A0A077ZBU9_TRITR Loading...

SNARE domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZBU9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 274 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
1M44Very low57.4Low255 Ų255153.1 Ų153.1100%1.25679%0.792SS**  01000-82.8175.4165.300106.6
2A52.3Low56.4Low97 Ų97158.1 Ų158.180%0.80280%0.804SS**  trans-131.3135.3173.400000106
3N64.2Low55.5Low107 Ų107162.6 Ų162.657%0.57281%0.805SS**  trans-72.1124.5-171.7-147.512.4000108.9F5 E6N3-F5 PolarHBondContact O-N 3.47Å; N3-E6 PolarHBondContact ND2-OE2 2.89Å
4P67Low54.8Low107 Ų107157.3 Ų157.370%0.69580%0.8SS**THydrogen-bonded Turntrans-80.621.8-171.832.5-35.4000114.3
5F67.8Low54.6Low183 Ų183156.3 Ų156.380%0.80381%0.805SS**THydrogen-bonded Turntrans-130.26.5-173.8-58.2-68.4000114.3N3N3-F5 PolarHBondContact O-N 3.47Å
6E57Low54.3Low131 Ų131158.8 Ų158.861%0.61281%0.811SS**  trans-118.6140175.7-82.9160.8142.200108.3N3N3-E6 PolarHBondContact ND2-OE2 2.89Å
7D58.5Low54.1Low148 Ų148161.5 Ų161.579%0.79182%0.816SS**  trans83.2107-178.3-45-25.6000112.3
8D56.2Low53.6Low145 Ų145159.3 Ų159.378%0.77582%0.815SS**  cis-151.8122.237.4-70.4-51000111
9Y55.4Low52.9Low228 Ų228156.4 Ų156.489%0.89482%0.817SS**  trans-95.196.4160.9-76.6-91.6000108.1
10D56.9Low52.5Low157 Ų157153.5 Ų153.584%0.8482%0.817SS**  trans-165.6135.8166.7-81.8-41.6000105.7
11D52Low52Low126 Ų126150.8 Ų150.867%0.67482%0.816SS**  cis-161.1115.415.7169.424.2000105.3R13D11-R13 PolarHBondContact O-N 3.45Å
12F45Very low51.7Low213 Ų213149.3 Ų149.393%0.93480%0.803SS**  trans-89.383.8178.1-157.4-88.7000108.9
13R44.8Very low51.1Low217 Ų217147.1 Ų147.182%0.81979%0.79SS**  trans-122.597.6174.2-133179.2171.3103.20.2113D11D11-R13 PolarHBondContact O-N 3.45Å
14A46.2Very low50.2Low88 Ų88146.5 Ų146.573%0.72779%0.794SS**  trans-10.6117.3160.500000118.5
15T51.5Low49.2Very low143 Ų143152 Ų15288%0.87780%0.802SS**  trans-139.1103.9138.452.70000110.1
16Q50.4Low48.4Very low195 Ų195148.1 Ų148.191%0.91179%0.794SS**  trans-69129.2165.2-82.2174.7-7.900110.3
17K50.2Low48.2Very low206 Ų206151.2 Ų151.290%0.89681%0.805SS**  trans-160.7141.2133.7-110.8175.3-177.5-175.90111
18P45.4Very low47.5Very low121 Ų121148.5 Ų148.579%0.78680%0.796SS**  trans-109.8173.4-154.336.7-23.6000114.7
19A40Very low47.6Very low104 Ų104145.4 Ų145.486%0.8679%0.786SS**  trans78.677.5161.700000117.7
20A44.7Very low47.7Very low99 Ų99145 Ų14582%0.81878%0.782SS**SBendtrans-142.5127147.100000109.4
21A42.9Very low47.9Very low97 Ų97143.1 Ų143.180%0.80277%0.772SS**  trans59.389.9164.800000117.9G23A21-G23 PolarHBondContact O-N 2.56Å
22F37.2Very low48.4Very low224 Ų224144.7 Ų144.798%0.98277%0.773SS**  trans-68.376.1149.1-175-98.4000108.1
23G41Very low49.9Very low51 Ų51140.5 Ų140.553%0.52676%0.761SS.*  trans-107102.9171.600000107.9A21 Y25A21-G23 PolarHBondContact O-N 2.56Å; G23-Y25 PolarHBondContact O-N 3.26Å; G23-Y25 VanDerWaalsContact O-N 3.1Å
24S43.7Very low51.7Low93 Ų93135.1 Ų135.165%0.6575%0.745SS**  trans-39.2109174.3-177.40000112.7T26S24-T26 PolarHBondContact O-N 3.23Å; S24-T26 WeakPolarHBondContact OG-CG2 3.49Å; S24-T26 PolarHBondContact OG-N 2.96Å
25Y46.4Very low53.5Low223 Ų223133.2 Ų133.288%0.87573%0.73SS**  trans-74.881.9154-74.3-81.2000107G23 K27G23-Y25 PolarHBondContact O-N 3.26Å; G23-Y25 VanDerWaalsContact O-N 3.1Å; Y25-K27 PolarHBondContact O-N 3.13Å
26T51.3Low55.2Low102 Ų102129 Ų12963%0.62671%0.709SS**  trans-59.9123.1149.751.50000105.8S24 P28S24-T26 PolarHBondContact O-N 3.23Å; S24-T26 WeakPolarHBondContact OG-CG2 3.49Å; S24-T26 PolarHBondContact OG-N 2.96Å; T26-P28 WeakPolarHBondContact O-CD 3.37Å
27K52.6Low57Low196 Ų196126 Ų12685%0.85269%0.691SS**  trans-89.190.7159-70.2-175.9179-178.40105.9Y25Y25-K27 PolarHBondContact O-N 3.13Å
28P44.4Very low58.7Low90 Ų90122.2 Ų122.258%0.58467%0.671SS**  trans-83.5155.516737.6-33.5000108.5T26T26-P28 WeakPolarHBondContact O-CD 3.37Å
29S57.1Low60.7Low81 Ų81121.1 Ų121.157%0.56666%0.656SS**SBendtrans10011.2153-42.50000120.8
30R58Low63.1Low219 Ų219122.8 Ų122.883%0.82665%0.646SS**SBendtrans-108.5-39.7162.9-91.8-175.1168.2147.8-2.3113.5F32R30-F32 VanDerWaalsContact C-N 3.29Å; R30-F32 PolarHBondContact O-N 3.42Å
31D61.1Low65.2Low117 Ų117122 Ų12263%0.62663%0.625SS**Hα-helixtrans-70.3-24.9-175.7-51.5-33.2000113.3A35D31-A35 WeakPolarHBondContact O-CB 3.49Å; D31-A35 PolarHBondContact O-N 3.26Å; D31-A35 VanDerWaalsContact O-N 3.12Å
32F62.4Low67.3Low159 Ų159121.6 Ų121.670%0.69761%0.609SS**Hα-helixtrans-71.6-38.4-179.7-77-80.3000113.2R30 E34 A36R30-F32 VanDerWaalsContact C-N 3.29Å; R30-F32 PolarHBondContact O-N 3.42Å; F32-E34 VanDerWaalsContact C-N 3.35Å; F32-A36 PolarHBondContact O-N 3.01Å
33D77.5Confident69.8Low126 Ų126113.6 Ų113.667%0.67458%0.575SS**Hα-helixtrans-70.2-36179-69.7-21.6000111.1Y37D33-Y37 WeakPolarHBondContact O-CB 3.5Å; D33-Y37 PolarHBondContact O-N 3.32Å; D33-Y37 VanDerWaalsContact O-N 3.09Å
34E81.8Confident72.3Confident103 Ų103113.9 Ų113.948%0.48157%0.572SS.*Hα-helixtrans-68.7-44177.4-177.7168.2-172.500111.8F32 Y37 Y38F32-E34 VanDerWaalsContact C-N 3.35Å; E34-Y37 WeakPolarHBondContact O-CB 3.49Å; E34-Y37 PolarHBondContact O-N 3.45Å; E34-Y38 HydrophobicContact CG-CD2 3.82Å; E34-Y38 HydrophobicContact CG-CE2 3.37Å; E34-Y38 WeakPolarHBondContact O-CD2 3.33Å; E34-Y38 PolarHBondContact O-N 3.13Å
35A83.3Confident74.5Confident49 Ų49112.1 Ų112.141%0.40556%0.563SS.*Hα-helixtrans-60.8-47.1176.200000112.2D31 Y37 Y38 E39D31-A35 WeakPolarHBondContact O-CB 3.49Å; D31-A35 PolarHBondContact O-N 3.26Å; D31-A35 VanDerWaalsContact O-N 3.12Å; A35-Y37 VanDerWaalsContact C-N 3.3Å; A35-Y37 PolarHBondContact O-N 3.34Å; A35-Y38 PolarHBondContact O-N 3.41Å; A35-E39 WeakPolarHBondContact O-CG 3.41Å; A35-E39 PolarHBondContact O-N 3Å
36A87.6Confident76.7Confident55 Ų55102.5 Ų102.546%0.45553%0.526SS..Hα-helixtrans-62.1-38.1177.700000112.2F32 E39 Q40F32-A36 PolarHBondContact O-N 3.01Å; A36-E39 PolarHBondContact O-N 3.36Å; A36-Q40 WeakPolarHBondContact O-CB 3.25Å; A36-Q40 PolarHBondContact O-N 2.99Å
37Y88.3Confident78.7Confident132 Ų132103 Ų10352%0.51852%0.522SS..Hα-helixtrans-63.2-40.2175.3176.3-110.2000112.5D33 E34 A35 Q41D33-Y37 WeakPolarHBondContact O-CB 3.5Å; D33-Y37 PolarHBondContact O-N 3.32Å; D33-Y37 VanDerWaalsContact O-N 3.09Å; E34-Y37 WeakPolarHBondContact O-CB 3.49Å; E34-Y37 PolarHBondContact O-N 3.45Å; A35-Y37 VanDerWaalsContact C-N 3.3Å; A35-Y37 PolarHBondContact O-N 3.34Å; Y37-Q41 HydrophobicContact CE2-CG 4.46Å; Y37-Q41 VanDerWaalsContact CZ-NE2 3.26Å; Y37-Q41 WeakPolarHBondContact O-CG 3.37Å; Y37-Q41 PolarHBondContact O-N 2.99Å; Y37-Q41 PolarHBondContact O-NE2 2.88Å
38Y87Confident80.7Confident125 Ų12597 Ų9749%0.4951%0.505SS..Hα-helixtrans-70.7-41.5175.5-73.6-58.6000112.7E34 A35 Q40 Q41 I42E34-Y38 HydrophobicContact CG-CD2 3.82Å; E34-Y38 HydrophobicContact CG-CE2 3.37Å; E34-Y38 WeakPolarHBondContact O-CD2 3.33Å; E34-Y38 PolarHBondContact O-N 3.13Å; A35-Y38 PolarHBondContact O-N 3.41Å; Y38-Q40 VanDerWaalsContact C-N 3.33Å; Y38-Q40 PolarHBondContact O-N 3.18Å; Y38-Q41 PolarHBondContact O-N 3.09Å; Y38-I42 VanDerWaalsContact O-CG1 3.32Å; Y38-I42 WeakPolarHBondContact O-CG1 3.38Å; Y38-I42 PolarHBondContact O-N 3.33Å
39E87.3Confident83Confident99 Ų9995.2 Ų95.246%0.46349%0.494SS..Hα-helixtrans-58.1-45.6175.5-74.7-175.7172.400111.6A35 A36 Q41 I42 E43 W189A35-E39 WeakPolarHBondContact O-CG 3.41Å; A35-E39 PolarHBondContact O-N 3Å; A36-E39 PolarHBondContact O-N 3.36Å; E39-Q41 VanDerWaalsContact C-N 3.33Å; E39-Q41 PolarHBondContact O-N 3.36Å; E39-I42 PolarHBondContact O-N 3.44Å; E39-E43 WeakPolarHBondContact O-CB 3.41Å; E39-E43 PolarHBondContact O-N 2.72Å; E39-W189 HydrophobicContact CB-CZ2 4.09Å; E39-W189 HydrophobicContact CG-CH2 4.07Å; E39-W189 HydrophobicContact CG-CZ2 3.83Å
40Q89.1Confident84.8Confident139 Ų13993.6 Ų93.665%0.6548%0.479SS*.Hα-helixtrans-61.8-40.1177.4-173.3-178.93.300112.1A36 Y38 A44A36-Q40 WeakPolarHBondContact O-CB 3.25Å; A36-Q40 PolarHBondContact O-N 2.99Å; Y38-Q40 VanDerWaalsContact C-N 3.33Å; Y38-Q40 PolarHBondContact O-N 3.18Å; Q40-A44 VanDerWaalsContact O-CB 3.3Å; Q40-A44 WeakPolarHBondContact O-CB 3.36Å; Q40-A44 PolarHBondContact O-N 2.9Å
41Q88.4Confident86.6Confident82 Ų8285.8 Ų85.838%0.38346%0.457SS..Hα-helixtrans-68.5-41.7177.6-76.6177.997.900112.7Y37 Y38 E39 E43 A44 A45Y37-Q41 HydrophobicContact CE2-CG 4.46Å; Y37-Q41 VanDerWaalsContact CZ-NE2 3.26Å; Y37-Q41 WeakPolarHBondContact O-CG 3.37Å; Y37-Q41 PolarHBondContact O-N 2.99Å; Y37-Q41 PolarHBondContact O-NE2 2.88Å; Y38-Q41 PolarHBondContact O-N 3.09Å; E39-Q41 VanDerWaalsContact C-N 3.33Å; E39-Q41 PolarHBondContact O-N 3.36Å; Q41-E43 VanDerWaalsContact C-N 3.33Å; Q41-A44 PolarHBondContact O-N 3.47Å; Q41-A45 WeakPolarHBondContact O-CB 3.49Å; Q41-A45 PolarHBondContact O-N 2.93Å
42I87.5Confident88.2Confident89 Ų8982.6 Ų82.646%0.45645%0.445SS..Hα-helixtrans-61-46.4176.1-69.2165.8000109.7Y38 E39 A45 L46 W189Y38-I42 VanDerWaalsContact O-CG1 3.32Å; Y38-I42 WeakPolarHBondContact O-CG1 3.38Å; Y38-I42 PolarHBondContact O-N 3.33Å; E39-I42 PolarHBondContact O-N 3.44Å; I42-A45 PolarHBondContact O-N 3.31Å; I42-L46 HydrophobicContact CG2-CD1 3.91Å; I42-L46 HydrophobicContact CG2-CG 4.48Å; I42-L46 WeakPolarHBondContact O-CG 3.34Å; I42-L46 PolarHBondContact O-N 3.46Å; I42-W189 HydrophobicContact CG2-CG 4.41Å
43E90Very high89.8Confident56 Ų5675.5 Ų75.526%0.26241%0.414SS..Hα-helixtrans-61.6-46177.7-175.4-178.9144.200112E39 Q41 A45 L46 Q47 R188E39-E43 WeakPolarHBondContact O-CB 3.41Å; E39-E43 PolarHBondContact O-N 2.72Å; Q41-E43 VanDerWaalsContact C-N 3.33Å; E43-A45 VanDerWaalsContact C-N 3.3Å; E43-A45 PolarHBondContact O-N 3.43Å; E43-L46 PolarHBondContact O-N 2.96Å; E43-Q47 WeakPolarHBondContact O-CB 3.34Å; E43-Q47 PolarHBondContact O-N 3.17Å; E43-R188 IonicContact OE1-CZ 3.02Å; E43-R188 IonicContact OE1-NH1 2.69Å; E43-R188 PolarHBondContact OE1-NH1 3.2Å; E43-R188 IonicContact OE1-NH2 2.65Å; E43-R188 PolarHBondContact OE1-NH2 3.25Å; E43-R188 IonicContact OE2-CZ 3.54Å; E43-R188 IonicContact OE2-NH1 2.89Å; E43-R188 PolarHBondContact OE2-NH1 3.1Å; E43-R188 IonicContact OE2-NH2 3.87Å
44A92.5Very high90.6Very high56 Ų5671.1 Ų71.146%0.46340%0.399SS..Hα-helixtrans-60.9-40.2176.600000111.8Q40 Q41 S48Q40-A44 VanDerWaalsContact O-CB 3.3Å; Q40-A44 WeakPolarHBondContact O-CB 3.36Å; Q40-A44 PolarHBondContact O-N 2.9Å; Q41-A44 PolarHBondContact O-N 3.47Å; A44-S48 VanDerWaalsContact O-CB 3.29Å; A44-S48 WeakPolarHBondContact O-CB 3.42Å; A44-S48 PolarHBondContact O-N 3.49Å
45A90.7Very high91.3Very high56 Ų5674.3 Ų74.346%0.46341%0.406SS..Hα-helixtrans-64.6-46.8176.300000111.7Q41 I42 E43 S48 S49Q41-A45 WeakPolarHBondContact O-CB 3.49Å; Q41-A45 PolarHBondContact O-N 2.93Å; I42-A45 PolarHBondContact O-N 3.31Å; E43-A45 VanDerWaalsContact C-N 3.3Å; E43-A45 PolarHBondContact O-N 3.43Å; A45-S48 PolarHBondContact O-N 2.95Å; A45-S49 WeakPolarHBondContact O-CB 3.4Å; A45-S49 PolarHBondContact O-N 2.97Å; A45-S49 PolarHBondContact O-OG 3.46Å; A45-S49 VanDerWaalsContact O-OG 3.12Å
46L91.8Very high92Very high22 Ų2273.8 Ų73.812%0.11540%0.4CS..Hα-helixtrans-63.7-42.1177.6-70.9168.6000111.7I42 E43 S48 S49 L50 W189 M192 I196I42-L46 HydrophobicContact CG2-CD1 3.91Å; I42-L46 HydrophobicContact CG2-CG 4.48Å; I42-L46 WeakPolarHBondContact O-CG 3.34Å; I42-L46 PolarHBondContact O-N 3.46Å; E43-L46 PolarHBondContact O-N 2.96Å; L46-S48 VanDerWaalsContact C-N 3.35Å; L46-S48 PolarHBondContact O-N 3Å; L46-S49 WeakPolarHBondContact O-CB 3.43Å; L46-S49 PolarHBondContact O-N 3.48Å; L46-L50 WeakPolarHBondContact O-CB 3.41Å; L46-L50 PolarHBondContact O-N 2.99Å; L46-W189 HydrophobicContact CD1-CB 3.81Å; L46-W189 HydrophobicContact CD1-CG 4.18Å; L46-M192 HydrophobicContact CB-CB 4.24Å; L46-M192 HydrophobicContact CB-CE 3.64Å; L46-M192 HydrophobicContact CB-SD 4.24Å; L46-M192 HydrophobicContact CD1-CB 4.37Å; L46-I196 HydrophobicContact CB-CD1 4.44Å; L46-I196 HydrophobicContact CD2-CD1 3.72Å
47Q93.9Very high92.3Very high113 Ų11372 Ų7253%0.52838%0.383SS..Hα-helixtrans-65.1-41.3177.7-172.7175.7-0.600111.5E43 L50 S51 M192E43-Q47 WeakPolarHBondContact O-CB 3.34Å; E43-Q47 PolarHBondContact O-N 3.17Å; Q47-L50 PolarHBondContact O-N 3.49Å; Q47-S51 PolarHBondContact O-N 3.18Å; Q47-M192 HydrophobicContact CB-CE 3.85Å; Q47-M192 VanDerWaalsContact N-CE 3.3Å
48S94.4Very high92.7Very high70 Ų7068.3 Ų68.349%0.4938%0.379SS..Hα-helixtrans-59.9-46.6172.7-179.90000110.9A44 A45 L46 S51 S52A44-S48 VanDerWaalsContact O-CB 3.29Å; A44-S48 WeakPolarHBondContact O-CB 3.42Å; A44-S48 PolarHBondContact O-N 3.49Å; A45-S48 PolarHBondContact O-N 2.95Å; L46-S48 VanDerWaalsContact C-N 3.35Å; L46-S48 PolarHBondContact O-N 3Å; S48-S51 PolarHBondContact O-N 3.42Å; S48-S51 PolarHBondContact O-OG 3.39Å; S48-S52 WeakPolarHBondContact O-CB 3.5Å; S48-S52 PolarHBondContact O-N 2.91Å
49S94.1Very high93.1Very high52 Ų5264.9 Ų64.936%0.36438%0.376SS..Hα-helixtrans-59.5-47.5177.6-690000112.4A45 L46 S51 S52 T53A45-S49 WeakPolarHBondContact O-CB 3.4Å; A45-S49 PolarHBondContact O-N 2.97Å; A45-S49 PolarHBondContact O-OG 3.46Å; A45-S49 VanDerWaalsContact O-OG 3.12Å; L46-S49 WeakPolarHBondContact O-CB 3.43Å; L46-S49 PolarHBondContact O-N 3.48Å; S49-S51 PolarHBondContact O-N 3.14Å; S49-S52 CarbonylContact O-C 3.59Å; S49-S52 WeakPolarHBondContact O-CA 3.29Å; S49-S52 WeakPolarHBondContact O-CB 3.46Å; S49-S52 PolarHBondContact O-N 3.42Å; S49-T53 WeakPolarHBondContact O-CG2 3.48Å; S49-T53 PolarHBondContact O-N 2.84Å; S49-T53 PolarHBondContact O-OG1 2.99Å
50L94.2Very high93.5Very high47 Ų4761.3 Ų61.325%0.24636%0.36CS..Hα-helixtrans-60.2-44.2177.4-172.3158.6000111.8L46 Q47 S52 T53 G54 E195 I196L46-L50 WeakPolarHBondContact O-CB 3.41Å; L46-L50 PolarHBondContact O-N 2.99Å; Q47-L50 PolarHBondContact O-N 3.49Å; L50-S52 VanDerWaalsContact C-N 3.25Å; L50-S52 PolarHBondContact O-N 3.4Å; L50-T53 PolarHBondContact O-N 2.89Å; L50-T53 PolarHBondContact O-OG1 3.39Å; L50-G54 PolarHBondContact O-N 3.45Å; L50-E195 VanDerWaalsContact CD1-CD 3.41Å; L50-E195 HydrophobicContact CD1-CG 4.23Å; L50-E195 WeakPolarHBondContact CD1-OE1 3.4Å; L50-E195 WeakPolarHBondContact CD1-OE2 3.48Å; L50-I196 HydrophobicContact CB-CG1 4.31Å
51S95.6Very high93.6Very high54 Ų5459.8 Ų59.838%0.37835%0.353SS..Hα-helixtrans-63.7-34174.678.40000112.3Q47 S48 S49 R55Q47-S51 PolarHBondContact O-N 3.18Å; S48-S51 PolarHBondContact O-N 3.42Å; S48-S51 PolarHBondContact O-OG 3.39Å; S49-S51 PolarHBondContact O-N 3.14Å; S51-R55 WeakPolarHBondContact O-CG 3.34Å; S51-R55 PolarHBondContact O-N 2.9Å; S51-R55 VanDerWaalsContact O-N 3.16Å
52S95.7Very high93.9Very high51 Ų5162 Ų6236%0.35736%0.364SS..Hα-helixtrans-73.1-44.3179.5-166.40000112S48 S49 L50 R55 S56S48-S52 WeakPolarHBondContact O-CB 3.5Å; S48-S52 PolarHBondContact O-N 2.91Å; S49-S52 CarbonylContact O-C 3.59Å; S49-S52 WeakPolarHBondContact O-CA 3.29Å; S49-S52 WeakPolarHBondContact O-CB 3.46Å; S49-S52 PolarHBondContact O-N 3.42Å; L50-S52 VanDerWaalsContact C-N 3.25Å; L50-S52 PolarHBondContact O-N 3.4Å; S52-R55 PolarHBondContact O-N 3.07Å; S52-S56 WeakPolarHBondContact O-CB 3.36Å; S52-S56 PolarHBondContact O-N 3.18Å; S52-S56 PolarHBondContact O-OG 3.47Å
53T95.6Very high94.3Very high10 Ų1059.8 Ų59.86%0.06136%0.359CS..Hα-helixtrans-65.2-41.6176.755.30000110.8S49 L50 R55 S56 I57 I196 N199 L200 M203S49-T53 WeakPolarHBondContact O-CG2 3.48Å; S49-T53 PolarHBondContact O-N 2.84Å; S49-T53 PolarHBondContact O-OG1 2.99Å; L50-T53 PolarHBondContact O-N 2.89Å; L50-T53 PolarHBondContact O-OG1 3.39Å; T53-R55 PolarHBondContact O-N 3.26Å; T53-S56 WeakPolarHBondContact O-CB 3.41Å; T53-S56 PolarHBondContact O-N 3.06Å; T53-S56 VanDerWaalsContact O-N 3.12Å; T53-I57 WeakPolarHBondContact O-CG1 3.35Å; T53-I57 PolarHBondContact O-N 3.25Å; T53-I196 HydrophobicContact CG2-CG2 4.33Å; T53-N199 HydrophobicContact CG2-CB 4.28Å; T53-N199 PolarHBondContact OG1-ND2 3.16Å; T53-L200 HydrophobicContact CG2-CD2 4.23Å; T53-L200 HydrophobicContact CG2-CG 4.47Å; T53-M203 HydrophobicContact CG2-SD 4.21Å
54G94.9Very high94.4Very high34 Ų3457.5 Ų57.535%0.35135%0.348SS..Hα-helixtrans-59.4-46.5174.900000113.1L50 S56 I57 A58L50-G54 PolarHBondContact O-N 3.45Å; G54-S56 VanDerWaalsContact C-N 3.3Å; G54-S56 PolarHBondContact O-N 2.74Å; G54-I57 PolarHBondContact O-N 3.36Å; G54-A58 PolarHBondContact O-N 3.27Å; G54-A58 VanDerWaalsContact O-N 3.12Å
55R96.7Very high94.4Very high170 Ų17061.9 Ų61.964%0.64236%0.359SS*.Hα-helixtrans-61.8-38.4173.4-73.6-175.2-60.6-160.51.9112.4S51 S52 T53 A58 A59S51-R55 WeakPolarHBondContact O-CG 3.34Å; S51-R55 PolarHBondContact O-N 2.9Å; S51-R55 VanDerWaalsContact O-N 3.16Å; S52-R55 PolarHBondContact O-N 3.07Å; T53-R55 PolarHBondContact O-N 3.26Å; R55-A58 PolarHBondContact O-N 3.14Å; R55-A59 WeakPolarHBondContact O-CB 3.29Å; R55-A59 PolarHBondContact O-N 2.88Å
56S96.4Very high94.7Very high38 Ų3863.6 Ų63.627%0.26636%0.363SS..Hα-helixtrans-67.9-41.7180-57.90000111.6S52 T53 G54 A59 L60S52-S56 WeakPolarHBondContact O-CB 3.36Å; S52-S56 PolarHBondContact O-N 3.18Å; S52-S56 PolarHBondContact O-OG 3.47Å; T53-S56 WeakPolarHBondContact O-CB 3.41Å; T53-S56 PolarHBondContact O-N 3.06Å; T53-S56 VanDerWaalsContact O-N 3.12Å; G54-S56 VanDerWaalsContact C-N 3.3Å; G54-S56 PolarHBondContact O-N 2.74Å; S56-A59 PolarHBondContact O-N 3.08Å; S56-L60 WeakPolarHBondContact O-CB 3.42Å; S56-L60 WeakPolarHBondContact O-CG 3.42Å; S56-L60 PolarHBondContact O-N 3.48Å
57I95.1Very high94.8Very high18 Ų1863 Ų639%0.09236%0.363CS..Hα-helixtrans-59.8-48.7174.4-69.9168.3000110.4T53 G54 A59 L60 Q61 N199 I202 M203T53-I57 WeakPolarHBondContact O-CG1 3.35Å; T53-I57 PolarHBondContact O-N 3.25Å; G54-I57 PolarHBondContact O-N 3.36Å; I57-A59 VanDerWaalsContact C-N 3.34Å; I57-A59 PolarHBondContact O-N 2.99Å; I57-L60 PolarHBondContact O-N 2.73Å; I57-Q61 HydrophobicContact CG2-CG 4.38Å; I57-Q61 WeakPolarHBondContact O-CG 3.33Å; I57-Q61 PolarHBondContact O-N 3.14Å; I57-N199 HydrophobicContact CD1-CB 3.72Å; I57-N199 VanDerWaalsContact CD1-OD1 3.23Å; I57-N199 WeakPolarHBondContact CD1-OD1 3.33Å; I57-I202 HydrophobicContact CD1-CB 4.18Å; I57-I202 HydrophobicContact CD1-CD1 4.4Å; I57-I202 HydrophobicContact CD1-CG2 4.09Å; I57-I202 HydrophobicContact CG1-CG2 4.13Å; I57-I202 HydrophobicContact CG2-CG2 4.14Å; I57-M203 HydrophobicContact CD1-CG 4.41Å; I57-M203 HydrophobicContact CG1-CG 3.55Å; I57-M203 HydrophobicContact CG1-SD 4.38Å
58A95.6Very high94.8Very high53 Ų5358.7 Ų58.744%0.43834%0.343SS..Hα-helixtrans-58.3-46.1178.100000111.6G54 R55 L60 Q61 E62G54-A58 PolarHBondContact O-N 3.27Å; G54-A58 VanDerWaalsContact O-N 3.12Å; R55-A58 PolarHBondContact O-N 3.14Å; A58-L60 VanDerWaalsContact C-N 3.34Å; A58-L60 PolarHBondContact O-N 2.96Å; A58-Q61 PolarHBondContact O-N 3.31Å; A58-E62 WeakPolarHBondContact O-CB 3.44Å; A58-E62 PolarHBondContact O-N 2.83Å
59A96.7Very high94.8Very high53 Ų5356.8 Ų56.844%0.43834%0.335SS..Hα-helixtrans-63.7-37177.100000112.9R55 S56 I57 A63R55-A59 WeakPolarHBondContact O-CB 3.29Å; R55-A59 PolarHBondContact O-N 2.88Å; S56-A59 PolarHBondContact O-N 3.08Å; I57-A59 VanDerWaalsContact C-N 3.34Å; I57-A59 PolarHBondContact O-N 2.99Å; A59-A63 WeakPolarHBondContact O-CB 3.45Å; A59-A63 PolarHBondContact O-N 3.34Å
60L94.3Very high94.8Very high24 Ų2457.4 Ų57.413%0.12634%0.336CS..Hα-helixtrans-70.3-37.9177.2-71.3166.7000112S56 I57 A58 A63 E64 M203 N206 L207 L210S56-L60 WeakPolarHBondContact O-CB 3.42Å; S56-L60 WeakPolarHBondContact O-CG 3.42Å; S56-L60 PolarHBondContact O-N 3.48Å; I57-L60 PolarHBondContact O-N 2.73Å; A58-L60 VanDerWaalsContact C-N 3.34Å; A58-L60 PolarHBondContact O-N 2.96Å; L60-A63 PolarHBondContact O-N 2.83Å; L60-E64 WeakPolarHBondContact O-CB 3.39Å; L60-E64 PolarHBondContact O-N 2.78Å; L60-M203 HydrophobicContact CD1-CB 3.89Å; L60-M203 HydrophobicContact CD1-CE 4.48Å; L60-M203 HydrophobicContact CD1-CG 3.83Å; L60-N206 HydrophobicContact CB-CB 3.87Å; L60-N206 HydrophobicContact CD1-CB 4.11Å; L60-N206 HydrophobicContact CG-CB 4.48Å; L60-L207 HydrophobicContact CD1-CG 4.31Å; L60-L207 HydrophobicContact CD2-CD2 3.57Å; L60-L207 HydrophobicContact CD2-CG 4.06Å; L60-L210 HydrophobicContact CB-CD1 4.4Å; L60-L210 HydrophobicContact CD2-CD1 3.46Å; L60-L210 VanDerWaalsContact CD2-CD1 3.46Å
61Q92.1Very high94.8Very high107 Ų10755.1 Ų55.150%0.533%0.325SS..Hα-helixtrans-66.2-43.1174.8-73.4175.4-25.900111.3I57 A58 E64 E65I57-Q61 HydrophobicContact CG2-CG 4.38Å; I57-Q61 WeakPolarHBondContact O-CG 3.33Å; I57-Q61 PolarHBondContact O-N 3.14Å; A58-Q61 PolarHBondContact O-N 3.31Å; Q61-E64 PolarHBondContact O-N 3.33Å; Q61-E65 PolarHBondContact O-N 2.9Å
62E94.4Very high94.7Very high129 Ų12956.6 Ų56.660%0.60333%0.326SS*.Hα-helixtrans-60.6-44.8173.3-176.4179.6-17500111.2A58 E64 E65 V66A58-E62 WeakPolarHBondContact O-CB 3.44Å; A58-E62 PolarHBondContact O-N 2.83Å; E62-E64 VanDerWaalsContact C-N 3.3Å; E62-E64 PolarHBondContact O-N 3Å; E62-E65 PolarHBondContact O-N 3.14Å; E62-V66 WeakPolarHBondContact O-CG2 3.33Å; E62-V66 PolarHBondContact O-N 2.91Å
63A95.5Very high94.6Very high43 Ų4359 Ų5936%0.35533%0.334SS..Hα-helixtrans-61.9-37.2176.100000112.5A59 L60 G67 L210A59-A63 WeakPolarHBondContact O-CB 3.45Å; A59-A63 PolarHBondContact O-N 3.34Å; L60-A63 PolarHBondContact O-N 2.83Å; A63-G67 PolarHBondContact O-N 3.29Å; A63-L210 HydrophobicContact CB-CD1 4.2Å; A63-L210 HydrophobicContact CB-CD2 4.09Å
64E92.1Very high94.5Very high7 Ų759.5 Ų59.53%0.03334%0.336CS..Hα-helixtrans-67.2-44.6176.6-176.8177.9172.200111.2L60 Q61 E62 G67 L68 I152 T156 R209 L210L60-E64 WeakPolarHBondContact O-CB 3.39Å; L60-E64 PolarHBondContact O-N 2.78Å; Q61-E64 PolarHBondContact O-N 3.33Å; E62-E64 VanDerWaalsContact C-N 3.3Å; E62-E64 PolarHBondContact O-N 3Å; E64-G67 PolarHBondContact O-N 3.1Å; E64-L68 HydrophobicContact CG-CD1 4.06Å; E64-L68 HydrophobicContact CG-CG 4.39Å; E64-L68 WeakPolarHBondContact O-CB 3.47Å; E64-L68 VanDerWaalsContact O-CG 3.27Å; E64-L68 WeakPolarHBondContact O-CG 3.43Å; E64-L68 PolarHBondContact O-N 3Å; E64-I152 HydrophobicContact CG-CG2 4.3Å; E64-I152 WeakPolarHBondContact OE1-CG2 3.44Å; E64-T156 PolarHBondContact OE1-OG1 3.44Å; E64-R209 IonicContact OE1-CZ 3.55Å; E64-R209 IonicContact OE1-NE 3.41Å; E64-R209 PolarHBondContact OE1-NE 3.16Å; E64-R209 IonicContact OE1-NH2 3.1Å; E64-R209 IonicContact OE2-CZ 3.11Å; E64-R209 IonicContact OE2-NE 3.77Å; E64-R209 PolarHBondContact OE2-NE 3.47Å; E64-R209 IonicContact OE2-NH2 3.09Å; E64-R209 PolarHBondContact OE2-NH2 3.22Å; E64-L210 HydrophobicContact CB-CD2 4.14Å
65E93.1Very high94.3Very high149 Ų14958.4 Ų58.470%0.69632%0.323SS*.Hα-helixtrans-59.9-49176.1-175.7177.518000111.5Q61 E62 G67 L68 G69Q61-E65 PolarHBondContact O-N 2.9Å; E62-E65 PolarHBondContact O-N 3.14Å; E65-G67 VanDerWaalsContact C-N 3.32Å; E65-G67 PolarHBondContact O-N 3.17Å; E65-L68 PolarHBondContact O-N 3.42Å; E65-G69 PolarHBondContact O-N 3.37Å
66V95.6Very high94.1Very high91 Ų9153.5 Ų53.555%0.55231%0.311SS*.Hα-helixtrans-60.9-42.8176.5172.30000111E62 G69 T70E62-V66 WeakPolarHBondContact O-CG2 3.33Å; E62-V66 PolarHBondContact O-N 2.91Å; V66-G69 PolarHBondContact O-N 3.49Å; V66-T70 WeakPolarHBondContact O-CB 3.15Å; V66-T70 PolarHBondContact O-N 3.41Å; V66-T70 PolarHBondContact O-OG1 3.11Å
67G94.8Very high93.8Very high11 Ų1156.3 Ų56.311%0.11332%0.32CS..Hα-helixtrans-63.1-43.2177.300000112.5A63 E64 E65 T70 A71A63-G67 PolarHBondContact O-N 3.29Å; E64-G67 PolarHBondContact O-N 3.1Å; E65-G67 VanDerWaalsContact C-N 3.32Å; E65-G67 PolarHBondContact O-N 3.17Å; G67-T70 PolarHBondContact O-N 2.93Å; G67-A71 WeakPolarHBondContact O-CB 3.16Å; G67-A71 PolarHBondContact O-N 2.96Å
68L94.1Very high93.5Very high21 Ų2155.5 Ų55.511%0.1132%0.317CS..Hα-helixtrans-68.4-35.7178.5-74.6173.9000112E64 E65 Q72 V149 I152 K153 L213E64-L68 HydrophobicContact CG-CD1 4.06Å; E64-L68 HydrophobicContact CG-CG 4.39Å; E64-L68 WeakPolarHBondContact O-CB 3.47Å; E64-L68 VanDerWaalsContact O-CG 3.27Å; E64-L68 WeakPolarHBondContact O-CG 3.43Å; E64-L68 PolarHBondContact O-N 3Å; E65-L68 PolarHBondContact O-N 3.42Å; L68-Q72 WeakPolarHBondContact O-CG 3.42Å; L68-Q72 PolarHBondContact O-N 3.38Å; L68-Q72 VanDerWaalsContact O-N 3.14Å; L68-Q72 PolarHBondContact O-NE2 3.29Å; L68-V149 HydrophobicContact CD2-CB 4.45Å; L68-V149 HydrophobicContact CD2-CG1 4.12Å; L68-V149 HydrophobicContact CD2-CG2 4.29Å; L68-I152 HydrophobicContact CD1-CG2 4.17Å; L68-I152 HydrophobicContact CD2-CB 4.26Å; L68-I152 HydrophobicContact CD2-CG2 3.88Å; L68-I152 HydrophobicContact CG-CG2 4.36Å; L68-K153 HydrophobicContact CD1-CG 4.45Å; L68-L213 HydrophobicContact CD2-CD1 4.31Å; L68-L213 HydrophobicContact CD2-CD2 4.42Å; L68-L213 HydrophobicContact CG-CD2 4.37Å
69G94.4Very high93.3Very high30 Ų3057.9 Ų57.931%0.30932%0.318SS..Hα-helixtrans-63-49.5170.700000111.3E65 V66 A71 Q72 D73E65-G69 PolarHBondContact O-N 3.37Å; V66-G69 PolarHBondContact O-N 3.49Å; G69-A71 VanDerWaalsContact C-N 3.28Å; G69-A71 PolarHBondContact O-N 3.19Å; G69-Q72 PolarHBondContact O-N 3.29Å; G69-D73 PolarHBondContact O-N 3.43Å
70T95.1Very high93Very high65 Ų6561.5 Ų61.540%0.39933%0.325SS..Hα-helixtrans-58.4-41.2176.6-56.30000111.7V66 G67 D73 L74 L217V66-T70 WeakPolarHBondContact O-CB 3.15Å; V66-T70 PolarHBondContact O-N 3.41Å; V66-T70 PolarHBondContact O-OG1 3.11Å; G67-T70 PolarHBondContact O-N 2.93Å; T70-D73 PolarHBondContact O-N 3.19Å; T70-L74 PolarHBondContact O-N 3.44Å; T70-L217 HydrophobicContact CG2-CD2 4.3Å
71A94.1Very high92.8Very high0 Ų062.1 Ų62.10%033%0.328CS..Hα-helixtrans-63.4-43178.300000112.3G67 G69 D73 L74 I75 L145 V149 L213 L217G67-A71 WeakPolarHBondContact O-CB 3.16Å; G67-A71 PolarHBondContact O-N 2.96Å; G69-A71 VanDerWaalsContact C-N 3.28Å; G69-A71 PolarHBondContact O-N 3.19Å; A71-D73 VanDerWaalsContact C-N 3.33Å; A71-D73 PolarHBondContact O-N 2.9Å; A71-L74 PolarHBondContact O-N 3.23Å; A71-I75 WeakPolarHBondContact O-CD1 3.48Å; A71-I75 VanDerWaalsContact O-CG1 3.23Å; A71-I75 WeakPolarHBondContact O-CG1 3.49Å; A71-I75 PolarHBondContact O-N 2.77Å; A71-L145 HydrophobicContact CB-CD1 3.81Å; A71-L145 HydrophobicContact CB-CD2 4.12Å; A71-L145 HydrophobicContact CB-CG 4.09Å; A71-V149 HydrophobicContact CB-CG2 3.4Å; A71-L213 HydrophobicContact CB-CD1 3.93Å; A71-L217 HydrophobicContact CB-CD2 3.75Å
72Q93.1Very high92.7Very high85 Ų8561.2 Ų61.240%0.39732%0.324SS..Hα-helixtrans-62.1-42.4175.4-74.5167.872.800111.6L68 G69 L74 I75 V76L68-Q72 WeakPolarHBondContact O-CG 3.42Å; L68-Q72 PolarHBondContact O-N 3.38Å; L68-Q72 VanDerWaalsContact O-N 3.14Å; L68-Q72 PolarHBondContact O-NE2 3.29Å; G69-Q72 PolarHBondContact O-N 3.29Å; Q72-L74 PolarHBondContact O-N 2.71Å; Q72-I75 PolarHBondContact O-N 3.4Å; Q72-V76 WeakPolarHBondContact O-CG2 3.4Å; Q72-V76 PolarHBondContact O-N 2.8Å
73D93.2Very high92.4Very high100 Ų10057.9 Ų57.954%0.53531%0.31SS..Hα-helixtrans-61.9-43.8175.8-77-18.5000111.8G69 T70 A71 V76 Q77G69-D73 PolarHBondContact O-N 3.43Å; T70-D73 PolarHBondContact O-N 3.19Å; A71-D73 VanDerWaalsContact C-N 3.33Å; A71-D73 PolarHBondContact O-N 2.9Å; D73-V76 PolarHBondContact O-N 2.8Å; D73-Q77 WeakPolarHBondContact O-CB 3.29Å; D73-Q77 WeakPolarHBondContact O-CG 3.42Å; D73-Q77 PolarHBondContact O-N 2.77Å
74L92.9Very high92.2Very high21 Ų2158.8 Ų58.811%0.1131%0.311CS..Hα-helixtrans-63.4-40.8175.8-75.5-177.8000112.1T70 A71 Q72 V76 Q77 G78 L145 L217 E220 V221 Q224T70-L74 PolarHBondContact O-N 3.44Å; A71-L74 PolarHBondContact O-N 3.23Å; Q72-L74 PolarHBondContact O-N 2.71Å; L74-V76 PolarHBondContact O-N 2.65Å; L74-Q77 PolarHBondContact O-N 3.33Å; L74-G78 PolarHBondContact O-N 3.13Å; L74-L145 HydrophobicContact CB-CD2 3.88Å; L74-L145 HydrophobicContact CD1-CD2 4.36Å; L74-L217 HydrophobicContact CD1-CD2 3.57Å; L74-E220 HydrophobicContact CB-CG 4.17Å; L74-V221 HydrophobicContact CD1-CG2 3.76Å; L74-V221 HydrophobicContact CD2-CG2 4.26Å; L74-Q224 PolarHBondContact O-NE2 2.9Å
75I91.2Very high92.2Very high12 Ų1260.1 Ų60.16%0.06232%0.318CS..Hα-helixtrans-59-49.7176.1-69.4157.4000110.1A71 Q72 Q77 G78 E79 L145 Q146 V149A71-I75 WeakPolarHBondContact O-CD1 3.48Å; A71-I75 VanDerWaalsContact O-CG1 3.23Å; A71-I75 WeakPolarHBondContact O-CG1 3.49Å; A71-I75 PolarHBondContact O-N 2.77Å; Q72-I75 PolarHBondContact O-N 3.4Å; I75-Q77 VanDerWaalsContact C-N 3.33Å; I75-Q77 PolarHBondContact O-N 3.04Å; I75-G78 PolarHBondContact O-N 3.35Å; I75-E79 WeakPolarHBondContact O-CG 3.37Å; I75-E79 PolarHBondContact O-N 2.73Å; I75-L145 HydrophobicContact CD1-CD2 4.35Å; I75-L145 HydrophobicContact CD1-CG 4.04Å; I75-L145 HydrophobicContact CG1-CB 4.29Å; I75-L145 HydrophobicContact CG1-CD2 3.89Å; I75-L145 HydrophobicContact CG1-CG 3.99Å; I75-Q146 HydrophobicContact CD1-CB 4.07Å; I75-V149 HydrophobicContact CD1-CG2 4.19Å
76V91.9Very high92Very high66 Ų6658.5 Ų58.540%0.431%0.306SS..Hα-helixtrans-62.8-39.1178.3172.40000111.6Q72 D73 L74 K80Q72-V76 WeakPolarHBondContact O-CG2 3.4Å; Q72-V76 PolarHBondContact O-N 2.8Å; D73-V76 PolarHBondContact O-N 2.8Å; L74-V76 PolarHBondContact O-N 2.65Å; V76-K80 HydrophobicContact CG1-CD 4.37Å; V76-K80 WeakPolarHBondContact O-CG 3.2Å; V76-K80 PolarHBondContact O-N 3.11Å; V76-K80 VanDerWaalsContact O-N 3.14Å
77Q90.3Very high91.8Very high97 Ų9758.9 Ų58.945%0.45330%0.3SS..Hα-helixtrans-66.8-41.5175.8-73.5175.243.700112D73 L74 I75 E79 K80 L81D73-Q77 WeakPolarHBondContact O-CB 3.29Å; D73-Q77 WeakPolarHBondContact O-CG 3.42Å; D73-Q77 PolarHBondContact O-N 2.77Å; L74-Q77 PolarHBondContact O-N 3.33Å; I75-Q77 VanDerWaalsContact C-N 3.33Å; I75-Q77 PolarHBondContact O-N 3.04Å; Q77-E79 PolarHBondContact O-N 3.25Å; Q77-K80 WeakPolarHBondContact O-CB 3.37Å; Q77-K80 PolarHBondContact O-N 3.39Å; Q77-L81 PolarHBondContact O-N 3.35Å
78G90.2Very high91.6Very high2 Ų259.2 Ų59.22%0.02130%0.299CS..Hα-helixtrans-59-46.3175.500000111.6L74 I75 K80 L81 Q82L74-G78 PolarHBondContact O-N 3.13Å; I75-G78 PolarHBondContact O-N 3.35Å; G78-K80 VanDerWaalsContact C-N 3.33Å; G78-K80 PolarHBondContact O-N 3.02Å; G78-L81 PolarHBondContact O-N 3.34Å; G78-Q82 WeakPolarHBondContact O-CG 3.38Å; G78-Q82 PolarHBondContact O-N 3.14Å
79E90.2Very high91.4Very high102 Ų10259.3 Ų59.348%0.47731%0.305SS..Hα-helixtrans-59.5-42.7174.5-71.5-173.6164.800112.3I75 Q77 Q82 N83I75-E79 WeakPolarHBondContact O-CG 3.37Å; I75-E79 PolarHBondContact O-N 2.73Å; Q77-E79 PolarHBondContact O-N 3.25Å; E79-Q82 PolarHBondContact O-N 3.36Å; E79-N83 WeakPolarHBondContact O-CB 3.41Å; E79-N83 PolarHBondContact O-N 3.41Å
80K90.8Very high91.2Very high130 Ų13060 Ų6057%0.56530%0.3SS*.Hα-helixtrans-62.5-46176.6-73.3169.5-176.7171.10111.3V76 Q77 G78 N83 V84V76-K80 HydrophobicContact CG1-CD 4.37Å; V76-K80 WeakPolarHBondContact O-CG 3.2Å; V76-K80 PolarHBondContact O-N 3.11Å; V76-K80 VanDerWaalsContact O-N 3.14Å; Q77-K80 WeakPolarHBondContact O-CB 3.37Å; Q77-K80 PolarHBondContact O-N 3.39Å; G78-K80 VanDerWaalsContact C-N 3.33Å; G78-K80 PolarHBondContact O-N 3.02Å; K80-N83 PolarHBondContact O-N 3.19Å; K80-V84 WeakPolarHBondContact O-CG2 3.37Å; K80-V84 PolarHBondContact O-N 3.13Å
81L89.9Confident90.9Very high36 Ų3660.1 Ų60.119%0.18830%0.297CS..Hα-helixtrans-62.4-43.3177.9-75.1171.8000111.7Q77 G78 N83 V84 D85 Q224 L227 I228Q77-L81 PolarHBondContact O-N 3.35Å; G78-L81 PolarHBondContact O-N 3.34Å; L81-N83 VanDerWaalsContact C-N 3.31Å; L81-N83 PolarHBondContact O-N 3.4Å; L81-V84 PolarHBondContact O-N 3.4Å; L81-D85 PolarHBondContact O-N 3.44Å; L81-Q224 HydrophobicContact CD1-CB 4.05Å; L81-Q224 HydrophobicContact CD1-CG 4.15Å; L81-L227 HydrophobicContact CB-CD2 3.59Å; L81-L227 HydrophobicContact CB-CG 4.22Å; L81-I228 HydrophobicContact CD1-CD1 4.09Å; L81-I228 HydrophobicContact CD1-CG1 3.79Å; L81-I228 HydrophobicContact CD2-CG1 3.87Å
82Q89.5Confident90.7Very high89 Ų8962.6 Ų62.642%0.41631%0.309SS..Hα-helixtrans-62.4-39.8175.4-72.2179.85.200111.8G78 E79 D85 R86 L227G78-Q82 WeakPolarHBondContact O-CG 3.38Å; G78-Q82 PolarHBondContact O-N 3.14Å; E79-Q82 PolarHBondContact O-N 3.36Å; Q82-D85 PolarHBondContact O-N 2.8Å; Q82-R86 WeakPolarHBondContact O-CB 3.43Å; Q82-R86 PolarHBondContact O-N 3.28Å; Q82-L227 HydrophobicContact CG-CD2 3.77Å
83N89.6Confident90.6Very high59 Ų5962.4 Ų62.432%0.31631%0.311SS..Hα-helixtrans-65.6-38.4175.3-177.754.9000112.2E79 K80 L81 R86 K87E79-N83 WeakPolarHBondContact O-CB 3.41Å; E79-N83 PolarHBondContact O-N 3.41Å; K80-N83 PolarHBondContact O-N 3.19Å; L81-N83 VanDerWaalsContact C-N 3.31Å; L81-N83 PolarHBondContact O-N 3.4Å; N83-R86 PolarHBondContact OD1-NH2 2.93Å; N83-K87 VanDerWaalsContact ND2-CE 3.34Å; N83-K87 WeakPolarHBondContact ND2-CE 3.45Å; N83-K87 WeakPolarHBondContact O-CB 3.37Å; N83-K87 VanDerWaalsContact O-CG 3.28Å; N83-K87 WeakPolarHBondContact O-CG 3.23Å; N83-K87 PolarHBondContact O-N 2.87Å
84V91Very high90.5Very high62 Ų6261.4 Ų61.438%0.37631%0.308SS..Hα-helixtrans-63.2-46.5172.8172.10000110.5K80 L81 R86 K87 L88 V231K80-V84 WeakPolarHBondContact O-CG2 3.37Å; K80-V84 PolarHBondContact O-N 3.13Å; L81-V84 PolarHBondContact O-N 3.4Å; V84-R86 VanDerWaalsContact C-N 3.34Å; V84-R86 PolarHBondContact O-N 2.82Å; V84-K87 PolarHBondContact O-N 3.48Å; V84-L88 HydrophobicContact CG1-CD1 3.97Å; V84-L88 HydrophobicContact CG1-CG 4.36Å; V84-L88 WeakPolarHBondContact O-CG 3.49Å; V84-L88 PolarHBondContact O-N 2.98Å; V84-V231 HydrophobicContact CG1-CG1 3.62Å; V84-V231 HydrophobicContact CG1-CG2 4.47Å
85D90.5Very high90.3Very high34 Ų3460.9 Ų60.918%0.18231%0.306CS..Hα-helixtrans-58.5-45.3178-171.567.9000112.1L81 Q82 L88 G89 L227 V231 K234L81-D85 PolarHBondContact O-N 3.44Å; Q82-D85 PolarHBondContact O-N 2.8Å; D85-L88 PolarHBondContact O-N 3.43Å; D85-G89 PolarHBondContact O-N 2.87Å; D85-L227 HydrophobicContact CB-CD1 3.88Å; D85-V231 HydrophobicContact CB-CG2 3.7Å; D85-K234 VanDerWaalsContact OD1-CD 3.29Å; D85-K234 WeakPolarHBondContact OD1-CD 3.42Å; D85-K234 WeakPolarHBondContact OD1-CE 3.23Å; D85-K234 IonicContact OD1-NZ 2.7Å; D85-K234 PolarHBondContact OD1-NZ 3.05Å; D85-K234 IonicContact OD2-NZ 2.8Å; D85-K234 PolarHBondContact OD2-NZ 3.2Å
86R90Very high90.3Very high116 Ų11665.3 Ų65.344%0.43833%0.325SS..Hα-helixtrans-61-48175.2-176.4178.263.4138-2.4111.7Q82 N83 V84 L88 G89 E90Q82-R86 WeakPolarHBondContact O-CB 3.43Å; Q82-R86 PolarHBondContact O-N 3.28Å; N83-R86 PolarHBondContact OD1-NH2 2.93Å; V84-R86 VanDerWaalsContact C-N 3.34Å; V84-R86 PolarHBondContact O-N 2.82Å; R86-L88 VanDerWaalsContact C-N 3.33Å; R86-L88 PolarHBondContact O-N 3.36Å; R86-G89 CarbonylContact O-C 3.6Å; R86-G89 WeakPolarHBondContact O-CA 3.43Å; R86-G89 PolarHBondContact O-N 3.29Å; R86-E90 PolarHBondContact O-N 3.48Å
87K91Very high90.1Very high98 Ų9864.7 Ų64.743%0.42632%0.317SS..Hα-helixtrans-61.5-39.4178-77.3175.9-179.2-680112.1N83 V84 G89 E90 I91N83-K87 VanDerWaalsContact ND2-CE 3.34Å; N83-K87 WeakPolarHBondContact ND2-CE 3.45Å; N83-K87 WeakPolarHBondContact O-CB 3.37Å; N83-K87 VanDerWaalsContact O-CG 3.28Å; N83-K87 WeakPolarHBondContact O-CG 3.23Å; N83-K87 PolarHBondContact O-N 2.87Å; V84-K87 PolarHBondContact O-N 3.48Å; K87-G89 VanDerWaalsContact C-N 3.29Å; K87-G89 PolarHBondContact O-N 2.82Å; K87-E90 PolarHBondContact O-N 3.07Å; K87-I91 VanDerWaalsContact O-CG1 3.23Å; K87-I91 WeakPolarHBondContact O-CG1 3.38Å; K87-I91 PolarHBondContact O-N 2.8Å
88L90.9Very high90.1Very high19 Ų1961.9 Ų61.910%0.09931%0.307CS..Hα-helixtrans-64.4-36173.8-72.8172.2000111.6V84 D85 R86 Q92 V231 K234 A235 T238V84-L88 HydrophobicContact CG1-CD1 3.97Å; V84-L88 HydrophobicContact CG1-CG 4.36Å; V84-L88 WeakPolarHBondContact O-CG 3.49Å; V84-L88 PolarHBondContact O-N 2.98Å; D85-L88 PolarHBondContact O-N 3.43Å; R86-L88 VanDerWaalsContact C-N 3.33Å; R86-L88 PolarHBondContact O-N 3.36Å; L88-Q92 WeakPolarHBondContact O-CB 3.23Å; L88-Q92 PolarHBondContact O-N 3.27Å; L88-V231 HydrophobicContact CD1-CB 4.43Å; L88-V231 HydrophobicContact CD1-CG1 3.83Å; L88-V231 WeakPolarHBondContact CD1-O 3.27Å; L88-K234 HydrophobicContact CB-CB 4.14Å; L88-K234 HydrophobicContact CD1-CB 4.02Å; L88-A235 HydrophobicContact CD1-CB 3.96Å; L88-A235 HydrophobicContact CD2-CB 4.2Å; L88-T238 HydrophobicContact CD2-CG2 4.33Å
89G90.2Very high90Very high22 Ų2264.6 Ų64.623%0.22732%0.319CS..Hα-helixtrans-59.1-52.5168.800000112.7D85 R86 K87 I91 Q92 D93D85-G89 PolarHBondContact O-N 2.87Å; R86-G89 CarbonylContact O-C 3.6Å; R86-G89 WeakPolarHBondContact O-CA 3.43Å; R86-G89 PolarHBondContact O-N 3.29Å; K87-G89 VanDerWaalsContact C-N 3.29Å; K87-G89 PolarHBondContact O-N 2.82Å; G89-I91 VanDerWaalsContact C-N 3.34Å; G89-I91 PolarHBondContact O-N 2.89Å; G89-Q92 WeakPolarHBondContact O-CB 3.5Å; G89-Q92 PolarHBondContact O-N 3.46Å; G89-Q92 VanDerWaalsContact O-N 3.11Å; G89-D93 PolarHBondContact O-N 3.47Å
90E89.9Confident89.9Confident44 Ų4468.7 Ų68.721%0.20633%0.33CS..Hα-helixtrans-57.2-44.2177.3-68-179.2172.900111.5R86 K87 D93 T94 R136R86-E90 PolarHBondContact O-N 3.48Å; K87-E90 PolarHBondContact O-N 3.07Å; E90-D93 PolarHBondContact O-N 3.29Å; E90-T94 WeakPolarHBondContact O-CB 3.38Å; E90-T94 PolarHBondContact O-N 3.46Å; E90-T94 PolarHBondContact O-OG1 3.14Å; E90-R136 IonicContact OE1-CZ 2.97Å; E90-R136 IonicContact OE1-NE 3.29Å; E90-R136 PolarHBondContact OE1-NE 3.47Å; E90-R136 VanDerWaalsContact OE1-NE 3.09Å; E90-R136 IonicContact OE1-NH2 2.75Å; E90-R136 PolarHBondContact OE1-NH2 3.21Å; E90-R136 VanDerWaalsContact OE1-NH2 3.1Å; E90-R136 IonicContact OE2-NH2 3.68Å; E90-R136 PolarHBondContact OE2-NH2 2.92Å; E90-R136 VanDerWaalsContact OE2-NH2 3.11Å
91I89.6Confident89.6Confident69 Ų6966.6 Ų66.635%0.35432%0.322SS..Hα-helixtrans-65.2-41.4177-63.4162.2000110.2K87 G89 D93 T94 T95 T238 V242K87-I91 VanDerWaalsContact O-CG1 3.23Å; K87-I91 WeakPolarHBondContact O-CG1 3.38Å; K87-I91 PolarHBondContact O-N 2.8Å; G89-I91 VanDerWaalsContact C-N 3.34Å; G89-I91 PolarHBondContact O-N 2.89Å; I91-D93 VanDerWaalsContact C-N 3.3Å; I91-D93 PolarHBondContact O-N 3.31Å; I91-T94 PolarHBondContact O-N 2.7Å; I91-T95 WeakPolarHBondContact O-CB 3.28Å; I91-T95 PolarHBondContact O-N 3.27Å; I91-T95 PolarHBondContact O-OG1 3.37Å; I91-T238 HydrophobicContact CB-CG2 3.99Å; I91-T238 HydrophobicContact CG2-CG2 3.31Å; I91-V242 HydrophobicContact CG2-CG2 4.21Å
92Q89.5Confident89.4Confident51 Ų5165.2 Ų65.224%0.23832%0.315CS..Hα-helixtrans-60.6-41177.8-168.5-168.7-110.200111.4L88 G89 T95 K96 K237L88-Q92 WeakPolarHBondContact O-CB 3.23Å; L88-Q92 PolarHBondContact O-N 3.27Å; G89-Q92 WeakPolarHBondContact O-CB 3.5Å; G89-Q92 PolarHBondContact O-N 3.46Å; G89-Q92 VanDerWaalsContact O-N 3.11Å; Q92-T95 WeakPolarHBondContact O-CB 3.3Å; Q92-T95 PolarHBondContact O-N 3.41Å; Q92-K96 WeakPolarHBondContact O-CG 3.34Å; Q92-K96 PolarHBondContact O-N 3.19Å; Q92-K237 VanDerWaalsContact OE1-NZ 3.17Å
93D90Very high88.9Confident82 Ų8264 Ų6444%0.43932%0.317SS..Hα-helixtrans-73.1-40.9178.8-70.1-26.2000112.3G89 E90 I91 T95 K96 Q97G89-D93 PolarHBondContact O-N 3.47Å; E90-D93 PolarHBondContact O-N 3.29Å; I91-D93 VanDerWaalsContact C-N 3.3Å; I91-D93 PolarHBondContact O-N 3.31Å; D93-T95 VanDerWaalsContact C-N 3.26Å; D93-T95 PolarHBondContact O-N 2.87Å; D93-K96 WeakPolarHBondContact O-CB 3.4Å; D93-K96 PolarHBondContact O-N 3.04Å; D93-K96 VanDerWaalsContact O-N 3.14Å; D93-K96 IonicContact OD1-NZ 2.78Å; D93-K96 PolarHBondContact OD1-NZ 2.93Å; D93-Q97 PolarHBondContact O-N 3.42Å
94T90.8Very high88.4Confident79 Ų7964 Ų6449%0.48532%0.321SS..Hα-helixtrans-56.3-43.3169.5-580000110.8E90 I91 K96 Q97 T98E90-T94 WeakPolarHBondContact O-CB 3.38Å; E90-T94 PolarHBondContact O-N 3.46Å; E90-T94 PolarHBondContact O-OG1 3.14Å; I91-T94 PolarHBondContact O-N 2.7Å; T94-K96 PolarHBondContact O-N 3.5Å; T94-Q97 WeakPolarHBondContact O-CB 3.35Å; T94-Q97 PolarHBondContact O-N 3.34Å; T94-T98 PolarHBondContact O-N 2.95Å; T94-T98 PolarHBondContact O-OG1 3.09Å
95T89.8Confident87.6Confident9 Ų965 Ų656%0.05532%0.324CS..Hα-helixtrans-63.7-41.7178-62.10000110.9I91 Q92 D93 Q97 T98 Q99 T241 Q245I91-T95 WeakPolarHBondContact O-CB 3.28Å; I91-T95 PolarHBondContact O-N 3.27Å; I91-T95 PolarHBondContact O-OG1 3.37Å; Q92-T95 WeakPolarHBondContact O-CB 3.3Å; Q92-T95 PolarHBondContact O-N 3.41Å; D93-T95 VanDerWaalsContact C-N 3.26Å; D93-T95 PolarHBondContact O-N 2.87Å; T95-Q97 VanDerWaalsContact C-N 3.32Å; T95-Q97 PolarHBondContact O-N 2.87Å; T95-T98 PolarHBondContact O-N 2.8Å; T95-Q99 PolarHBondContact O-N 3.1Å; T95-T241 HydrophobicContact CG2-CG2 3.11Å; T95-Q245 PolarHBondContact O-NE2 3.39Å
96K90.5Very high86.5Confident105 Ų10571 Ų7146%0.45735%0.348SS..Hα-helixtrans-60.2-42.4173-69.9170.4-167.6156.40111.6Q92 D93 T94 Q99 R100Q92-K96 WeakPolarHBondContact O-CG 3.34Å; Q92-K96 PolarHBondContact O-N 3.19Å; D93-K96 WeakPolarHBondContact O-CB 3.4Å; D93-K96 PolarHBondContact O-N 3.04Å; D93-K96 VanDerWaalsContact O-N 3.14Å; D93-K96 IonicContact OD1-NZ 2.78Å; D93-K96 PolarHBondContact OD1-NZ 2.93Å; T94-K96 PolarHBondContact O-N 3.5Å; K96-Q99 PolarHBondContact O-N 3.49Å; K96-R100 WeakPolarHBondContact O-CG 3.35Å; K96-R100 PolarHBondContact O-N 3.43Å
97Q88.2Confident85.1Confident53 Ų5369 Ų6925%0.24835%0.352CS..Hα-helixtrans-63.3-48.4176.1-178.4174.16.200111.2D93 T94 T95 Q99 R100 H101D93-Q97 PolarHBondContact O-N 3.42Å; T94-Q97 WeakPolarHBondContact O-CB 3.35Å; T94-Q97 PolarHBondContact O-N 3.34Å; T95-Q97 VanDerWaalsContact C-N 3.32Å; T95-Q97 PolarHBondContact O-N 2.87Å; Q97-Q99 VanDerWaalsContact C-N 3.27Å; Q97-Q99 PolarHBondContact O-N 2.89Å; Q97-R100 WeakPolarHBondContact O-CB 3.45Å; Q97-R100 PolarHBondContact O-N 3.19Å; Q97-H101 WeakPolarHBondContact CG-NE2 3.32Å; Q97-H101 PolarHBondContact O-CD2 3.23Å; Q97-H101 PolarHBondContact O-N 3.48Å; Q97-H101 VanDerWaalsContact O-N 3.07Å
98T88.9Confident83.3Confident38 Ų3869 Ų6923%0.23336%0.36CS..Hα-helixtrans-55.4-40.8175.1-61.40000111.7T94 T95 R100 H101 L102T94-T98 PolarHBondContact O-N 2.95Å; T94-T98 PolarHBondContact O-OG1 3.09Å; T95-T98 PolarHBondContact O-N 2.8Å; T98-R100 VanDerWaalsContact C-N 3.32Å; T98-R100 PolarHBondContact O-N 2.92Å; T98-H101 PolarHBondContact O-N 3.2Å; T98-L102 HydrophobicContact CG2-CD1 4.01Å; T98-L102 HydrophobicContact CG2-CG 4.25Å; T98-L102 WeakPolarHBondContact O-CG 3.44Å; T98-L102 PolarHBondContact O-N 3.11Å
99Q89.2Confident81.6Confident60 Ų6076.2 Ų76.228%0.2839%0.391SS..Hα-helixtrans-63.1-38.9178-165.957.635.600112.2T95 K96 Q97 S103 Q245T95-Q99 PolarHBondContact O-N 3.1Å; K96-Q99 PolarHBondContact O-N 3.49Å; Q97-Q99 VanDerWaalsContact C-N 3.27Å; Q97-Q99 PolarHBondContact O-N 2.89Å; Q99-S103 WeakPolarHBondContact O-CB 3.44Å; Q99-S103 PolarHBondContact O-N 3.36Å; Q99-S103 PolarHBondContact O-OG 3.28Å; Q99-Q245 VanDerWaalsContact OE1-NE2 3.1Å
100R88.1Confident79.8Confident188 Ų18878.6 Ų78.671%0.70942%0.415SS*.Hα-helixtrans-64.4-42175.2-66.3172.4-178.9164.5-0.1110.9K96 Q97 T98 S103 S104K96-R100 WeakPolarHBondContact O-CG 3.35Å; K96-R100 PolarHBondContact O-N 3.43Å; Q97-R100 WeakPolarHBondContact O-CB 3.45Å; Q97-R100 PolarHBondContact O-N 3.19Å; T98-R100 VanDerWaalsContact C-N 3.32Å; T98-R100 PolarHBondContact O-N 2.92Å; R100-S103 PolarHBondContact O-N 3.38Å; R100-S104 PolarHBondContact O-N 2.95Å; R100-S104 PolarHBondContact O-OG 3.34Å
101H84.8Confident77.8Confident85 Ų8579.4 Ų79.439%0.39443%0.426SS..Hα-helixtrans-66.8-42.1176-69.3-69.5000112.9Q97 T98 S103 S104 L105Q97-H101 WeakPolarHBondContact CG-NE2 3.32Å; Q97-H101 PolarHBondContact O-CD2 3.23Å; Q97-H101 PolarHBondContact O-N 3.48Å; Q97-H101 VanDerWaalsContact O-N 3.07Å; T98-H101 PolarHBondContact O-N 3.2Å; H101-S103 VanDerWaalsContact C-N 3.31Å; H101-S103 PolarHBondContact O-N 3.07Å; H101-S104 WeakPolarHBondContact CA-OG 3.37Å; H101-S104 PolarHBondContact O-N 3.42Å; H101-S104 PolarHBondContact O-OG 3.49Å; H101-L105 WeakPolarHBondContact O-CB 3.2Å; H101-L105 WeakPolarHBondContact O-CG 3.38Å; H101-L105 PolarHBondContact O-N 2.93Å
102L84.4Confident76.1Confident8 Ų883.8 Ų83.84%0.04245%0.447CS..Hα-helixtrans-64-38.9175.2-71.1173.4000111.5T98 L105 K106 Q245 Q248 M249 L252T98-L102 HydrophobicContact CG2-CD1 4.01Å; T98-L102 HydrophobicContact CG2-CG 4.25Å; T98-L102 WeakPolarHBondContact O-CG 3.44Å; T98-L102 PolarHBondContact O-N 3.11Å; L102-L105 PolarHBondContact O-N 2.87Å; L102-K106 WeakPolarHBondContact O-CB 3.32Å; L102-K106 PolarHBondContact O-N 2.92Å; L102-Q245 HydrophobicContact CD1-CB 3.97Å; L102-Q245 HydrophobicContact CD1-CG 3.95Å; L102-Q248 HydrophobicContact CD1-CB 4.12Å; L102-M249 HydrophobicContact CD2-CB 4.27Å; L102-M249 HydrophobicContact CD2-CE 4.49Å; L102-L252 HydrophobicContact CD2-CD1 3.8Å
103S79.9Confident74.4Confident64 Ų6490.5 Ų90.545%0.44848%0.475SS..Hα-helixtrans-66.2-40.2175.9-56.30000111.7Q99 R100 H101 S107Q99-S103 WeakPolarHBondContact O-CB 3.44Å; Q99-S103 PolarHBondContact O-N 3.36Å; Q99-S103 PolarHBondContact O-OG 3.28Å; R100-S103 PolarHBondContact O-N 3.38Å; H101-S103 VanDerWaalsContact C-N 3.31Å; H101-S103 PolarHBondContact O-N 3.07Å; S103-S107 PolarHBondContact O-N 3.44Å
104S79.4Confident72.7Confident57 Ų5793.6 Ų93.640%0.39949%0.492SS..Hα-helixtrans-68.9-39.9176.170.10000112.1R100 H101 K106 S107 V108R100-S104 PolarHBondContact O-N 2.95Å; R100-S104 PolarHBondContact O-OG 3.34Å; H101-S104 WeakPolarHBondContact CA-OG 3.37Å; H101-S104 PolarHBondContact O-N 3.42Å; H101-S104 PolarHBondContact O-OG 3.49Å; S104-K106 PolarHBondContact O-N 3.23Å; S104-S107 WeakPolarHBondContact O-CB 3.46Å; S104-S107 PolarHBondContact O-N 2.8Å; S104-S107 VanDerWaalsContact O-N 3.1Å; S104-V108 WeakPolarHBondContact O-CG2 3.4Å; S104-V108 PolarHBondContact O-N 3.41Å
105L74.1Confident71.1Confident85 Ų8598.7 Ų98.745%0.44550%0.503SS..Hα-helixtrans-61.7-43.6174.3-73.5173.7000112H101 L102 S107 V108 F109 L252H101-L105 WeakPolarHBondContact O-CB 3.2Å; H101-L105 WeakPolarHBondContact O-CG 3.38Å; H101-L105 PolarHBondContact O-N 2.93Å; L102-L105 PolarHBondContact O-N 2.87Å; L105-S107 PolarHBondContact O-N 2.77Å; L105-V108 PolarHBondContact O-N 3.18Å; L105-V108 VanDerWaalsContact O-N 3.17Å; L105-F109 WeakPolarHBondContact O-CD2 3.31Å; L105-F109 PolarHBondContact O-N 3.14Å; L105-L252 HydrophobicContact CB-CD1 4.4Å
106K67.9Low69.6Low159 Ų159107.7 Ų107.769%0.69154%0.542SS*.Hα-helixtrans-58.3-34.4174.4-171.4174.3-179.7174.90112L102 S104L102-K106 WeakPolarHBondContact O-CB 3.32Å; L102-K106 PolarHBondContact O-N 2.92Å; S104-K106 PolarHBondContact O-N 3.23Å
107S59.4Low68Low73 Ų73107.1 Ų107.151%0.5155%0.551SS.*Hα-helixtrans-73.4-39.2176.5-168.20000112.9S103 S104 L105 F109 G110 S111S103-S107 PolarHBondContact O-N 3.44Å; S104-S107 WeakPolarHBondContact O-CB 3.46Å; S104-S107 PolarHBondContact O-N 2.8Å; S104-S107 VanDerWaalsContact O-N 3.1Å; L105-S107 PolarHBondContact O-N 2.77Å; S107-F109 VanDerWaalsContact C-N 3.35Å; S107-F109 PolarHBondContact O-N 3.23Å; S107-G110 PolarHBondContact O-N 3.49Å; S107-G110 VanDerWaalsContact O-N 3.13Å; S107-S111 PolarHBondContact O-N 3.26Å; S107-S111 PolarHBondContact O-OG 2.89Å
108V54.7Low66.4Low99 Ų99113.8 Ų113.860%0.658%0.579SS**Hα-helixtrans-66.7-33.7-176.3173.60000112.3S104 L105 G110 S111S104-V108 WeakPolarHBondContact O-CG2 3.4Å; S104-V108 PolarHBondContact O-N 3.41Å; L105-V108 PolarHBondContact O-N 3.18Å; L105-V108 VanDerWaalsContact O-N 3.17Å; V108-G110 PolarHBondContact O-N 3.25Å; V108-S111 PolarHBondContact O-N 2.93Å
109F54Low65Low171 Ų171118.8 Ų118.875%0.7560%0.604SS**THydrogen-bonded Turntrans-70.6-10.6175.4-81.8-84.6000114.2L105 S107L105-F109 WeakPolarHBondContact O-CD2 3.31Å; L105-F109 PolarHBondContact O-N 3.14Å; S107-F109 VanDerWaalsContact C-N 3.35Å; S107-F109 PolarHBondContact O-N 3.23Å
110G51.6Low63.5Low72 Ų72124.6 Ų124.674%0.74263%0.629SS**THydrogen-bonded Turntrans-107.5-9.9176.300000115.3S107 V108S107-G110 PolarHBondContact O-N 3.49Å; S107-G110 VanDerWaalsContact O-N 3.13Å; V108-G110 PolarHBondContact O-N 3.25Å
111S48.1Very low62Low61 Ų61119.2 Ų119.243%0.42762%0.624SS.*  trans-12866.4-16865.90000113.2S107 V108 K113S107-S111 PolarHBondContact O-N 3.26Å; S107-S111 PolarHBondContact O-OG 2.89Å; V108-S111 PolarHBondContact O-N 2.93Å; S111-K113 PolarHBondContact O-N 3.01Å
112M54.1Low60.7Low160 Ų160118.3 Ų118.379%0.78863%0.632SS**THydrogen-bonded Turntrans-77.545.9171.8-152.6176.6-6500112.2Y115M112-Y115 HydrophobicContact CG-CE2 4.3Å
113K54.5Low59.4Low193 Ų193126 Ų12684%0.83967%0.665SS**THydrogen-bonded Turntrans-137.4-7.8176.8-100-177.9176.4167.80117.1S111S111-K113 PolarHBondContact O-N 3.01Å
114N55.2Low58.3Low146 Ų146126.1 Ų126.178%0.78167%0.67SS**  trans-119.284.2178.1-84.722.9000112.5F116N114-F116 PolarHBondContact O-N 2.82Å
115Y55.9Low57.3Low186 Ų186124.7 Ų124.773%0.72966%0.661SS**  trans-84.711.9-178.7-85.8-89.7000115.3M112M112-Y115 HydrophobicContact CG-CE2 4.3Å
116F58.1Low56.5Low199 Ų199123.5 Ų123.587%0.87366%0.664SS**SBendtrans-124.326.7-164.4-94.1-84.7000117.5N114N114-F116 PolarHBondContact O-N 2.82Å
117S57.5Low56.1Low92 Ų92119 Ų11964%0.64366%0.656SS**  trans-139.221.7178.6-52.20000115.8D119S117-D119 VanDerWaalsContact C-N 3.31Å; S117-D119 PolarHBondContact O-N 3.17Å
118K55.3Low55.9Low194 Ų194118 Ų11884%0.84365%0.653SS**Hα-helixtrans-65.7-23.9-170.3-130.9175179.4-178.40114.9
119D59.2Low56Low142 Ų142118.5 Ų118.576%0.75965%0.651SS**Hα-helixtrans-79.1-26.6-176.4-70.8-45.9000114.5S117 K123S117-D119 VanDerWaalsContact C-N 3.31Å; S117-D119 PolarHBondContact O-N 3.17Å; D119-K123 PolarHBondContact O-N 3.31Å
120K57.3Low56.1Low183 Ų183113.5 Ų113.580%0.79664%0.642SS**Hα-helixtrans-75.9-33.7-174.3-133.9179.1-172.7-175.50112.6A124K120-A124 PolarHBondContact O-N 2.94Å
121A56.6Low56.1Low74 Ų74116.4 Ų116.461%0.61264%0.639SS**Hα-helixtrans-74.1-38.5179.900000112.6A125A121-A125 PolarHBondContact O-N 3.41Å
122A56.9Low56.3Low66 Ų66117.3 Ų117.355%0.54564%0.639SS.*Hα-helixtrans-68.3-40.3178.200000112A125 A126A122-A125 PolarHBondContact O-N 3.38Å; A122-A126 PolarHBondContact O-N 3.4Å; A122-A126 VanDerWaalsContact O-N 3.14Å
123K58.3Low56.1Low171 Ų171116.5 Ų116.574%0.74363%0.633SS**Hα-helixtrans-70-33.2-179.6-147.3172-172.5174.60113D119 A127D119-K123 PolarHBondContact O-N 3.31Å; K123-A127 WeakPolarHBondContact O-CB 3.32Å; K123-A127 PolarHBondContact O-N 3Å; K123-A127 VanDerWaalsContact O-N 3.13Å
124A56.7Low55.8Low66 Ų66115 Ų11555%0.54563%0.63SS.*Hα-helixtrans-69.7-35.5174.400000112.8K120 A128K120-A124 PolarHBondContact O-N 2.94Å; A124-A128 PolarHBondContact O-N 2.8Å
125A57.1Low55.6Low27 Ų27111.5 Ų111.522%0.22362%0.616CS.*Hα-helixtrans-69.7-38.8175.600000112.2A121 A122 A128 L129A121-A125 PolarHBondContact O-N 3.41Å; A122-A125 PolarHBondContact O-N 3.38Å; A125-A128 PolarHBondContact O-N 3.3Å; A125-L129 PolarHBondContact O-N 2.94Å
126A58.3Low55.4Low60 Ų60108.7 Ų108.750%0.49660%0.604SS.*Hα-helixtrans-67.6-37.517600000112.7A122 A128 L129 A130A122-A126 PolarHBondContact O-N 3.4Å; A122-A126 VanDerWaalsContact O-N 3.14Å; A126-A128 VanDerWaalsContact C-N 3.35Å; A126-L129 PolarHBondContact O-N 3.27Å; A126-A130 PolarHBondContact O-N 3.49Å
127A59.1Low54.9Low64 Ų64106.3 Ų106.353%0.52960%0.599SS.*Hα-helixtrans-68.5-31.8177.100000113.1K123 A130 L131K123-A127 WeakPolarHBondContact O-CB 3.32Å; K123-A127 PolarHBondContact O-N 3Å; K123-A127 VanDerWaalsContact O-N 3.13Å; A127-A130 PolarHBondContact O-N 2.81Å; A127-L131 PolarHBondContact O-N 2.93Å
128A56.2Low54.6Low53 Ų53110.3 Ų110.344%0.43861%0.608SS.*Hα-helixtrans-68.9-34.8175.900000112.7A124 A125 A126A124-A128 PolarHBondContact O-N 2.8Å; A125-A128 PolarHBondContact O-N 3.3Å; A126-A128 VanDerWaalsContact C-N 3.35Å
129L56.3Low54.5Low108 Ų108110.1 Ų110.157%0.56561%0.607SS**Hα-helixtrans-71.3-33.1175.4-73.7165.3000112.6A125 A126A125-L129 PolarHBondContact O-N 2.94Å; A126-L129 PolarHBondContact O-N 3.27Å
130A55.8Low54.3Low67 Ų67107.5 Ų107.555%0.55460%0.598SS**Hα-helixtrans-74.4-22.4-178.900000114A126 A127A126-A130 PolarHBondContact O-N 3.49Å; A127-A130 PolarHBondContact O-N 2.81Å
131L52.4Low54.4Low133 Ų133109.6 Ų109.670%0.69660%0.601SS**Hα-helixtrans-81.9-25.1179.6-158.676.1000112.6A127A127-L131 PolarHBondContact O-N 2.93Å
132D51Low54.8Low80 Ų80108.7 Ų108.743%0.42859%0.594SS.*Hα-helixtrans-75.2-25.6-176.3-166.352000113.2Q134 S135D132-Q134 VanDerWaalsContact C-N 3.31Å; D132-Q134 PolarHBondContact O-N 2.99Å; D132-S135 PolarHBondContact O-OG 3.38Å
133E51.4Low55.9Low142 Ų142106.7 Ų106.766%0.66457%0.574SS**G310 helixtrans-64.9-33178.6-161.385.2-165.200112.2R136E133-R136 PolarHBondContact O-N 3.4Å
134Q48Very low57.2Low162 Ų162100.3 Ų100.376%0.75755%0.551SS**G310 helixtrans-81.7-19.6-171.9-68.9-176.4-8.400114.2D132 R136D132-Q134 VanDerWaalsContact C-N 3.31Å; D132-Q134 PolarHBondContact O-N 2.99Å; Q134-R136 VanDerWaalsContact C-N 3.33Å
135S49.2Very low58.8Low72 Ų7297.1 Ų97.150%0.50353%0.525SS..G310 helixtrans-83.5-6.3173.832.90000113.9D132 I137D132-S135 PolarHBondContact O-OG 3.38Å; S135-I137 VanDerWaalsContact C-N 3.33Å; S135-I137 PolarHBondContact O-N 3.04Å
136R52.1Low60.4Low127 Ų12798.4 Ų98.448%0.47953%0.527SS..SBendtrans-84.71.4-168.1-128.5173.6-174.8-161.34.3115.6E90 E133 Q134E90-R136 IonicContact OE1-CZ 2.97Å; E90-R136 IonicContact OE1-NE 3.29Å; E90-R136 PolarHBondContact OE1-NE 3.47Å; E90-R136 VanDerWaalsContact OE1-NE 3.09Å; E90-R136 IonicContact OE1-NH2 2.75Å; E90-R136 PolarHBondContact OE1-NH2 3.21Å; E90-R136 VanDerWaalsContact OE1-NH2 3.1Å; E90-R136 IonicContact OE2-NH2 3.68Å; E90-R136 PolarHBondContact OE2-NH2 2.92Å; E90-R136 VanDerWaalsContact OE2-NH2 3.11Å; E133-R136 PolarHBondContact O-N 3.4Å; Q134-R136 VanDerWaalsContact C-N 3.33Å
137I49.1Very low62Low149 Ų14999.2 Ų99.276%0.76452%0.523SS*.  trans-117.651-177.4-41.3177000110.5S135S135-I137 VanDerWaalsContact C-N 3.33Å; S135-I137 PolarHBondContact O-N 3.04Å
138Q51.2Low63.4Low176 Ų17696.9 Ų96.982%0.82250%0.502SS*.  trans-91.1107.3159.8-68.3-172.231.900107
139K51.8Low65.1Low190 Ų19094.4 Ų94.483%0.82648%0.481SS*.PPolyproline II helixtrans-52.6139.2170.4-78.3-177.6175.3-175.20108.5R141K139-R141 PolarHBondContact O-N 2.8Å; K139-R141 VanDerWaalsContact O-N 3.11Å
140P55.9Low66.8Low88 Ų8892.3 Ų92.357%0.57147%0.47SS*.PPolyproline II helixtrans-56.1122.6173.723.8-31.1000108.2A142P140-A142 PolarHBondContact O-N 2.94Å
141R58Low68.4Low226 Ų22696 Ų9685%0.85347%0.47SS*.PPolyproline II helixtrans-68.3125.8174.9176.9176.6174.4153.2-2.2106.7K139 T143K139-R141 PolarHBondContact O-N 2.8Å; K139-R141 VanDerWaalsContact O-N 3.11Å; R141-T143 PolarHBondContact O-N 3.31Å
142A65.9Low70.2Confident56 Ų5689.6 Ų89.646%0.46344%0.437SS..PPolyproline II helixtrans-52.1126.417300000109.4P140 Q146P140-A142 PolarHBondContact O-N 2.94Å; A142-Q146 HydrophobicContact CB-CG 4.49Å
143T79.8Confident72Confident23 Ų2389.6 Ų89.614%0.14143%0.433CS..PPolyproline II helixtrans-71.8161.1178.862.80000110.2R141 L145 Q146 N147 E220R141-T143 PolarHBondContact O-N 3.31Å; T143-L145 PolarHBondContact O-N 3.11Å; T143-Q146 PolarHBondContact O-N 3Å; T143-Q146 PolarHBondContact OG1-N 3.41Å; T143-N147 PolarHBondContact O-N 3.5Å; T143-N147 PolarHBondContact O-ND2 2.82Å; T143-N147 VanDerWaalsContact O-ND2 3.14Å; T143-E220 VanDerWaalsContact CB-OE2 3.32Å; T143-E220 WeakPolarHBondContact CB-OE2 3.35Å; T143-E220 PolarHBondContact OG1-OE2 3.28Å
144S85.9Confident73.6Confident37 Ų3789.2 Ų89.226%0.25943%0.431SS..Hα-helixtrans-57.5-34.7173.452.20000111.1N147 T148 E219S144-N147 PolarHBondContact O-N 2.88Å; S144-T148 PolarHBondContact O-N 3.03Å; S144-T148 VanDerWaalsContact O-N 3.09Å; S144-T148 PolarHBondContact O-OG1 3.42Å; S144-E219 WeakPolarHBondContact CB-OE2 3.5Å; S144-E219 PolarHBondContact OG-OE2 2.99Å
145L89.7Confident75.2Confident0 Ų085.9 Ų85.90%042%0.418CS..Hα-helixtrans-63.8-44.9175.1-174.959.4000112.9A71 L74 I75 T143 N147 T148 V149 L213 A216 L217 E220A71-L145 HydrophobicContact CB-CD1 3.81Å; A71-L145 HydrophobicContact CB-CD2 4.12Å; A71-L145 HydrophobicContact CB-CG 4.09Å; L74-L145 HydrophobicContact CB-CD2 3.88Å; L74-L145 HydrophobicContact CD1-CD2 4.36Å; I75-L145 HydrophobicContact CD1-CD2 4.35Å; I75-L145 HydrophobicContact CD1-CG 4.04Å; I75-L145 HydrophobicContact CG1-CB 4.29Å; I75-L145 HydrophobicContact CG1-CD2 3.89Å; I75-L145 HydrophobicContact CG1-CG 3.99Å; T143-L145 PolarHBondContact O-N 3.11Å; L145-N147 VanDerWaalsContact C-N 3.32Å; L145-N147 PolarHBondContact O-N 3.01Å; L145-T148 WeakPolarHBondContact O-CB 3.49Å; L145-T148 PolarHBondContact O-N 3.37Å; L145-T148 VanDerWaalsContact O-N 3.09Å; L145-V149 HydrophobicContact CD1-CG2 4.35Å; L145-V149 HydrophobicContact CG-CG2 4.46Å; L145-V149 WeakPolarHBondContact O-CG2 3.42Å; L145-V149 PolarHBondContact O-N 3.23Å; L145-L213 HydrophobicContact CD1-CD1 4.43Å; L145-A216 HydrophobicContact CD1-CB 3.66Å; L145-L217 HydrophobicContact CD1-CD2 4.05Å; L145-L217 HydrophobicContact CD1-CG 4.23Å; L145-L217 HydrophobicContact CD2-CD2 4.15Å; L145-E220 HydrophobicContact CB-CB 4.15Å; L145-E220 HydrophobicContact CB-CG 4.36Å; L145-E220 HydrophobicContact CD2-CB 3.75Å; L145-E220 HydrophobicContact CD2-CG 3.64Å
146Q91.5Very high76.5Confident54 Ų5486.1 Ų86.125%0.25242%0.417SS..Hα-helixtrans-57.7-46.4176.8-178.561.86200111.3I75 A142 T143 T148 V149 D150I75-Q146 HydrophobicContact CD1-CB 4.07Å; A142-Q146 HydrophobicContact CB-CG 4.49Å; T143-Q146 PolarHBondContact O-N 3Å; T143-Q146 PolarHBondContact OG1-N 3.41Å; Q146-T148 VanDerWaalsContact C-N 3.26Å; Q146-T148 PolarHBondContact O-N 2.88Å; Q146-V149 PolarHBondContact O-N 3.09Å; Q146-D150 PolarHBondContact NE2-OD1 3.23Å; Q146-D150 PolarHBondContact NE2-OD2 3.2Å; Q146-D150 VanDerWaalsContact O-CG 3.26Å; Q146-D150 PolarHBondContact O-N 3.36Å
147N91.2Very high77.1Confident77 Ų7784.9 Ų84.941%0.41243%0.428SS..Hα-helixtrans-61.6-35.8177.4-62.4-49.6000112.4T143 S144 L145 R151T143-N147 PolarHBondContact O-N 3.5Å; T143-N147 PolarHBondContact O-ND2 2.82Å; T143-N147 VanDerWaalsContact O-ND2 3.14Å; S144-N147 PolarHBondContact O-N 2.88Å; L145-N147 VanDerWaalsContact C-N 3.32Å; L145-N147 PolarHBondContact O-N 3.01Å; N147-R151 VanDerWaalsContact O-CG 3.23Å; N147-R151 WeakPolarHBondContact O-CG 3.4Å; N147-R151 PolarHBondContact O-N 3.5Å; N147-R151 VanDerWaalsContact O-N 3.1Å
148T90.2Very high77.3Confident15 Ų1579.9 Ų79.99%0.09241%0.413CS..Hα-helixtrans-69.6-44178.2-56.30000111.1S144 L145 Q146 D150 R151 I152 E212 A216S144-T148 PolarHBondContact O-N 3.03Å; S144-T148 VanDerWaalsContact O-N 3.09Å; S144-T148 PolarHBondContact O-OG1 3.42Å; L145-T148 WeakPolarHBondContact O-CB 3.49Å; L145-T148 PolarHBondContact O-N 3.37Å; L145-T148 VanDerWaalsContact O-N 3.09Å; Q146-T148 VanDerWaalsContact C-N 3.26Å; Q146-T148 PolarHBondContact O-N 2.88Å; T148-D150 VanDerWaalsContact C-N 3.33Å; T148-D150 PolarHBondContact O-N 3.09Å; T148-R151 PolarHBondContact O-N 3.39Å; T148-I152 HydrophobicContact CG2-CD1 3.8Å; T148-I152 HydrophobicContact CG2-CG1 4.46Å; T148-I152 WeakPolarHBondContact O-CB 3.33Å; T148-I152 WeakPolarHBondContact O-CG1 3.44Å; T148-I152 PolarHBondContact O-N 2.88Å; T148-E212 HydrophobicContact CG2-CB 4.41Å; T148-E212 HydrophobicContact CG2-CG 3.74Å; T148-A216 HydrophobicContact CG2-CB 3.79Å; T148-A216 WeakPolarHBondContact OG1-CB 3.31Å
149V91.7Very high77.2Confident0 Ų074.1 Ų74.10%040%0.401CS..Hα-helixtrans-60.2-44.1175.8168.70000111L68 A71 I75 L145 Q146 I152 K153 L213L68-V149 HydrophobicContact CD2-CB 4.45Å; L68-V149 HydrophobicContact CD2-CG1 4.12Å; L68-V149 HydrophobicContact CD2-CG2 4.29Å; A71-V149 HydrophobicContact CB-CG2 3.4Å; I75-V149 HydrophobicContact CD1-CG2 4.19Å; L145-V149 HydrophobicContact CD1-CG2 4.35Å; L145-V149 HydrophobicContact CG-CG2 4.46Å; L145-V149 WeakPolarHBondContact O-CG2 3.42Å; L145-V149 PolarHBondContact O-N 3.23Å; Q146-V149 PolarHBondContact O-N 3.09Å; V149-I152 PolarHBondContact O-N 3.43Å; V149-K153 HydrophobicContact CG1-CD 3.98Å; V149-K153 HydrophobicContact CG1-CG 4.5Å; V149-K153 WeakPolarHBondContact O-CB 3.18Å; V149-K153 VanDerWaalsContact O-CG 3.28Å; V149-K153 WeakPolarHBondContact O-CG 3.33Å; V149-K153 PolarHBondContact O-N 3.44Å; V149-L213 HydrophobicContact CG2-CD1 4.38Å
150D91.1Very high76.9Confident64 Ų6470.6 Ų70.634%0.34239%0.39SS..Hα-helixtrans-64.6-44179.9-66.7-29.1000111.1Q146 T148 K153 E154Q146-D150 PolarHBondContact NE2-OD1 3.23Å; Q146-D150 PolarHBondContact NE2-OD2 3.2Å; Q146-D150 VanDerWaalsContact O-CG 3.26Å; Q146-D150 PolarHBondContact O-N 3.36Å; T148-D150 VanDerWaalsContact C-N 3.33Å; T148-D150 PolarHBondContact O-N 3.09Å; D150-K153 PolarHBondContact O-N 3.3Å; D150-E154 WeakPolarHBondContact O-CB 3.37Å; D150-E154 WeakPolarHBondContact O-CG 3.23Å; D150-E154 PolarHBondContact O-N 2.82Å
151R89.7Confident76.3Confident144 Ų14475.7 Ų75.754%0.54340%0.404SS..Hα-helixtrans-61-46.8175.1-74.4171.9-177.1-166.3-1.7113.2N147 T148 K153 E154 D155N147-R151 VanDerWaalsContact O-CG 3.23Å; N147-R151 WeakPolarHBondContact O-CG 3.4Å; N147-R151 PolarHBondContact O-N 3.5Å; N147-R151 VanDerWaalsContact O-N 3.1Å; T148-R151 PolarHBondContact O-N 3.39Å; R151-K153 VanDerWaalsContact C-N 3.31Å; R151-K153 PolarHBondContact O-N 3.29Å; R151-E154 WeakPolarHBondContact O-CB 3.48Å; R151-E154 PolarHBondContact O-N 3.28Å; R151-D155 PolarHBondContact O-N 3.21Å
152I89.1Confident75.6Confident0 Ų070.2 Ų70.20%040%0.4CS..Hα-helixtrans-64.9-39.5179.8-70.2172.1000110.4E64 L68 T148 V149 E154 D155 T156 R209 L213E64-I152 HydrophobicContact CG-CG2 4.3Å; E64-I152 WeakPolarHBondContact OE1-CG2 3.44Å; L68-I152 HydrophobicContact CD1-CG2 4.17Å; L68-I152 HydrophobicContact CD2-CB 4.26Å; L68-I152 HydrophobicContact CD2-CG2 3.88Å; L68-I152 HydrophobicContact CG-CG2 4.36Å; T148-I152 HydrophobicContact CG2-CD1 3.8Å; T148-I152 HydrophobicContact CG2-CG1 4.46Å; T148-I152 WeakPolarHBondContact O-CB 3.33Å; T148-I152 WeakPolarHBondContact O-CG1 3.44Å; T148-I152 PolarHBondContact O-N 2.88Å; V149-I152 PolarHBondContact O-N 3.43Å; I152-E154 VanDerWaalsContact C-N 3.34Å; I152-D155 PolarHBondContact O-N 3.31Å; I152-T156 WeakPolarHBondContact O-CB 3.35Å; I152-T156 PolarHBondContact O-N 3.49Å; I152-T156 PolarHBondContact O-OG1 3.28Å; I152-T156 VanDerWaalsContact O-OG1 3.08Å; I152-R209 HydrophobicContact CD1-CB 4.4Å; I152-R209 WeakPolarHBondContact CD1-O 3.37Å; I152-R209 HydrophobicContact CG1-CB 4.23Å; I152-R209 HydrophobicContact CG1-CG 4.43Å; I152-R209 HydrophobicContact CG2-CB 4.3Å; I152-L213 HydrophobicContact CD1-CB 3.67Å; I152-L213 HydrophobicContact CD1-CD1 4.12Å; I152-L213 HydrophobicContact CD1-CG 4.34Å
153K88.8Confident74.5Confident80 Ų8074.8 Ų74.835%0.34842%0.417SS..Hα-helixtrans-63.8-40174.3-76.3177.4177.2178.80111.9L68 V149 D150 R151 S157L68-K153 HydrophobicContact CD1-CG 4.45Å; V149-K153 HydrophobicContact CG1-CD 3.98Å; V149-K153 HydrophobicContact CG1-CG 4.5Å; V149-K153 WeakPolarHBondContact O-CB 3.18Å; V149-K153 VanDerWaalsContact O-CG 3.28Å; V149-K153 WeakPolarHBondContact O-CG 3.33Å; V149-K153 PolarHBondContact O-N 3.44Å; D150-K153 PolarHBondContact O-N 3.3Å; R151-K153 VanDerWaalsContact C-N 3.31Å; R151-K153 PolarHBondContact O-N 3.29Å; K153-S157 VanDerWaalsContact O-CB 3.31Å; K153-S157 WeakPolarHBondContact O-CB 3.39Å; K153-S157 PolarHBondContact O-N 2.91Å; K153-S157 PolarHBondContact O-OG 3.33Å
154E85.8Confident72.8Confident134 Ų13477.5 Ų77.563%0.62643%0.43SS*.Hα-helixtrans-63.9-46.1174-75.4176-176.800111.4D150 R151 I152 T156 S157 G158D150-E154 WeakPolarHBondContact O-CB 3.37Å; D150-E154 WeakPolarHBondContact O-CG 3.23Å; D150-E154 PolarHBondContact O-N 2.82Å; R151-E154 WeakPolarHBondContact O-CB 3.48Å; R151-E154 PolarHBondContact O-N 3.28Å; I152-E154 VanDerWaalsContact C-N 3.34Å; E154-T156 VanDerWaalsContact C-N 3.31Å; E154-T156 PolarHBondContact O-N 2.88Å; E154-S157 PolarHBondContact O-N 3.43Å; E154-G158 WeakPolarHBondContact O-CA 3.36Å; E154-G158 PolarHBondContact O-N 2.84Å
155D81.4Confident70.7Confident91 Ų9181.2 Ų81.249%0.48745%0.453SS..Hα-helixtrans-64-35.1178.3-77.8-7000112.6R151 I152R151-D155 PolarHBondContact O-N 3.21Å; I152-D155 PolarHBondContact O-N 3.31Å
156T76Confident68.5Low78 Ų7885.8 Ų85.848%0.47949%0.486SS..Hα-helixtrans-81.8-30.3-178.7-64.20000112.5E64 I152 E154 R209E64-T156 PolarHBondContact OE1-OG1 3.44Å; I152-T156 WeakPolarHBondContact O-CB 3.35Å; I152-T156 PolarHBondContact O-N 3.49Å; I152-T156 PolarHBondContact O-OG1 3.28Å; I152-T156 VanDerWaalsContact O-OG1 3.08Å; E154-T156 VanDerWaalsContact C-N 3.31Å; E154-T156 PolarHBondContact O-N 2.88Å; T156-R209 PolarHBondContact OG1-NE 3.12Å; T156-R209 VanDerWaalsContact OG1-NE 3.16Å
157S65.4Low66.4Low101 Ų10192 Ų9271%0.70651%0.507SS*.Hα-helixtrans-95.2-26.4179.762.30000114K153 E154K153-S157 VanDerWaalsContact O-CB 3.31Å; K153-S157 WeakPolarHBondContact O-CB 3.39Å; K153-S157 PolarHBondContact O-N 2.91Å; K153-S157 PolarHBondContact O-OG 3.33Å; E154-S157 PolarHBondContact O-N 3.43Å
158G53.3Low64.4Low44 Ų4492.8 Ų92.845%0.45451%0.51SS..SBendtrans-95.691.5178.100000110.4E154 L160E154-G158 WeakPolarHBondContact O-CA 3.36Å; E154-G158 PolarHBondContact O-N 2.84Å; G158-L160 PolarHBondContact O-N 3.34Å
159G48.5Very low62Low54 Ų5496.1 Ų96.156%0.55753%0.533SS*.  trans-50.5110.9174.400000111.7F161G159-F161 VanDerWaalsContact O-CD2 3.23Å; G159-F161 WeakPolarHBondContact O-CD2 3.34Å; G159-F161 PolarHBondContact O-N 3.18Å
160L46.2Very low59.6Low117 Ų11799.3 Ų99.361%0.61357%0.566SS**SBendtrans39.611.1144.9-87.3127.9000121.6G158 C169G158-L160 PolarHBondContact O-N 3.34Å; L160-C169 WeakPolarHBondContact CD2-SG 3.47Å
161F44.2Very low57.5Low195 Ų19599.4 Ų99.486%0.85558%0.582SS**  trans-131.262.8-172.6-58.8-72.3000112.4G159G159-F161 VanDerWaalsContact O-CD2 3.23Å; G159-F161 WeakPolarHBondContact O-CD2 3.34Å; G159-F161 PolarHBondContact O-N 3.18Å
162S42.1Very low55.9Low110 Ų11095.1 Ų95.177%0.76958%0.582SS**SBendtrans-155.4112.4155.8-140.10000111.7N164S162-N164 PolarHBondContact O-N 2.94Å
163D43.2Very low54.9Low153 Ų15399.5 Ų99.582%0.81862%0.618SS**SBendtrans74.55.6158-68.4-9.8000122.9
164N44Very low54.1Low80 Ų8098.3 Ų98.343%0.42862%0.619SS.*  trans-162.779.3157.9-120.9-37.9000115S162 S166 R167S162-N164 PolarHBondContact O-N 2.94Å; N164-S166 PolarHBondContact O-N 3.02Å; N164-R167 PolarHBondContact O-N 3.14Å
165P41.9Very low53.8Low114 Ų11495.6 Ų95.674%0.7461%0.612SS**THydrogen-bonded Turntrans-64.4-8.4176.426.7-32.7000113.3
166S42.5Very low53.9Low97 Ų9793.7 Ų93.768%0.67860%0.601SS**THydrogen-bonded Turntrans-98.63.9-177.6-51.40000115.3N164N164-S166 PolarHBondContact O-N 3.02Å
167R47.7Very low54.4Low185 Ų18593.1 Ų93.170%0.69860%0.601SS**THydrogen-bonded Turntrans-128.1-3-178.1-68.9-167.5-169.4-155.53.1116.6N164 R208N164-R167 PolarHBondContact O-N 3.14Å; R167-R208 PolarHBondContact O-NH1 2.94Å
168I49.3Very low55.4Low93 Ų9393.6 Ų93.648%0.47760%0.595SS.*SBendtrans-120.8-15-174.2-65.6173.5000112.5
169C40.7Very low56.9Low84 Ų8494.8 Ų94.857%0.56860%0.601SS**SBendtrans-141.139.1179.6-83.70000114.4L160L160-C169 WeakPolarHBondContact CD2-SG 3.47Å
170G40.4Very low58.7Low68 Ų6894.9 Ų94.970%0.70159%0.59SS**SBendtrans-16630.9-174.500000117.8
171G47.2Very low60.5Low66 Ų6692.4 Ų92.468%0.6857%0.573SS**  trans-116.4-8.8-177.800000115.8
172G56.8Low62.6Low53 Ų5390.4 Ų90.455%0.54657%0.566SS.*SBendtrans-70.1130.2175.600000110.6
173A67.2Low64.6Low92 Ų9289.1 Ų89.176%0.7656%0.558SS**PPolyproline II helixtrans-60125.9162.800000106.6T175A173-T175 PolarHBondContact O-N 2.96Å
174P72.9Confident66.7Low56 Ų5682.9 Ų82.936%0.36452%0.524SS..PPolyproline II helixtrans-58.3143.6-179.322.7-32.5000110.6L176P174-L176 PolarHBondContact O-N 3.14Å
175T79.9Confident68.6Low76 Ų7682.3 Ų82.347%0.46653%0.53SS..SBendtrans-62.6-28.5-17662.60000112.3A173 E197 L200A173-T175 PolarHBondContact O-N 2.96Å; T175-E197 VanDerWaalsContact CB-OE1 3.27Å; T175-E197 WeakPolarHBondContact CB-OE1 3.38Å; T175-E197 WeakPolarHBondContact CG2-OE1 3.41Å; T175-E197 PolarHBondContact N-OE1 3.2Å; T175-E197 PolarHBondContact OG1-OE1 3.33Å; T175-L200 HydrophobicContact CG2-CD1 3.42Å; T175-L200 VanDerWaalsContact CG2-CD1 3.42Å
176L82.7Confident70.7Confident52 Ų5281.3 Ų81.327%0.27254%0.54SS..SBendtrans-113.3148.3-179.8-63.5-175.4000112.7P174 T180 R181 I184 N193P174-L176 PolarHBondContact O-N 3.14Å; L176-T180 HydrophobicContact CB-CG2 4.46Å; L176-T180 HydrophobicContact CD1-CG2 4.02Å; L176-T180 HydrophobicContact CD2-CG2 4.43Å; L176-R181 HydrophobicContact CB-CG 3.99Å; L176-R181 HydrophobicContact CD1-CG 4.44Å; L176-R181 VanDerWaalsContact O-CZ 3.26Å; L176-R181 PolarHBondContact O-NE 3.26Å; L176-R181 PolarHBondContact O-NH2 2.95Å; L176-I184 HydrophobicContact CD1-CD1 3.61Å; L176-N193 HydrophobicContact CD1-CB 4.34Å; L176-N193 WeakPolarHBondContact CD1-OD1 3.4Å; L176-N193 WeakPolarHBondContact CG-OD1 3.18Å
177S86.5Confident73Confident66 Ų6678.8 Ų78.846%0.46252%0.521SS..  trans-60153.3171.8820000111.7A179 T180 R181S177-A179 PolarHBondContact O-N 3.06Å; S177-T180 PolarHBondContact O-N 3.26Å; S177-T180 VanDerWaalsContact O-N 3.13Å; S177-T180 PolarHBondContact OG-N 3.37Å; S177-T180 PolarHBondContact OG-OG1 3.25Å; S177-R181 PolarHBondContact O-N 2.86Å
178D85.7Confident75Confident110 Ų11076.2 Ų76.259%0.58851%0.512SS*.Hα-helixtrans-60.1-36.2179.9-65.8-31.1000112.2R181 Q182D178-R181 PolarHBondContact O-N 3.48Å; D178-R181 IonicContact OD1-CZ 3.67Å; D178-R181 IonicContact OD1-NH2 2.7Å; D178-R181 PolarHBondContact OD1-NH2 3.37Å; D178-Q182 WeakPolarHBondContact O-CB 3.29Å; D178-Q182 VanDerWaalsContact O-CG 3.31Å; D178-Q182 WeakPolarHBondContact O-CG 3.41Å; D178-Q182 PolarHBondContact O-N 3.47Å
179A85Confident76.9Confident70 Ų7074.7 Ų74.758%0.57950%0.5SS*.Hα-helixtrans-63.6-43.317600000111.7S177 Q182 S183S177-A179 PolarHBondContact O-N 3.06Å; A179-Q182 PolarHBondContact O-N 3.3Å; A179-S183 PolarHBondContact O-N 3.1Å
180T86.1Confident79.3Confident55 Ų5570.8 Ų70.834%0.33747%0.474SS..Hα-helixtrans-64-46.1176.5-49.40000110.5L176 S177 Q182 S183 I184L176-T180 HydrophobicContact CB-CG2 4.46Å; L176-T180 HydrophobicContact CD1-CG2 4.02Å; L176-T180 HydrophobicContact CD2-CG2 4.43Å; S177-T180 PolarHBondContact O-N 3.26Å; S177-T180 VanDerWaalsContact O-N 3.13Å; S177-T180 PolarHBondContact OG-N 3.37Å; S177-T180 PolarHBondContact OG-OG1 3.25Å; T180-Q182 VanDerWaalsContact C-N 3.33Å; T180-Q182 PolarHBondContact O-N 3.31Å; T180-S183 PolarHBondContact O-N 2.96Å; T180-S183 PolarHBondContact O-OG 2.96Å; T180-I184 WeakPolarHBondContact O-CG1 3.35Å; T180-I184 PolarHBondContact O-N 2.91Å
181R85.3Confident81.7Confident65 Ų6570.5 Ų70.525%0.24547%0.465CS..Hα-helixtrans-61.3-40.3178.1-90.5178.4-71144.617.4112.8L176 S177 D178 S183 I184 A185L176-R181 HydrophobicContact CB-CG 3.99Å; L176-R181 HydrophobicContact CD1-CG 4.44Å; L176-R181 VanDerWaalsContact O-CZ 3.26Å; L176-R181 PolarHBondContact O-NE 3.26Å; L176-R181 PolarHBondContact O-NH2 2.95Å; S177-R181 PolarHBondContact O-N 2.86Å; D178-R181 PolarHBondContact O-N 3.48Å; D178-R181 IonicContact OD1-CZ 3.67Å; D178-R181 IonicContact OD1-NH2 2.7Å; D178-R181 PolarHBondContact OD1-NH2 3.37Å; R181-S183 VanDerWaalsContact C-N 3.32Å; R181-S183 PolarHBondContact O-N 2.87Å; R181-I184 WeakPolarHBondContact O-CG1 3.32Å; R181-I184 PolarHBondContact O-N 2.89Å; R181-A185 VanDerWaalsContact O-CB 3.32Å; R181-A185 WeakPolarHBondContact O-CB 3.5Å; R181-A185 PolarHBondContact O-N 2.87Å
182Q86.7Confident83.8Confident153 Ų15368.3 Ų68.372%0.71544%0.437SS*.Hα-helixtrans-64-36.7173.1-72175.416.900112.5D178 A179 T180 A185D178-Q182 WeakPolarHBondContact O-CB 3.29Å; D178-Q182 VanDerWaalsContact O-CG 3.31Å; D178-Q182 WeakPolarHBondContact O-CG 3.41Å; D178-Q182 PolarHBondContact O-N 3.47Å; A179-Q182 PolarHBondContact O-N 3.3Å; T180-Q182 VanDerWaalsContact C-N 3.33Å; T180-Q182 PolarHBondContact O-N 3.31Å; Q182-A185 PolarHBondContact O-N 2.97Å
183S85.9Confident85.4Confident84 Ų8465.9 Ų65.959%0.58741%0.412SS*.Hα-helixtrans-69.9-30.2179.172.90000113.8A179 T180 R181A179-S183 PolarHBondContact O-N 3.1Å; T180-S183 PolarHBondContact O-N 2.96Å; T180-S183 PolarHBondContact O-OG 2.96Å; R181-S183 VanDerWaalsContact C-N 3.32Å; R181-S183 PolarHBondContact O-N 2.87Å
184I86.2Confident86.6Confident22 Ų2265.9 Ų65.911%0.11340%0.399CS..Hα-helixtrans-98.2-6.4178.368.6179.4000112.7L176 T180 R181 G186 T187 W189 G190 N193L176-I184 HydrophobicContact CD1-CD1 3.61Å; T180-I184 WeakPolarHBondContact O-CG1 3.35Å; T180-I184 PolarHBondContact O-N 2.91Å; R181-I184 WeakPolarHBondContact O-CG1 3.32Å; R181-I184 PolarHBondContact O-N 2.89Å; I184-G186 PolarHBondContact O-N 3.24Å; I184-T187 WeakPolarHBondContact O-CB 3.23Å; I184-T187 PolarHBondContact O-N 3.05Å; I184-T187 PolarHBondContact O-OG1 3.18Å; I184-W189 HydrophobicContact CB-CB 4.18Å; I184-W189 HydrophobicContact CG2-CB 4.19Å; I184-G190 VanDerWaalsContact O-CA 3.31Å; I184-G190 WeakPolarHBondContact O-CA 3.25Å; I184-G190 PolarHBondContact O-N 2.88Å; I184-N193 HydrophobicContact CD1-CB 3.97Å
185A84.6Confident87.5Confident68 Ų6867.6 Ų67.656%0.56240%0.402SS*.THydrogen-bonded Turntrans-58.3129.1-179.400000110.7R181 Q182 T187R181-A185 VanDerWaalsContact O-CB 3.32Å; R181-A185 WeakPolarHBondContact O-CB 3.5Å; R181-A185 PolarHBondContact O-N 2.87Å; Q182-A185 PolarHBondContact O-N 2.97Å; A185-T187 PolarHBondContact O-N 3.44Å
186G85.8Confident88.1Confident92 Ų9264.6 Ų64.695%0.94838%0.383SS*.THydrogen-bonded Turntrans77.5-1.8-176.400000115.2I184I184-G186 PolarHBondContact O-N 3.24Å
187T90Very high88.5Confident45 Ų4564.1 Ų64.128%0.27638%0.379SS..SBendtrans-91.5166.7169.775.10000110.8I184 A185 W189 G190 A191I184-T187 WeakPolarHBondContact O-CB 3.23Å; I184-T187 PolarHBondContact O-N 3.05Å; I184-T187 PolarHBondContact O-OG1 3.18Å; A185-T187 PolarHBondContact O-N 3.44Å; T187-W189 HydrophobicContact CG2-CE3 4.08Å; T187-W189 HydrophobicContact CG2-CZ3 4.27Å; T187-W189 PolarHBondContact O-N 3.41Å; T187-W189 PolarHBondContact OG1-N 2.93Å; T187-G190 PolarHBondContact O-N 3.3Å; T187-G190 VanDerWaalsContact O-N 3.17Å; T187-G190 PolarHBondContact OG1-N 2.97Å; T187-A191 PolarHBondContact O-N 2.96Å
188R89.8Confident88.7Confident131 Ų13166.5 Ų66.549%0.49439%0.387SS..Hα-helixtrans-55.9-37.5169.8172.4178.9170.4-157.1-4.1112.3E43 G190 A191 M192E43-R188 IonicContact OE1-CZ 3.02Å; E43-R188 IonicContact OE1-NH1 2.69Å; E43-R188 PolarHBondContact OE1-NH1 3.2Å; E43-R188 IonicContact OE1-NH2 2.65Å; E43-R188 PolarHBondContact OE1-NH2 3.25Å; E43-R188 IonicContact OE2-CZ 3.54Å; E43-R188 IonicContact OE2-NH1 2.89Å; E43-R188 PolarHBondContact OE2-NH1 3.1Å; E43-R188 IonicContact OE2-NH2 3.87Å; R188-G190 VanDerWaalsContact C-N 3.32Å; R188-G190 PolarHBondContact O-N 2.97Å; R188-A191 PolarHBondContact O-N 2.92Å; R188-M192 HydrophobicContact CG-CG 4.46Å; R188-M192 HydrophobicContact CG-SD 4.1Å; R188-M192 WeakPolarHBondContact O-CG 3.34Å; R188-M192 PolarHBondContact O-N 3.39Å
189W89.5Confident89.1Confident60 Ų6062.4 Ų62.423%0.22737%0.365CS..Hα-helixtrans-66-37179.1-52.8-63.4000111.8E39 I42 L46 I184 T187 M192 N193E39-W189 HydrophobicContact CB-CZ2 4.09Å; E39-W189 HydrophobicContact CG-CH2 4.07Å; E39-W189 HydrophobicContact CG-CZ2 3.83Å; I42-W189 HydrophobicContact CG2-CG 4.41Å; L46-W189 HydrophobicContact CD1-CB 3.81Å; L46-W189 HydrophobicContact CD1-CG 4.18Å; I184-W189 HydrophobicContact CB-CB 4.18Å; I184-W189 HydrophobicContact CG2-CB 4.19Å; T187-W189 HydrophobicContact CG2-CE3 4.08Å; T187-W189 HydrophobicContact CG2-CZ3 4.27Å; T187-W189 PolarHBondContact O-N 3.41Å; T187-W189 PolarHBondContact OG1-N 2.93Å; W189-M192 PolarHBondContact O-N 2.96Å; W189-N193 WeakPolarHBondContact O-CB 3.36Å; W189-N193 PolarHBondContact O-N 3.24Å
190G90.5Very high89.4Confident3 Ų362 Ų623%0.03135%0.353CS..Hα-helixtrans-60.9-49.8173.400000111.8I184 T187 R188 M192 N193 D194I184-G190 VanDerWaalsContact O-CA 3.31Å; I184-G190 WeakPolarHBondContact O-CA 3.25Å; I184-G190 PolarHBondContact O-N 2.88Å; T187-G190 PolarHBondContact O-N 3.3Å; T187-G190 VanDerWaalsContact O-N 3.17Å; T187-G190 PolarHBondContact OG1-N 2.97Å; R188-G190 VanDerWaalsContact C-N 3.32Å; R188-G190 PolarHBondContact O-N 2.97Å; G190-M192 PolarHBondContact O-N 3.4Å; G190-N193 WeakPolarHBondContact O-CB 3.42Å; G190-N193 PolarHBondContact O-N 3.06Å; G190-N193 VanDerWaalsContact O-N 3.14Å; G190-D194 PolarHBondContact O-N 3.46Å
191A91.4Very high89.6Confident61 Ų6160.3 Ų60.350%0.50435%0.347SS..Hα-helixtrans-60.4-42.2177.700000112.9T187 R188 N193 D194 E195T187-A191 PolarHBondContact O-N 2.96Å; R188-A191 PolarHBondContact O-N 2.92Å; A191-N193 VanDerWaalsContact C-N 3.35Å; A191-D194 PolarHBondContact O-N 2.84Å; A191-E195 PolarHBondContact O-N 3.45Å; A191-E195 VanDerWaalsContact O-N 3.1Å
192M91.6Very high89.8Confident20 Ų2061 Ų6110%0.09936%0.355CS..Hα-helixtrans-65.4-38175.4-69.3177.675.300112.1L46 Q47 R188 W189 G190 I196L46-M192 HydrophobicContact CB-CB 4.24Å; L46-M192 HydrophobicContact CB-CE 3.64Å; L46-M192 HydrophobicContact CB-SD 4.24Å; L46-M192 HydrophobicContact CD1-CB 4.37Å; Q47-M192 HydrophobicContact CB-CE 3.85Å; Q47-M192 VanDerWaalsContact N-CE 3.3Å; R188-M192 HydrophobicContact CG-CG 4.46Å; R188-M192 HydrophobicContact CG-SD 4.1Å; R188-M192 WeakPolarHBondContact O-CG 3.34Å; R188-M192 PolarHBondContact O-N 3.39Å; W189-M192 PolarHBondContact O-N 2.96Å; G190-M192 PolarHBondContact O-N 3.4Å; M192-I196 WeakPolarHBondContact O-CD1 3.43Å; M192-I196 VanDerWaalsContact O-CG1 3.24Å; M192-I196 WeakPolarHBondContact O-CG1 3.33Å; M192-I196 PolarHBondContact O-N 2.84Å; M192-I196 VanDerWaalsContact O-N 3.08Å
193N90.8Very high90Very high3 Ų355.2 Ų55.22%0.01633%0.328CS..Hα-helixtrans-65.4-46175.5-17782.4000111.5L176 I184 W189 G190 A191 E195 I196 E197L176-N193 HydrophobicContact CD1-CB 4.34Å; L176-N193 WeakPolarHBondContact CD1-OD1 3.4Å; L176-N193 WeakPolarHBondContact CG-OD1 3.18Å; I184-N193 HydrophobicContact CD1-CB 3.97Å; W189-N193 WeakPolarHBondContact O-CB 3.36Å; W189-N193 PolarHBondContact O-N 3.24Å; G190-N193 WeakPolarHBondContact O-CB 3.42Å; G190-N193 PolarHBondContact O-N 3.06Å; G190-N193 VanDerWaalsContact O-N 3.14Å; A191-N193 VanDerWaalsContact C-N 3.35Å; N193-E195 VanDerWaalsContact C-N 3.29Å; N193-E195 PolarHBondContact O-N 3.5Å; N193-I196 WeakPolarHBondContact O-CA 3.28Å; N193-I196 WeakPolarHBondContact O-CB 3.38Å; N193-I196 PolarHBondContact O-N 3.34Å; N193-E197 WeakPolarHBondContact O-CG 3.27Å; N193-E197 PolarHBondContact O-N 3.45Å
194D91.1Very high90.3Very high92 Ų9255.3 Ų55.349%0.49232%0.319SS..Hα-helixtrans-58.9-42.3178.7-65-19000110.8G190 A191 I196 E197 D198G190-D194 PolarHBondContact O-N 3.46Å; A191-D194 PolarHBondContact O-N 2.84Å; D194-I196 VanDerWaalsContact C-N 3.35Å; D194-I196 PolarHBondContact O-N 3.2Å; D194-E197 PolarHBondContact O-N 3.33Å; D194-D198 PolarHBondContact O-N 2.69Å
195E92.2Very high90.4Very high92 Ų9255.1 Ų55.143%0.4332%0.322SS..Hα-helixtrans-63.9-36.7173.8-173.2-18016000112.9L50 A191 N193 N199L50-E195 VanDerWaalsContact CD1-CD 3.41Å; L50-E195 HydrophobicContact CD1-CG 4.23Å; L50-E195 WeakPolarHBondContact CD1-OE1 3.4Å; L50-E195 WeakPolarHBondContact CD1-OE2 3.48Å; A191-E195 PolarHBondContact O-N 3.45Å; A191-E195 VanDerWaalsContact O-N 3.1Å; N193-E195 VanDerWaalsContact C-N 3.29Å; N193-E195 PolarHBondContact O-N 3.5Å; E195-N199 WeakPolarHBondContact O-CB 3.48Å; E195-N199 PolarHBondContact O-N 2.7Å; E195-N199 PolarHBondContact O-ND2 2.97Å
196I92.1Very high90.7Very high12 Ų1252.1 Ų52.16%0.06230%0.296CS..Hα-helixtrans-64.4-45.1174.2-70.6160.7000110.3L46 L50 T53 M192 N193 D194 N199 L200L46-I196 HydrophobicContact CB-CD1 4.44Å; L46-I196 HydrophobicContact CD2-CD1 3.72Å; L50-I196 HydrophobicContact CB-CG1 4.31Å; T53-I196 HydrophobicContact CG2-CG2 4.33Å; M192-I196 WeakPolarHBondContact O-CD1 3.43Å; M192-I196 VanDerWaalsContact O-CG1 3.24Å; M192-I196 WeakPolarHBondContact O-CG1 3.33Å; M192-I196 PolarHBondContact O-N 2.84Å; M192-I196 VanDerWaalsContact O-N 3.08Å; N193-I196 WeakPolarHBondContact O-CA 3.28Å; N193-I196 WeakPolarHBondContact O-CB 3.38Å; N193-I196 PolarHBondContact O-N 3.34Å; D194-I196 VanDerWaalsContact C-N 3.35Å; D194-I196 PolarHBondContact O-N 3.2Å; I196-N199 PolarHBondContact O-N 3.45Å; I196-L200 HydrophobicContact CG2-CD1 4.08Å; I196-L200 HydrophobicContact CG2-CG 4.37Å; I196-L200 VanDerWaalsContact O-CG 3.27Å; I196-L200 WeakPolarHBondContact O-CG 3.2Å; I196-L200 PolarHBondContact O-N 3.29Å
197E91.1Very high91Very high43 Ų4352.1 Ų52.120%0.20127%0.274CS..Hα-helixtrans-62.5-44.1178.1-63.5-72.5-173.900111.7T175 N193 D194 N199 L200 G201T175-E197 VanDerWaalsContact CB-OE1 3.27Å; T175-E197 WeakPolarHBondContact CB-OE1 3.38Å; T175-E197 WeakPolarHBondContact CG2-OE1 3.41Å; T175-E197 PolarHBondContact N-OE1 3.2Å; T175-E197 PolarHBondContact OG1-OE1 3.33Å; N193-E197 WeakPolarHBondContact O-CG 3.27Å; N193-E197 PolarHBondContact O-N 3.45Å; D194-E197 PolarHBondContact O-N 3.33Å; E197-N199 VanDerWaalsContact C-N 3.33Å; E197-N199 PolarHBondContact O-N 2.85Å; E197-L200 PolarHBondContact O-N 2.71Å; E197-G201 PolarHBondContact O-N 3.35Å
198D91.1Very high91.1Very high115 Ų11556.2 Ų56.262%0.61529%0.285SS*.Hα-helixtrans-59.5-46.1175.3-76.4-13.9000110.9D194 L200 G201 I202D194-D198 PolarHBondContact O-N 2.69Å; D198-L200 VanDerWaalsContact C-N 3.34Å; D198-L200 PolarHBondContact O-N 3.08Å; D198-G201 PolarHBondContact O-N 3.37Å; D198-I202 WeakPolarHBondContact O-CG1 3.46Å; D198-I202 PolarHBondContact O-N 2.93Å
199N93.4Very high91.2Very high24 Ų2451.6 Ų51.613%0.12827%0.267CS..Hα-helixtrans-61.9-40.4176-75.5-37.8000112.2T53 I57 E195 I196 E197 G201 I202 M203T53-N199 HydrophobicContact CG2-CB 4.28Å; T53-N199 PolarHBondContact OG1-ND2 3.16Å; I57-N199 HydrophobicContact CD1-CB 3.72Å; I57-N199 VanDerWaalsContact CD1-OD1 3.23Å; I57-N199 WeakPolarHBondContact CD1-OD1 3.33Å; E195-N199 WeakPolarHBondContact O-CB 3.48Å; E195-N199 PolarHBondContact O-N 2.7Å; E195-N199 PolarHBondContact O-ND2 2.97Å; I196-N199 PolarHBondContact O-N 3.45Å; E197-N199 VanDerWaalsContact C-N 3.33Å; E197-N199 PolarHBondContact O-N 2.85Å; N199-G201 VanDerWaalsContact C-N 3.32Å; N199-I202 PolarHBondContact O-N 3.17Å; N199-M203 VanDerWaalsContact O-CG 3.25Å; N199-M203 WeakPolarHBondContact O-CG 3.48Å; N199-M203 PolarHBondContact O-N 2.92Å
200L92.4Very high91.4Very high61 Ų6150.5 Ų50.532%0.31927%0.266SS..Hα-helixtrans-64.6-37.3175.8-72174.8000111.7T53 T175 I196 E197 D198 M203 E204T53-L200 HydrophobicContact CG2-CD2 4.23Å; T53-L200 HydrophobicContact CG2-CG 4.47Å; T175-L200 HydrophobicContact CG2-CD1 3.42Å; T175-L200 VanDerWaalsContact CG2-CD1 3.42Å; I196-L200 HydrophobicContact CG2-CD1 4.08Å; I196-L200 HydrophobicContact CG2-CG 4.37Å; I196-L200 VanDerWaalsContact O-CG 3.27Å; I196-L200 WeakPolarHBondContact O-CG 3.2Å; I196-L200 PolarHBondContact O-N 3.29Å; E197-L200 PolarHBondContact O-N 2.71Å; D198-L200 VanDerWaalsContact C-N 3.34Å; D198-L200 PolarHBondContact O-N 3.08Å; L200-M203 HydrophobicContact CD2-CE 4.45Å; L200-M203 HydrophobicContact CD2-SD 4.16Å; L200-M203 PolarHBondContact O-N 2.9Å; L200-E204 PolarHBondContact O-N 3.12Å
201G89.7Confident91.6Very high21 Ų2157.4 Ų57.422%0.21630%0.295CS..Hα-helixtrans-61.9-43.8172.100000112.5E197 D198 N199 E204 G205E197-G201 PolarHBondContact O-N 3.35Å; D198-G201 PolarHBondContact O-N 3.37Å; N199-G201 VanDerWaalsContact C-N 3.32Å; G201-E204 PolarHBondContact O-N 3.47Å; G201-G205 PolarHBondContact O-N 2.81Å
202I89.9Confident91.6Very high80 Ų8057.3 Ų57.341%0.4128%0.284SS..Hα-helixtrans-61-46173.5-65.5166.8000110.3I57 D198 N199 E204 G205 N206I57-I202 HydrophobicContact CD1-CB 4.18Å; I57-I202 HydrophobicContact CD1-CD1 4.4Å; I57-I202 HydrophobicContact CD1-CG2 4.09Å; I57-I202 HydrophobicContact CG1-CG2 4.13Å; I57-I202 HydrophobicContact CG2-CG2 4.14Å; D198-I202 WeakPolarHBondContact O-CG1 3.46Å; D198-I202 PolarHBondContact O-N 2.93Å; N199-I202 PolarHBondContact O-N 3.17Å; I202-E204 VanDerWaalsContact C-N 3.35Å; I202-E204 PolarHBondContact O-N 2.85Å; I202-G205 PolarHBondContact O-N 3.42Å; I202-N206 PolarHBondContact O-N 3.41Å; I202-N206 PolarHBondContact O-OD1 3.35Å
203M92Very high91.8Very high31 Ų3156.4 Ų56.415%0.15328%0.28CS..Hα-helixtrans-60.6-41.8177.5-70.6173.254.700112T53 I57 L60 N199 L200 G205 N206 L207T53-M203 HydrophobicContact CG2-SD 4.21Å; I57-M203 HydrophobicContact CD1-CG 4.41Å; I57-M203 HydrophobicContact CG1-CG 3.55Å; I57-M203 HydrophobicContact CG1-SD 4.38Å; L60-M203 HydrophobicContact CD1-CB 3.89Å; L60-M203 HydrophobicContact CD1-CE 4.48Å; L60-M203 HydrophobicContact CD1-CG 3.83Å; N199-M203 VanDerWaalsContact O-CG 3.25Å; N199-M203 WeakPolarHBondContact O-CG 3.48Å; N199-M203 PolarHBondContact O-N 2.92Å; L200-M203 HydrophobicContact CD2-CE 4.45Å; L200-M203 HydrophobicContact CD2-SD 4.16Å; L200-M203 PolarHBondContact O-N 2.9Å; M203-G205 VanDerWaalsContact C-N 3.35Å; M203-G205 PolarHBondContact O-N 2.9Å; M203-N206 PolarHBondContact O-N 2.75Å; M203-L207 WeakPolarHBondContact O-CB 3.4Å; M203-L207 VanDerWaalsContact O-CG 3.25Å; M203-L207 WeakPolarHBondContact O-CG 3.38Å; M203-L207 PolarHBondContact O-N 3.34Å
204E90.3Very high91.9Very high86 Ų8658.1 Ų58.140%0.40230%0.298SS..Hα-helixtrans-59.2-46.1175.4-171.8-168.1163.400111L200 G201 I202 L207 R208L200-E204 PolarHBondContact O-N 3.12Å; G201-E204 PolarHBondContact O-N 3.47Å; I202-E204 VanDerWaalsContact C-N 3.35Å; I202-E204 PolarHBondContact O-N 2.85Å; E204-L207 PolarHBondContact O-N 3.48Å; E204-R208 PolarHBondContact O-N 3.36Å
205G89.5Confident92.1Very high17 Ų1759.3 Ų59.318%0.17530%0.304CS..Hα-helixtrans-58.7-49.3175.300000112.2G201 I202 M203 L207 R208 R209G201-G205 PolarHBondContact O-N 2.81Å; I202-G205 PolarHBondContact O-N 3.42Å; M203-G205 VanDerWaalsContact C-N 3.35Å; M203-G205 PolarHBondContact O-N 2.9Å; G205-L207 PolarHBondContact O-N 2.91Å; G205-R208 PolarHBondContact O-N 2.75Å; G205-R209 PolarHBondContact O-N 3.42Å
206N90.7Very high92.2Very high5 Ų555.2 Ų55.23%0.02729%0.285CS..Hα-helixtrans-60.6-43.7177.4-61.7-5000111.4L60 I202 M203 R208 R209 L210L60-N206 HydrophobicContact CB-CB 3.87Å; L60-N206 HydrophobicContact CD1-CB 4.11Å; L60-N206 HydrophobicContact CG-CB 4.48Å; I202-N206 PolarHBondContact O-N 3.41Å; I202-N206 PolarHBondContact O-OD1 3.35Å; M203-N206 PolarHBondContact O-N 2.75Å; N206-R208 PolarHBondContact O-N 3.33Å; N206-R209 PolarHBondContact O-N 3.43Å; N206-R209 PolarHBondContact OD1-NH2 3.49Å; N206-L210 WeakPolarHBondContact O-CB 3.35Å; N206-L210 WeakPolarHBondContact O-CG 3.35Å; N206-L210 PolarHBondContact O-N 2.73Å
207L92.6Very high92.3Very high92 Ų9256 Ų5648%0.48229%0.29SS..Hα-helixtrans-64.7-37.4177.7-75.6171.5000112.4L60 M203 E204 G205 K211L60-L207 HydrophobicContact CD1-CG 4.31Å; L60-L207 HydrophobicContact CD2-CD2 3.57Å; L60-L207 HydrophobicContact CD2-CG 4.06Å; M203-L207 WeakPolarHBondContact O-CB 3.4Å; M203-L207 VanDerWaalsContact O-CG 3.25Å; M203-L207 WeakPolarHBondContact O-CG 3.38Å; M203-L207 PolarHBondContact O-N 3.34Å; E204-L207 PolarHBondContact O-N 3.48Å; G205-L207 PolarHBondContact O-N 2.91Å; L207-K211 VanDerWaalsContact O-CB 3.29Å; L207-K211 WeakPolarHBondContact O-CB 3.48Å; L207-K211 PolarHBondContact O-N 2.9Å
208R91.4Very high92.5Very high131 Ų13156 Ų5649%0.49430%0.302SS..Hα-helixtrans-62.2-47.5173.8177.4-177.4-86.4172.50.1110.6R167 E204 G205 N206 K211 E212R167-R208 PolarHBondContact O-NH1 2.94Å; E204-R208 PolarHBondContact O-N 3.36Å; G205-R208 PolarHBondContact O-N 2.75Å; N206-R208 PolarHBondContact O-N 3.33Å; R208-K211 WeakPolarHBondContact O-CB 3.33Å; R208-K211 PolarHBondContact O-N 3.2Å; R208-E212 PolarHBondContact O-N 3.44Å
209R91.8Very high92.6Very high35 Ų3555.2 Ų55.213%0.13229%0.294CS..Hα-helixtrans-62.9-45.4177.5-66.5-166.9-51.5-83.4-1111.6E64 I152 T156 G205 N206 K211 E212 L213E64-R209 IonicContact OE1-CZ 3.55Å; E64-R209 IonicContact OE1-NE 3.41Å; E64-R209 PolarHBondContact OE1-NE 3.16Å; E64-R209 IonicContact OE1-NH2 3.1Å; E64-R209 IonicContact OE2-CZ 3.11Å; E64-R209 IonicContact OE2-NE 3.77Å; E64-R209 PolarHBondContact OE2-NE 3.47Å; E64-R209 IonicContact OE2-NH2 3.09Å; E64-R209 PolarHBondContact OE2-NH2 3.22Å; I152-R209 HydrophobicContact CD1-CB 4.4Å; I152-R209 WeakPolarHBondContact CD1-O 3.37Å; I152-R209 HydrophobicContact CG1-CB 4.23Å; I152-R209 HydrophobicContact CG1-CG 4.43Å; I152-R209 HydrophobicContact CG2-CB 4.3Å; T156-R209 PolarHBondContact OG1-NE 3.12Å; T156-R209 VanDerWaalsContact OG1-NE 3.16Å; G205-R209 PolarHBondContact O-N 3.42Å; N206-R209 PolarHBondContact O-N 3.43Å; N206-R209 PolarHBondContact OD1-NH2 3.49Å; R209-K211 VanDerWaalsContact C-N 3.3Å; R209-K211 PolarHBondContact O-N 3.3Å; R209-E212 PolarHBondContact O-N 2.88Å; R209-L213 WeakPolarHBondContact O-CB 3.29Å; R209-L213 PolarHBondContact O-N 3.29Å
210L93.7Very high92.5Very high37 Ų3754.2 Ų54.219%0.19429%0.288CS..Hα-helixtrans-59.7-38.7174.5-76.7173.6000112.6L60 A63 E64 N206 G214L60-L210 HydrophobicContact CB-CD1 4.4Å; L60-L210 HydrophobicContact CD2-CD1 3.46Å; L60-L210 VanDerWaalsContact CD2-CD1 3.46Å; A63-L210 HydrophobicContact CB-CD1 4.2Å; A63-L210 HydrophobicContact CB-CD2 4.09Å; E64-L210 HydrophobicContact CB-CD2 4.14Å; N206-L210 WeakPolarHBondContact O-CB 3.35Å; N206-L210 WeakPolarHBondContact O-CG 3.35Å; N206-L210 PolarHBondContact O-N 2.73Å; L210-G214 PolarHBondContact O-N 3.46Å
211K94.6Very high92.5Very high148 Ų14854.2 Ų54.264%0.64329%0.291SS*.Hα-helixtrans-64.6-46.7174.9178.3-177.8177.4179.20111.3L207 R208 R209 L213 G214 L215L207-K211 VanDerWaalsContact O-CB 3.29Å; L207-K211 WeakPolarHBondContact O-CB 3.48Å; L207-K211 PolarHBondContact O-N 2.9Å; R208-K211 WeakPolarHBondContact O-CB 3.33Å; R208-K211 PolarHBondContact O-N 3.2Å; R209-K211 VanDerWaalsContact C-N 3.3Å; R209-K211 PolarHBondContact O-N 3.3Å; K211-L213 VanDerWaalsContact C-N 3.34Å; K211-G214 PolarHBondContact O-N 3.19Å; K211-L215 HydrophobicContact CG-CD1 4.3Å; K211-L215 WeakPolarHBondContact O-CG 3.35Å; K211-L215 PolarHBondContact O-N 2.87Å
212E92.7Very high92.7Very high58 Ų5858.2 Ų58.227%0.27130%0.304SS..Hα-helixtrans-60.1-47.2177.9-165.8178.7166.100110.7T148 R208 R209 G214 L215 A216T148-E212 HydrophobicContact CG2-CB 4.41Å; T148-E212 HydrophobicContact CG2-CG 3.74Å; R208-E212 PolarHBondContact O-N 3.44Å; R209-E212 PolarHBondContact O-N 2.88Å; E212-G214 PolarHBondContact O-N 3.3Å; E212-L215 PolarHBondContact O-N 2.99Å; E212-A216 WeakPolarHBondContact O-CB 3.27Å; E212-A216 PolarHBondContact O-N 2.77Å
213L94.5Very high92.7Very high2 Ų258.4 Ų58.41%0.0130%0.303CS..Hα-helixtrans-59.4-47.8175.6-169.658.7000112.1L68 A71 L145 V149 I152 R209 K211 L215 A216 L217L68-L213 HydrophobicContact CD2-CD1 4.31Å; L68-L213 HydrophobicContact CD2-CD2 4.42Å; L68-L213 HydrophobicContact CG-CD2 4.37Å; A71-L213 HydrophobicContact CB-CD1 3.93Å; L145-L213 HydrophobicContact CD1-CD1 4.43Å; V149-L213 HydrophobicContact CG2-CD1 4.38Å; I152-L213 HydrophobicContact CD1-CB 3.67Å; I152-L213 HydrophobicContact CD1-CD1 4.12Å; I152-L213 HydrophobicContact CD1-CG 4.34Å; R209-L213 WeakPolarHBondContact O-CB 3.29Å; R209-L213 PolarHBondContact O-N 3.29Å; K211-L213 VanDerWaalsContact C-N 3.34Å; L213-L215 VanDerWaalsContact C-N 3.33Å; L213-L215 PolarHBondContact O-N 3.39Å; L213-A216 PolarHBondContact O-N 2.66Å; L213-L217 HydrophobicContact CD1-CG 4.4Å; L213-L217 HydrophobicContact CG-CD1 3.97Å; L213-L217 HydrophobicContact CG-CG 4.32Å; L213-L217 WeakPolarHBondContact O-CB 3.25Å; L213-L217 WeakPolarHBondContact O-CG 3.43Å; L213-L217 PolarHBondContact O-N 3.42Å
214G94.1Very high92.7Very high39 Ų3957.5 Ų57.540%0.40230%0.299SS..Hα-helixtrans-61.7-39.1179.900000113.1L210 K211 E212 G218L210-G214 PolarHBondContact O-N 3.46Å; K211-G214 PolarHBondContact O-N 3.19Å; E212-G214 PolarHBondContact O-N 3.3Å; G214-G218 PolarHBondContact O-N 2.99Å
215L95.1Very high92.8Very high116 Ų11657.1 Ų57.161%0.60730%0.299SS*.Hα-helixtrans-66.6-45174.3-70.2174.5000111.5K211 E212 L213 G218 E219K211-L215 HydrophobicContact CG-CD1 4.3Å; K211-L215 WeakPolarHBondContact O-CG 3.35Å; K211-L215 PolarHBondContact O-N 2.87Å; E212-L215 PolarHBondContact O-N 2.99Å; L213-L215 VanDerWaalsContact C-N 3.33Å; L213-L215 PolarHBondContact O-N 3.39Å; L215-G218 PolarHBondContact O-N 3.12Å; L215-E219 PolarHBondContact O-N 3.03Å
216A93.4Very high93Very high6 Ų660.2 Ų60.25%0.0531%0.312CS..Hα-helixtrans-66-40.3178.900000112.4L145 T148 E212 L213 E219 E220L145-A216 HydrophobicContact CD1-CB 3.66Å; T148-A216 HydrophobicContact CG2-CB 3.79Å; T148-A216 WeakPolarHBondContact OG1-CB 3.31Å; E212-A216 WeakPolarHBondContact O-CB 3.27Å; E212-A216 PolarHBondContact O-N 2.77Å; L213-A216 PolarHBondContact O-N 2.66Å; A216-E219 PolarHBondContact O-N 3.27Å; A216-E220 WeakPolarHBondContact O-CB 3.48Å; A216-E220 PolarHBondContact O-N 2.97Å
217L94.9Very high92.9Very high30 Ų3061.4 Ų61.416%0.15732%0.318CS..Hα-helixtrans-60-46.2172.8-73.8171.7000110.8T70 A71 L74 L145 L213 E220 V221T70-L217 HydrophobicContact CG2-CD2 4.3Å; A71-L217 HydrophobicContact CB-CD2 3.75Å; L74-L217 HydrophobicContact CD1-CD2 3.57Å; L145-L217 HydrophobicContact CD1-CD2 4.05Å; L145-L217 HydrophobicContact CD1-CG 4.23Å; L145-L217 HydrophobicContact CD2-CD2 4.15Å; L213-L217 HydrophobicContact CD1-CG 4.4Å; L213-L217 HydrophobicContact CG-CD1 3.97Å; L213-L217 HydrophobicContact CG-CG 4.32Å; L213-L217 WeakPolarHBondContact O-CB 3.25Å; L213-L217 WeakPolarHBondContact O-CG 3.43Å; L213-L217 PolarHBondContact O-N 3.42Å; L217-E220 PolarHBondContact O-N 2.98Å; L217-V221 VanDerWaalsContact O-CG2 3.31Å; L217-V221 WeakPolarHBondContact O-CG2 3.36Å; L217-V221 PolarHBondContact O-N 3.42Å
218G94.1Very high93Very high43 Ų4360.5 Ų60.544%0.44331%0.313SS..Hα-helixtrans-62.6-41.8178.100000112.9G214 L215 Q222G214-G218 PolarHBondContact O-N 2.99Å; L215-G218 PolarHBondContact O-N 3.12Å; G218-Q222 PolarHBondContact O-N 3.44Å
219E93.2Very high93.1Very high97 Ų9758.5 Ų58.545%0.45331%0.312SS..Hα-helixtrans-63.3-47.2175-167.1-168.5-177.500111.5S144 L215 A216 V221 Q222 Q223S144-E219 WeakPolarHBondContact CB-OE2 3.5Å; S144-E219 PolarHBondContact OG-OE2 2.99Å; L215-E219 PolarHBondContact O-N 3.03Å; A216-E219 PolarHBondContact O-N 3.27Å; E219-V221 PolarHBondContact O-N 3.38Å; E219-Q222 PolarHBondContact O-N 3.24Å; E219-Q223 WeakPolarHBondContact O-CG 3.45Å; E219-Q223 PolarHBondContact O-N 2.94Å; E219-Q223 PolarHBondContact OE1-NE2 3.19Å; E219-Q223 VanDerWaalsContact OE1-NE2 3.17Å
220E91.3Very high93.1Very high3 Ų360 Ų601%0.01432%0.323CS..Hα-helixtrans-61.8-44.2179-176.470.5-142.800111.5L74 T143 L145 A216 L217 Q222 Q223 Q224L74-E220 HydrophobicContact CB-CG 4.17Å; T143-E220 VanDerWaalsContact CB-OE2 3.32Å; T143-E220 WeakPolarHBondContact CB-OE2 3.35Å; T143-E220 PolarHBondContact OG1-OE2 3.28Å; L145-E220 HydrophobicContact CB-CB 4.15Å; L145-E220 HydrophobicContact CB-CG 4.36Å; L145-E220 HydrophobicContact CD2-CB 3.75Å; L145-E220 HydrophobicContact CD2-CG 3.64Å; A216-E220 WeakPolarHBondContact O-CB 3.48Å; A216-E220 PolarHBondContact O-N 2.97Å; L217-E220 PolarHBondContact O-N 2.98Å; E220-Q222 VanDerWaalsContact C-N 3.32Å; E220-Q222 PolarHBondContact O-N 2.88Å; E220-Q223 PolarHBondContact O-N 2.88Å; E220-Q224 VanDerWaalsContact CG-NE2 3.32Å; E220-Q224 WeakPolarHBondContact O-CB 3.38Å; E220-Q224 VanDerWaalsContact O-CG 3.32Å; E220-Q224 WeakPolarHBondContact O-CG 3.24Å; E220-Q224 PolarHBondContact O-N 3.22Å; E220-Q224 PolarHBondContact OE1-NE2 2.9Å
221V93.3Very high93Very high61 Ų6159.1 Ų59.137%0.3732%0.319SS..Hα-helixtrans-60.4-42.7175.6169.30000111L74 L217 E219 Q224 N225L74-V221 HydrophobicContact CD1-CG2 3.76Å; L74-V221 HydrophobicContact CD2-CG2 4.26Å; L217-V221 VanDerWaalsContact O-CG2 3.31Å; L217-V221 WeakPolarHBondContact O-CG2 3.36Å; L217-V221 PolarHBondContact O-N 3.42Å; E219-V221 PolarHBondContact O-N 3.38Å; V221-Q224 PolarHBondContact O-N 2.93Å; V221-N225 WeakPolarHBondContact O-CB 3.32Å; V221-N225 PolarHBondContact O-N 3.31Å; V221-N225 PolarHBondContact O-ND2 3.02Å
222Q92.9Very high93Very high106 Ų10654.3 Ų54.350%0.49531%0.307SS..Hα-helixtrans-63-44.9177.5-174.459.536.800111.6G218 E219 E220 Q224 N225 D226G218-Q222 PolarHBondContact O-N 3.44Å; E219-Q222 PolarHBondContact O-N 3.24Å; E220-Q222 VanDerWaalsContact C-N 3.32Å; E220-Q222 PolarHBondContact O-N 2.88Å; Q222-Q224 VanDerWaalsContact C-N 3.33Å; Q222-Q224 PolarHBondContact O-N 3.5Å; Q222-N225 PolarHBondContact O-N 2.92Å; Q222-D226 PolarHBondContact NE2-OD1 3.36Å; Q222-D226 PolarHBondContact O-N 3.35Å; Q222-D226 VanDerWaalsContact O-N 3.14Å
223Q91Very high93Very high84 Ų8458.4 Ų58.439%0.39332%0.32SS..Hα-helixtrans-61.8-41.2176.4-69.4178.323.700111.8E219 E220 D226 L227E219-Q223 WeakPolarHBondContact O-CG 3.45Å; E219-Q223 PolarHBondContact O-N 2.94Å; E219-Q223 PolarHBondContact OE1-NE2 3.19Å; E219-Q223 VanDerWaalsContact OE1-NE2 3.17Å; E220-Q223 PolarHBondContact O-N 2.88Å; Q223-D226 PolarHBondContact O-N 3.47Å; Q223-L227 WeakPolarHBondContact O-CB 3.39Å; Q223-L227 PolarHBondContact O-N 2.98Å
224Q90.9Very high92.9Very high12 Ų1261.6 Ų61.66%0.05633%0.333CS..Hα-helixtrans-68.3-37.9177.1-71.3-175.430.700112.3L74 L81 E220 V221 Q222 D226 L227 I228L74-Q224 PolarHBondContact O-NE2 2.9Å; L81-Q224 HydrophobicContact CD1-CB 4.05Å; L81-Q224 HydrophobicContact CD1-CG 4.15Å; E220-Q224 VanDerWaalsContact CG-NE2 3.32Å; E220-Q224 WeakPolarHBondContact O-CB 3.38Å; E220-Q224 VanDerWaalsContact O-CG 3.32Å; E220-Q224 WeakPolarHBondContact O-CG 3.24Å; E220-Q224 PolarHBondContact O-N 3.22Å; E220-Q224 PolarHBondContact OE1-NE2 2.9Å; V221-Q224 PolarHBondContact O-N 2.93Å; Q222-Q224 VanDerWaalsContact C-N 3.33Å; Q222-Q224 PolarHBondContact O-N 3.5Å; Q224-D226 PolarHBondContact O-N 3.01Å; Q224-L227 CarbonylContact O-C 3.57Å; Q224-L227 WeakPolarHBondContact O-CB 3.3Å; Q224-L227 PolarHBondContact O-N 3.42Å; Q224-I228 WeakPolarHBondContact O-CB 3.46Å; Q224-I228 VanDerWaalsContact O-CG1 3.23Å; Q224-I228 WeakPolarHBondContact O-CG1 3.23Å; Q224-I228 PolarHBondContact O-N 3.24Å
225N93.3Very high92.9Very high77 Ų7761.4 Ų61.441%0.41233%0.328SS..Hα-helixtrans-59.5-47.1174.6-73.4-23.9000111.4V221 Q222 L227 I228 D229V221-N225 WeakPolarHBondContact O-CB 3.32Å; V221-N225 PolarHBondContact O-N 3.31Å; V221-N225 PolarHBondContact O-ND2 3.02Å; Q222-N225 PolarHBondContact O-N 2.92Å; N225-L227 VanDerWaalsContact C-N 3.27Å; N225-L227 PolarHBondContact O-N 2.84Å; N225-I228 PolarHBondContact O-N 2.96Å; N225-D229 PolarHBondContact O-N 2.59Å; N225-D229 VanDerWaalsContact O-N 3.13Å
226D92.6Very high92.9Very high83 Ų8361 Ų6144%0.44433%0.326SS..Hα-helixtrans-62.8-36.7176.5-66.7-20.3000111.6Q222 Q223 Q224 N230Q222-D226 PolarHBondContact NE2-OD1 3.36Å; Q222-D226 PolarHBondContact O-N 3.35Å; Q222-D226 VanDerWaalsContact O-N 3.14Å; Q223-D226 PolarHBondContact O-N 3.47Å; Q224-D226 PolarHBondContact O-N 3.01Å; D226-N230 PolarHBondContact O-N 2.75Å; D226-N230 PolarHBondContact O-ND2 2.82Å
227L90.6Very high92.9Very high29 Ų2966.2 Ų66.215%0.15235%0.348CS..Hα-helixtrans-68.8-41.7176.5-176.358.5000112.2L81 Q82 D85 Q223 Q224 N225 D229 N230 V231L81-L227 HydrophobicContact CB-CD2 3.59Å; L81-L227 HydrophobicContact CB-CG 4.22Å; Q82-L227 HydrophobicContact CG-CD2 3.77Å; D85-L227 HydrophobicContact CB-CD1 3.88Å; Q223-L227 WeakPolarHBondContact O-CB 3.39Å; Q223-L227 PolarHBondContact O-N 2.98Å; Q224-L227 CarbonylContact O-C 3.57Å; Q224-L227 WeakPolarHBondContact O-CB 3.3Å; Q224-L227 PolarHBondContact O-N 3.42Å; N225-L227 VanDerWaalsContact C-N 3.27Å; N225-L227 PolarHBondContact O-N 2.84Å; L227-D229 VanDerWaalsContact C-N 3.32Å; L227-D229 PolarHBondContact O-N 2.67Å; L227-N230 WeakPolarHBondContact O-CB 3.38Å; L227-N230 PolarHBondContact O-N 2.9Å; L227-V231 HydrophobicContact CD1-CG2 4.22Å; L227-V231 HydrophobicContact CG-CG2 4.31Å; L227-V231 WeakPolarHBondContact O-CB 3.43Å; L227-V231 VanDerWaalsContact O-CG2 3.3Å; L227-V231 WeakPolarHBondContact O-CG2 3.11Å; L227-V231 PolarHBondContact O-N 3.44Å
228I93.5Very high92.7Very high74 Ų7465.3 Ų65.338%0.37934%0.344SS..Hα-helixtrans-59-44.6176.5-72.2163.1000110.2L81 Q224 N225 N230 V231 A232L81-I228 HydrophobicContact CD1-CD1 4.09Å; L81-I228 HydrophobicContact CD1-CG1 3.79Å; L81-I228 HydrophobicContact CD2-CG1 3.87Å; Q224-I228 WeakPolarHBondContact O-CB 3.46Å; Q224-I228 VanDerWaalsContact O-CG1 3.23Å; Q224-I228 WeakPolarHBondContact O-CG1 3.23Å; Q224-I228 PolarHBondContact O-N 3.24Å; N225-I228 PolarHBondContact O-N 2.96Å; I228-N230 VanDerWaalsContact C-N 3.33Å; I228-N230 PolarHBondContact O-N 3.25Å; I228-V231 PolarHBondContact O-N 2.96Å; I228-A232 WeakPolarHBondContact O-CB 3.44Å; I228-A232 PolarHBondContact O-N 3.13Å
229D94.1Very high92.7Very high89 Ų8967.7 Ų67.748%0.47635%0.346SS..Hα-helixtrans-60.4-41.8176.2-84.2-5.7000112.4N225 L227 R233N225-D229 PolarHBondContact O-N 2.59Å; N225-D229 VanDerWaalsContact O-N 3.13Å; L227-D229 VanDerWaalsContact C-N 3.32Å; L227-D229 PolarHBondContact O-N 2.67Å; D229-R233 WeakPolarHBondContact O-CG 3.47Å; D229-R233 PolarHBondContact O-N 3.39Å; D229-R233 VanDerWaalsContact O-N 3.11Å
230N91Very high92.6Very high67 Ų6768.3 Ų68.336%0.35835%0.352SS..Hα-helixtrans-66.3-45176.1-75.6-45000112D226 L227 I228 R233 K234D226-N230 PolarHBondContact O-N 2.75Å; D226-N230 PolarHBondContact O-ND2 2.82Å; L227-N230 WeakPolarHBondContact O-CB 3.38Å; L227-N230 PolarHBondContact O-N 2.9Å; I228-N230 VanDerWaalsContact C-N 3.33Å; I228-N230 PolarHBondContact O-N 3.25Å; N230-R233 PolarHBondContact O-N 2.92Å; N230-R233 PolarHBondContact OD1-NH2 2.94Å; N230-K234 WeakPolarHBondContact O-CB 3.47Å; N230-K234 WeakPolarHBondContact O-CG 3.49Å; N230-K234 PolarHBondContact O-N 3.08Å
231V92.5Very high92.6Very high18 Ų1870.7 Ų70.711%0.10937%0.367CS..Hα-helixtrans-61.2-45.5176.9163.80000110.4V84 D85 L88 L227 I228 K234 A235V84-V231 HydrophobicContact CG1-CG1 3.62Å; V84-V231 HydrophobicContact CG1-CG2 4.47Å; D85-V231 HydrophobicContact CB-CG2 3.7Å; L88-V231 HydrophobicContact CD1-CB 4.43Å; L88-V231 HydrophobicContact CD1-CG1 3.83Å; L88-V231 WeakPolarHBondContact CD1-O 3.27Å; L227-V231 HydrophobicContact CD1-CG2 4.22Å; L227-V231 HydrophobicContact CG-CG2 4.31Å; L227-V231 WeakPolarHBondContact O-CB 3.43Å; L227-V231 VanDerWaalsContact O-CG2 3.3Å; L227-V231 WeakPolarHBondContact O-CG2 3.11Å; L227-V231 PolarHBondContact O-N 3.44Å; I228-V231 PolarHBondContact O-N 2.96Å; V231-K234 PolarHBondContact O-N 3.1Å; V231-A235 WeakPolarHBondContact O-CB 3.49Å; V231-A235 PolarHBondContact O-N 3.3Å
232A93.9Very high92.6Very high47 Ų4770.6 Ų70.639%0.38837%0.366SS..Hα-helixtrans-58.8-51.3177.300000111.2I228 K234 A235 D236I228-A232 WeakPolarHBondContact O-CB 3.44Å; I228-A232 PolarHBondContact O-N 3.13Å; A232-K234 VanDerWaalsContact C-N 3.35Å; A232-K234 PolarHBondContact O-N 3.14Å; A232-A235 PolarHBondContact O-N 2.86Å; A232-D236 PolarHBondContact O-N 3.05Å
233R93.4Very high92.6Very high144 Ų14468.7 Ų68.754%0.54336%0.359SS..Hα-helixtrans-58.6-43.2176.3-73.2-172-68.8-96.83.8112.6D229 N230 K237D229-R233 WeakPolarHBondContact O-CG 3.47Å; D229-R233 PolarHBondContact O-N 3.39Å; D229-R233 VanDerWaalsContact O-N 3.11Å; N230-R233 PolarHBondContact O-N 2.92Å; N230-R233 PolarHBondContact OD1-NH2 2.94Å; R233-K237 WeakPolarHBondContact O-CB 3.35Å; R233-K237 PolarHBondContact O-N 3.44Å
234K92.5Very high92.6Very high69 Ų6968.5 Ų68.530%0.336%0.361SS..Hα-helixtrans-68.5-37.3178-76.7179.6-175.2173.40112D85 L88 N230 V231 A232 T238D85-K234 VanDerWaalsContact OD1-CD 3.29Å; D85-K234 WeakPolarHBondContact OD1-CD 3.42Å; D85-K234 WeakPolarHBondContact OD1-CE 3.23Å; D85-K234 IonicContact OD1-NZ 2.7Å; D85-K234 PolarHBondContact OD1-NZ 3.05Å; D85-K234 IonicContact OD2-NZ 2.8Å; D85-K234 PolarHBondContact OD2-NZ 3.2Å; L88-K234 HydrophobicContact CB-CB 4.14Å; L88-K234 HydrophobicContact CD1-CB 4.02Å; N230-K234 WeakPolarHBondContact O-CB 3.47Å; N230-K234 WeakPolarHBondContact O-CG 3.49Å; N230-K234 PolarHBondContact O-N 3.08Å; V231-K234 PolarHBondContact O-N 3.1Å; A232-K234 VanDerWaalsContact C-N 3.35Å; A232-K234 PolarHBondContact O-N 3.14Å; K234-T238 WeakPolarHBondContact O-CB 3.34Å; K234-T238 PolarHBondContact O-N 3.02Å; K234-T238 PolarHBondContact O-OG1 2.91Å
235A94Very high92.6Very high35 Ų3568.5 Ų68.529%0.28936%0.361SS..Hα-helixtrans-65.2-49.3178.200000110.7L88 V231 A232 K237 T238 N239L88-A235 HydrophobicContact CD1-CB 3.96Å; L88-A235 HydrophobicContact CD2-CB 4.2Å; V231-A235 WeakPolarHBondContact O-CB 3.49Å; V231-A235 PolarHBondContact O-N 3.3Å; A232-A235 PolarHBondContact O-N 2.86Å; A235-K237 PolarHBondContact O-N 3.22Å; A235-T238 PolarHBondContact O-N 3.45Å; A235-N239 VanDerWaalsContact O-CB 3.29Å; A235-N239 WeakPolarHBondContact O-CB 3.36Å; A235-N239 PolarHBondContact O-N 2.97Å
236D94.5Very high92.4Very high107 Ų10769.3 Ų69.357%0.57237%0.366SS*.Hα-helixtrans-58.4-48.3177.5-73.7-22.9000111.7A232 T238 N239 L240A232-D236 PolarHBondContact O-N 3.05Å; D236-T238 PolarHBondContact O-N 3.09Å; D236-N239 PolarHBondContact O-N 3.39Å; D236-L240 WeakPolarHBondContact O-CG 3.49Å; D236-L240 PolarHBondContact O-N 3.21Å
237K92.9Very high92.3Very high115 Ų11572 Ų7250%0.537%0.37SS..Hα-helixtrans-61.5-44.4177.5-177.7-178.8178.6-170.80112Q92 R233 A235 T241Q92-K237 VanDerWaalsContact OE1-NZ 3.17Å; R233-K237 WeakPolarHBondContact O-CB 3.35Å; R233-K237 PolarHBondContact O-N 3.44Å; A235-K237 PolarHBondContact O-N 3.22Å; K237-T241 WeakPolarHBondContact O-CB 3.11Å; K237-T241 PolarHBondContact O-N 3.42Å; K237-T241 VanDerWaalsContact O-N 3.08Å; K237-T241 PolarHBondContact O-OG1 3.43Å
238T91.1Very high92.1Very high11 Ų1173.9 Ų73.97%0.06738%0.377CS..Hα-helixtrans-62.1-47.8178.1-65.80000110.5L88 I91 K234 A235 D236 L240 T241 V242L88-T238 HydrophobicContact CD2-CG2 4.33Å; I91-T238 HydrophobicContact CB-CG2 3.99Å; I91-T238 HydrophobicContact CG2-CG2 3.31Å; K234-T238 WeakPolarHBondContact O-CB 3.34Å; K234-T238 PolarHBondContact O-N 3.02Å; K234-T238 PolarHBondContact O-OG1 2.91Å; A235-T238 PolarHBondContact O-N 3.45Å; D236-T238 PolarHBondContact O-N 3.09Å; T238-L240 PolarHBondContact O-N 2.95Å; T238-T241 PolarHBondContact O-N 2.65Å; T238-T241 VanDerWaalsContact O-N 3.14Å; T238-V242 HydrophobicContact CG2-CG2 4.23Å; T238-V242 WeakPolarHBondContact O-CG2 3.32Å; T238-V242 PolarHBondContact O-N 2.94Å
239N93.5Very high91.8Very high93 Ų9374.4 Ų74.450%0.49738%0.38SS..Hα-helixtrans-58.2-50.3179.2-169.535.2000111.6A235 D236 T241 V242 D243A235-N239 VanDerWaalsContact O-CB 3.29Å; A235-N239 WeakPolarHBondContact O-CB 3.36Å; A235-N239 PolarHBondContact O-N 2.97Å; D236-N239 PolarHBondContact O-N 3.39Å; N239-T241 VanDerWaalsContact C-N 3.27Å; N239-T241 PolarHBondContact O-N 2.69Å; N239-V242 PolarHBondContact O-N 3.01Å; N239-D243 WeakPolarHBondContact O-CB 3.46Å; N239-D243 PolarHBondContact O-N 3.05Å
240L92.8Very high91.5Very high111 Ų11174 Ų7458%0.58138%0.38SS*.Hα-helixtrans-58.1-38.7176.2-71.9173.6000112.7D236 T238 N244D236-L240 WeakPolarHBondContact O-CG 3.49Å; D236-L240 PolarHBondContact O-N 3.21Å; T238-L240 PolarHBondContact O-N 2.95Å; L240-N244 WeakPolarHBondContact O-CB 3.39Å; L240-N244 VanDerWaalsContact O-CG 3.26Å; L240-N244 PolarHBondContact O-N 3.35Å; L240-N244 VanDerWaalsContact O-N 3.14Å; L240-N244 PolarHBondContact O-ND2 2.93Å
241T91.4Very high91.2Very high52 Ų5278.9 Ų78.932%0.31939%0.393SS..Hα-helixtrans-74.4-43.1-177.8-470000111.3T95 K237 T238 N239 N244 Q245T95-T241 HydrophobicContact CG2-CG2 3.11Å; K237-T241 WeakPolarHBondContact O-CB 3.11Å; K237-T241 PolarHBondContact O-N 3.42Å; K237-T241 VanDerWaalsContact O-N 3.08Å; K237-T241 PolarHBondContact O-OG1 3.43Å; T238-T241 PolarHBondContact O-N 2.65Å; T238-T241 VanDerWaalsContact O-N 3.14Å; N239-T241 VanDerWaalsContact C-N 3.27Å; N239-T241 PolarHBondContact O-N 2.69Å; T241-N244 PolarHBondContact O-N 3.3Å; T241-Q245 WeakPolarHBondContact O-CG 3.35Å; T241-Q245 PolarHBondContact O-N 3.27Å
242V91.6Very high90.6Very high60 Ų6081 Ų8136%0.36440%0.404SS..Hα-helixtrans-62.1-44.1175.8171.50000110.8I91 T238 N239 N244 Q245 N246I91-V242 HydrophobicContact CG2-CG2 4.21Å; T238-V242 HydrophobicContact CG2-CG2 4.23Å; T238-V242 WeakPolarHBondContact O-CG2 3.32Å; T238-V242 PolarHBondContact O-N 2.94Å; N239-V242 PolarHBondContact O-N 3.01Å; V242-N244 VanDerWaalsContact C-N 3.35Å; V242-N244 PolarHBondContact O-N 3.44Å; V242-Q245 PolarHBondContact O-N 3.4Å; V242-N246 WeakPolarHBondContact O-CB 3.35Å; V242-N246 PolarHBondContact O-N 3.38Å
243D93.3Very high89.8Confident65 Ų6585.2 Ų85.235%0.34842%0.419SS..Hα-helixtrans-59-44.5175.4-91.2-8.5000112.3N239 Q245 N246 R247N239-D243 WeakPolarHBondContact O-CB 3.46Å; N239-D243 PolarHBondContact O-N 3.05Å; D243-Q245 VanDerWaalsContact C-N 3.34Å; D243-Q245 PolarHBondContact O-N 2.88Å; D243-N246 PolarHBondContact O-N 3.46Å; D243-R247 WeakPolarHBondContact O-CG 3.31Å; D243-R247 PolarHBondContact O-N 2.65Å
244N91.3Very high88.6Confident81 Ų8180.8 Ų80.843%0.43342%0.418SS..Hα-helixtrans-63.3-40.3176.6-78.8-38.5000111.9L240 T241 V242 R247 Q248L240-N244 WeakPolarHBondContact O-CB 3.39Å; L240-N244 VanDerWaalsContact O-CG 3.26Å; L240-N244 PolarHBondContact O-N 3.35Å; L240-N244 VanDerWaalsContact O-N 3.14Å; L240-N244 PolarHBondContact O-ND2 2.93Å; T241-N244 PolarHBondContact O-N 3.3Å; V242-N244 VanDerWaalsContact C-N 3.35Å; V242-N244 PolarHBondContact O-N 3.44Å; N244-R247 PolarHBondContact O-N 3.5Å; N244-Q248 WeakPolarHBondContact O-CG 3.42Å; N244-Q248 PolarHBondContact O-N 3.47Å
245Q90Very high86.9Confident12 Ų1281 Ų816%0.05643%0.429CS..Hα-helixtrans-68.1-39.9176.5-73.8-174.8-13.900112.6T95 Q99 L102 T241 V242 D243 R247 Q248 M249T95-Q245 PolarHBondContact O-NE2 3.39Å; Q99-Q245 VanDerWaalsContact OE1-NE2 3.1Å; L102-Q245 HydrophobicContact CD1-CB 3.97Å; L102-Q245 HydrophobicContact CD1-CG 3.95Å; T241-Q245 WeakPolarHBondContact O-CG 3.35Å; T241-Q245 PolarHBondContact O-N 3.27Å; V242-Q245 PolarHBondContact O-N 3.4Å; D243-Q245 VanDerWaalsContact C-N 3.34Å; D243-Q245 PolarHBondContact O-N 2.88Å; Q245-R247 VanDerWaalsContact C-N 3.33Å; Q245-R247 PolarHBondContact O-N 3.25Å; Q245-Q248 PolarHBondContact O-N 3.25Å; Q245-Q248 VanDerWaalsContact O-N 3.14Å; Q245-M249 WeakPolarHBondContact O-CB 3.38Å; Q245-M249 PolarHBondContact O-N 3.02Å
246N89.8Confident84.9Confident94 Ų9486 Ų8650%0.50345%0.451SS..Hα-helixtrans-61.2-42.5174.4-17033.3000111V242 D243 Q248 M249 T250V242-N246 WeakPolarHBondContact O-CB 3.35Å; V242-N246 PolarHBondContact O-N 3.38Å; D243-N246 PolarHBondContact O-N 3.46Å; N246-Q248 PolarHBondContact O-N 3.32Å; N246-M249 PolarHBondContact O-N 3.37Å; N246-T250 WeakPolarHBondContact O-CB 3.45Å; N246-T250 VanDerWaalsContact O-CG2 3.29Å; N246-T250 WeakPolarHBondContact O-CG2 3.32Å; N246-T250 PolarHBondContact O-N 3.4Å; N246-T250 PolarHBondContact O-OG1 3.05Å
247R90.4Very high82.7Confident140 Ų14090.1 Ų90.153%0.52846%0.463SS..Hα-helixtrans-62.9-38.6172.2-70175-168.7173.53.6112.9D243 N244 Q245 T250 R251D243-R247 WeakPolarHBondContact O-CG 3.31Å; D243-R247 PolarHBondContact O-N 2.65Å; N244-R247 PolarHBondContact O-N 3.5Å; Q245-R247 VanDerWaalsContact C-N 3.33Å; Q245-R247 PolarHBondContact O-N 3.25Å; R247-T250 WeakPolarHBondContact CA-OG1 3.5Å; R247-T250 PolarHBondContact O-OG1 3.17Å; R247-R251 WeakPolarHBondContact O-CB 3.31Å; R247-R251 VanDerWaalsContact O-CG 3.25Å; R247-R251 WeakPolarHBondContact O-CG 3.34Å; R247-R251 PolarHBondContact O-N 3.33Å; R247-R251 VanDerWaalsContact O-N 3.13Å
248Q87.7Confident80.8Confident67 Ų6793.9 Ų93.931%0.31348%0.48SS..Hα-helixtrans-66.8-44.8176.2-74.2178.522.200111.5L102 N244 Q245 N246 R251 L252L102-Q248 HydrophobicContact CD1-CB 4.12Å; N244-Q248 WeakPolarHBondContact O-CG 3.42Å; N244-Q248 PolarHBondContact O-N 3.47Å; Q245-Q248 PolarHBondContact O-N 3.25Å; Q245-Q248 VanDerWaalsContact O-N 3.14Å; N246-Q248 PolarHBondContact O-N 3.32Å; Q248-R251 PolarHBondContact O-N 3.12Å; Q248-L252 WeakPolarHBondContact O-CG 3.5Å; Q248-L252 PolarHBondContact O-N 3.32Å
249M85.8Confident78.7Confident86 Ų86101.7 Ų101.742%0.42452%0.515SS..Hα-helixtrans-64.2-45.2179-169.4-178.9-64.600111.8L102 Q245 N246 R251 L252 L253L102-M249 HydrophobicContact CD2-CB 4.27Å; L102-M249 HydrophobicContact CD2-CE 4.49Å; Q245-M249 WeakPolarHBondContact O-CB 3.38Å; Q245-M249 PolarHBondContact O-N 3.02Å; N246-M249 PolarHBondContact O-N 3.37Å; M249-R251 VanDerWaalsContact C-N 3.32Å; M249-R251 PolarHBondContact O-N 3.19Å; M249-L252 PolarHBondContact O-N 3.34Å; M249-L253 HydrophobicContact CG-CD1 4.09Å; M249-L253 WeakPolarHBondContact O-CG 3.48Å; M249-L253 PolarHBondContact O-N 2.95Å
250T87.3Confident76.3Confident79 Ų79106.8 Ų106.849%0.48553%0.533SS..Hα-helixtrans-63.1-35.7175.750.80000112.5N246 R247 G254N246-T250 WeakPolarHBondContact O-CB 3.45Å; N246-T250 VanDerWaalsContact O-CG2 3.29Å; N246-T250 WeakPolarHBondContact O-CG2 3.32Å; N246-T250 PolarHBondContact O-N 3.4Å; N246-T250 PolarHBondContact O-OG1 3.05Å; R247-T250 WeakPolarHBondContact CA-OG1 3.5Å; R247-T250 PolarHBondContact O-OG1 3.17Å; T250-G254 WeakPolarHBondContact O-CA 3.47Å; T250-G254 PolarHBondContact O-N 3.2Å
251R85.7Confident74Confident170 Ų170111.4 Ų111.464%0.64255%0.548SS*.Hα-helixtrans-63.9-47.2170.9-74.2172.4-171.1166.82.4111.5R247 Q248 M249 L253 G254 S255R247-R251 WeakPolarHBondContact O-CB 3.31Å; R247-R251 VanDerWaalsContact O-CG 3.25Å; R247-R251 WeakPolarHBondContact O-CG 3.34Å; R247-R251 PolarHBondContact O-N 3.33Å; R247-R251 VanDerWaalsContact O-N 3.13Å; Q248-R251 PolarHBondContact O-N 3.12Å; M249-R251 VanDerWaalsContact C-N 3.32Å; M249-R251 PolarHBondContact O-N 3.19Å; R251-L253 VanDerWaalsContact C-N 3.29Å; R251-L253 PolarHBondContact O-N 3.34Å; R251-G254 PolarHBondContact O-N 2.89Å; R251-S255 WeakPolarHBondContact O-CB 3.01Å; R251-S255 PolarHBondContact O-N 3.48Å; R251-S255 VanDerWaalsContact O-N 3.09Å; R251-S255 PolarHBondContact O-OG 3.31Å
252L79Confident72Confident62 Ų62113.5 Ų113.533%0.32557%0.571SS.*Hα-helixtrans-60.4-37.5178.8-71.1172.1000112.4L102 L105 Q248 M249L102-L252 HydrophobicContact CD2-CD1 3.8Å; L105-L252 HydrophobicContact CB-CD1 4.4Å; Q248-L252 WeakPolarHBondContact O-CG 3.5Å; Q248-L252 PolarHBondContact O-N 3.32Å; M249-L252 PolarHBondContact O-N 3.34Å
253L77.8Confident70Confident137 Ų137114.6 Ų114.672%0.71759%0.587SS**Hα-helixtrans-81.9-28.7179.4-66.4168.7000113.9M249 R251M249-L253 HydrophobicContact CG-CD1 4.09Å; M249-L253 WeakPolarHBondContact O-CG 3.48Å; M249-L253 PolarHBondContact O-N 2.95Å; R251-L253 VanDerWaalsContact C-N 3.29Å; R251-L253 PolarHBondContact O-N 3.34Å
254G67.9Low67.9Low50 Ų50119.3 Ų119.352%0.51561%0.611SS.*Hα-helixtrans-101.6-6.5-171.500000115.9T250 R251 D256T250-G254 WeakPolarHBondContact O-CA 3.47Å; T250-G254 PolarHBondContact O-N 3.2Å; R251-G254 PolarHBondContact O-N 2.89Å; G254-D256 PolarHBondContact O-N 3.1Å
255S57.3Low66.2Low75 Ų75120.7 Ų120.752%0.52462%0.624SS.*G310 helixtrans-69.2-15-175.7-65.10000114.6R251 K257R251-S255 WeakPolarHBondContact O-CB 3.01Å; R251-S255 PolarHBondContact O-N 3.48Å; R251-S255 VanDerWaalsContact O-N 3.09Å; R251-S255 PolarHBondContact O-OG 3.31Å; S255-K257 VanDerWaalsContact C-N 3.27Å; S255-K257 PolarHBondContact O-N 2.61Å
256D51.1Low64.3Low140 Ų140127.1 Ų127.175%0.74966%0.659SS**G310 helixtrans-73.8-9.3-175-80.2-32.7000115.3G254G254-D256 PolarHBondContact O-N 3.1Å
257K50.2Low62.5Low193 Ų193126.8 Ų126.884%0.83967%0.669SS**G310 helixtrans-100.2-6-174.6-66.1-168.3-179.1-178.50116.2S255S255-K257 VanDerWaalsContact C-N 3.27Å; S255-K257 PolarHBondContact O-N 2.61Å
258K51.4Low60.8Low194 Ų194129.5 Ų129.584%0.84369%0.685SS**SBendtrans-114.9-6-175.1-75.8-171177.6-177.10117.1
259Q46.9Very low59.2Low174 Ų174130.7 Ų130.781%0.81371%0.706SS**SBendtrans-97.2-9.9176.6-72.5-172-3.700115.5K261Q259-K261 PolarHBondContact O-N 3.49Å
260K43.6Very low57.6Low201 Ų201131.2 Ų131.287%0.87472%0.724SS**THydrogen-bonded Turntrans-81.6-1.9177.1-93.2-173.9177.1-179.30116.1
261K45.2Very low55.9Low207 Ų207135.6 Ų135.690%0.974%0.743SS**THydrogen-bonded Turntrans-104.5-2.8179.2-106.1-170.5177.9-170.90115.5Q259Q259-K261 PolarHBondContact O-N 3.49Å
262A49.8Very low54.4Low97 Ų97137.1 Ų137.180%0.80276%0.755SS**SBendtrans-108.99.8-17700000114.2
263A48.3Very low53.3Low83 Ų83143 Ų14369%0.68678%0.783SS**  trans-12320.7-174.100000114.3P265A263-P265 WeakPolarHBondContact O-CD 3.47Å
264L49.7Very low52.3Low163 Ų163146 Ų14685%0.85381%0.811SS**  trans-91.2116171.2-132.385.1000109D266L264-D266 PolarHBondContact O-N 3.06Å
265P54.8Low51.5Low110 Ų110150.9 Ų150.971%0.71483%0.826SS**  trans-70.2130.3178.728.3-31.8000109.9A263 A267A263-P265 WeakPolarHBondContact O-CD 3.47Å; P265-A267 VanDerWaalsContact C-N 3.26Å; P265-A267 PolarHBondContact O-N 2.89Å
266D49.9Very low51.2Low147 Ų147154.8 Ų154.879%0.78684%0.841SS**  trans-70.483.2171.4-166.43.3000109.3L264L264-D266 PolarHBondContact O-N 3.06Å
267A53.2Low51.2Low87 Ų87155.7 Ų155.772%0.71985%0.847SS**  trans-97.926.3-18000000112.6P265P265-A267 VanDerWaalsContact C-N 3.26Å; P265-A267 PolarHBondContact O-N 2.89Å
268K53.6Low51.3Low198 Ų198153.5 Ų153.586%0.86185%0.847SS**  trans-103.76.4177.4-95.3-170.7176-175.30115.5
269A54.7Low51.3Low92 Ų92150.9 Ų150.976%0.7685%0.847SS**  trans-93.56.717900000115.5
270A52Low51.6Low96 Ų96149.4 Ų149.479%0.79385%0.849SS**  trans-98.221.9-172.800000115.9
271L52Low52.2Low171 Ų171145.7 Ų145.790%0.89585%0.848SS**  trans-128.164.8179.9-152.581.8000112.5
272K53.6Low52.7Low202 Ų202141 Ų14188%0.87884%0.844SS**  trans-158.4102.7156.2-152163.9-179.7179.90111.4
273M55.9Low52.9Low187 Ų187144.7 Ų144.792%0.92185%0.847SS**  trans-140.3157158-74.1-149.6-128.200106.5
274P57.6Low53.4Low200 Ų200150.3 Ų150.3100%1.29986%0.862SS**  cis-83.60-3334.3-32.3000113.3

Retrieved 274 of 274 residues in 135.9 ms (Link to these results)