydrophobicContact CB-CG2 3.97Å; R228-E254 WeakPolarHBondContact CD-OE1 3.47Å; R228-E254 IonicContact NH1-OE1 3.95Å; R228-E254 IonicContact NH1-OE2 3.33Å; R228-E254 PolarHBondContact NH1-OE2 2.86Å; R228-E254 VanDerWaalsContact NH1-OE2 3.09Å
229L95.8Very high89.8Confident31 Ų3139.6 Ų39.616%0.16218%0.183CC..Hα-helixtrans-60.5-50.3179.5-68.7170.8000111.2I225 R226 R232 I233 T271 M274 L278I225-L229 HydrophobicContact CG2-CD1 3.98Å; I225-L229 HydrophobicContact CG2-CG 4.44Å; I225-L229 WeakPolarHBondContact O-CG 3.34Å; I225-L229 PolarHBondContact O-N 2.88Å; R226-L229 PolarHBondContact O-N 3.01Å; L229-R232 PolarHBondContact O-N 3.09Å; L229-I233 WeakPolarHBondContact O-CG1 3.45Å; L229-I233 PolarHBondContact O-N 2.86Å; L229-T271 HydrophobicContact CD1-CG2 4.43Å; L229-T271 HydrophobicContact CD2-CG2 4.35Å; L229-M274 HydrophobicContact CD1-CB 4.2Å; L229-M274 WeakPolarHBondContact CD1-O 3.47Å; L229-L278 HydrophobicContact CB-CD1 3.58Å; L229-L278 HydrophobicContact CD1-CD1 4.07Å; L229-L278 HydrophobicContact CG-CD1 4.41Å
230L93.8Very high88.7Confident0 Ų044.5 Ų44.50%022%0.218CC..Hα-helixtrans-61-48.2179.8-73.4170.9000112.4F160 P162 W165 R226 T227 R232 I233 L234 L278 M283F160-L230 HydrophobicContact CB-CD2 4.36Å; F160-L230 HydrophobicContact CD1-CD2 4.34Å; P162-L230 HydrophobicContact CB-CB 3.88Å; P162-L230 HydrophobicContact CB-CD1 4.3Å; W165-L230 HydrophobicContact CG-CD1 4.46Å; R226-L230 HydrophobicContact CG-CD1 4.04Å; R226-L230 WeakPolarHBondContact O-CB 3.33Å; R226-L230 WeakPolarHBondContact O-CG 3.28Å; R226-L230 PolarHBondContact O-N 3.43Å; T227-L230 PolarHBondContact O-N 3.15Å; L230-R232 VanDerWaalsContact C-N 3.28Å; L230-R232 PolarHBondContact O-N 3.42Å; L230-I233 PolarHBondContact O-N 3.43Å; L230-L234 WeakPolarHBondContact O-CB 3.27Å; L230-L234 VanDerWaalsContact O-CG 3.28Å; L230-L234 WeakPolarHBondContact O-CG 3.34Å; L230-L234 PolarHBondContact O-N 3.31Å; L230-L278 HydrophobicContact CD2-CD2 3.51Å; L230-L278 HydrophobicContact CG-CD2 4.34Å; L230-M283 HydrophobicContact CD2-CE 3.82Å
231L92.8Very high87.2Confident1 Ų151.8 Ų51.81%0.00525%0.25CS..Hα-helixtrans-63.7-33.8179.3-71.2177.9000112.4P162 W163 T227 R235 T249 L250P162-L231 HydrophobicContact CB-CD2 3.73Å; P162-L231 HydrophobicContact CB-CG 3.82Å; P162-L231 HydrophobicContact CG-CD2 3.62Å; P162-L231 HydrophobicContact CG-CG 4.28Å; W163-L231 HydrophobicContact CH2-CD2 4.38Å; W163-L231 HydrophobicContact CZ2-CD2 4.32Å; T227-L231 HydrophobicContact CG2-CD1 3.87Å; T227-L231 HydrophobicContact CG2-CG 4.39Å; T227-L231 WeakPolarHBondContact O-CB 3.28Å; T227-L231 WeakPolarHBondContact O-CG 3.46Å; T227-L231 PolarHBondContact O-N 3.43Å; L231-R235 PolarHBondContact O-N 3.36Å; L231-T249 HydrophobicContact CD1-CG2 3.85Å; L231-L250 HydrophobicContact CB-CD1 4.21Å; L231-L250 HydrophobicContact CB-CD2 3.81Å; L231-L250 HydrophobicContact CB-CG 3.89Å; L231-L250 HydrophobicContact CD1-CD2 4.18Å; L231-L250 HydrophobicContact CD1-CG 3.94Å
232R91.6Very high86.1Confident132 Ų13254.5 Ų54.550%0.49827%0.267SS..Hα-helixtrans-68.9-43175.3-75.2177.8-178.1-169.42.5112R228 L229 L230 R235 L250 E254R228-R232 WeakPolarHBondContact O-CB 3.3Å; R228-R232 VanDerWaalsContact O-CG 3.25Å; R228-R232 WeakPolarHBondContact O-CG 3.49Å; R228-R232 PolarHBondContact O-N 3.39Å; L229-R232 PolarHBondContact O-N 3.09Å; L230-R232 VanDerWaalsContact C-N 3.28Å; L230-R232 PolarHBondContact O-N 3.42Å; R232-R235 VanDerWaalsContact O-CB 3.29Å; R232-R235 WeakPolarHBondContact O-CB 3.32Å; R232-R235 PolarHBondContact O-N 2.82Å; R232-L250 HydrophobicContact CG-CD2 4.28Å; R232-E254 IonicContact CZ-OE1 2.75Å; R232-E254 IonicContact NH2-OE1 3.43Å; R232-E254 PolarHBondContact NH2-OE1 2.94Å
233I88.3Confident85.4Confident53 Ų5356.8 Ų56.827%0.27228%0.279SS..Hα-helixtrans-62.9-46.7176.9-69.4167.9000110.6L229 L230 R235 L278 M283L229-I233 WeakPolarHBondContact O-CG1 3.45Å; L229-I233 PolarHBondContact O-N 2.86Å; L230-I233 PolarHBondContact O-N 3.43Å; I233-R235 PolarHBondContact O-N 2.96Å; I233-L278 HydrophobicContact CD1-CB 3.76Å; I233-L278 HydrophobicContact CD1-CD1 3.85Å; I233-L278 HydrophobicContact CD1-CG 4.28Å; I233-M283 HydrophobicContact CD1-SD 4.5Å; I233-M283 HydrophobicContact CG2-CE 4.32Å; I233-M283 HydrophobicContact CG2-SD 4.3Å
234L82.7Confident84.9Confident39 Ų3963.4 Ų63.420%0.20431%0.309CS..Hα-helixtrans-72.1-14.9-177.3-64.9173.3000113.2P162 L230 Q236 Q237 Q238P162-L234 HydrophobicContact CG-CD1 4.19Å; L230-L234 WeakPolarHBondContact O-CB 3.27Å; L230-L234 VanDerWaalsContact O-CG 3.28Å; L230-L234 WeakPolarHBondContact O-CG 3.34Å; L230-L234 PolarHBondContact O-N 3.31Å; L234-Q236 VanDerWaalsContact C-N 3.25Å; L234-Q236 PolarHBondContact O-N 2.87Å; L234-Q236 VanDerWaalsContact O-N 3.13Å; L234-Q237 PolarHBondContact O-N 3.46Å; L234-Q238 WeakPolarHBondContact O-CG 3.2Å
235R81.4Confident84.5Confident133 Ų13370.2 Ų70.250%0.50234%0.335SS..G310 helixtrans-52.9-40-173.8-166.8-179.4-170.9-175.63.8113.5L231 R232 I233 Q237 L243 E247L231-R235 PolarHBondContact O-N 3.36Å; R232-R235 VanDerWaalsContact O-CB 3.29Å; R232-R235 WeakPolarHBondContact O-CB 3.32Å; R232-R235 PolarHBondContact O-N 2.82Å; I233-R235 PolarHBondContact O-N 2.96Å; R235-Q237 PolarHBondContact O-N 2.84Å; R235-L243 HydrophobicContact CG-CD1 3.68Å; R235-E247 IonicContact CZ-OE1 3.21Å; R235-E247 IonicContact NE-OE1 2.8Å; R235-E247 IonicContact NH2-OE1 2.97Å; R235-E247 PolarHBondContact NH2-OE1 3.44Å
236Q71.7Confident84.1Confident188 Ų18870.3 Ų70.388%0.87934%0.336SS*.G310 helixtrans-71.4-16.8-177.1-64.5-177.81.200113.5L234L234-Q236 VanDerWaalsContact C-N 3.25Å; L234-Q236 PolarHBondContact O-N 2.87Å; L234-Q236 VanDerWaalsContact O-N 3.13Å
237Q70.5Confident83.9Confident101 Ų10173.1 Ų73.147%0.47235%0.349SS..G310 helixtrans-103.3-0.8-174.1-60.7179.13.400113.1L234 R235L234-Q237 PolarHBondContact O-N 3.46Å; R235-Q237 PolarHBondContact O-N 2.84Å
238Q69.9Low83.7Confident44 Ų4479.9 Ų79.921%0.20638%0.378CS..  trans-94.6141.7-170.1-73178.80.900113.5L234 V242 S246L234-Q238 WeakPolarHBondContact O-CG 3.2Å; Q238-V242 HydrophobicContact CB-CB 4.2Å; Q238-V242 HydrophobicContact CB-CG1 4.09Å; Q238-V242 HydrophobicContact CG-CB 4.36Å; Q238-V242 HydrophobicContact CG-CG1 3.71Å; Q238-S246 VanDerWaalsContact CD-OG 3.3Å; Q238-S246 PolarHBondContact NE2-OG 2.96Å; Q238-S246 VanDerWaalsContact NE2-OG 3.16Å; Q238-S246 VanDerWaalsContact OE1-CB 3.24Å; Q238-S246 PolarHBondContact OE1-OG 3.44Å
239S73.3Confident83.6Confident74 Ų7478.9 Ų78.952%0.51738%0.376SS..  trans-69.9161.716767.70000111.4F241 V242 L243S239-F241 VanDerWaalsContact C-N 3.33Å; S239-F241 PolarHBondContact O-N 3.42Å; S239-V242 PolarHBondContact O-N 3.05Å; S239-V242 VanDerWaalsContact O-N 3.12Å; S239-V242 WeakPolarHBondContact OG-CG2 3.32Å; S239-L243 WeakPolarHBondContact O-CB 3.24Å; S239-L243 PolarHBondContact O-N 3.24Å
240S72Confident83.6Confident106 Ų10678.5 Ų78.574%0.74137%0.374SS*.Hα-helixtrans-56.5-38.4-171.8560000114.8Q244S240-Q244 PolarHBondContact O-N 2.87Å
241F64.9Low83.7Confident153 Ų15386.5 Ų86.567%0.67140%0.404SS*.Hα-helixtrans-70.6-43.1177.4177.4-99.1000112.3S239 L243 Q244 R245S239-F241 VanDerWaalsContact C-N 3.33Å; S239-F241 PolarHBondContact O-N 3.42Å; F241-L243 PolarHBondContact O-N 3.34Å; F241-Q244 PolarHBondContact O-N 2.72Å; F241-R245 PolarHBondContact O-N 3.36Å
242V75.8Confident84Confident57 Ų5789.2 Ų89.235%0.34542%0.418SS..Hα-helixtrans-63.8-38177.1-178.30000109.8Q238 S239 Q244 R245 S246Q238-V242 HydrophobicContact CB-CB 4.2Å; Q238-V242 HydrophobicContact CB-CG1 4.09Å; Q238-V242 HydrophobicContact CG-CB 4.36Å; Q238-V242 HydrophobicContact CG-CG1 3.71Å; S239-V242 PolarHBondContact O-N 3.05Å; S239-V242 VanDerWaalsContact O-N 3.12Å; S239-V242 WeakPolarHBondContact OG-CG2 3.32Å; V242-Q244 PolarHBondContact O-N 2.96Å; V242-R245 PolarHBondContact O-N 3.45Å; V242-S246 PolarHBondContact O-N 3.43Å; V242-S246 PolarHBondContact O-OG 3.13Å; V242-S246 VanDerWaalsContact O-OG 3.07Å
243L81.8Confident84.3Confident48 Ų4883 Ų8325%0.25139%0.394SS..Hα-helixtrans-60-44.9176.7-176.264.7000112.3R235 S239 F241 R245 S246 E247R235-L243 HydrophobicContact CG-CD1 3.68Å; S239-L243 WeakPolarHBondContact O-CB 3.24Å; S239-L243 PolarHBondContact O-N 3.24Å; F241-L243 PolarHBondContact O-N 3.34Å; L243-R245 VanDerWaalsContact C-N 3.34Å; L243-R245 PolarHBondContact O-N 3.19Å; L243-S246 PolarHBondContact O-N 3.44Å; L243-E247 HydrophobicContact CD1-CG 4.22Å; L243-E247 HydrophobicContact CG-CG 4.36Å; L243-E247 WeakPolarHBondContact O-CB 3.07Å; L243-E247 WeakPolarHBondContact O-CG 3.32Å; L243-E247 PolarHBondContact O-N 2.93Å
244Q86.3Confident84.7Confident138 Ų13882.8 Ų82.865%0.64539%0.392SS*.Hα-helixtrans-60.2-43.1179-172.8-176500112.1S240 F241 V242 E247 K248S240-Q244 PolarHBondContact O-N 2.87Å; F241-Q244 PolarHBondContact O-N 2.72Å; V242-Q244 PolarHBondContact O-N 2.96Å; Q244-E247 PolarHBondContact O-N 3.48Å; Q244-K248 PolarHBondContact O-N 2.92Å
245R90.3Very high85.4Confident146 Ų14686.7 Ų86.755%0.55141%0.409SS*.Hα-helixtrans-64.7-43.3176.9-173.9-174.2167.9164.8-2.2111.2W163 F241 V242 L243 K248 T249W163-R245 HydrophobicContact CH2-CG 3.7Å; W163-R245 HydrophobicContact CZ2-CG 4.38Å; W163-R245 HydrophobicContact CZ3-CG 4.28Å; F241-R245 PolarHBondContact O-N 3.36Å; V242-R245 PolarHBondContact O-N 3.45Å; L243-R245 VanDerWaalsContact C-N 3.34Å; L243-R245 PolarHBondContact O-N 3.19Å; R245-K248 PolarHBondContact O-N 3.42Å; R245-T249 WeakPolarHBondContact O-CB 3.4Å; R245-T249 PolarHBondContact O-N 2.9Å; R245-T249 PolarHBondContact O-OG1 3.21Å
246S91.4Very high86.2Confident2 Ų280.7 Ų80.71%0.01439%0.389CS..Hα-helixtrans-61.9-44.6176.7-63.30000112Q238 V242 L243 T249 L250Q238-S246 VanDerWaalsContact CD-OG 3.3Å; Q238-S246 PolarHBondContact NE2-OG 2.96Å; Q238-S246 VanDerWaalsContact NE2-OG 3.16Å; Q238-S246 VanDerWaalsContact OE1-CB 3.24Å; Q238-S246 PolarHBondContact OE1-OG 3.44Å; V242-S246 PolarHBondContact O-N 3.43Å; V242-S246 PolarHBondContact O-OG 3.13Å; V242-S246 VanDerWaalsContact O-OG 3.07Å; L243-S246 PolarHBondContact O-N 3.44Å; S246-T249 PolarHBondContact O-N 3.36Å; S246-L250 WeakPolarHBondContact O-CB 3.26Å; S246-L250 WeakPolarHBondContact O-CG 3.32Å; S246-L250 PolarHBondContact O-N 3.3Å
247E91.8Very high87.5Confident58 Ų5872.3 Ų72.327%0.27135%0.349SS..Hα-helixtrans-64.7-41.6178.5-73.7-176.5163.400112.4R235 L243 Q244 T249 L250 R251R235-E247 IonicContact CZ-OE1 3.21Å; R235-E247 IonicContact NE-OE1 2.8Å; R235-E247 IonicContact NH2-OE1 2.97Å; R235-E247 PolarHBondContact NH2-OE1 3.44Å; L243-E247 HydrophobicContact CD1-CG 4.22Å; L243-E247 HydrophobicContact CG-CG 4.36Å; L243-E247 WeakPolarHBondContact O-CB 3.07Å; L243-E247 WeakPolarHBondContact O-CG 3.32Å; L243-E247 PolarHBondContact O-N 2.93Å; Q244-E247 PolarHBondContact O-N 3.48Å; E247-T249 VanDerWaalsContact C-N 3.3Å; E247-T249 PolarHBondContact O-N 2.94Å; E247-L250 PolarHBondContact O-N 3.3Å; E247-R251 WeakPolarHBondContact O-CG 3.49Å; E247-R251 PolarHBondContact O-N 3.06Å; E247-R251 VanDerWaalsContact O-N 3.08Å
248K93.8Very high88.7Confident143 Ų14374.5 Ų74.562%0.62236%0.36SS*.Hα-helixtrans-59-45.2172.8-178.8179.4177.6-179.20111.1Q244 R245 R251 I252Q244-K248 PolarHBondContact O-N 2.92Å; R245-K248 PolarHBondContact O-N 3.42Å; K248-R251 PolarHBondContact O-N 3.43Å; K248-I252 HydrophobicContact CG-CD1 4.18Å; K248-I252 WeakPolarHBondContact O-CG1 3.33Å; K248-I252 PolarHBondContact O-N 3.23Å; K248-I252 VanDerWaalsContact O-N 3.15Å
249T95.6Very high90Very high10 Ų1079.4 Ų79.46%0.06138%0.376CS..Hα-helixtrans-68.4-38-177.8-52.40000111.3W163 F166 T227 L231 R245 S246 E247 R251 I252 T253W163-T249 HydrophobicContact CE3-CG2 4.45Å; W163-T249 HydrophobicContact CZ3-CG2 3.77Å; W163-T249 VanDerWaalsContact CZ3-OG1 3.27Å; W163-T249 WeakPolarHBondContact CZ3-OG1 3.27Å; F166-T249 HydrophobicContact CD1-CG2 4.09Å; F166-T249 HydrophobicContact CD2-CG2 3.66Å; F166-T249 HydrophobicContact CE1-CG2 4.11Å; F166-T249 HydrophobicContact CE2-CG2 3.7Å; F166-T249 HydrophobicContact CG-CG2 3.86Å; F166-T249 HydrophobicContact CZ-CG2 3.92Å; T227-T249 HydrophobicContact CG2-CG2 4.5Å; L231-T249 HydrophobicContact CD1-CG2 3.85Å; R245-T249 WeakPolarHBondContact O-CB 3.4Å; R245-T249 PolarHBondContact O-N 2.9Å; R245-T249 PolarHBondContact O-OG1 3.21Å; S246-T249 PolarHBondContact O-N 3.36Å; E247-T249 VanDerWaalsContact C-N 3.3Å; E247-T249 PolarHBondContact O-N 2.94Å; T249-R251 PolarHBondContact O-N 3.5Å; T249-I252 PolarHBondContact O-N 3.4Å; T249-T253 WeakPolarHBondContact O-CB 3.34Å; T249-T253 PolarHBondContact O-N 3.23Å; T249-T253 PolarHBondContact O-OG1 3.46Å
250L95.9Very high91Very high23 Ų2376.6 Ų76.612%0.1236%0.356CS..Hα-helixtrans-58.4-45.3172.1-81.6170.3000111.6R228 L231 R232 S246 E247 T253 E254R228-L250 HydrophobicContact CB-CD2 4.39Å; R228-L250 HydrophobicContact CG-CD2 4.14Å; L231-L250 HydrophobicContact CB-CD1 4.21Å; L231-L250 HydrophobicContact CB-CD2 3.81Å; L231-L250 HydrophobicContact CB-CG 3.89Å; L231-L250 HydrophobicContact CD1-CD2 4.18Å; L231-L250 HydrophobicContact CD1-CG 3.94Å; R232-L250 HydrophobicContact CG-CD2 4.28Å; S246-L250 WeakPolarHBondContact O-CB 3.26Å; S246-L250 WeakPolarHBondContact O-CG 3.32Å; S246-L250 PolarHBondContact O-N 3.3Å; E247-L250 PolarHBondContact O-N 3.3Å; L250-T253 WeakPolarHBondContact O-CB 3.4Å; L250-T253 PolarHBondContact O-N 2.95Å; L250-T253 VanDerWaalsContact O-N 3.17Å; L250-E254 WeakPolarHBondContact O-CG 3.31Å; L250-E254 PolarHBondContact O-N 3.33Å
251R96.9Very high92.2Very high167 Ų16777.9 Ų77.963%0.6335%0.354SS*.Hα-helixtrans-59-49.6176.1-67.8175.6-169.8-179.33.4112E247 K248 T249 T253 E254 E255E247-R251 WeakPolarHBondContact O-CG 3.49Å; E247-R251 PolarHBondContact O-N 3.06Å; E247-R251 VanDerWaalsContact O-N 3.08Å; K248-R251 PolarHBondContact O-N 3.43Å; T249-R251 PolarHBondContact O-N 3.5Å; R251-T253 PolarHBondContact O-N 3.29Å; R251-E254 PolarHBondContact O-N 3.15Å; R251-E255 WeakPolarHBondContact O-CG 3.36Å; R251-E255 PolarHBondContact O-N 3.06Å
252I97.8Very high93.6Very high59 Ų5971.4 Ų71.430%0.30333%0.327SS..Hα-helixtrans-58.6-37.7176.9-63.1165.9000110.9F166 K248 T249 A256F166-I252 HydrophobicContact CE2-CB 4.39Å; F166-I252 HydrophobicContact CE2-CG2 3.95Å; F166-I252 HydrophobicContact CZ-CB 4.38Å; F166-I252 HydrophobicContact CZ-CG2 3.84Å; K248-I252 HydrophobicContact CG-CD1 4.18Å; K248-I252 WeakPolarHBondContact O-CG1 3.33Å; K248-I252 PolarHBondContact O-N 3.23Å; K248-I252 VanDerWaalsContact O-N 3.15Å; T249-I252 PolarHBondContact O-N 3.4Å; I252-A256 WeakPolarHBondContact O-CB 3.22Å; I252-A256 PolarHBondContact O-N 3.45Å
253T97.9Very high94.5Very high0 Ų075.8 Ų75.80%034%0.342CS..Hα-helixtrans-67.2-43.4179.1-60.50000111.5F224 R228 T249 L250 R251 A256 L257F224-T253 HydrophobicContact CB-CG2 3.87Å; F224-T253 HydrophobicContact CD1-CG2 4.03Å; F224-T253 HydrophobicContact CG-CG2 4.37Å; F224-T253 WeakPolarHBondContact O-CG2 3.44Å; R228-T253 HydrophobicContact CB-CG2 3.97Å; T249-T253 WeakPolarHBondContact O-CB 3.34Å; T249-T253 PolarHBondContact O-N 3.23Å; T249-T253 PolarHBondContact O-OG1 3.46Å; L250-T253 WeakPolarHBondContact O-CB 3.4Å; L250-T253 PolarHBondContact O-N 2.95Å; L250-T253 VanDerWaalsContact O-N 3.17Å; R251-T253 PolarHBondContact O-N 3.29Å; T253-A256 PolarHBondContact O-N 2.85Å; T253-L257 HydrophobicContact CG2-CD1 4.4Å; T253-L257 WeakPolarHBondContact O-CG 3.39Å; T253-L257 PolarHBondContact O-N 2.84Å
254E97.4Very high95Very high50 Ų5080.1 Ų80.123%0.23436%0.361CS..Hα-helixtrans-68.2-39.9176.7-59.1-68.3-178.500111.2R228 R232 L250 R251 A256 L257 Q258R228-E254 WeakPolarHBondContact CD-OE1 3.47Å; R228-E254 IonicContact NH1-OE1 3.95Å; R228-E254 IonicContact NH1-OE2 3.33Å; R228-E254 PolarHBondContact NH1-OE2 2.86Å; R228-E254 VanDerWaalsContact NH1-OE2 3.09Å; R232-E254 IonicContact CZ-OE1 2.75Å; R232-E254 IonicContact NH2-OE1 3.43Å; R232-E254 PolarHBondContact NH2-OE1 2.94Å; L250-E254 WeakPolarHBondContact O-CG 3.31Å; L250-E254 PolarHBondContact O-N 3.33Å; R251-E254 PolarHBondContact O-N 3.15Å; E254-A256 VanDerWaalsContact C-N 3.33Å; E254-A256 PolarHBondContact O-N 3.47Å; E254-L257 PolarHBondContact O-N 3.2Å; E254-Q258 WeakPolarHBondContact O-CB 3.47Å; E254-Q258 VanDerWaalsContact O-CG 3.29Å; E254-Q258 WeakPolarHBondContact O-CG 3.28Å; E254-Q258 PolarHBondContact O-N 3.1Å
255E97.8Very high95.3Very high120 Ų12076 Ų7656%0.56135%0.35SS*.Hα-helixtrans-59.7-43173.6-72.3167.6-167.600111.4R251 Q258 R259R251-E255 WeakPolarHBondContact O-CG 3.36Å; R251-E255 PolarHBondContact O-N 3.06Å; E255-Q258 PolarHBondContact O-N 2.83Å; E255-R259 WeakPolarHBondContact O-CB 3.47Å; E255-R259 PolarHBondContact O-N 3.32Å
256A97.8Very high95.3Very high8 Ų870.1 Ų70.17%0.06633%0.331CS..Hα-helixtrans-64.5-42176.100000112.2L173 F224 I252 T253 E254 R259 L260L173-A256 HydrophobicContact CD2-CB 4.32Å; F224-A256 HydrophobicContact CD1-CB 4.23Å; F224-A256 HydrophobicContact CD2-CB 3.9Å; F224-A256 HydrophobicContact CE1-CB 3.99Å; F224-A256 HydrophobicContact CE2-CB 3.65Å; F224-A256 HydrophobicContact CG-CB 4.2Å; F224-A256 HydrophobicContact CZ-CB 3.69Å; I252-A256 WeakPolarHBondContact O-CB 3.22Å; I252-A256 PolarHBondContact O-N 3.45Å; T253-A256 PolarHBondContact O-N 2.85Å; E254-A256 VanDerWaalsContact C-N 3.33Å; E254-A256 PolarHBondContact O-N 3.47Å; A256-R259 PolarHBondContact O-N 3.46Å; A256-L260 WeakPolarHBondContact O-CB 3.41Å; A256-L260 VanDerWaalsContact O-CG 3.28Å; A256-L260 WeakPolarHBondContact O-CG 2.83Å; A256-L260 PolarHBondContact O-N 3.16Å
257L97.7Very high95.5Very high11 Ų1171.5 Ų71.56%0.05834%0.338CS..Hα-helixtrans-66.5-37.9176.3-73.2171.5000112.3F224 I225 T253 E254 R259 L260 N261 P262F224-L257 HydrophobicContact CB-CD1 4.3Å; F224-L257 HydrophobicContact CB-CD2 3.76Å; F224-L257 HydrophobicContact CB-CG 3.84Å; I225-L257 HydrophobicContact CG1-CD1 4.31Å; I225-L257 HydrophobicContact CG1-CD2 4.04Å; T253-L257 HydrophobicContact CG2-CD1 4.4Å; T253-L257 WeakPolarHBondContact O-CG 3.39Å; T253-L257 PolarHBondContact O-N 2.84Å; E254-L257 PolarHBondContact O-N 3.2Å; L257-R259 VanDerWaalsContact C-N 3.33Å; L257-L260 PolarHBondContact O-N 3.07Å; L257-N261 PolarHBondContact O-N 3.31Å; L257-P262 VanDerWaalsContact O-CD 3.28Å; L257-P262 WeakPolarHBondContact O-CD 3.37Å
258Q96.9Very high95.6Very high147 Ų14774.9 Ų74.969%0.68735%0.353SS*.Hα-helixtrans-62.1-42.4172.7-74.1173.6-000111.4E254 E255 N261E254-Q258 WeakPolarHBondContact O-CB 3.47Å; E254-Q258 VanDerWaalsContact O-CG 3.29Å; E254-Q258 WeakPolarHBondContact O-CG 3.28Å; E254-Q258 PolarHBondContact O-N 3.1Å; E255-Q258 PolarHBondContact O-N 2.83Å; Q258-N261 PolarHBondContact O-N 2.93Å
259R95.9Very high95.6Very high147 Ų14768.7 Ų68.756%0.55533%0.329SS*.Hα-helixtrans-64.7-42.9176.6-176.6-178.6178.2-158.4-4.3112.5D177 E255 A256 L257 N261D177-R259 VanDerWaalsContact CG-NH2 3.29Å; D177-R259 IonicContact OD1-CZ 2.72Å; D177-R259 IonicContact OD1-NH1 3.26Å; D177-R259 PolarHBondContact OD1-NH1 2.96Å; D177-R259 VanDerWaalsContact OD1-NH1 3.08Å; D177-R259 IonicContact OD1-NH2 3.35Å; D177-R259 PolarHBondContact OD1-NH2 2.89Å; D177-R259 IonicContact OD2-CZ 3.59Å; D177-R259 IonicContact OD2-NH1 2.81Å; D177-R259 PolarHBondContact OD2-NH1 3.24Å; D177-R259 IonicContact OD2-NH2 3.46Å; D177-R259 PolarHBondContact OD2-NH2 3.24Å; E255-R259 WeakPolarHBondContact O-CB 3.47Å; E255-R259 PolarHBondContact O-N 3.32Å; A256-R259 PolarHBondContact O-N 3.46Å; L257-R259 VanDerWaalsContact C-N 3.33Å; R259-N261 PolarHBondContact O-N 3.39Å
260L95.7Very high95.6Very high16 Ų1668.5 Ų68.58%0.08433%0.328CS..Hα-helixtrans-69.6-23.4178.1-71.4165.1000112.5L173 L176 W217 A220 F224 A256 L257L173-L260 HydrophobicContact CD1-CD2 4Å; L173-L260 HydrophobicContact CD1-CG 4.34Å; L176-L260 HydrophobicContact CD1-CD2 3.87Å; W217-L260 HydrophobicContact CG-CD2 4.42Å; W217-L260 PolarHBondContact NE1-O 2.69Å; A220-L260 HydrophobicContact CB-CD1 3.85Å; A220-L260 HydrophobicContact CB-CD2 4.22Å; F224-L260 HydrophobicContact CD2-CD1 3.73Å; F224-L260 HydrophobicContact CE2-CD1 4.04Å; A256-L260 WeakPolarHBondContact O-CB 3.41Å; A256-L260 VanDerWaalsContact O-CG 3.28Å; A256-L260 WeakPolarHBondContact O-CG 2.83Å; A256-L260 PolarHBondContact O-N 3.16Å; L257-L260 PolarHBondContact O-N 3.07Å
261N96.1Very high95.6Very high132 Ų13269.2 Ų69.271%0.70633%0.333SS*.  trans46.652.8175-166.639.4000114.8L257 Q258 R259L257-N261 PolarHBondContact O-N 3.31Å; Q258-N261 PolarHBondContact O-N 2.93Å; R259-N261 PolarHBondContact O-N 3.39Å
262P94.9Very high95.5Very high17 Ų1767.8 Ų67.811%0.1133%0.334CS..  trans-64.3140.6174.529.4-34.2000110.8W217 L257 L267W217-P262 HydrophobicContact CH2-CB 3.79Å; W217-P262 HydrophobicContact CZ2-CB 3.77Å; L257-P262 VanDerWaalsContact O-CD 3.28Å; L257-P262 WeakPolarHBondContact O-CD 3.37Å; P262-L267 HydrophobicContact CG-CB 4.49Å; P262-L267 HydrophobicContact CG-CD1 4.38Å
263K93.9Very high95.3Very high150 Ų15065.9 Ų65.965%0.65233%0.325SS*.  trans-57.5150.7170.8-65.9-178.9-179.8178.50110A265 T266 L267K263-A265 VanDerWaalsContact C-N 3.28Å; K263-A265 PolarHBondContact O-N 3.05Å; K263-T266 WeakPolarHBondContact O-CA 3.31Å; K263-T266 WeakPolarHBondContact O-CB 3.41Å; K263-T266 PolarHBondContact O-N 3.44Å; K263-L267 PolarHBondContact O-N 3.16Å
264E93.3Very high95.2Very high138 Ų13865.9 Ų65.965%0.64533%0.325SS*.Hα-helixtrans-55.6-42.6-179.3-171.260.3-152.600112.3T266 L267 Q268E264-T266 VanDerWaalsContact C-N 3.3Å; E264-T266 PolarHBondContact O-N 3.19Å; E264-L267 PolarHBondContact O-N 3.49Å; E264-Q268 WeakPolarHBondContact O-CB 3.47Å; E264-Q268 PolarHBondContact O-N 3.44Å
265A91.6Very high95Very high52 Ų5265.9 Ų65.943%0.4333%0.33SS..Hα-helixtrans-59.4-41.1176.100000112.3K263 A269 Q316K263-A265 VanDerWaalsContact C-N 3.28Å; K263-A265 PolarHBondContact O-N 3.05Å; A265-A269 WeakPolarHBondContact O-CB 3.45Å; A265-A269 PolarHBondContact O-N 3.31Å; A265-Q316 VanDerWaalsContact C-NE2 3.33Å; A265-Q316 VanDerWaalsContact C-OE1 3.26Å; A265-Q316 PolarHBondContact O-NE2 3.01Å
266T91.7Very high94.8Very high22 Ų2267.2 Ų67.214%0.13534%0.337CS..Hα-helixtrans-70.3-43.4178.6-51.70000110.6W217 L218 K263 E264 Q268 A269 L270 Q316W217-T266 HydrophobicContact CH2-CG2 4.11Å; W217-T266 HydrophobicContact CZ3-CG2 4.25Å; L218-T266 HydrophobicContact CD1-CG2 4.41Å; K263-T266 WeakPolarHBondContact O-CA 3.31Å; K263-T266 WeakPolarHBondContact O-CB 3.41Å; K263-T266 PolarHBondContact O-N 3.44Å; E264-T266 VanDerWaalsContact C-N 3.3Å; E264-T266 PolarHBondContact O-N 3.19Å; T266-Q268 VanDerWaalsContact C-N 3.31Å; T266-Q268 PolarHBondContact O-N 3.33Å; T266-A269 PolarHBondContact O-N 3.4Å; T266-L270 HydrophobicContact CG2-CD1 4.09Å; T266-L270 HydrophobicContact CG2-CG 4.33Å; T266-L270 WeakPolarHBondContact O-CB 3.26Å; T266-L270 VanDerWaalsContact O-CG 3.26Å; T266-L270 WeakPolarHBondContact O-CG 3.42Å; T266-L270 PolarHBondContact O-N 2.9Å; T266-Q316 PolarHBondContact OG1-OE1 3.2Å
267L94Very high94.4Very high32 Ų3268.4 Ų68.417%0.16834%0.342CS..Hα-helixtrans-58.7-43.5175.4-177.363.2000111.4I225 P262 K263 E264 T271I225-L267 HydrophobicContact CD1-CD1 3.66Å; I225-L267 HydrophobicContact CG1-CD1 3.93Å; P262-L267 HydrophobicContact CG-CB 4.49Å; P262-L267 HydrophobicContact CG-CD1 4.38Å; K263-L267 PolarHBondContact O-N 3.16Å; E264-L267 PolarHBondContact O-N 3.49Å; L267-T271 VanDerWaalsContact O-CB 3.27Å; L267-T271 WeakPolarHBondContact O-CB 3.43Å; L267-T271 PolarHBondContact O-N 3.16Å; L267-T271 PolarHBondContact O-OG1 3.22Å
268Q94.7Very high94.1Very high128 Ų12868.8 Ų68.860%0.59834%0.344SS*.Hα-helixtrans-64.2-51178.2-175.2174.61.600111.5E264 T266 L270 T271 E272E264-Q268 WeakPolarHBondContact O-CB 3.47Å; E264-Q268 PolarHBondContact O-N 3.44Å; T266-Q268 VanDerWaalsContact C-N 3.31Å; T266-Q268 PolarHBondContact O-N 3.33Å; Q268-L270 PolarHBondContact O-N 3.08Å; Q268-T271 WeakPolarHBondContact O-CB 3.37Å; Q268-T271 PolarHBondContact O-N 3.17Å; Q268-T271 VanDerWaalsContact O-N 3.15Å; Q268-E272 PolarHBondContact O-N 3.26Å
269A93.9Very high93.6Very high14 Ų1464.8 Ų64.812%0.11633%0.326CS..Hα-helixtrans-64-41.4-17900000112.9A265 T266 T271 E272 V273 A312A265-A269 WeakPolarHBondContact O-CB 3.45Å; A265-A269 PolarHBondContact O-N 3.31Å; T266-A269 PolarHBondContact O-N 3.4Å; A269-T271 VanDerWaalsContact C-N 3.31Å; A269-T271 PolarHBondContact O-N 3.12Å; A269-E272 PolarHBondContact O-N 3.43Å; A269-V273 WeakPolarHBondContact O-CG2 3.22Å; A269-V273 PolarHBondContact O-N 3.4Å; A269-V273 VanDerWaalsContact O-N 3.17Å; A269-A312 HydrophobicContact CB-CB 4.21Å
270L95.3Very high92.9Very high5 Ų560.5 Ų60.53%0.02632%0.318CS..Hα-helixtrans-64.6-38174-69.5-179000111.7L218 C221 M222 I225 T266 Q268 M274 I309L218-L270 HydrophobicContact CD1-CD1 4.1Å; L218-L270 HydrophobicContact CD1-CD2 4.05Å; L218-L270 HydrophobicContact CD1-CG 4.49Å; C221-L270 HydrophobicContact CB-CD1 3.63Å; M222-L270 HydrophobicContact CB-CD2 4.26Å; I225-L270 HydrophobicContact CD1-CB 3.46Å; I225-L270 VanDerWaalsContact CD1-CB 3.46Å; I225-L270 HydrophobicContact CD1-CD1 3.76Å; I225-L270 HydrophobicContact CD1-CG 4.28Å; T266-L270 HydrophobicContact CG2-CD1 4.09Å; T266-L270 HydrophobicContact CG2-CG 4.33Å; T266-L270 WeakPolarHBondContact O-CB 3.26Å; T266-L270 VanDerWaalsContact O-CG 3.26Å; T266-L270 WeakPolarHBondContact O-CG 3.42Å; T266-L270 PolarHBondContact O-N 2.9Å; Q268-L270 PolarHBondContact O-N 3.08Å; L270-M274 WeakPolarHBondContact O-CB 3.37Å; L270-M274 WeakPolarHBondContact O-CG 3.4Å; L270-M274 PolarHBondContact O-N 3.22Å; L270-I309 HydrophobicContact CD2-CB 4.3Å; L270-I309 HydrophobicContact CD2-CD1 4.08Å; L270-I309 HydrophobicContact CD2-CG1 3.85Å; L270-I309 HydrophobicContact CD2-CG2 3.64Å
271T96.1Very high91.9Very high38 Ų3865.8 Ų65.823%0.23334%0.342CS..Hα-helixtrans-65-41.4177.3-61.30000111.2L229 L267 Q268 A269 M274 S275L229-T271 HydrophobicContact CD1-CG2 4.43Å; L229-T271 HydrophobicContact CD2-CG2 4.35Å; L267-T271 VanDerWaalsContact O-CB 3.27Å; L267-T271 WeakPolarHBondContact O-CB 3.43Å; L267-T271 PolarHBondContact O-N 3.16Å; L267-T271 PolarHBondContact O-OG1 3.22Å; Q268-T271 WeakPolarHBondContact O-CB 3.37Å; Q268-T271 PolarHBondContact O-N 3.17Å; Q268-T271 VanDerWaalsContact O-N 3.15Å; A269-T271 VanDerWaalsContact C-N 3.31Å; A269-T271 PolarHBondContact O-N 3.12Å; T271-M274 PolarHBondContact O-N 2.9Å; T271-S275 WeakPolarHBondContact O-CB 3.23Å; T271-S275 PolarHBondContact O-N 3.06Å; T271-S275 PolarHBondContact O-OG 3.43Å
272E94.8Very high90.8Very high137 Ų13765.1 Ų65.164%0.6433%0.333SS*.Hα-helixtrans-57.3-58176.2-175.4174.6179.500110.8Q268 A269 M274 S275 E276Q268-E272 PolarHBondContact O-N 3.26Å; A269-E272 PolarHBondContact O-N 3.43Å; E272-M274 PolarHBondContact O-N 3.42Å; E272-S275 PolarHBondContact O-N 3.41Å; E272-S275 VanDerWaalsContact O-N 3.09Å; E272-S275 PolarHBondContact O-OG 2.83Å; E272-E276 PolarHBondContact O-N 3.37Å
273V93.9Very high90Very high20 Ų2065.1 Ų65.112%0.12133%0.332CS..Hα-helixtrans-59.5-45179.6178.60000111.6A269 S275 E276 I309A269-V273 WeakPolarHBondContact O-CG2 3.22Å; A269-V273 PolarHBondContact O-N 3.4Å; A269-V273 VanDerWaalsContact O-N 3.17Å; V273-S275 PolarHBondContact O-N 2.9Å; V273-E276 PolarHBondContact O-N 3.5Å; V273-I309 HydrophobicContact CB-CG1 4.33Å; V273-I309 HydrophobicContact CG1-CD1 4.47Å; V273-I309 HydrophobicContact CG1-CG1 3.94Å
274M95.4Very high88.7Confident0 Ų065.5 Ų65.50%033%0.329CS..THydrogen-bonded Turntrans-77.84.6-178.5-61.5-48.1-70.600113.8W165 M222 I225 R226 L229 L270 T271 E272 L278 W305 I309W165-M274 HydrophobicContact CE3-CE 4.22Å; W165-M274 HydrophobicContact CH2-CE 3.57Å; W165-M274 HydrophobicContact CZ2-CE 4.19Å; W165-M274 HydrophobicContact CZ3-CE 3.58Å; M222-M274 HydrophobicContact CB-CG 4.18Å; M222-M274 HydrophobicContact CB-SD 4.31Å; M222-M274 HydrophobicContact CE-CE 3.68Å; M222-M274 HydrophobicContact CE-SD 3.57Å; M222-M274 VanDerWaalsContact CE-SD 3.57Å; I225-M274 HydrophobicContact CG2-CB 4.26Å; R226-M274 HydrophobicContact CB-CB 4.33Å; R226-M274 HydrophobicContact CB-CE 3.48Å; R226-M274 VanDerWaalsContact CB-CE 3.48Å; R226-M274 HydrophobicContact CB-CG 4.46Å; R226-M274 WeakPolarHBondContact CD-O 3.43Å; R226-M274 HydrophobicContact CG-CE 3.53Å; R226-M274 PolarHBondContact NH1-O 3.02Å; L229-M274 HydrophobicContact CD1-CB 4.2Å; L229-M274 WeakPolarHBondContact CD1-O 3.47Å; L270-M274 WeakPolarHBondContact O-CB 3.37Å; L270-M274 WeakPolarHBondContact O-CG 3.4Å; L270-M274 PolarHBondContact O-N 3.22Å; T271-M274 PolarHBondContact O-N 2.9Å; E272-M274 PolarHBondContact O-N 3.42Å; M274-L278 WeakPolarHBondContact O-CD1 3.38Å; M274-W305 HydrophobicContact CE-CG 4.28Å; M274-W305 HydrophobicContact SD-CB 4.26Å; M274-W305 HydrophobicContact SD-CG 4.22Å; M274-I309 HydrophobicContact SD-CD1 3.9Å
275S94.3Very high87Confident49 Ų4966.5 Ų66.534%0.34333%0.333SS..THydrogen-bonded Turntrans-115.6-11.4175.469.10000114T271 E272 V273 D277 L278T271-S275 WeakPolarHBondContact O-CB 3.23Å; T271-S275 PolarHBondContact O-N 3.06Å; T271-S275 PolarHBondContact O-OG 3.43Å; E272-S275 PolarHBondContact O-N 3.41Å; E272-S275 VanDerWaalsContact O-N 3.09Å; E272-S275 PolarHBondContact O-OG 2.83Å; V273-S275 PolarHBondContact O-N 2.9Å; S275-D277 VanDerWaalsContact C-N 3.29Å; S275-D277 PolarHBondContact O-N 2.89Å; S275-L278 WeakPolarHBondContact O-CB 3.33Å; S275-L278 PolarHBondContact O-N 3.46Å
276E92.6Very high85.5Confident149 Ų14967.6 Ų67.670%0.69633%0.332SS*.THydrogen-bonded Turntrans-54.1-41.2-172.8-171.6-178.2168.100113.5E272 V273E272-E276 PolarHBondContact O-N 3.37Å; V273-E276 PolarHBondContact O-N 3.5Å
277D89.7Confident83.8Confident33 Ų3374.1 Ų74.118%0.17636%0.355CS..THydrogen-bonded Turntrans-96.54.8-17968.5-27.6000114.1R226 S275 I279 R304R226-D277 IonicContact CZ-OD1 3.78Å; R226-D277 IonicContact CZ-OD2 2.79Å; R226-D277 IonicContact NH1-OD1 3.09Å; R226-D277 PolarHBondContact NH1-OD1 3.15Å; R226-D277 VanDerWaalsContact NH2-CG 3.29Å; R226-D277 IonicContact NH2-OD1 2.76Å; R226-D277 PolarHBondContact NH2-OD1 3.23Å; R226-D277 IonicContact NH2-OD2 3.86Å; R226-D277 PolarHBondContact NH2-OD2 2.99Å; S275-D277 VanDerWaalsContact C-N 3.29Å; S275-D277 PolarHBondContact O-N 2.89Å; D277-I279 VanDerWaalsContact C-N 3.28Å; D277-I279 PolarHBondContact O-N 3.47Å; D277-R304 IonicContact OD2-CZ 3.96Å; D277-R304 IonicContact OD2-NE 2.85Å; D277-R304 IonicContact OD2-NH2 3.66Å; D277-R304 PolarHBondContact OD2-NH2 3.12Å
278L90.6Very high82.1Confident18 Ų1875 Ų759%0.09436%0.359CS..  trans-86.761.8-178.6-62.3-174.4000112.6F160 R226 L229 L230 I233 M274 S275 M283F160-L278 HydrophobicContact CD1-CD2 4.03Å; F160-L278 HydrophobicContact CE1-CD2 4.16Å; R226-L278 VanDerWaalsContact NH1-CD2 3.32Å; R226-L278 VanDerWaalsContact NH1-CG 3.26Å; L229-L278 HydrophobicContact CB-CD1 3.58Å; L229-L278 HydrophobicContact CD1-CD1 4.07Å; L229-L278 HydrophobicContact CG-CD1 4.41Å; L230-L278 HydrophobicContact CD2-CD2 3.51Å; L230-L278 HydrophobicContact CG-CD2 4.34Å; I233-L278 HydrophobicContact CD1-CB 3.76Å; I233-L278 HydrophobicContact CD1-CD1 3.85Å; I233-L278 HydrophobicContact CD1-CG 4.28Å; M274-L278 WeakPolarHBondContact O-CD1 3.38Å; S275-L278 WeakPolarHBondContact O-CB 3.33Å; S275-L278 PolarHBondContact O-N 3.46Å; L278-M283 HydrophobicContact CB-SD 4.42Å; L278-M283 HydrophobicContact CD2-CE 4.45Å; L278-M283 HydrophobicContact CD2-SD 4.09Å
279I86.8Confident80.5Confident64 Ų6474.8 Ų74.833%0.32836%0.361SS..  trans-97.7113177.9-59.1168.3000108.4D277 E281 K282 M283D277-I279 VanDerWaalsContact C-N 3.28Å; D277-I279 PolarHBondContact O-N 3.47Å; I279-E281 HydrophobicContact CG2-CB 4.46Å; I279-E281 WeakPolarHBondContact CG2-OE2 3.48Å; I279-E281 PolarHBondContact O-N 3.3Å; I279-E281 VanDerWaalsContact O-N 3.07Å; I279-K282 HydrophobicContact CB-CB 4.36Å; I279-K282 HydrophobicContact CB-CD 4.34Å; I279-K282 HydrophobicContact CB-CG 4.25Å; I279-K282 HydrophobicContact CD1-CD 4.05Å; I279-K282 HydrophobicContact CG2-CG 4.24Å; I279-K282 PolarHBondContact O-N 3Å; I279-M283 WeakPolarHBondContact O-CG 3.47Å; I279-M283 PolarHBondContact O-N 3.46Å
280P80.8Confident79.5Confident57 Ų5775.9 Ų75.937%0.3738%0.375SS..Hα-helixtrans-53.6-33.2-172.3-29.336.2000115.1R284P280-R284 PolarHBondContact O-N 3.45Å
281E75.6Confident78.9Confident127 Ų12779.4 Ų79.459%0.59339%0.391SS*.Hα-helixtrans-66-50.4177.6-65.569.2-152.200111I279 M283 R284I279-E281 HydrophobicContact CG2-CB 4.46Å; I279-E281 WeakPolarHBondContact CG2-OE2 3.48Å; I279-E281 PolarHBondContact O-N 3.3Å; I279-E281 VanDerWaalsContact O-N 3.07Å; E281-M283 PolarHBondContact O-N 3.44Å; E281-R284 PolarHBondContact O-N 2.89Å
282K73.7Confident78.3Confident117 Ų11780.1 Ų80.151%0.50940%0.397SS..Hα-helixtrans-65.7-38.3178.6-63.9-172-180179.60112.2I279 R284 E285 D286I279-K282 HydrophobicContact CB-CB 4.36Å; I279-K282 HydrophobicContact CB-CD 4.34Å; I279-K282 HydrophobicContact CB-CG 4.25Å; I279-K282 HydrophobicContact CD1-CD 4.05Å; I279-K282 HydrophobicContact CG2-CG 4.24Å; I279-K282 PolarHBondContact O-N 3Å; K282-R284 PolarHBondContact O-N 3.23Å; K282-R284 VanDerWaalsContact O-N 3.15Å; K282-E285 PolarHBondContact O-N 3.04Å; K282-D286 PolarHBondContact O-N 3.12Å
283M78.2Confident77.8Confident18 Ų1876 Ų769%0.08938%0.379CS..Hα-helixtrans-61.2-24.5177.9-69.1178.865.600113.5F160 L230 I233 L278 I279 E281F160-M283 HydrophobicContact CB-CE 3.98Å; F160-M283 HydrophobicContact CD1-CE 3.92Å; F160-M283 HydrophobicContact CD1-CG 3.79Å; F160-M283 HydrophobicContact CD1-SD 4.24Å; F160-M283 HydrophobicContact CD2-CB 4.35Å; F160-M283 HydrophobicContact CD2-CG 4.14Å; F160-M283 HydrophobicContact CE1-CG 3.73Å; F160-M283 HydrophobicContact CE1-SD 4.48Å; F160-M283 HydrophobicContact CE2-CB 4.45Å; F160-M283 HydrophobicContact CE2-CG 4.08Å; F160-M283 HydrophobicContact CG-CE 4.01Å; F160-M283 HydrophobicContact CG-CG 4Å; F160-M283 HydrophobicContact CZ-CG 3.88Å; L230-M283 HydrophobicContact CD2-CE 3.82Å; I233-M283 HydrophobicContact CD1-SD 4.5Å; I233-M283 HydrophobicContact CG2-CE 4.32Å; I233-M283 HydrophobicContact CG2-SD 4.3Å; L278-M283 HydrophobicContact CB-SD 4.42Å; L278-M283 HydrophobicContact CD2-CE 4.45Å; L278-M283 HydrophobicContact CD2-SD 4.09Å; I279-M283 WeakPolarHBondContact O-CG 3.47Å; I279-M283 PolarHBondContact O-N 3.46Å; E281-M283 PolarHBondContact O-N 3.44Å
284R66.8Low77.1Confident158 Ų15882.8 Ų82.860%0.59642%0.415SS*.Hα-helixtrans-86.9-18.7175.5-71.5-174.5-166.6-170.35.7113.6P280 E281 K282 Y287P280-R284 PolarHBondContact O-N 3.45Å; E281-R284 PolarHBondContact O-N 2.89Å; K282-R284 PolarHBondContact O-N 3.23Å; K282-R284 VanDerWaalsContact O-N 3.15Å; R284-Y287 WeakPolarHBondContact O-CD2 3.32Å; R284-Y287 VanDerWaalsContact O-CE2 3.24Å; R284-Y287 WeakPolarHBondContact O-CE2 3.07Å
285E56.1Low76.1Confident158 Ų15887 Ų8774%0.73845%0.445SS*.Hα-helixtrans-92.1-31.6-178.1-68.7174.1177.200110.9K282 Y287K282-E285 PolarHBondContact O-N 3.04Å; E285-Y287 PolarHBondContact O-N 3.29Å
286D60.1Low75.2Confident75 Ų7585.8 Ų85.840%0.40144%0.435SS..  trans-80.934.6-177.9-66.2-26.7000114.6F160 K282 Q288F160-D286 HydrophobicContact CE2-CB 3.9Å; K282-D286 PolarHBondContact O-N 3.12Å; D286-Q288 PolarHBondContact O-N 3.37Å
287Y56.2Low74.3Confident159 Ų15984.4 Ų84.462%0.62444%0.44SS*.  trans-71.580.6171.6-76.3-83.8000110.1R284 E285 D289R284-Y287 WeakPolarHBondContact O-CD2 3.32Å; R284-Y287 VanDerWaalsContact O-CE2 3.24Å; R284-Y287 WeakPolarHBondContact O-CE2 3.07Å; E285-Y287 PolarHBondContact O-N 3.29Å; Y287-D289 PolarHBondContact O-N 3.37Å
288Q57.9Low73.6Confident51 Ų5186.3 Ų86.324%0.23845%0.45CS..  trans-74.933.9-178.9-64.8-178.6-13.900113.5T124 D286 G290 E291T124-Q288 PolarHBondContact OG1-O 3.15Å; D286-Q288 PolarHBondContact O-N 3.37Å; Q288-G290 PolarHBondContact O-N 3.38Å; Q288-E291 HydrophobicContact CB-CG 4.43Å
289D60.8Low73Confident123 Ų12390.5 Ų90.566%0.65847%0.469SS*.THydrogen-bonded Turntrans-76.4112.3178.7-83.8-10.1000109.8Y287Y287-D289 PolarHBondContact O-N 3.37Å
290G73.8Confident72.9Confident38 Ų3889.8 Ų89.839%0.39247%0.47SS..THydrogen-bonded Turntrans85.211.417200000115.3T124 C125 Q288T124-G290 PolarHBondContact OG1-N 3.43Å; C125-G290 PolarHBondContact SG-N 3.27Å; Q288-G290 PolarHBondContact O-N 3.38Å
291E81.9Confident73.2Confident79 Ų7987.7 Ų87.737%0.36946%0.455SS..  trans-61.4143.5174.2-67.3-169.9168.300111.6N123 T124 Q288 L293 V296N123-E291 CarbonylContact C-O 3.46Å; N123-E291 WeakPolarHBondContact CA-O 3.46Å; N123-E291 WeakPolarHBondContact CB-O 3.43Å; T124-E291 HydrophobicContact CG2-CB 4.09Å; T124-E291 PolarHBondContact N-O 3.16Å; T124-E291 PolarHBondContact OG1-N 2.73Å; Q288-E291 HydrophobicContact CB-CG 4.43Å; E291-L293 PolarHBondContact O-N 2.92Å; E291-V296 HydrophobicContact CB-CG2 3.58Å; E291-V296 WeakPolarHBondContact OE2-CG2 3.2Å
292S84.9Confident73.8Confident52 Ų5285.9 Ų85.936%0.36444%0.443SS..BIsolated β-bridgetrans-66.3132.1177.81770000110.8N294 S295 V296S292-N294 PolarHBondContact O-N 3.09Å; S292-N294 PolarHBondContact OG-N 2.97Å; S292-S295 PolarHBondContact O-N 3.42Å; S292-S295 PolarHBondContact O-OG 3.37Å; S292-V296 WeakPolarHBondContact O-CG2 3.38Å; S292-V296 PolarHBondContact O-N 3.27Å
293L82.8Confident74.4Confident50 Ų5086.6 Ų86.626%0.26245%0.448SS..THydrogen-bonded Turntrans-61.6-18.9178.6-65.4178.4000113.1S122 T124 L127 E291 S295S122-L293 PolarHBondContact O-N 3.5Å; T124-L293 HydrophobicContact CG2-CD2 4.3Å; L127-L293 HydrophobicContact CB-CD1 4.41Å; L127-L293 HydrophobicContact CB-CD2 4.27Å; L127-L293 HydrophobicContact CD2-CD2 3.93Å; E291-L293 PolarHBondContact O-N 2.92Å; L293-S295 VanDerWaalsContact C-N 3.32Å
294N80Confident74.9Confident164 Ų16489 Ų8988%0.87746%0.456SS*.THydrogen-bonded Turntrans-74.4-22176.1-65.7-17.8000113.1S292S292-N294 PolarHBondContact O-N 3.09Å; S292-N294 PolarHBondContact OG-N 2.97Å
295S74.5Confident76Confident89 Ų8981.6 Ų81.662%0.62243%0.428SS*.THydrogen-bonded Turntrans-104.5-16.6-178.951.80000113.4S292 L293 C297S292-S295 PolarHBondContact O-N 3.42Å; S292-S295 PolarHBondContact O-OG 3.37Å; L293-S295 VanDerWaalsContact C-N 3.32Å; S295-C297 PolarHBondContact O-N 2.96Å
296V75.7Confident77.7Confident23 Ų2374.1 Ų74.114%0.13939%0.393CS..  trans-82.4118.5-179.2-172.40000110.7T124 E291 S292 L298T124-V296 HydrophobicContact CG2-CG2 3.78Å; E291-V296 HydrophobicContact CB-CG2 3.58Å; E291-V296 WeakPolarHBondContact OE2-CG2 3.2Å; S292-V296 WeakPolarHBondContact O-CG2 3.38Å; S292-V296 PolarHBondContact O-N 3.27Å; V296-L298 HydrophobicContact CG1-CD2 3.49Å; V296-L298 VanDerWaalsContact CG1-CD2 3.49Å; V296-L298 HydrophobicContact CG1-CG 3.68Å; V296-L298 PolarHBondContact O-N 3.03Å
297C73.4Confident79.2Confident119 Ų11973 Ų7380%0.80439%0.391SS*.  trans-86.596.8167.1-172.90000109.3S295 Q299S295-C297 PolarHBondContact O-N 2.96Å; C297-Q299 PolarHBondContact O-N 2.92Å
298L74.9Confident80.8Confident73 Ų7367.8 Ų67.838%0.38238%0.377SS..  trans-86.9105.9176.9-66.3175.4000110.3L127 L157 V296L127-L298 HydrophobicContact CD2-CD1 4.17Å; L157-L298 HydrophobicContact CD1-CD1 3.96Å; L157-L298 HydrophobicContact CD1-CD2 3.65Å; L157-L298 HydrophobicContact CD1-CG 4.44Å; V296-L298 HydrophobicContact CG1-CD2 3.49Å; V296-L298 VanDerWaalsContact CG1-CD2 3.49Å; V296-L298 HydrophobicContact CG1-CG 3.68Å; V296-L298 PolarHBondContact O-N 3.03Å
299Q78.8Confident82.2Confident107 Ų10765.3 Ų65.350%0.537%0.366SS..  trans-65.8138.5167.7-70.2-177.7-10.200110.4S156 C297 R304S156-Q299 PolarHBondContact OG-O 3.49Å; C297-Q299 PolarHBondContact O-N 2.92Å; Q299-R304 HydrophobicContact CB-CB 4.28Å
300S84.6Confident83.5Confident48 Ų4862.1 Ų62.134%0.33635%0.349SS..  trans-64.7150177.269.30000110.7R302 E303 R304S300-R302 PolarHBondContact O-N 2.85Å; S300-R302 VanDerWaalsContact O-N 3.12Å; S300-E303 WeakPolarHBondContact CB-OE2 3.35Å; S300-E303 PolarHBondContact N-OE2 2.74Å; S300-E303 VanDerWaalsContact N-OE2 3.15Å; S300-E303 PolarHBondContact O-N 2.71Å; S300-E303 WeakPolarHBondContact OG-CB 3.49Å; S300-E303 WeakPolarHBondContact OG-CG 3.4Å; S300-E303 PolarHBondContact OG-N 2.8Å; S300-E303 VanDerWaalsContact OG-N 3.14Å; S300-E303 PolarHBondContact OG-OE2 3.13Å; S300-R304 WeakPolarHBondContact O-CB 2.84Å; S300-R304 PolarHBondContact O-N 3.41Å
301F87.1Confident84.2Confident14 Ų1466.1 Ų66.16%0.06136%0.36CS..Hα-helixtrans-53.3-35.2174.5-178.6-85.8000111.2Q152 C155 S156 W165 L168 M222 W305 W306Q152-F301 HydrophobicContact CB-CB 4Å; Q152-F301 HydrophobicContact CB-CD1 4.44Å; Q152-F301 HydrophobicContact CB-CD2 3.94Å; Q152-F301 HydrophobicContact CB-CG 3.88Å; Q152-F301 HydrophobicContact CG-CD1 4.06Å; Q152-F301 HydrophobicContact CG-CD2 4.03Å; Q152-F301 HydrophobicContact CG-CE1 4.26Å; Q152-F301 HydrophobicContact CG-CE2 4.2Å; Q152-F301 HydrophobicContact CG-CG 3.95Å; Q152-F301 HydrophobicContact CG-CZ 4.32Å; C155-F301 HydrophobicContact CB-CD2 4.06Å; C155-F301 HydrophobicContact CB-CE2 4.08Å; S156-F301 VanDerWaalsContact OG-CA 3.28Å; S156-F301 WeakPolarHBondContact OG-CA 3.46Å; S156-F301 PolarHBondContact OG-N 3.15Å; W165-F301 HydrophobicContact CE3-CE2 4.48Å; W165-F301 HydrophobicContact CH2-CD2 4.3Å; W165-F301 AromaticContact CH2-CE2 3.62Å; W165-F301 HydrophobicContact CH2-CE2 3.62Å; W165-F301 HydrophobicContact CH2-CZ 4.41Å; W165-F301 AromaticContact CZ3-CE2 3.46Å; W165-F301 HydrophobicContact CZ3-CE2 3.46Å; W165-F301 VanDerWaalsContact CZ3-CE2 3.46Å; W165-F301 AromaticContact CZ3-CZ 3.98Å; W165-F301 HydrophobicContact CZ3-CZ 3.98Å; L168-F301 HydrophobicContact CD2-CE2 4.02Å; L168-F301 HydrophobicContact CD2-CZ 4.15Å; M222-F301 HydrophobicContact CE-CE1 4.19Å; M222-F301 HydrophobicContact CE-CE2 4.39Å; M222-F301 HydrophobicContact CE-CZ 3.6Å; M222-F301 HydrophobicContact SD-CE1 4.31Å; M222-F301 HydrophobicContact SD-CZ 4.01Å; F301-W305 AromaticContact CD2-CE3 3.79Å; F301-W305 HydrophobicContact CD2-CE3 3.79Å; F301-W305 AromaticContact CD2-CZ3 3.96Å; F301-W305 HydrophobicContact CD2-CZ3 3.96Å; F301-W305 HydrophobicContact CE2-CE3 4.17Å; F301-W305 HydrophobicContact CG-CE3 4.27Å; F301-W305 PolarHBondContact O-N 3.35Å; F301-W306 HydrophobicContact CD1-CB 4.25Å; F301-W306 HydrophobicContact CE1-CB 4.29Å; F301-W306 HydrophobicContact CE1-CE3 4.4Å; F301-W306 PolarHBondContact O-N 3.39Å
302R87.8Confident84.3Confident89 Ų8963.4 Ų63.434%0.33635%0.352SS..Iπ-helixtrans-64.8-54.4179.8177.9177.6-95.4-156.85.8111.8E206 E210 S300 R304 W306 S307E206-R302 IonicContact OE1-CZ 3.87Å; E206-R302 VanDerWaalsContact OE1-CZ 3.3Å; E206-R302 IonicContact OE1-NH1 2.81Å; E206-R302 PolarHBondContact OE1-NH1 3.36Å; E206-R302 IonicContact OE1-NH2 3.13Å; E206-R302 PolarHBondContact OE1-NH2 3.11Å; E210-R302 IonicContact OE1-CZ 2.76Å; E210-R302 IonicContact OE1-NE 3.22Å; E210-R302 PolarHBondContact OE1-NE 3.28Å; E210-R302 IonicContact OE1-NH2 2.64Å; E210-R302 PolarHBondContact OE1-NH2 3.44Å; S300-R302 PolarHBondContact O-N 2.85Å; S300-R302 VanDerWaalsContact O-N 3.12Å; R302-R304 VanDerWaalsContact C-N 3.34Å; R302-R304 PolarHBondContact O-N 2.91Å; R302-W306 HydrophobicContact CB-CB 4.36Å; R302-W306 HydrophobicContact CG-CB 4.33Å; R302-W306 PolarHBondContact O-N 3.14Å; R302-W306 VanDerWaalsContact O-N 3.13Å; R302-S307 PolarHBondContact O-N 3.25Å; R302-S307 PolarHBondContact O-OG 3.36Å
303E86.6Confident84.1Confident131 Ų13162.6 Ų62.661%0.61235%0.348SS*.Iπ-helixtrans-63.7-41.4-178.7-70.4159.5155.300111.8S300S300-E303 WeakPolarHBondContact CB-OE2 3.35Å; S300-E303 PolarHBondContact N-OE2 2.74Å; S300-E303 VanDerWaalsContact N-OE2 3.15Å; S300-E303 PolarHBondContact O-N 2.71Å; S300-E303 WeakPolarHBondContact OG-CB 3.49Å; S300-E303 WeakPolarHBondContact OG-CG 3.4Å; S300-E303 PolarHBondContact OG-N 2.8Å; S300-E303 VanDerWaalsContact OG-N 3.14Å; S300-E303 PolarHBondContact OG-OE2 3.13Å
304R87.3Confident83.8Confident68 Ų6863 Ų6326%0.25736%0.359SS..Iπ-helixtrans-75.4-35.7-172.3-168.6170.3170.9174.5-0.1113.8D277 Q299 S300 R302D277-R304 IonicContact OD2-CZ 3.96Å; D277-R304 IonicContact OD2-NE 2.85Å; D277-R304 IonicContact OD2-NH2 3.66Å; D277-R304 PolarHBondContact OD2-NH2 3.12Å; Q299-R304 HydrophobicContact CB-CB 4.28Å; S300-R304 WeakPolarHBondContact O-CB 2.84Å; S300-R304 PolarHBondContact O-N 3.41Å; R302-R304 VanDerWaalsContact C-N 3.34Å; R302-R304 PolarHBondContact O-N 2.91Å
305W91.4Very high83.1Confident4 Ų460.2 Ų60.22%0.01535%0.352CS..Iπ-helixtrans-135.6-44.3-176-57.6-70.9000113.9C155 P159 W165 M222 M274 F301 S307 S308 I309C155-W305 WeakPolarHBondContact O-CH2 3.34Å; P159-W305 HydrophobicContact CB-CH2 3.9Å; P159-W305 HydrophobicContact CB-CZ2 3.85Å; W165-W305 AromaticContact CH2-CD2 3.77Å; W165-W305 HydrophobicContact CH2-CD2 3.77Å; W165-W305 AromaticContact CH2-CE3 3.65Å; W165-W305 HydrophobicContact CH2-CE3 3.65Å; W165-W305 HydrophobicContact CH2-CG 4.43Å; W165-W305 HydrophobicContact CH2-CH2 4.02Å; W165-W305 HydrophobicContact CH2-CZ2 4.14Å; W165-W305 AromaticContact CH2-CZ3 3.78Å; W165-W305 HydrophobicContact CH2-CZ3 3.78Å; W165-W305 HydrophobicContact CZ2-CD2 4.25Å; W165-W305 HydrophobicContact CZ2-CE3 4.17Å; W165-W305 AromaticContact CZ2-CH2 3.66Å; W165-W305 HydrophobicContact CZ2-CH2 3.66Å; W165-W305 AromaticContact CZ2-CZ2 3.74Å; W165-W305 HydrophobicContact CZ2-CZ2 3.74Å; W165-W305 AromaticContact CZ2-CZ3 3.89Å; W165-W305 HydrophobicContact CZ2-CZ3 3.89Å; M222-W305 HydrophobicContact CE-CB 4Å; M274-W305 HydrophobicContact CE-CG 4.28Å; M274-W305 HydrophobicContact SD-CB 4.26Å; M274-W305 HydrophobicContact SD-CG 4.22Å; F301-W305 AromaticContact CD2-CE3 3.79Å; F301-W305 HydrophobicContact CD2-CE3 3.79Å; F301-W305 AromaticContact CD2-CZ3 3.96Å; F301-W305 HydrophobicContact CD2-CZ3 3.96Å; F301-W305 HydrophobicContact CE2-CE3 4.17Å; F301-W305 HydrophobicContact CG-CE3 4.27Å; F301-W305 PolarHBondContact O-N 3.35Å; W305-S307 PolarHBondContact O-N 3.37Å; W305-S308 PolarHBondContact O-N 2.85Å; W305-I309 WeakPolarHBondContact O-CG1 3.32Å; W305-I309 PolarHBondContact O-N 3.08Å; W305-I309 VanDerWaalsContact O-N 3.14Å
306W91.6Very high82.6Confident1 Ų158.4 Ų58.40%0.00433%0.334CS..Iπ-helixtrans-64.5-43-167.8-166.5-125.9000113.5R215 L218 R219 M222 F301 R302 S308 I309 L310R215-W306 HydrophobicContact CB-CH2 4.43Å; R215-W306 HydrophobicContact CB-CZ2 4.17Å; R215-W306 HydrophobicContact CG-CZ2 4.28Å; R215-W306 WeakPolarHBondContact O-CH2 3.43Å; L218-W306 HydrophobicContact CB-CH2 4.32Å; L218-W306 HydrophobicContact CD2-CH2 4.3Å; L218-W306 HydrophobicContact CG-CH2 4.46Å; L218-W306 HydrophobicContact CG-CZ3 4.46Å; R219-W306 HydrophobicContact CB-CH2 4.05Å; R219-W306 HydrophobicContact CB-CZ3 3.97Å; R219-W306 HydrophobicContact CG-CZ3 4.41Å; M222-W306 HydrophobicContact SD-CE3 3.62Å; M222-W306 HydrophobicContact SD-CZ3 3.7Å; F301-W306 HydrophobicContact CD1-CB 4.25Å; F301-W306 HydrophobicContact CE1-CB 4.29Å; F301-W306 HydrophobicContact CE1-CE3 4.4Å; F301-W306 PolarHBondContact O-N 3.39Å; R302-W306 HydrophobicContact CB-CB 4.36Å; R302-W306 HydrophobicContact CG-CB 4.33Å; R302-W306 PolarHBondContact O-N 3.14Å; R302-W306 VanDerWaalsContact O-N 3.13Å; W306-S308 PolarHBondContact O-N 3.43Å; W306-I309 HydrophobicContact CE3-CG2 4.36Å; W306-I309 HydrophobicContact CZ3-CG2 4.28Å; W306-I309 WeakPolarHBondContact O-CB 3.31Å; W306-I309 PolarHBondContact O-N 3.14Å; W306-L310 HydrophobicContact CD2-CG 4.48Å; W306-L310 HydrophobicContact CZ2-CD2 4.02Å; W306-L310 WeakPolarHBondContact O-CG 3.31Å; W306-L310 PolarHBondContact O-N 3.46Å
307S90.5Very high81.3Confident50 Ų5063 Ų6335%0.3536%0.362SS..Hα-helixtrans-61.5-44.3-178.6-64.60000111.8R302 W305 I309 L310 L311R302-S307 PolarHBondContact O-N 3.25Å; R302-S307 PolarHBondContact O-OG 3.36Å; W305-S307 PolarHBondContact O-N 3.37Å; S307-I309 VanDerWaalsContact C-N 3.32Å; S307-I309 PolarHBondContact O-N 2.9Å; S307-L310 PolarHBondContact O-N 2.94Å; S307-L311 WeakPolarHBondContact O-CG 3.48Å; S307-L311 PolarHBondContact O-N 2.98Å; S307-L311 VanDerWaalsContact O-N 3.1Å
308S89.6Confident79.7Confident50 Ų5064.2 Ų64.235%0.3536%0.361SS..Hα-helixtrans-63.2-38.6176.1-56.80000111.9W305 W306 L311 A312W305-S308 PolarHBondContact O-N 2.85Å; W306-S308 PolarHBondContact O-N 3.43Å; S308-L311 PolarHBondContact O-N 2.83Å; S308-A312 WeakPolarHBondContact O-CB 3.27Å; S308-A312 PolarHBondContact O-N 3.49Å
309I89.1Confident77.9Confident0 Ų063.5 Ų63.50%037%0.37CS..Hα-helixtrans-64.8-43.1176.1-74.3171.3000111.8L218 M222 L270 V273 M274 W305 W306 S307 L311 A312 A313L218-I309 HydrophobicContact CD1-CG2 4.21Å; L218-I309 HydrophobicContact CD2-CG2 3.56Å; L218-I309 HydrophobicContact CG-CG2 3.74Å; M222-I309 HydrophobicContact CB-CD1 3.7Å; M222-I309 HydrophobicContact CE-CD1 3.31Å; M222-I309 HydrophobicContact CG-CD1 4.07Å; M222-I309 HydrophobicContact SD-CD1 3.36Å; M222-I309 WeakPolarHBondContact SD-CD1 3.46Å; L270-I309 HydrophobicContact CD2-CB 4.3Å; L270-I309 HydrophobicContact CD2-CD1 4.08Å; L270-I309 HydrophobicContact CD2-CG1 3.85Å; L270-I309 HydrophobicContact CD2-CG2 3.64Å; V273-I309 HydrophobicContact CB-CG1 4.33Å; V273-I309 HydrophobicContact CG1-CD1 4.47Å; V273-I309 HydrophobicContact CG1-CG1 3.94Å; M274-I309 HydrophobicContact SD-CD1 3.9Å; W305-I309 WeakPolarHBondContact O-CG1 3.32Å; W305-I309 PolarHBondContact O-N 3.08Å; W305-I309 VanDerWaalsContact O-N 3.14Å; W306-I309 HydrophobicContact CE3-CG2 4.36Å; W306-I309 HydrophobicContact CZ3-CG2 4.28Å; W306-I309 WeakPolarHBondContact O-CB 3.31Å; W306-I309 PolarHBondContact O-N 3.14Å; S307-I309 VanDerWaalsContact C-N 3.32Å; S307-I309 PolarHBondContact O-N 2.9Å; I309-L311 VanDerWaalsContact C-N 3.32Å; I309-L311 PolarHBondContact O-N 3.26Å; I309-A312 PolarHBondContact O-N 3.43Å; I309-A313 WeakPolarHBondContact O-CB 3.34Å; I309-A313 PolarHBondContact O-N 3.16Å
310L88.1Confident75.8Confident55 Ų5564.7 Ų64.729%0.28839%0.388SS..Hα-helixtrans-63.6-39.5177.5-69.7177.7000111.7L218 W306 S307 A313 A314L218-L310 HydrophobicContact CD2-CD2 4.33Å; W306-L310 HydrophobicContact CD2-CG 4.48Å; W306-L310 HydrophobicContact CZ2-CD2 4.02Å; W306-L310 WeakPolarHBondContact O-CG 3.31Å; W306-L310 PolarHBondContact O-N 3.46Å; S307-L310 PolarHBondContact O-N 2.94Å; L310-A313 PolarHBondContact O-N 3.26Å; L310-A314 WeakPolarHBondContact O-CB 3.45Å; L310-A314 PolarHBondContact O-N 3.16Å
311L86.8Confident73.5Confident122 Ų12271.1 Ų71.164%0.63941%0.412SS*.Hα-helixtrans-65.2-43.3175-70.2171.4000112S307 S308 I309 A314 S315S307-L311 WeakPolarHBondContact O-CG 3.48Å; S307-L311 PolarHBondContact O-N 2.98Å; S307-L311 VanDerWaalsContact O-N 3.1Å; S308-L311 PolarHBondContact O-N 2.83Å; I309-L311 VanDerWaalsContact C-N 3.32Å; I309-L311 PolarHBondContact O-N 3.26Å; L311-A314 PolarHBondContact O-N 2.97Å; L311-S315 PolarHBondContact O-N 2.83Å; L311-S315 VanDerWaalsContact O-N 3.12Å; L311-S315 PolarHBondContact O-OG 3.07Å
312A83.9Confident71.2Confident23 Ų2375.2 Ų75.219%0.1945%0.449CS..Hα-helixtrans-63.9-41.8176.900000111.9A269 S308 I309 S315 Q316A269-A312 HydrophobicContact CB-CB 4.21Å; S308-A312 WeakPolarHBondContact O-CB 3.27Å; S308-A312 PolarHBondContact O-N 3.49Å; I309-A312 PolarHBondContact O-N 3.43Å; A312-S315 PolarHBondContact O-N 2.93Å; A312-Q316 WeakPolarHBondContact O-CG 3.19Å
313A80.7Confident68.7Low35 Ų3579.2 Ų79.229%0.28947%0.471SS..Hα-helixtrans-67.4-40.8177.400000112.4L218 I309 L310 S315 Q316L218-A313 HydrophobicContact CD2-CB 3.94Å; I309-A313 WeakPolarHBondContact O-CB 3.34Å; I309-A313 PolarHBondContact O-N 3.16Å; L310-A313 PolarHBondContact O-N 3.26Å; A313-S315 VanDerWaalsContact C-N 3.3Å; A313-S315 PolarHBondContact O-N 3.11Å; A313-Q316 PolarHBondContact O-N 3.25Å
314A77.3Confident67Low59 Ų5982.6 Ų82.649%0.48851%0.505SS..Hα-helixtrans-64.4-35.7177.500000112.5L310 L311 Q316 T317L310-A314 WeakPolarHBondContact O-CB 3.45Å; L310-A314 PolarHBondContact O-N 3.16Å; L311-A314 PolarHBondContact O-N 2.97Å; A314-Q316 PolarHBondContact O-N 3.36Å; A314-T317 PolarHBondContact O-N 3.24Å; A314-T317 PolarHBondContact O-OG1 3.04Å
315S66.3Low66Low104 Ų10483.4 Ų83.473%0.72752%0.517SS*.THydrogen-bonded Turntrans-69.9-9.9178.6-55.30000113.7L311 A312 A313L311-S315 PolarHBondContact O-N 2.83Å; L311-S315 VanDerWaalsContact O-N 3.12Å; L311-S315 PolarHBondContact O-OG 3.07Å; A312-S315 PolarHBondContact O-N 2.93Å; A313-S315 VanDerWaalsContact C-N 3.3Å; A313-S315 PolarHBondContact O-N 3.11Å
316Q64.3Low64.7Low52 Ų5287.5 Ų87.524%0.24354%0.543CS..THydrogen-bonded Turntrans-102.314.7177.9-64.6-174.312.800113.4A265 T266 A312 A313 A314 D318A265-Q316 VanDerWaalsContact C-NE2 3.33Å; A265-Q316 VanDerWaalsContact C-OE1 3.26Å; A265-Q316 PolarHBondContact O-NE2 3.01Å; T266-Q316 PolarHBondContact OG1-OE1 3.2Å; A312-Q316 WeakPolarHBondContact O-CG 3.19Å; A313-Q316 PolarHBondContact O-N 3.25Å; A314-Q316 PolarHBondContact O-N 3.36Å; Q316-D318 VanDerWaalsContact C-N 3.29Å; Q316-D318 PolarHBondContact O-N 3.02Å
317T46.9Very low63.2Low118 Ų11892.3 Ų92.372%0.72457%0.573SS**  trans-72.385.8168.545.50000110A314 G319A314-T317 PolarHBondContact O-N 3.24Å; A314-T317 PolarHBondContact O-OG1 3.04Å; T317-G319 PolarHBondContact O-N 2.62Å
318D40.3Very low61.6Low146 Ų14694.8 Ų94.878%0.78159%0.587SS**PPolyproline II helixtrans-62.6126.2169.3-75.2-36.6000109.8Q316Q316-D318 VanDerWaalsContact C-N 3.29Å; Q316-D318 PolarHBondContact O-N 3.02Å
319G36.3Very low59.9Low57 Ų5797.6 Ų97.659%0.58860%0.601SS**PPolyproline II helixtrans-60.6168.2173.200000112.9T317 Q321T317-G319 PolarHBondContact O-N 2.62Å; G319-Q321 PolarHBondContact O-N 3.07Å; G319-Q321 VanDerWaalsContact O-N 3.17Å
320P35.2Very low57.9Low133 Ų133104.1 Ų104.186%0.86464%0.641SS**PPolyproline II helixtrans-59.1123.9-175.523.4-31.3000110.4A322P320-A322 PolarHBondContact O-N 3.03Å
321Q36.8Very low55.7Low182 Ų182107.6 Ų107.685%0.8567%0.667SS**  trans-61.6104.3163.4-74-173.8-12.200107.3G319 E323G319-Q321 PolarHBondContact O-N 3.07Å; G319-Q321 VanDerWaalsContact O-N 3.17Å; Q321-E323 PolarHBondContact O-N 3.27Å
322A37.8Very low53.4Low100 Ų100106.5 Ų106.583%0.82667%0.669SS**  trans-67.7106.9161.300000106.7P320P320-A322 PolarHBondContact O-N 3.03Å
323E35.5Very low50.8Low174 Ų174113.5 Ų113.581%0.81371%0.709SS**  trans-66.6142165.1-72.9-173158.900109.4Q321Q321-E323 PolarHBondContact O-N 3.27Å
324P52.5Low48.1Very low202 Ų202120.6 Ų120.6100%1.31275%0.747SS**  trans-71.10-178.328.4-34.2000114.7

Retrieved 324 of 324 residues in 289.8 ms (Link to these results)