A0A096NEF5_PAPAN Loading...

Transmembrane protein 200A

AlphaFold DB , UniProt , Accession A0A096NEF5, Species PAPAN (Papio anubis, Olive baboon), Gene TMEM200A, Length 491 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M37.3Very low44.8Very low248 Ų248135 Ų135100%1.22287%0.866SS**  01710-78.3165.36500109.1
2I39.1Very low44.7Very low158 Ų158131 Ų13181%0.8185%0.854SS**  trans-101.5145.5-159.9-63159000112.2
3A46Very low44.6Very low92 Ų92128.9 Ų128.976%0.7685%0.854SS**  trans152.9106.6155.400000107.6
4T47.1Very low44.9Very low129 Ų129132.6 Ų132.679%0.79186%0.86SS**  cis65.9104.122.869.30000117.6
5G40.5Very low44.5Very low88 Ų88135 Ų13591%0.90785%0.852SS**  trans109.5147.8149.600000116.8
6G41.9Very low44.2Very low71 Ų71140 Ų14073%0.73285%0.849SS**  trans147.21.7160.400000121.1I8G6-I8 VanDerWaalsContact C-N 3.34Å; G6-I8 PolarHBondContact O-N 3.01Å
7V46.3Very low44Very low152 Ų152143.6 Ų143.692%0.92186%0.855SS**  trans-8663.8-173.6-164.90000113.1
8I52.5Low43.3Very low158 Ų158143.4 Ų143.481%0.8185%0.849SS**  trans-149.9160172.4-4175000112.2G6G6-I8 VanDerWaalsContact C-N 3.34Å; G6-I8 PolarHBondContact O-N 3.01Å
9T49Very low42.8Very low131 Ų131141.6 Ų141.680%0.80485%0.845SS**  trans94.439.9-179.7-33.50000116.5
10G46.3Very low42.4Very low82 Ų82139.4 Ų139.485%0.84584%0.843SS**  trans-97.46.1171.800000116.3
11L47.4Very low41.9Very low176 Ų176144.5 Ų144.592%0.92185%0.847SS**SBendtrans-1263.5-158.3-105.9161.2000116.5
12A43Very low41.6Very low87 Ų87137.4 Ų137.472%0.71982%0.821SS**SBendtrans-113.1-5.4-171.200000115.7L14A12-L14 PolarHBondContact O-N 3.43Å
13A43.7Very low41.3Very low104 Ų104139.5 Ų139.586%0.8683%0.828SS**  trans-85-0.2-171.600000115.5K15A13-K15 PolarHBondContact O-N 3.37Å
14L48.2Very low40.6Very low180 Ų180143.3 Ų143.394%0.94283%0.83SS**  trans-81.349.4-179.4-16476.3000112.8A12A12-L14 PolarHBondContact O-N 3.43Å
15K39.5Very low40Very low169 Ų169146.3 Ų146.374%0.73584%0.835SS**SBendtrans-157.4105.7175.2-152.9168.4-173.5176.20113.5A13A13-K15 PolarHBondContact O-N 3.37Å
16R39.8Very low39.5Very low215 Ų215147.2 Ų147.281%0.81182%0.822SS**  trans57.1110.3164.3-59176.2-179.2176.7-3116.4
17Q40.3Very low38.7Very low201 Ų201150.6 Ų150.694%0.93982%0.824SS**  trans-131.4124.7142.5-133.3176.7-12.700108.7
18D32.1Very low38.1Very low140 Ų140151.1 Ų151.175%0.74982%0.82SS**  trans-91.8158.3-172.1-75.4-74.2000112.6
19S34.1Very low37.1Very low110 Ų110148.8 Ų148.877%0.76982%0.818SS**  trans51.3116.8145.7-153.10000121.1
20A34.4Very low36.5Very low97 Ų97148.6 Ų148.680%0.80282%0.819SS**  trans45.7105.7137.100000120
21R30.7Very low35.6Very low246 Ų246149.7 Ų149.793%0.92881%0.814SS**  trans-145.2140.3150.2-165.2169.5-179.21670.1112.1
22S32.3Very low35.3Very low99 Ų99146.8 Ų146.869%0.69281%0.806SS**  trans62.598.7168.7-159.30000118.1
23Q32.1Very low34.6Very low202 Ų202147.5 Ų147.594%0.94481%0.812SS**  -132.3126.9102.1-79-151.7-1200109.3
24Q31.3Very low34Very low172 Ų172149 Ų14980%0.80481%0.81SS**  trans-137102.7-179.1-164.4155.3-11.800107.8
25H34.1Very low33.4Very low193 Ų193149.6 Ų149.689%0.89481%0.808SS**  trans-141.2129.8168.1-134.5-86.3000108.5
26V30.9Very low33.1Very low107 Ų107150 Ų15065%0.64881%0.813SS**  trans-117130.8-171.4171.70000107.9
27N25.6Very low32.7Very low142 Ų142149.5 Ų149.576%0.75982%0.816SS**  -172.9146.1127-105.1-35.1000116.1
28L33.1Very low32.6Very low162 Ų162148.4 Ų148.485%0.84881%0.808SS**  trans66.3148.9165-82.473.2000120
29S30.7Very low32.9Very low110 Ų110147.7 Ų147.777%0.76981%0.811SS**  trans-133.9165.3-178.6-140.90000107.4
30P36.3Very low33.4Very low126 Ų126149.9 Ų149.982%0.81881%0.813SS**  -138.5173.45932.3-10.9000116.6
31S28.6Very low33.6Very low106 Ų106156.9 Ų156.974%0.74182%0.818SS**  trans-88.3-177.8169.7-138.30000110.7
32P39.9Very low34Very low115 Ų115156.5 Ų156.575%0.74782%0.817SS**  cis-134.7165.1-5.640.9-24.8000116.1
33A29.7Very low34.5Very low102 Ų102162.5 Ų162.584%0.84383%0.825SS**  trans-160.4128.5151.400000111.9
34T30.8Very low35Very low135 Ų135159 Ų15983%0.82882%0.819SS**  trans-91.8128.8179.7-51.40000111.5
35Q36.1Very low35.1Very low193 Ų193161.8 Ų161.890%0.90282%0.822SS**  trans-159.8145.4153.5-116.2166.257.900112.6
36E31.8Very low35.4Very low177 Ų177156.9 Ų156.983%0.82782%0.815SS**  trans-79.4129.9-165.3-60.3-172125.100114.3K38E36-K38 PolarHBondContact O-N 3.45Å; E36-K38 VanDerWaalsContact O-N 3.17Å
37K32.3Very low35.4Very low204 Ų204158.1 Ų158.189%0.88782%0.818SS**  trans-82.989.2168.8-70.5179.1-179.4173.20110.4P39K37-P39 WeakPolarHBondContact O-CD 3.49Å
38K38.6Very low36Very low179 Ų179157 Ų15778%0.77882%0.816SS**  trans-50.6119.5167.9-71.4178.5178.8174.40109.6E36 I40E36-K38 PolarHBondContact O-N 3.45Å; E36-K38 VanDerWaalsContact O-N 3.17Å; K38-I40 PolarHBondContact O-N 3.36Å; K38-I40 VanDerWaalsContact O-N 3.09Å
39P38.5Very low36.1Very low124 Ų124153.6 Ų153.681%0.80580%0.801SS**  trans-70.6110.7179.227.2-32.7000109.5K37 R41K37-P39 WeakPolarHBondContact O-CD 3.49Å; P39-R41 PolarHBondContact O-N 2.96Å; P39-R41 VanDerWaalsContact O-N 3.09Å
40I43.2Very low36.5Very low156 Ų156153.6 Ų153.680%0.880%0.797SS**  trans-54.3119170.5-68171.4000107.7K38 R42K38-I40 PolarHBondContact O-N 3.36Å; K38-I40 VanDerWaalsContact O-N 3.09Å; I40-R42 VanDerWaalsContact C-N 3.35Å; I40-R42 PolarHBondContact O-N 3.07Å
41R38.3Very low36.7Very low245 Ų245153 Ų15393%0.92579%0.791SS**  trans-54.497.8175.3-102.8-178.7168.7175.7-3.9108.7P39 R43P39-R41 PolarHBondContact O-N 2.96Å; P39-R41 VanDerWaalsContact O-N 3.09Å; R41-R43 PolarHBondContact O-N 2.96Å
42R39.8Very low37.4Very low238 Ų238158.5 Ų158.590%0.89880%0.795SS**  trans-58.8124.4165.7-69.9-179.7175.7174-1105.8I40I40-R42 VanDerWaalsContact C-N 3.35Å; I40-R42 PolarHBondContact O-N 3.07Å
43R42.9Very low37.9Very low225 Ų225155 Ų15585%0.84978%0.78SS**  trans-49141.4169.5-61.6-177.7-176.9-171.6-0107.4R41 R45R41-R43 PolarHBondContact O-N 2.96Å; R43-R45 PolarHBondContact O-N 2.9Å
44P42.7Very low38.9Very low127 Ų127159.7 Ų159.783%0.82578%0.781SS**  trans-49.9115.4161-21.532.8000106.4
45R34.4Very low40.1Very low232 Ų232156.9 Ų156.988%0.87576%0.76SS**  trans-58.9140.3155.2-71.5-171.8169.7-159.7-5104.3R43 D47R43-R45 PolarHBondContact O-N 2.9Å; R45-D47 PolarHBondContact O-N 3.09Å
46A38.3Very low41.3Very low89 Ų89157.3 Ų157.374%0.73675%0.754SS**  trans-47.5115.6166.600000105.7V48A46-V48 PolarHBondContact O-N 3.45Å
47D31.4Very low42.5Very low134 Ų134152.8 Ų152.872%0.71774%0.735SS**  trans-61.4113.6175.4-172.91.9000103.4R45 V49R45-D47 PolarHBondContact O-N 3.09Å; D47-V49 HydrophobicContact CB-CG2 3.83Å; D47-V49 PolarHBondContact O-N 3.06Å; D47-V49 WeakPolarHBondContact OD2-CG2 3.37Å
48V38.1Very low43.9Very low118 Ų118154.4 Ų154.472%0.71574%0.737SS**  trans-7672.2168.9-1740000103.7A46 V50A46-V48 PolarHBondContact O-N 3.45Å; V48-V50 HydrophobicContact CG1-CG2 4.01Å; V48-V50 PolarHBondContact O-N 3.41Å
49V35.9Very low45.6Very low90 Ų90148 Ų14855%0.54572%0.715SS.*  trans-59.390.2160.3-167.70000102.8D47 V51D47-V49 HydrophobicContact CB-CG2 3.83Å; D47-V49 PolarHBondContact O-N 3.06Å; D47-V49 WeakPolarHBondContact OD2-CG2 3.37Å; V49-V51 HydrophobicContact CB-CG2 4.09Å; V49-V51 HydrophobicContact CG1-CG2 3.5Å; V49-V51 VanDerWaalsContact CG1-CG2 3.5Å; V49-V51 PolarHBondContact O-N 3.39Å
50V39.7Very low47.5Very low110 Ų110146.8 Ų146.867%0.66771%0.707SS**  trans-62.781.2156-178.80000103.2V48 R52V48-V50 HydrophobicContact CG1-CG2 4.01Å; V48-V50 PolarHBondContact O-N 3.41Å; V50-R52 HydrophobicContact CG1-CB 4.44Å; V50-R52 WeakPolarHBondContact O-CA 3.48Å; V50-R52 PolarHBondContact O-N 2.91Å
51V40.7Very low49.3Very low115 Ų115140.1 Ų140.170%0.69767%0.674SS**  trans-61.980.4162.9178.70000102.9V49 G53V49-V51 HydrophobicContact CB-CG2 4.09Å; V49-V51 HydrophobicContact CG1-CG2 3.5Å; V49-V51 VanDerWaalsContact CG1-CG2 3.5Å; V49-V51 PolarHBondContact O-N 3.39Å; V51-G53 VanDerWaalsContact C-N 3.33Å; V51-G53 WeakPolarHBondContact O-CA 3.38Å; V51-G53 PolarHBondContact O-N 3.2Å
52R43.4Very low51.6Low220 Ų220128.4 Ų128.483%0.8363%0.63SS**  trans-54.2100.1-161.9171.4-176.3173.7170.3-0.6106.3V50 K54V50-R52 HydrophobicContact CG1-CB 4.44Å; V50-R52 WeakPolarHBondContact O-CA 3.48Å; V50-R52 PolarHBondContact O-N 2.91Å; R52-K54 PolarHBondContact O-N 3.46Å
53G50.2Low54Low41 Ų41123 Ų12342%0.42361%0.613SS.*  trans-55.7104.5-152.400000109.4V51 I55V51-G53 VanDerWaalsContact C-N 3.33Å; V51-G53 WeakPolarHBondContact O-CA 3.38Å; V51-G53 PolarHBondContact O-N 3.2Å; G53-I55 WeakPolarHBondContact O-CG1 3.42Å; G53-I55 PolarHBondContact O-N 3.42Å
54K49.2Very low56.3Low201 Ų201117.4 Ų117.487%0.87460%0.595SS**  trans-74.166.2169.3-81.1-172.7171.5-177.90106.4R52 R56R52-K54 PolarHBondContact O-N 3.46Å; K54-R56 PolarHBondContact O-N 3.17Å
55I57Low58.6Low76 Ų76112.8 Ų112.839%0.3956%0.563SS.*  trans-52115.9170.1-18.9-179000104G53 L57G53-I55 WeakPolarHBondContact O-CG1 3.42Å; G53-I55 PolarHBondContact O-N 3.42Å; I55-L57 PolarHBondContact O-N 3.39Å
56R61.1Low61.4Low203 Ų203105.8 Ų105.877%0.76654%0.542SS*.  trans-73.285.1179.6-72.6-178.8167.1-159.7-4.5106.6K54 Y58 S59K54-R56 PolarHBondContact O-N 3.17Å; R56-Y58 PolarHBondContact O-N 3.33Å; R56-S59 WeakPolarHBondContact O-CA 3.48Å; R56-S59 WeakPolarHBondContact O-CB 3.28Å; R56-S59 PolarHBondContact O-N 2.84Å
57L57Low63.9Low82 Ų82104.3 Ų104.343%0.42952%0.522SS..THydrogen-bonded Turntrans-61.6-20.3176.7-69169.2000111.7I55 S59 G62 F63 I66I55-L57 PolarHBondContact O-N 3.39Å; L57-S59 VanDerWaalsContact C-N 3.3Å; L57-G62 CarbonylContact O-C 3.59Å; L57-G62 VanDerWaalsContact O-C 3.24Å; L57-G62 WeakPolarHBondContact O-CA 3.32Å; L57-F63 PolarHBondContact O-N 2.89Å; L57-I66 HydrophobicContact CB-CD1 4.38Å
58Y60.7Low67Low237 Ų23797.9 Ų97.993%0.92949%0.488SS*.THydrogen-bonded Turntrans-84.410.8167.9-63.2-79.1000114.5R56R56-Y58 PolarHBondContact O-N 3.33Å
59S74.4Confident69.7Low46 Ų4695 Ų9532%0.32247%0.47SS..SBendtrans-74.9150.1162.6-172.70000109.2R56 L57 S61 G62 F63R56-S59 WeakPolarHBondContact O-CA 3.48Å; R56-S59 WeakPolarHBondContact O-CB 3.28Å; R56-S59 PolarHBondContact O-N 2.84Å; L57-S59 VanDerWaalsContact C-N 3.3Å; S59-S61 PolarHBondContact O-N 3.29Å; S59-S61 VanDerWaalsContact O-N 3.13Å; S59-G62 WeakPolarHBondContact O-CA 3.31Å; S59-G62 PolarHBondContact O-N 2.85Å; S59-F63 PolarHBondContact O-N 3.41Å
60P79.9Confident72.5Confident97 Ų9795.3 Ų95.363%0.6347%0.468SS*.Hα-helixtrans-51.9-38.4-179.2-30.336.7000114.6F63 F64P60-F63 WeakPolarHBondContact O-CB 3.22Å; P60-F63 PolarHBondContact O-N 2.91Å; P60-F64 WeakPolarHBondContact O-CD2 3.42Å; P60-F64 PolarHBondContact O-N 3.43Å
61S80.8Confident75.1Confident16 Ų1692.1 Ų92.111%0.11245%0.447CS..Hα-helixtrans-68.5-30.9174.850.50000113.8S59 L65S59-S61 PolarHBondContact O-N 3.29Å; S59-S61 VanDerWaalsContact O-N 3.13Å; S61-L65 PolarHBondContact O-N 3.44Å
62G86.9Confident77.6Confident0 Ų087.6 Ų87.60%042%0.42CS..Hα-helixtrans-70.4-3617300000112.7L57 S59 L65 I66L57-G62 CarbonylContact O-C 3.59Å; L57-G62 VanDerWaalsContact O-C 3.24Å; L57-G62 WeakPolarHBondContact O-CA 3.32Å; S59-G62 WeakPolarHBondContact O-CA 3.31Å; S59-G62 PolarHBondContact O-N 2.85Å; G62-L65 PolarHBondContact O-N 3.22Å; G62-I66 WeakPolarHBondContact O-CG1 2.97Å; G62-I66 PolarHBondContact O-N 3.09Å
63F89.3Confident80.1Confident124 Ų12481.9 Ų81.954%0.54441%0.405SS..Hα-helixtrans-61-46.5173.2176.8-97.2000111.9L57 S59 P60 L65 I66 L67L57-F63 PolarHBondContact O-N 2.89Å; S59-F63 PolarHBondContact O-N 3.41Å; P60-F63 WeakPolarHBondContact O-CB 3.22Å; P60-F63 PolarHBondContact O-N 2.91Å; F63-L65 VanDerWaalsContact C-N 3.29Å; F63-L65 PolarHBondContact O-N 3.38Å; F63-I66 PolarHBondContact O-N 3.09Å; F63-L67 HydrophobicContact CE1-CD2 4.26Å; F63-L67 WeakPolarHBondContact O-CB 3.44Å; F63-L67 PolarHBondContact O-N 2.89Å
64F90.9Very high82Confident108 Ų10883.2 Ų83.247%0.47440%0.402SS..Hα-helixtrans-63.2-32.6176.2-70.1-65.5000113.3P60 L67 G68 A143P60-F64 WeakPolarHBondContact O-CD2 3.42Å; P60-F64 PolarHBondContact O-N 3.43Å; F64-L67 HydrophobicContact CD1-CD2 4.45Å; F64-L67 PolarHBondContact O-N 2.86Å; F64-G68 PolarHBondContact O-N 3.24Å; F64-A143 HydrophobicContact CB-CB 3.73Å
65L91.3Very high84Confident29 Ų2973.7 Ų73.715%0.15236%0.36CS..Hα-helixtrans-65.8-46.6173.7-173.1159.1000111.1S61 G62 F63 L67 G68 V69 F140 A143 N144 L147S61-L65 PolarHBondContact O-N 3.44Å; G62-L65 PolarHBondContact O-N 3.22Å; F63-L65 VanDerWaalsContact C-N 3.29Å; F63-L65 PolarHBondContact O-N 3.38Å; L65-L67 VanDerWaalsContact C-N 3.33Å; L65-L67 PolarHBondContact O-N 3.24Å; L65-G68 PolarHBondContact O-N 3.46Å; L65-V69 HydrophobicContact CD2-CG2 4.31Å; L65-V69 WeakPolarHBondContact O-CG2 3.48Å; L65-V69 PolarHBondContact O-N 3.47Å; L65-F140 HydrophobicContact CD1-CE2 4.29Å; L65-F140 HydrophobicContact CD2-CD2 4.26Å; L65-F140 HydrophobicContact CD2-CE2 3.87Å; L65-F140 HydrophobicContact CG-CD2 3.93Å; L65-F140 HydrophobicContact CG-CE2 3.77Å; L65-A143 HydrophobicContact CB-CB 4.2Å; L65-N144 HydrophobicContact CD1-CB 4.46Å; L65-L147 HydrophobicContact CD1-CD2 3.55Å
66I92.3Very high85.6Confident85 Ų8573.9 Ų73.944%0.43636%0.362SS..Hα-helixtrans-61.2-42.7175.9-65.9163.7000110.7L57 G62 F63 V69 L70L57-I66 HydrophobicContact CB-CD1 4.38Å; G62-I66 WeakPolarHBondContact O-CG1 2.97Å; G62-I66 PolarHBondContact O-N 3.09Å; F63-I66 PolarHBondContact O-N 3.09Å; I66-V69 PolarHBondContact O-N 2.79Å; I66-L70 WeakPolarHBondContact O-CB 3.25Å; I66-L70 PolarHBondContact O-N 3.3Å
67L92.6Very high87Confident58 Ų5866.5 Ų66.530%0.30434%0.344SS..Hα-helixtrans-63.7-43.9177.5-177.461.3000112.2F63 F64 L65 V69 L70 I71F63-L67 HydrophobicContact CE1-CD2 4.26Å; F63-L67 WeakPolarHBondContact O-CB 3.44Å; F63-L67 PolarHBondContact O-N 2.89Å; F64-L67 HydrophobicContact CD1-CD2 4.45Å; F64-L67 PolarHBondContact O-N 2.86Å; L65-L67 VanDerWaalsContact C-N 3.33Å; L65-L67 PolarHBondContact O-N 3.24Å; L67-V69 VanDerWaalsContact C-N 3.35Å; L67-V69 PolarHBondContact O-N 3.14Å; L67-L70 PolarHBondContact O-N 2.93Å; L67-I71 HydrophobicContact CD1-CD1 4.04Å; L67-I71 HydrophobicContact CD1-CG1 4.34Å; L67-I71 HydrophobicContact CG-CD1 3.91Å; L67-I71 VanDerWaalsContact O-CG1 3.3Å; L67-I71 WeakPolarHBondContact O-CG1 3.15Å; L67-I71 PolarHBondContact O-N 2.86Å
68G94.9Very high88.4Confident0 Ų063.9 Ų63.90%033%0.33CS..Hα-helixtrans-61.2-40.9174.900000112.8F64 L65 S72F64-G68 PolarHBondContact O-N 3.24Å; L65-G68 PolarHBondContact O-N 3.46Å; G68-S72 VanDerWaalsContact O-CB 3.27Å; G68-S72 WeakPolarHBondContact O-CB 3.32Å; G68-S72 PolarHBondContact O-N 3.34Å
69V94.7Very high89.7Confident57 Ų5753.4 Ų53.435%0.34529%0.292SS..Hα-helixtrans-63.7-44.61731720000111.4L65 I66 L67 S72 I73 F140L65-V69 HydrophobicContact CD2-CG2 4.31Å; L65-V69 WeakPolarHBondContact O-CG2 3.48Å; L65-V69 PolarHBondContact O-N 3.47Å; I66-V69 PolarHBondContact O-N 2.79Å; L67-V69 VanDerWaalsContact C-N 3.35Å; L67-V69 PolarHBondContact O-N 3.14Å; V69-S72 PolarHBondContact O-N 2.85Å; V69-I73 HydrophobicContact CG1-CD1 3.77Å; V69-I73 HydrophobicContact CG1-CG1 4.4Å; V69-I73 VanDerWaalsContact O-CG1 3.32Å; V69-I73 WeakPolarHBondContact O-CG1 3.47Å; V69-I73 PolarHBondContact O-N 2.86Å; V69-F140 HydrophobicContact CG2-CD2 3.62Å; V69-F140 HydrophobicContact CG2-CE2 3.76Å
70L94.8Very high90.3Very high97 Ų9755 Ų5551%0.50830%0.3SS..Hα-helixtrans-61-47.1178.2-178.664.4000111.8I66 L67 S72 I73 I74I66-L70 WeakPolarHBondContact O-CB 3.25Å; I66-L70 PolarHBondContact O-N 3.3Å; L67-L70 PolarHBondContact O-N 2.93Å; L70-S72 VanDerWaalsContact C-N 3.32Å; L70-S72 PolarHBondContact O-N 3.36Å; L70-I73 PolarHBondContact O-N 3.11Å; L70-I74 HydrophobicContact CD1-CD1 4.5Å; L70-I74 HydrophobicContact CG-CD1 4.21Å; L70-I74 WeakPolarHBondContact O-CG1 3.49Å; L70-I74 PolarHBondContact O-N 3.3Å
71I94Very high90.4Very high42 Ų4256.4 Ų56.422%0.21530%0.301CS..Hα-helixtrans-63.3-39.5176.8-65.2166.1000110.7L67 I74 G75 I135 I139L67-I71 HydrophobicContact CD1-CD1 4.04Å; L67-I71 HydrophobicContact CD1-CG1 4.34Å; L67-I71 HydrophobicContact CG-CD1 3.91Å; L67-I71 VanDerWaalsContact O-CG1 3.3Å; L67-I71 WeakPolarHBondContact O-CG1 3.15Å; L67-I71 PolarHBondContact O-N 2.86Å; I71-I74 PolarHBondContact O-N 2.87Å; I71-G75 PolarHBondContact O-N 3.27Å; I71-I135 HydrophobicContact CG2-CG2 3.89Å; I71-I139 HydrophobicContact CD1-CD1 3.89Å
72S94.7Very high90.4Very high20 Ų2056.1 Ų56.114%0.1430%0.301CS..Hα-helixtrans-63.9-43.1175.6-1730000112.2G68 V69 L70 I74 G75 I76G68-S72 VanDerWaalsContact O-CB 3.27Å; G68-S72 WeakPolarHBondContact O-CB 3.32Å; G68-S72 PolarHBondContact O-N 3.34Å; V69-S72 PolarHBondContact O-N 2.85Å; L70-S72 VanDerWaalsContact C-N 3.32Å; L70-S72 PolarHBondContact O-N 3.36Å; S72-I74 PolarHBondContact O-N 2.99Å; S72-G75 PolarHBondContact O-N 3.4Å; S72-I76 WeakPolarHBondContact O-CB 3.48Å; S72-I76 WeakPolarHBondContact O-CD1 3.12Å; S72-I76 VanDerWaalsContact O-CG1 3.25Å; S72-I76 WeakPolarHBondContact O-CG1 3.41Å; S72-I76 PolarHBondContact O-N 3.47Å
73I94.4Very high89.9Confident101 Ų10162.7 Ų62.752%0.51833%0.326SS..Hα-helixtrans-61.6-43174.8-69.5165.3000111V69 L70 I76 A77V69-I73 HydrophobicContact CG1-CD1 3.77Å; V69-I73 HydrophobicContact CG1-CG1 4.4Å; V69-I73 VanDerWaalsContact O-CG1 3.32Å; V69-I73 WeakPolarHBondContact O-CG1 3.47Å; V69-I73 PolarHBondContact O-N 2.86Å; L70-I73 PolarHBondContact O-N 3.11Å; I73-I76 PolarHBondContact O-N 3.28Å; I73-A77 WeakPolarHBondContact O-CB 3.01Å; I73-A77 PolarHBondContact O-N 3.34Å
74I90.8Very high89.5Confident69 Ų6965 Ų6535%0.35433%0.331SS..Hα-helixtrans-60.6-49.4174.1-67.3164.4000109.9L70 I71 S72 I76 A77 M78L70-I74 HydrophobicContact CD1-CD1 4.5Å; L70-I74 HydrophobicContact CG-CD1 4.21Å; L70-I74 WeakPolarHBondContact O-CG1 3.49Å; L70-I74 PolarHBondContact O-N 3.3Å; I71-I74 PolarHBondContact O-N 2.87Å; S72-I74 PolarHBondContact O-N 2.99Å; I74-I76 VanDerWaalsContact C-N 3.31Å; I74-I76 PolarHBondContact O-N 2.77Å; I74-A77 PolarHBondContact O-N 2.98Å; I74-A77 VanDerWaalsContact O-N 3.14Å; I74-M78 HydrophobicContact CG2-CG 4.09Å; I74-M78 WeakPolarHBondContact O-CB 3.29Å; I74-M78 WeakPolarHBondContact O-CG 3.26Å; I74-M78 PolarHBondContact O-N 3.38Å
75G91.8Very high88.1Confident0 Ų064.3 Ų64.30%034%0.338CS..Hα-helixtrans-60.5-37.1178.600000113.9I71 S72 A79 T132I71-G75 PolarHBondContact O-N 3.27Å; S72-G75 PolarHBondContact O-N 3.4Å; G75-A79 VanDerWaalsContact O-CB 3.31Å; G75-A79 WeakPolarHBondContact O-CB 3.47Å; G75-A79 PolarHBondContact O-N 2.89Å; G75-T132 VanDerWaalsContact CA-OG1 3.26Å; G75-T132 WeakPolarHBondContact CA-OG1 3.47Å
76I91.3Very high86.6Confident81 Ų8169.3 Ų69.342%0.41536%0.361SS..Hα-helixtrans-66.3-45.7173.2-68.9162000110.7S72 I73 I74 M78 A79 V80 M133S72-I76 WeakPolarHBondContact O-CB 3.48Å; S72-I76 WeakPolarHBondContact O-CD1 3.12Å; S72-I76 VanDerWaalsContact O-CG1 3.25Å; S72-I76 WeakPolarHBondContact O-CG1 3.41Å; S72-I76 PolarHBondContact O-N 3.47Å; I73-I76 PolarHBondContact O-N 3.28Å; I74-I76 VanDerWaalsContact C-N 3.31Å; I74-I76 PolarHBondContact O-N 2.77Å; I76-M78 VanDerWaalsContact C-N 3.34Å; I76-M78 PolarHBondContact O-N 3.02Å; I76-A79 PolarHBondContact O-N 3.06Å; I76-V80 HydrophobicContact CG2-CG2 4.4Å; I76-V80 WeakPolarHBondContact O-CB 3.16Å; I76-V80 VanDerWaalsContact O-CG2 3.32Å; I76-V80 WeakPolarHBondContact O-CG2 3.28Å; I76-V80 PolarHBondContact O-N 3.28Å; I76-M133 HydrophobicContact CG1-CG 4.47Å; I76-M133 HydrophobicContact CG1-SD 4.42Å
77A89.1Confident84.4Confident47 Ų4774 Ų7439%0.38838%0.378SS..Hα-helixtrans-61.9-42.7176.500000111.7I73 I74 V80 L81I73-A77 WeakPolarHBondContact O-CB 3.01Å; I73-A77 PolarHBondContact O-N 3.34Å; I74-A77 PolarHBondContact O-N 2.98Å; I74-A77 VanDerWaalsContact O-N 3.14Å; A77-V80 PolarHBondContact O-N 3.21Å; A77-L81 WeakPolarHBondContact O-CB 3.37Å; A77-L81 VanDerWaalsContact O-CG 3.28Å; A77-L81 WeakPolarHBondContact O-CG 3.48Å; A77-L81 PolarHBondContact O-N 3.33Å
78M85.8Confident82.5Confident28 Ų2878.6 Ų78.614%0.13840%0.398CS..Hα-helixtrans-65-37.8176.4-65.4-69.8-67.200112.1I74 I76 G82 F116 L120 L128I74-M78 HydrophobicContact CG2-CG 4.09Å; I74-M78 WeakPolarHBondContact O-CB 3.29Å; I74-M78 WeakPolarHBondContact O-CG 3.26Å; I74-M78 PolarHBondContact O-N 3.38Å; I76-M78 VanDerWaalsContact C-N 3.34Å; I76-M78 PolarHBondContact O-N 3.02Å; M78-G82 PolarHBondContact O-N 2.76Å; M78-F116 HydrophobicContact CE-CD1 4.13Å; M78-F116 HydrophobicContact CE-CG 4.49Å; M78-L120 HydrophobicContact CE-CD1 3.82Å; M78-L120 HydrophobicContact CE-CD2 3.64Å; M78-L120 HydrophobicContact CE-CG 4.11Å; M78-L128 HydrophobicContact CE-CD2 4.28Å
79A88.1Confident80.2Confident16 Ų1686 Ų8613%0.13243%0.432CS..Hα-helixtrans-66.9-47.6172.100000111.5G75 I76 L81 G82 Y83G75-A79 VanDerWaalsContact O-CB 3.31Å; G75-A79 WeakPolarHBondContact O-CB 3.47Å; G75-A79 PolarHBondContact O-N 2.89Å; I76-A79 PolarHBondContact O-N 3.06Å; A79-L81 VanDerWaalsContact C-N 3.31Å; A79-L81 PolarHBondContact O-N 2.73Å; A79-G82 PolarHBondContact O-N 3.23Å; A79-Y83 HydrophobicContact CB-CD2 4.44Å; A79-Y83 WeakPolarHBondContact O-CB 3.08Å; A79-Y83 VanDerWaalsContact O-CD2 3.22Å; A79-Y83 WeakPolarHBondContact O-CD2 3.3Å; A79-Y83 PolarHBondContact O-N 2.84Å
80V87.4Confident77.9Confident81 Ų8192.1 Ų92.149%0.49145%0.454SS..Hα-helixtrans-60.5-39.6178.5169.50000111.5I76 A77 W84I76-V80 HydrophobicContact CG2-CG2 4.4Å; I76-V80 WeakPolarHBondContact O-CB 3.16Å; I76-V80 VanDerWaalsContact O-CG2 3.32Å; I76-V80 WeakPolarHBondContact O-CG2 3.28Å; I76-V80 PolarHBondContact O-N 3.28Å; A77-V80 PolarHBondContact O-N 3.21Å; V80-W84 WeakPolarHBondContact O-CA 3.48Å; V80-W84 WeakPolarHBondContact O-CB 3Å; V80-W84 PolarHBondContact O-N 2.71Å
81L82.2Confident76Confident125 Ų12592 Ų9265%0.65445%0.453SS*.Hα-helixtrans-69.5-44.1174.1-69.9168.8000112.1A77 A79 Y83 W84A77-L81 WeakPolarHBondContact O-CB 3.37Å; A77-L81 VanDerWaalsContact O-CG 3.28Å; A77-L81 WeakPolarHBondContact O-CG 3.48Å; A77-L81 PolarHBondContact O-N 3.33Å; A79-L81 VanDerWaalsContact C-N 3.31Å; A79-L81 PolarHBondContact O-N 2.73Å; L81-Y83 VanDerWaalsContact C-N 3.32Å; L81-Y83 PolarHBondContact O-N 2.72Å; L81-W84 WeakPolarHBondContact O-CB 3.33Å; L81-W84 PolarHBondContact O-N 2.74Å
82G80.5Confident73.7Confident10 Ų1096.7 Ų96.710%0.10348%0.479CS..Hα-helixtrans-67.1-28.4178.600000114.4M78 A79 K126M78-G82 PolarHBondContact O-N 2.76Å; A79-G82 PolarHBondContact O-N 3.23Å; G82-K126 WeakPolarHBondContact O-CE 3.42Å; G82-K126 WeakPolarHBondContact O-CG 3.42Å
83Y76.3Confident71.3Confident138 Ų13899.9 Ų99.954%0.54151%0.507SS..THydrogen-bonded Turntrans-98.71.8173.2-69.1-69000113.6A79 L81 K126 P130A79-Y83 HydrophobicContact CB-CD2 4.44Å; A79-Y83 WeakPolarHBondContact O-CB 3.08Å; A79-Y83 VanDerWaalsContact O-CD2 3.22Å; A79-Y83 WeakPolarHBondContact O-CD2 3.3Å; A79-Y83 PolarHBondContact O-N 2.84Å; L81-Y83 VanDerWaalsContact C-N 3.32Å; L81-Y83 PolarHBondContact O-N 2.72Å; Y83-K126 HydrophobicContact CD1-CG 4.49Å; Y83-K126 HydrophobicContact CE1-CB 4.47Å; Y83-K126 HydrophobicContact CE1-CG 4.34Å; Y83-K126 PolarHBondContact OH-O 3.46Å; Y83-P130 HydrophobicContact CE2-CG 4.23Å
84W80.9Confident69.1Low172 Ų172101.9 Ų101.965%0.65251%0.514SS*.SBendtrans-63.3126.6173.3-166.7-102.8000108.3V80 L81 Q86V80-W84 WeakPolarHBondContact O-CA 3.48Å; V80-W84 WeakPolarHBondContact O-CB 3Å; V80-W84 PolarHBondContact O-N 2.71Å; L81-W84 WeakPolarHBondContact O-CB 3.33Å; L81-W84 PolarHBondContact O-N 2.74Å; W84-Q86 PolarHBondContact O-N 2.67Å
85P62.7Low67.1Low95 Ų95102.3 Ų102.362%0.61752%0.52SS*.  trans-69101.8-179.527-32.8000108.7K87P85-K87 PolarHBondContact O-N 2.8Å
86Q59.8Low65Low134 Ų134107.9 Ų107.963%0.62655%0.554SS**  trans-56.8107174.6-163.873.9-3.500108W84 E88W84-Q86 PolarHBondContact O-N 2.67Å; Q86-E88 PolarHBondContact O-N 3.17Å; Q86-E88 VanDerWaalsContact O-N 3.09Å
87K46.2Very low62.7Low183 Ų183111 Ų11180%0.79657%0.571SS**  trans-73.9103.5173.4-69.7-175.2179.9-179.70107.1P85P85-K87 PolarHBondContact O-N 2.8Å
88E52.7Low60.4Low154 Ų154112.3 Ų112.372%0.7258%0.577SS**SBendtrans-59.7146.7-174.1-59.3175.8161.900111.1Q86Q86-E88 PolarHBondContact O-N 3.17Å; Q86-E88 VanDerWaalsContact O-N 3.09Å
89H46.3Very low58.6Low157 Ų157115.6 Ų115.673%0.72760%0.598SS**SBendtrans67.241.5170-54.2-64.2000119.5
90F46.8Very low56.8Low184 Ų184120.8 Ų120.881%0.80762%0.624SS**SBendtrans-132.6-7.8161-93.7-81.8000116.8
91I54.7Low54.8Low94 Ų94125.8 Ų125.848%0.48264%0.642SS.*SBendtrans-98.1-16.4-169.9-64.5178.7000113.8A93 E94 T95I91-A93 PolarHBondContact O-N 3.49Å; I91-A93 VanDerWaalsContact O-N 3.07Å; I91-E94 PolarHBondContact O-N 2.99Å; I91-T95 HydrophobicContact CG2-CG2 3.62Å; I91-T95 WeakPolarHBondContact O-CG2 3.49Å; I91-T95 PolarHBondContact O-OG1 3.22Å
92D44.9Very low53.2Low142 Ų142124.4 Ų124.476%0.75964%0.639SS**THydrogen-bonded Turntrans-67.2-8.5179.2-63.6-35.9000114.2
93A44.8Very low51.6Low87 Ų87130.3 Ų130.372%0.71966%0.664SS**THydrogen-bonded Turntrans-102.3-16.2-179.400000114.9I91I91-A93 PolarHBondContact O-N 3.49Å; I91-A93 VanDerWaalsContact O-N 3.07Å
94E47.8Very low50.1Low142 Ų142129.9 Ų129.966%0.66468%0.675SS**THydrogen-bonded Turntrans-117.4-10.2-168.1-155.4177.116400113.9I91 T96 S98I91-E94 PolarHBondContact O-N 2.99Å; E94-T96 VanDerWaalsContact C-N 3.29Å; E94-T96 PolarHBondContact O-N 2.91Å; E94-S98 PolarHBondContact O-OG 2.79Å; E94-S98 VanDerWaalsContact O-OG 3.06Å
95T50.1Low48.4Very low78 Ų78129.9 Ų129.948%0.47969%0.686SS.*THydrogen-bonded Turntrans-74.5-13.4-179.944.90000114.5I91I91-T95 HydrophobicContact CG2-CG2 3.62Å; I91-T95 WeakPolarHBondContact O-CG2 3.49Å; I91-T95 PolarHBondContact O-OG1 3.22Å
96T47.3Very low47.8Very low118 Ų118130.4 Ų130.472%0.72468%0.676SS**THydrogen-bonded Turntrans-88-11.5-178.551.90000114.5E94E94-T96 VanDerWaalsContact C-N 3.29Å; E94-T96 PolarHBondContact O-N 2.91Å
97L42.9Very low47.4Very low147 Ų147129.9 Ų129.977%0.7768%0.678SS**THydrogen-bonded Turntrans-119.6-31.4-169.5-160.9147.6000114T99L97-T99 PolarHBondContact O-N 2.87Å
98S40.8Very low47.8Very low73 Ų73129.9 Ų129.951%0.5168%0.68SS.*THydrogen-bonded Turntrans-84.9-1.4-169.751.90000116.1E94 N100E94-S98 PolarHBondContact O-OG 2.79Å; E94-S98 VanDerWaalsContact O-OG 3.06Å; S98-N100 PolarHBondContact O-N 2.93Å
99T48.6Very low47.8Very low97 Ų97124.5 Ų124.560%0.59567%0.666SS**THydrogen-bonded Turntrans-80.6-8.4-165.943.90000116.4L97L97-T99 PolarHBondContact O-N 2.87Å
100N49.2Very low48.5Very low125 Ų125117.6 Ų117.667%0.66864%0.638SS**SBendtrans-94.6-28.1-171-73.1-61.5000116S98S98-N100 PolarHBondContact O-N 2.93Å
101E45.6Very low49.2Very low186 Ų186113.2 Ų113.287%0.86963%0.626SS**THydrogen-bonded Turntrans-87.3-16-166.3-62.5-160.7137.700115.7Q103E101-Q103 PolarHBondContact O-N 3.4Å
102T47.9Very low49.4Very low96 Ų96112.7 Ų112.759%0.58963%0.627SS**THydrogen-bonded Turntrans-91.711.7-176.455.30000114.7V104T102-V104 PolarHBondContact O-N 3.35Å
103Q47.3Very low50.1Low135 Ų135108.9 Ų108.963%0.63161%0.609SS**  trans-72.7-27-169.2-158.9172.116.300114.3E101 I105 R106E101-Q103 PolarHBondContact O-N 3.4Å; Q103-I105 PolarHBondContact O-N 2.79Å; Q103-R106 PolarHBondContact O-N 3.31Å
104V45.2Very low50.9Low129 Ų129111.8 Ų111.878%0.78260%0.601SS**THydrogen-bonded Turntrans-72.3-32.3-164-176.30000114.5T102T102-V104 PolarHBondContact O-N 3.35Å
105I46Very low51.6Low172 Ų172111.4 Ų111.488%0.88260%0.597SS**THydrogen-bonded Turntrans-10413.4-176.9-38.4-177.2000111.4Q103Q103-I105 PolarHBondContact O-N 2.79Å
106R48.6Very low52.2Low105 Ų105110.5 Ų110.540%0.39659%0.587SS.*  trans-119.217-168.5-153.8-177173.1-166-3.2114.3Q103 G110 V113Q103-R106 PolarHBondContact O-N 3.31Å; R106-G110 WeakPolarHBondContact O-CA 3.23Å; R106-G110 PolarHBondContact O-N 3.41Å; R106-V113 VanDerWaalsContact NH2-CG1 3.25Å
107N52.3Low53Low124 Ų124109 Ų10966%0.66357%0.572SS**Hα-helixtrans-71.6-49.7-174.2-78.2-17.3000114.3
108E54Low53.9Low182 Ų182108.7 Ų108.785%0.8557%0.566SS**Hα-helixtrans-74.6-49.4177.4-65.8-163.9154.200112.3G110 V111E108-G110 PolarHBondContact O-N 2.85Å; E108-G110 VanDerWaalsContact O-N 3.17Å; E108-V111 PolarHBondContact O-N 3.47Å
109G52.6Low54.6Low41 Ų41112.3 Ų112.342%0.42358%0.575SS.*Hα-helixtrans-63.2-19.8174.600000113.5V112 V113G109-V112 PolarHBondContact O-N 3.01Å; G109-V113 WeakPolarHBondContact O-CG2 3.22Å; G109-V113 PolarHBondContact O-N 3.33Å
110G60.7Low55Low13 Ų13109.5 Ų109.513%0.13456%0.556CS.*Hα-helixtrans-63.5-45.7-179.800000112.6R106 E108 V112 V113 R114R106-G110 WeakPolarHBondContact O-CA 3.23Å; R106-G110 PolarHBondContact O-N 3.41Å; E108-G110 PolarHBondContact O-N 2.85Å; E108-G110 VanDerWaalsContact O-N 3.17Å; G110-V112 VanDerWaalsContact C-N 3.33Å; G110-V112 PolarHBondContact O-N 3.04Å; G110-V113 PolarHBondContact O-N 2.93Å; G110-R114 WeakPolarHBondContact O-CB 3.19Å; G110-R114 WeakPolarHBondContact O-CG 3.33Å; G110-R114 PolarHBondContact O-N 2.99Å
111V62.1Low55.3Low92 Ų92112 Ų11256%0.55856%0.563SS**Hα-helixtrans-60.6-45.5179.7-177.30000110.7E108 R114 F115E108-V111 PolarHBondContact O-N 3.47Å; V111-R114 PolarHBondContact O-N 3.21Å; V111-F115 HydrophobicContact CG1-CD2 4.22Å; V111-F115 HydrophobicContact CG1-CE2 4.49Å; V111-F115 PolarHBondContact O-N 3.46Å
112V58.1Low55.8Low83 Ų83106.1 Ų106.150%0.50354%0.543SS..Hα-helixtrans-63.7-45.6178.9179.10000111.2G109 G110 F115 F116G109-V112 PolarHBondContact O-N 3.01Å; G110-V112 VanDerWaalsContact C-N 3.33Å; G110-V112 PolarHBondContact O-N 3.04Å; V112-F115 PolarHBondContact O-N 3.27Å; V112-F116 HydrophobicContact CG1-CD2 3.88Å; V112-F116 HydrophobicContact CG1-CE2 3.59Å; V112-F116 VanDerWaalsContact O-CD2 3.23Å; V112-F116 WeakPolarHBondContact O-CD2 3.16Å; V112-F116 PolarHBondContact O-N 2.93Å
113V60.7Low56.6Low62 Ų62108.1 Ų108.138%0.37655%0.55SS..Hα-helixtrans-71.9-31.9179.3-179.20000112.2R106 G109 G110 F116 E117R106-V113 VanDerWaalsContact NH2-CG1 3.25Å; G109-V113 WeakPolarHBondContact O-CG2 3.22Å; G109-V113 PolarHBondContact O-N 3.33Å; G110-V113 PolarHBondContact O-N 2.93Å; V113-F116 PolarHBondContact O-N 3.25Å; V113-E117 VanDerWaalsContact O-CB 3.22Å; V113-E117 WeakPolarHBondContact O-CB 3.41Å; V113-E117 PolarHBondContact O-N 2.79Å
114R61.9Low57.4Low148 Ų148108.9 Ų108.956%0.55855%0.551SS**Hα-helixtrans-63.1-41.2170.3-73.6-63.9-162.1-170.64.5111.7G110 V111 E117 Q118G110-R114 WeakPolarHBondContact O-CB 3.19Å; G110-R114 WeakPolarHBondContact O-CG 3.33Å; G110-R114 PolarHBondContact O-N 2.99Å; V111-R114 PolarHBondContact O-N 3.21Å; R114-E117 WeakPolarHBondContact CD-OE2 3.2Å; R114-E117 IonicContact CZ-OE2 2.72Å; R114-E117 IonicContact NE-OE2 3.77Å; R114-E117 IonicContact NH1-OE2 2.85Å; R114-E117 PolarHBondContact NH1-OE2 3.4Å; R114-E117 WeakPolarHBondContact O-CB 3.09Å; R114-E117 PolarHBondContact O-N 2.93Å; R114-Q118 WeakPolarHBondContact O-CG 3.35Å; R114-Q118 PolarHBondContact O-N 3.37Å
115F60.9Low58.4Low133 Ų133106.8 Ų106.858%0.58353%0.534SS*.Hα-helixtrans-63.7-42.7174-103.3-83.5000112V111 V112 Q118 H119V111-F115 HydrophobicContact CG1-CD2 4.22Å; V111-F115 HydrophobicContact CG1-CE2 4.49Å; V111-F115 PolarHBondContact O-N 3.46Å; V112-F115 PolarHBondContact O-N 3.27Å; F115-Q118 PolarHBondContact O-N 2.72Å; F115-H119 PolarHBondContact O-N 3.44Å
116F63.9Low59.7Low60 Ų60103.5 Ų103.526%0.26351%0.513SS..Hα-helixtrans-62.8-47.6171.9-76.6-60.2000111.6M78 V112 V113 Q118 H119 L120M78-F116 HydrophobicContact CE-CD1 4.13Å; M78-F116 HydrophobicContact CE-CG 4.49Å; V112-F116 HydrophobicContact CG1-CD2 3.88Å; V112-F116 HydrophobicContact CG1-CE2 3.59Å; V112-F116 VanDerWaalsContact O-CD2 3.23Å; V112-F116 WeakPolarHBondContact O-CD2 3.16Å; V112-F116 PolarHBondContact O-N 2.93Å; V113-F116 PolarHBondContact O-N 3.25Å; F116-Q118 PolarHBondContact O-N 2.99Å; F116-H119 CarbonylContact O-C 3.48Å; F116-H119 PolarHBondContact O-N 3.36Å; F116-L120 HydrophobicContact CB-CD1 4.17Å; F116-L120 WeakPolarHBondContact O-CB 3.35Å; F116-L120 WeakPolarHBondContact O-CD1 3.49Å; F116-L120 WeakPolarHBondContact O-CG 3.27Å; F116-L120 PolarHBondContact O-N 3.02Å
117E63.1Low61.1Low87 Ų87105 Ų10541%0.40753%0.526SS..Hα-helixtrans-52.7-39.6176.8-173.9171.5-118.200112V113 R114V113-E117 VanDerWaalsContact O-CB 3.22Å; V113-E117 WeakPolarHBondContact O-CB 3.41Å; V113-E117 PolarHBondContact O-N 2.79Å; R114-E117 WeakPolarHBondContact CD-OE2 3.2Å; R114-E117 IonicContact CZ-OE2 2.72Å; R114-E117 IonicContact NE-OE2 3.77Å; R114-E117 IonicContact NH1-OE2 2.85Å; R114-E117 PolarHBondContact NH1-OE2 3.4Å; R114-E117 WeakPolarHBondContact O-CB 3.09Å; R114-E117 PolarHBondContact O-N 2.93Å
118Q63.3Low62.7Low140 Ų140101 Ų10165%0.65450%0.504SS*.Hα-helixtrans-73.6-35.3174.1-70.8173.6-6.600114.1R114 F115 F116R114-Q118 WeakPolarHBondContact O-CG 3.35Å; R114-Q118 PolarHBondContact O-N 3.37Å; F115-Q118 PolarHBondContact O-N 2.72Å; F116-Q118 PolarHBondContact O-N 2.99Å
119H55.6Low64.2Low149 Ų14992.3 Ų92.369%0.6946%0.464SS*.Hα-helixtrans-82.3-11.8175.1-95.94.9000114.4F115 F116F115-H119 PolarHBondContact O-N 3.44Å; F116-H119 CarbonylContact O-C 3.48Å; F116-H119 PolarHBondContact O-N 3.36Å
120L56.8Low66.1Low37 Ų3793 Ų9319%0.19446%0.461CS..  trans-92.1-10.8-177.5-78170.5000114.6M78 F116 S122 M125 L128M78-L120 HydrophobicContact CE-CD1 3.82Å; M78-L120 HydrophobicContact CE-CD2 3.64Å; M78-L120 HydrophobicContact CE-CG 4.11Å; F116-L120 HydrophobicContact CB-CD1 4.17Å; F116-L120 WeakPolarHBondContact O-CB 3.35Å; F116-L120 WeakPolarHBondContact O-CD1 3.49Å; F116-L120 WeakPolarHBondContact O-CG 3.27Å; F116-L120 PolarHBondContact O-N 3.02Å; L120-S122 PolarHBondContact O-N 3.03Å; L120-M125 HydrophobicContact CB-CG 4.06Å; L120-M125 HydrophobicContact CB-SD 3.95Å; L120-M125 HydrophobicContact CD2-CB 3.89Å; L120-M125 HydrophobicContact CD2-CG 3.53Å; L120-M125 HydrophobicContact CD2-SD 3.92Å; L120-M125 HydrophobicContact CG-CG 4.4Å; L120-M125 HydrophobicContact CG-SD 4.42Å; L120-M125 WeakPolarHBondContact O-CG 3.27Å; L120-M125 VanDerWaalsContact O-SD 3.35Å; L120-L128 HydrophobicContact CD2-CD2 4.03Å
121H55.5Low67.5Low178 Ų17899 Ų9982%0.82448%0.484SS*.SBendtrans-75.530.7-165.7-14385.2000115.9
122S55.9Low68.9Low62 Ų6295.7 Ų95.743%0.43446%0.463SS..SBendtrans-159.1169.3165.5580000110L120 K124 M125L120-S122 PolarHBondContact O-N 3.03Å; S122-K124 PolarHBondContact O-N 2.89Å; S122-M125 WeakPolarHBondContact O-CG 3.44Å; S122-M125 PolarHBondContact O-N 3.44Å
123D64.5Low70.5Confident138 Ų13895.3 Ų95.374%0.73846%0.457SS*.THydrogen-bonded Turntrans-52.6-11.2-167.9-59.5-84.9000117.6M125 K126D123-M125 PolarHBondContact O-N 2.92Å; D123-K126 PolarHBondContact O-N 3.23Å
124K63.7Low72.1Confident152 Ų15294.1 Ų94.166%0.66146%0.457SS*.THydrogen-bonded Turntrans-52.9-19.9170.7-61.4-180-177.2176.80113.5S122 K126 M127 L128S122-K124 PolarHBondContact O-N 2.89Å; K124-K126 VanDerWaalsContact C-N 3.26Å; K124-K126 PolarHBondContact O-N 2.88Å; K124-M127 PolarHBondContact O-N 2.96Å; K124-L128 PolarHBondContact O-N 2.78Å
125M65.5Low73.7Confident84 Ų8490.8 Ų90.841%0.41445%0.45SS..Hα-helixtrans-44.7-48173.3-55.6-154.1-76.300113.2L120 S122 D123 M127 L128 G129L120-M125 HydrophobicContact CB-CG 4.06Å; L120-M125 HydrophobicContact CB-SD 3.95Å; L120-M125 HydrophobicContact CD2-CB 3.89Å; L120-M125 HydrophobicContact CD2-CG 3.53Å; L120-M125 HydrophobicContact CD2-SD 3.92Å; L120-M125 HydrophobicContact CG-CG 4.4Å; L120-M125 HydrophobicContact CG-SD 4.42Å; L120-M125 WeakPolarHBondContact O-CG 3.27Å; L120-M125 VanDerWaalsContact O-SD 3.35Å; S122-M125 WeakPolarHBondContact O-CG 3.44Å; S122-M125 PolarHBondContact O-N 3.44Å; D123-M125 PolarHBondContact O-N 2.92Å; M125-M127 VanDerWaalsContact C-N 3.27Å; M125-M127 PolarHBondContact O-N 2.7Å; M125-L128 PolarHBondContact O-N 2.76Å; M125-G129 PolarHBondContact O-N 2.88Å
126K73.6Confident75.3Confident103 Ų10384.4 Ų84.445%0.44842%0.422SS..Hα-helixtrans-67.5-25-178-77.7167.5-179.3165.40113.4G82 Y83 D123 K124 P130G82-K126 WeakPolarHBondContact O-CE 3.42Å; G82-K126 WeakPolarHBondContact O-CG 3.42Å; Y83-K126 HydrophobicContact CD1-CG 4.49Å; Y83-K126 HydrophobicContact CE1-CB 4.47Å; Y83-K126 HydrophobicContact CE1-CG 4.34Å; Y83-K126 PolarHBondContact OH-O 3.46Å; D123-K126 PolarHBondContact O-N 3.23Å; K124-K126 VanDerWaalsContact C-N 3.26Å; K124-K126 PolarHBondContact O-N 2.88Å; K126-P130 WeakPolarHBondContact O-CD 3.2Å; K126-P130 WeakPolarHBondContact O-CG 3.17Å
127M78.9Confident76.8Confident136 Ų13684.5 Ų84.567%0.6742%0.424SS*.Hα-helixtrans-89.9-30176-58.5-57.2-68.100112.1K124 M125 F131K124-M127 PolarHBondContact O-N 2.96Å; M125-M127 VanDerWaalsContact C-N 3.27Å; M125-M127 PolarHBondContact O-N 2.7Å; M127-F131 VanDerWaalsContact O-CB 3.3Å; M127-F131 WeakPolarHBondContact O-CB 3.42Å; M127-F131 PolarHBondContact O-N 2.76Å
128L84.4Confident78.4Confident40 Ų4086.6 Ų86.621%0.20943%0.433CS..Hα-helixtrans-68.7-35.7-178.1-173.562.6000112.6M78 L120 K124 M125 F131 T132M78-L128 HydrophobicContact CE-CD2 4.28Å; L120-L128 HydrophobicContact CD2-CD2 4.03Å; K124-L128 PolarHBondContact O-N 2.78Å; M125-L128 PolarHBondContact O-N 2.76Å; L128-F131 HydrophobicContact CD1-CD1 4.28Å; L128-F131 PolarHBondContact O-N 2.79Å; L128-T132 HydrophobicContact CD1-CG2 3.96Å; L128-T132 HydrophobicContact CG-CG2 4.28Å; L128-T132 WeakPolarHBondContact O-CB 3.38Å; L128-T132 WeakPolarHBondContact O-CG2 3.3Å; L128-T132 PolarHBondContact O-N 3.48Å; L128-T132 PolarHBondContact O-OG1 3.36Å
129G87.4Confident79.9Confident0 Ų082.2 Ų82.20%041%0.413CS..Hα-helixtrans-57.8-60.8173.300000112.7M125 F131 T132 M133M125-G129 PolarHBondContact O-N 2.88Å; G129-F131 VanDerWaalsContact C-N 3.29Å; G129-F131 PolarHBondContact O-N 3.47Å; G129-T132 PolarHBondContact O-N 3.49Å; G129-T132 PolarHBondContact O-OG1 3.04Å; G129-T132 VanDerWaalsContact O-OG1 3.11Å; G129-M133 VanDerWaalsContact O-CB 3.29Å; G129-M133 WeakPolarHBondContact O-CB 3.42Å; G129-M133 PolarHBondContact O-N 3.22Å
130P90.5Very high81.7Confident56 Ų5678.6 Ų78.636%0.36440%0.396SS..Hα-helixtrans-56-37.1174-2836.2000114.3Y83 K126 G134Y83-P130 HydrophobicContact CE2-CG 4.23Å; K126-P130 WeakPolarHBondContact O-CD 3.2Å; K126-P130 WeakPolarHBondContact O-CG 3.17Å; P130-G134 PolarHBondContact O-N 3.44Å
131F90.9Very high83.4Confident140 Ų14081.7 Ų81.761%0.61441%0.411SS*.Hα-helixtrans-65.9-46.9176.9179.1-99.9000112.7M127 L128 G129 G134 I135M127-F131 VanDerWaalsContact O-CB 3.3Å; M127-F131 WeakPolarHBondContact O-CB 3.42Å; M127-F131 PolarHBondContact O-N 2.76Å; L128-F131 HydrophobicContact CD1-CD1 4.28Å; L128-F131 PolarHBondContact O-N 2.79Å; G129-F131 VanDerWaalsContact C-N 3.29Å; G129-F131 PolarHBondContact O-N 3.47Å; F131-G134 PolarHBondContact O-N 3.36Å; F131-I135 PolarHBondContact O-N 3.27Å
132T90.6Very high85.2Confident21 Ų2175.7 Ų75.713%0.12939%0.388CS..Hα-helixtrans-72.9-32.8178.550.70000112.5G75 L128 G129 G136G75-T132 VanDerWaalsContact CA-OG1 3.26Å; G75-T132 WeakPolarHBondContact CA-OG1 3.47Å; L128-T132 HydrophobicContact CD1-CG2 3.96Å; L128-T132 HydrophobicContact CG-CG2 4.28Å; L128-T132 WeakPolarHBondContact O-CB 3.38Å; L128-T132 WeakPolarHBondContact O-CG2 3.3Å; L128-T132 PolarHBondContact O-N 3.48Å; L128-T132 PolarHBondContact O-OG1 3.36Å; G129-T132 PolarHBondContact O-N 3.49Å; G129-T132 PolarHBondContact O-OG1 3.04Å; G129-T132 VanDerWaalsContact O-OG1 3.11Å; T132-G136 PolarHBondContact O-N 2.91Å
133M93.7Very high86.9Confident75 Ų7573 Ų7337%0.36937%0.37SS..Hα-helixtrans-59.2-46.6165.7175.5-177167.500110.8I76 G129 G136 I137I76-M133 HydrophobicContact CG1-CG 4.47Å; I76-M133 HydrophobicContact CG1-SD 4.42Å; G129-M133 VanDerWaalsContact O-CB 3.29Å; G129-M133 WeakPolarHBondContact O-CB 3.42Å; G129-M133 PolarHBondContact O-N 3.22Å; M133-G136 PolarHBondContact O-N 2.98Å; M133-I137 HydrophobicContact CE-CD1 3.66Å; M133-I137 HydrophobicContact CG-CD1 3.7Å; M133-I137 WeakPolarHBondContact O-CB 3.14Å; M133-I137 VanDerWaalsContact O-CG1 3.27Å; M133-I137 WeakPolarHBondContact O-CG1 3.49Å; M133-I137 PolarHBondContact O-N 3.38Å
134G94.3Very high88.1Confident37 Ų3768.7 Ų68.738%0.38135%0.347SS..Hα-helixtrans-59.7-47.4177.600000113.2P130 F131 I137 F138P130-G134 PolarHBondContact O-N 3.44Å; F131-G134 PolarHBondContact O-N 3.36Å; G134-I137 PolarHBondContact O-N 3.29Å; G134-F138 WeakPolarHBondContact O-CB 3.41Å; G134-F138 PolarHBondContact O-N 3.27Å
135I94.6Very high89.3Confident78 Ų7864.2 Ų64.240%0.434%0.338SS..Hα-helixtrans-66.9-37.7178.6-147.371.9000111.9I71 F131 F138 I139I71-I135 HydrophobicContact CG2-CG2 3.89Å; F131-I135 PolarHBondContact O-N 3.27Å; I135-F138 PolarHBondContact O-N 2.91Å; I135-I139 WeakPolarHBondContact O-CD1 3.27Å; I135-I139 VanDerWaalsContact O-CG1 3.27Å; I135-I139 WeakPolarHBondContact O-CG1 3.32Å; I135-I139 PolarHBondContact O-N 2.8Å
136G95Very high90.4Very high0 Ų064.1 Ų64.10%034%0.339CS..Hα-helixtrans-64.4-43.1174.900000113T132 M133 I139 F140T132-G136 PolarHBondContact O-N 2.91Å; M133-G136 PolarHBondContact O-N 2.98Å; G136-I139 PolarHBondContact O-N 3.34Å; G136-F140 VanDerWaalsContact O-CB 3.32Å; G136-F140 WeakPolarHBondContact O-CB 3.38Å; G136-F140 PolarHBondContact O-N 3.46Å
137I94.9Very high90.8Very high61 Ų6160.5 Ų60.531%0.31332%0.324SS..Hα-helixtrans-66.1-40.8175.5-69.7169.5000111.3M133 G134 F140 I141M133-I137 HydrophobicContact CE-CD1 3.66Å; M133-I137 HydrophobicContact CG-CD1 3.7Å; M133-I137 WeakPolarHBondContact O-CB 3.14Å; M133-I137 VanDerWaalsContact O-CG1 3.27Å; M133-I137 WeakPolarHBondContact O-CG1 3.49Å; M133-I137 PolarHBondContact O-N 3.38Å; G134-I137 PolarHBondContact O-N 3.29Å; I137-F140 PolarHBondContact O-N 2.85Å; I137-I141 HydrophobicContact CG2-CD1 3.7Å; I137-I141 HydrophobicContact CG2-CG1 4.33Å; I137-I141 VanDerWaalsContact O-CG1 3.31Å; I137-I141 WeakPolarHBondContact O-CG1 3.31Å; I137-I141 PolarHBondContact O-N 2.95Å
138F96.4Very high90.7Very high132 Ų13259.2 Ų59.258%0.57932%0.316SS*.Hα-helixtrans-59.9-50.9175176.5-103.3000111.5G134 I135 F140 I141 C142G134-F138 WeakPolarHBondContact O-CB 3.41Å; G134-F138 PolarHBondContact O-N 3.27Å; I135-F138 PolarHBondContact O-N 2.91Å; F138-F140 VanDerWaalsContact C-N 3.31Å; F138-F140 PolarHBondContact O-N 3.48Å; F138-I141 PolarHBondContact O-N 2.88Å; F138-C142 PolarHBondContact O-N 3.33Å; F138-C142 PolarHBondContact O-SG 3.19Å
139I94.4Very high90.5Very high48 Ų4862.2 Ų62.225%0.24633%0.329CS..Hα-helixtrans-58-44.5175.8-67.8164.6000110.7I71 I135 G136 C142 A143I71-I139 HydrophobicContact CD1-CD1 3.89Å; I135-I139 WeakPolarHBondContact O-CD1 3.27Å; I135-I139 VanDerWaalsContact O-CG1 3.27Å; I135-I139 WeakPolarHBondContact O-CG1 3.32Å; I135-I139 PolarHBondContact O-N 2.8Å; G136-I139 PolarHBondContact O-N 3.34Å; I139-C142 PolarHBondContact O-N 3.38Å; I139-A143 WeakPolarHBondContact O-CB 3.49Å; I139-A143 PolarHBondContact O-N 2.84Å
140F93.5Very high89.9Confident73 Ų7365.1 Ų65.132%0.3234%0.344SS..Hα-helixtrans-60.8-45.2177.2174.8-102.9000112.6L65 V69 G136 I137 F138 N144L65-F140 HydrophobicContact CD1-CE2 4.29Å; L65-F140 HydrophobicContact CD2-CD2 4.26Å; L65-F140 HydrophobicContact CD2-CE2 3.87Å; L65-F140 HydrophobicContact CG-CD2 3.93Å; L65-F140 HydrophobicContact CG-CE2 3.77Å; V69-F140 HydrophobicContact CG2-CD2 3.62Å; V69-F140 HydrophobicContact CG2-CE2 3.76Å; G136-F140 VanDerWaalsContact O-CB 3.32Å; G136-F140 WeakPolarHBondContact O-CB 3.38Å; G136-F140 PolarHBondContact O-N 3.46Å; I137-F140 PolarHBondContact O-N 2.85Å; F138-F140 VanDerWaalsContact C-N 3.31Å; F138-F140 PolarHBondContact O-N 3.48Å; F140-N144 WeakPolarHBondContact O-CB 3.41Å; F140-N144 PolarHBondContact O-N 2.86Å
141I93.9Very high89Confident102 Ų10267 Ų6752%0.52334%0.344SS..Hα-helixtrans-66.4-45.2179.2-69.3169.5000110.8I137 F138 N144 A145I137-I141 HydrophobicContact CG2-CD1 3.7Å; I137-I141 HydrophobicContact CG2-CG1 4.33Å; I137-I141 VanDerWaalsContact O-CG1 3.31Å; I137-I141 WeakPolarHBondContact O-CG1 3.31Å; I137-I141 PolarHBondContact O-N 2.95Å; F138-I141 PolarHBondContact O-N 2.88Å; I141-N144 PolarHBondContact O-N 3.5Å; I141-A145 WeakPolarHBondContact O-CB 3.38Å; I141-A145 PolarHBondContact O-N 3.23Å
142C92.6Very high87.6Confident51 Ų5164.9 Ų64.935%0.34534%0.34SS..Hα-helixtrans-62.6-46.6176.5-69.50000112.1F138 I139 N144 A145 I146F138-C142 PolarHBondContact O-N 3.33Å; F138-C142 PolarHBondContact O-SG 3.19Å; I139-C142 PolarHBondContact O-N 3.38Å; C142-N144 VanDerWaalsContact C-N 3.33Å; C142-N144 PolarHBondContact O-N 2.99Å; C142-A145 PolarHBondContact O-N 3.01Å; C142-I146 WeakPolarHBondContact O-CG1 3.02Å; C142-I146 PolarHBondContact O-N 2.8Å
143A90.8Very high86.1Confident5 Ų568 Ų684%0.04135%0.351CS..Hα-helixtrans-62.8-39.8176.200000111.9F64 L65 I139 I146 L147F64-A143 HydrophobicContact CB-CB 3.73Å; L65-A143 HydrophobicContact CB-CB 4.2Å; I139-A143 WeakPolarHBondContact O-CB 3.49Å; I139-A143 PolarHBondContact O-N 2.84Å; A143-I146 PolarHBondContact O-N 2.91Å; A143-L147 VanDerWaalsContact O-CB 3.26Å; A143-L147 WeakPolarHBondContact O-CB 3.49Å; A143-L147 PolarHBondContact O-N 2.85Å
144N89.6Confident84.4Confident48 Ų4870 Ų7026%0.25736%0.36SS..Hα-helixtrans-69.1-38.4177.5-167.152000111.9L65 F140 I141 C142 L147 H148L65-N144 HydrophobicContact CD1-CB 4.46Å; F140-N144 WeakPolarHBondContact O-CB 3.41Å; F140-N144 PolarHBondContact O-N 2.86Å; I141-N144 PolarHBondContact O-N 3.5Å; C142-N144 VanDerWaalsContact C-N 3.33Å; C142-N144 PolarHBondContact O-N 2.99Å; N144-L147 PolarHBondContact O-N 3.13Å; N144-H148 PolarHBondContact ND2-CD2 3.36Å; N144-H148 VanDerWaalsContact ND2-CD2 3.29Å; N144-H148 PolarHBondContact ND2-NE2 3.34Å; N144-H148 WeakPolarHBondContact O-CB 3.49Å; N144-H148 PolarHBondContact O-CD2 3.28Å; N144-H148 PolarHBondContact O-N 3.42Å; N144-H148 PolarHBondContact OD1-CD2 3.43Å
145A90.1Very high82.4Confident58 Ų5871.3 Ų71.348%0.47936%0.361SS..Hα-helixtrans-60.4-48.8173.300000111.4I141 C142 L147 H148 E149I141-A145 WeakPolarHBondContact O-CB 3.38Å; I141-A145 PolarHBondContact O-N 3.23Å; C142-A145 PolarHBondContact O-N 3.01Å; A145-L147 VanDerWaalsContact C-N 3.3Å; A145-L147 PolarHBondContact O-N 3.05Å; A145-H148 PolarHBondContact O-N 3.4Å; A145-E149 WeakPolarHBondContact O-CB 3.1Å; A145-E149 PolarHBondContact O-N 3.14Å
146I87.3Confident80.5Confident83 Ų8373.8 Ų73.843%0.42637%0.368SS..Hα-helixtrans-61.7-37.9175.2-66165.1000111.1C142 A143 N150C142-I146 WeakPolarHBondContact O-CG1 3.02Å; C142-I146 PolarHBondContact O-N 2.8Å; A143-I146 PolarHBondContact O-N 2.91Å; I146-N150 WeakPolarHBondContact CG2-ND2 3.42Å; I146-N150 WeakPolarHBondContact O-CB 3.33Å; I146-N150 PolarHBondContact O-N 3.18Å; I146-N150 PolarHBondContact O-ND2 2.87Å
147L82.4Confident78.6Confident26 Ų2679.1 Ų79.114%0.13640%0.396CS..Hα-helixtrans-69.6-38.5176.8-173.664.2000112L65 A143 N144 A145 R151L65-L147 HydrophobicContact CD1-CD2 3.55Å; A143-L147 VanDerWaalsContact O-CB 3.26Å; A143-L147 WeakPolarHBondContact O-CB 3.49Å; A143-L147 PolarHBondContact O-N 2.85Å; N144-L147 PolarHBondContact O-N 3.13Å; A145-L147 VanDerWaalsContact C-N 3.3Å; A145-L147 PolarHBondContact O-N 3.05Å; L147-R151 WeakPolarHBondContact O-CB 3.18Å; L147-R151 PolarHBondContact O-N 2.81Å
148H77.3Confident76.8Confident109 Ų10981.4 Ų81.451%0.50541%0.408SS..Hα-helixtrans-67.8-41.7174.4-86.6-75.7000112.1N144 A145 R151 D152N144-H148 PolarHBondContact ND2-CD2 3.36Å; N144-H148 VanDerWaalsContact ND2-CD2 3.29Å; N144-H148 PolarHBondContact ND2-NE2 3.34Å; N144-H148 WeakPolarHBondContact O-CB 3.49Å; N144-H148 PolarHBondContact O-CD2 3.28Å; N144-H148 PolarHBondContact O-N 3.42Å; N144-H148 PolarHBondContact OD1-CD2 3.43Å; A145-H148 PolarHBondContact O-N 3.4Å; H148-R151 PolarHBondContact O-N 3.45Å; H148-D152 WeakPolarHBondContact O-CB 3.26Å; H148-D152 PolarHBondContact O-N 3.5Å
149E81.1Confident74.9Confident104 Ų10480.8 Ų80.849%0.48641%0.406SS..Hα-helixtrans-61.1-45.1175.5-165.1-148.6149.300111.3A145 D152 K153A145-E149 WeakPolarHBondContact O-CB 3.1Å; A145-E149 PolarHBondContact O-N 3.14Å; E149-D152 PolarHBondContact O-N 3.3Å; E149-K153 WeakPolarHBondContact O-CG 3.33Å; E149-K153 PolarHBondContact O-N 3.4Å; E149-K153 WeakPolarHBondContact OE1-CE 3.45Å; E149-K153 IonicContact OE1-NZ 2.64Å; E149-K153 PolarHBondContact OE1-NZ 2.99Å
150N74.9Confident73.2Confident60 Ų6082.6 Ų82.632%0.32142%0.415SS..Hα-helixtrans-72.7-31.8176.9-71.3-58.1000112.7I146 K153 E154I146-N150 WeakPolarHBondContact CG2-ND2 3.42Å; I146-N150 WeakPolarHBondContact O-CB 3.33Å; I146-N150 PolarHBondContact O-N 3.18Å; I146-N150 PolarHBondContact O-ND2 2.87Å; N150-K153 WeakPolarHBondContact O-CB 3.19Å; N150-K153 PolarHBondContact O-N 3.27Å; N150-K153 PolarHBondContact OD1-NZ 3.3Å; N150-E154 PolarHBondContact O-N 2.85Å
151R70.1Confident71.9Confident96 Ų9688.4 Ų88.436%0.36243%0.434SS..Hα-helixtrans-68-38.9172.4-169.9-174.8-175.8111.93.2111.9L147 H148 K153 E154 T155L147-R151 WeakPolarHBondContact O-CB 3.18Å; L147-R151 PolarHBondContact O-N 2.81Å; H148-R151 PolarHBondContact O-N 3.45Å; R151-K153 VanDerWaalsContact C-N 3.32Å; R151-K153 PolarHBondContact O-N 2.82Å; R151-E154 PolarHBondContact O-N 3.18Å; R151-T155 PolarHBondContact O-N 2.88Å; R151-T155 PolarHBondContact O-OG1 3.05Å
152D61.5Low70.4Confident96 Ų9688.3 Ų88.351%0.51344%0.435SS..Hα-helixtrans-61.1-43.9175.1-175.358.7000110.5H148 E149 E154 T155 K156H148-D152 WeakPolarHBondContact O-CB 3.26Å; H148-D152 PolarHBondContact O-N 3.5Å; E149-D152 PolarHBondContact O-N 3.3Å; D152-E154 PolarHBondContact O-N 2.84Å; D152-T155 WeakPolarHBondContact CA-OG1 3.24Å; D152-T155 PolarHBondContact O-N 3.23Å; D152-T155 PolarHBondContact O-OG1 3.34Å; D152-T155 VanDerWaalsContact O-OG1 3.14Å; D152-K156 WeakPolarHBondContact O-CB 3.3Å; D152-K156 PolarHBondContact O-N 3.35Å
153K60.4Low69.4Low87 Ų8789.2 Ų89.238%0.37844%0.436SS..Hα-helixtrans-56-49.2170.4-64.2167.5-161.2168.40111.7E149 N150 R151 K156 I157E149-K153 WeakPolarHBondContact O-CG 3.33Å; E149-K153 PolarHBondContact O-N 3.4Å; E149-K153 WeakPolarHBondContact OE1-CE 3.45Å; E149-K153 IonicContact OE1-NZ 2.64Å; E149-K153 PolarHBondContact OE1-NZ 2.99Å; N150-K153 WeakPolarHBondContact O-CB 3.19Å; N150-K153 PolarHBondContact O-N 3.27Å; N150-K153 PolarHBondContact OD1-NZ 3.3Å; R151-K153 VanDerWaalsContact C-N 3.32Å; R151-K153 PolarHBondContact O-N 2.82Å; K153-K156 PolarHBondContact O-N 3.47Å; K153-I157 WeakPolarHBondContact O-CB 3.37Å; K153-I157 WeakPolarHBondContact O-CD1 3.45Å; K153-I157 WeakPolarHBondContact O-CG1 3.49Å; K153-I157 PolarHBondContact O-N 2.85Å
154E56.8Low68.1Low116 Ų11696 Ų9654%0.54246%0.461SS..Hα-helixtrans-60.9-44.4176.7-75.1-172.8169.800112.8N150 R151 D152 I157 I158N150-E154 PolarHBondContact O-N 2.85Å; R151-E154 PolarHBondContact O-N 3.18Å; D152-E154 PolarHBondContact O-N 2.84Å; E154-I157 PolarHBondContact O-N 3.49Å; E154-I158 WeakPolarHBondContact O-CG1 3.16Å; E154-I158 PolarHBondContact O-N 2.86Å
155T53.8Low66.9Low65 Ų6597.1 Ų97.140%0.39947%0.473SS..Hα-helixtrans-70-34.1178.545.70000112.7R151 D152 I158 H159R151-T155 PolarHBondContact O-N 2.88Å; R151-T155 PolarHBondContact O-OG1 3.05Å; D152-T155 WeakPolarHBondContact CA-OG1 3.24Å; D152-T155 PolarHBondContact O-N 3.23Å; D152-T155 PolarHBondContact O-OG1 3.34Å; D152-T155 VanDerWaalsContact O-OG1 3.14Å; T155-I158 PolarHBondContact O-N 3.48Å; T155-H159 WeakPolarHBondContact O-CB 3.32Å; T155-H159 PolarHBondContact O-N 3.04Å
156K53.8Low66Low129 Ų12997.4 Ų97.456%0.56147%0.469SS*.Hα-helixtrans-66.7-38172.5-171.2173.5-174.1173.20111.3D152 K153 M160D152-K156 WeakPolarHBondContact O-CB 3.3Å; D152-K156 PolarHBondContact O-N 3.35Å; K153-K156 PolarHBondContact O-N 3.47Å; K156-M160 WeakPolarHBondContact O-CB 3.31Å; K156-M160 VanDerWaalsContact O-CG 3.23Å; K156-M160 WeakPolarHBondContact O-CG 3.14Å; K156-M160 PolarHBondContact O-N 2.98Å
157I54.4Low65.1Low112 Ų11296.9 Ų96.957%0.57447%0.469SS*.Hα-helixtrans-65.2-43172.1-71.5162.4000110.9K153 E154 R161K153-I157 WeakPolarHBondContact O-CB 3.37Å; K153-I157 WeakPolarHBondContact O-CD1 3.45Å; K153-I157 WeakPolarHBondContact O-CG1 3.49Å; K153-I157 PolarHBondContact O-N 2.85Å; E154-I157 PolarHBondContact O-N 3.49Å; I157-R161 VanDerWaalsContact O-CB 3.24Å; I157-R161 WeakPolarHBondContact O-CB 3.41Å; I157-R161 PolarHBondContact O-N 3.45Å
158I58.1Low64.6Low110 Ų110100.8 Ų100.856%0.56449%0.489SS*.Hα-helixtrans-63.6-47.1176-68.5164.3000110.8E154 T155 R161 D162E154-I158 WeakPolarHBondContact O-CG1 3.16Å; E154-I158 PolarHBondContact O-N 2.86Å; T155-I158 PolarHBondContact O-N 3.48Å; I158-R161 PolarHBondContact O-N 3.05Å; I158-D162 WeakPolarHBondContact O-CB 3.26Å; I158-D162 PolarHBondContact O-N 2.84Å
159H55.8Low64.4Low119 Ų11999.7 Ų99.755%0.55149%0.487SS*.Hα-helixtrans-62.9-42.9178.6-175.1-107.6000112.3T155 D162 I163T155-H159 WeakPolarHBondContact O-CB 3.32Å; T155-H159 PolarHBondContact O-N 3.04Å; H159-D162 PolarHBondContact O-N 3.34Å; H159-I163 VanDerWaalsContact CE1-CD1 3.49Å; H159-I163 WeakPolarHBondContact CE1-CD1 3.37Å; H159-I163 WeakPolarHBondContact O-CG1 3.34Å; H159-I163 PolarHBondContact O-N 3.42Å
160M59.9Low64.1Low86 Ų8699 Ų9942%0.42449%0.486SS..Hα-helixtrans-60.5-45.2171.3-76.6-69.1-169.500111.6K156 D162 I163 Y164K156-M160 WeakPolarHBondContact O-CB 3.31Å; K156-M160 VanDerWaalsContact O-CG 3.23Å; K156-M160 WeakPolarHBondContact O-CG 3.14Å; K156-M160 PolarHBondContact O-N 2.98Å; M160-D162 VanDerWaalsContact C-N 3.32Å; M160-D162 PolarHBondContact O-N 3Å; M160-I163 PolarHBondContact O-N 3.41Å; M160-Y164 HydrophobicContact CB-CD2 4.41Å; M160-Y164 HydrophobicContact CB-CE2 4.31Å; M160-Y164 WeakPolarHBondContact O-CD2 3.4Å; M160-Y164 PolarHBondContact O-N 2.88Å; M160-Y164 HydrophobicContact SD-CE2 4.07Å
161R64.6Low63.7Low195 Ų195100.5 Ų100.574%0.73649%0.491SS*.Hα-helixtrans-63.1-37.8179.7-168.3178.8-164.3161.66.5112.1I157 I158 S165I157-R161 VanDerWaalsContact O-CB 3.24Å; I157-R161 WeakPolarHBondContact O-CB 3.41Å; I157-R161 PolarHBondContact O-N 3.45Å; I158-R161 PolarHBondContact O-N 3.05Å; R161-S165 WeakPolarHBondContact O-CB 3.42Å; R161-S165 PolarHBondContact O-N 2.77Å
162D63.6Low63.6Low99 Ų9999.6 Ų99.653%0.52950%0.496SS..Hα-helixtrans-69.6-42.8176.7-166.637.4000111.7I158 H159 M160 S165 T166I158-D162 WeakPolarHBondContact O-CB 3.26Å; I158-D162 PolarHBondContact O-N 2.84Å; H159-D162 PolarHBondContact O-N 3.34Å; M160-D162 VanDerWaalsContact C-N 3.32Å; M160-D162 PolarHBondContact O-N 3Å; D162-S165 PolarHBondContact O-N 3.35Å; D162-T166 WeakPolarHBondContact O-CB 3.35Å; D162-T166 WeakPolarHBondContact O-CG2 3.23Å; D162-T166 PolarHBondContact O-N 2.89Å; D162-T166 PolarHBondContact O-OG1 2.92Å
163I71.5Confident63.7Low71 Ų7199.1 Ų99.136%0.36449%0.493SS..Hα-helixtrans-59.1-49.4171.8-70.9168.1000111.1H159 M160 T166 V167H159-I163 VanDerWaalsContact CE1-CD1 3.49Å; H159-I163 WeakPolarHBondContact CE1-CD1 3.37Å; H159-I163 WeakPolarHBondContact O-CG1 3.34Å; H159-I163 PolarHBondContact O-N 3.42Å; M160-I163 PolarHBondContact O-N 3.41Å; I163-T166 PolarHBondContact O-OG1 3.34Å; I163-T166 VanDerWaalsContact O-OG1 3.05Å; I163-V167 WeakPolarHBondContact O-CB 3.48Å; I163-V167 VanDerWaalsContact O-CG2 3.26Å; I163-V167 WeakPolarHBondContact O-CG2 3.24Å; I163-V167 PolarHBondContact O-N 3.32Å
164Y63.2Low63.8Low146 Ų146101.2 Ų101.257%0.57350%0.498SS*.Hα-helixtrans-67.6-37.9178.5-70.3-59.9000112.3M160 V167 I168M160-Y164 HydrophobicContact CB-CD2 4.41Å; M160-Y164 HydrophobicContact CB-CE2 4.31Å; M160-Y164 WeakPolarHBondContact O-CD2 3.4Å; M160-Y164 PolarHBondContact O-N 2.88Å; M160-Y164 HydrophobicContact SD-CE2 4.07Å; Y164-V167 PolarHBondContact O-N 2.9Å; Y164-I168 VanDerWaalsContact O-CB 3.3Å; Y164-I168 WeakPolarHBondContact O-CB 3.32Å; Y164-I168 WeakPolarHBondContact O-CD1 3.4Å; Y164-I168 WeakPolarHBondContact O-CG1 3.12Å; Y164-I168 PolarHBondContact O-N 2.88Å
165S65.1Low64.2Low72 Ų72100.9 Ų100.950%0.50350%0.499SS..Hα-helixtrans-67.4-41178.1-165.70000112R161 D162 I168 D169R161-S165 WeakPolarHBondContact O-CB 3.42Å; R161-S165 PolarHBondContact O-N 2.77Å; D162-S165 PolarHBondContact O-N 3.35Å; S165-I168 PolarHBondContact O-N 2.81Å; S165-D169 VanDerWaalsContact O-CB 3.31Å; S165-D169 WeakPolarHBondContact O-CB 3.19Å; S165-D169 PolarHBondContact O-N 3.18Å
166T70.4Confident64.6Low64 Ų64103.5 Ų103.539%0.39351%0.505SS..Hα-helixtrans-68.8-38.2175.650.80000111.9D162 I163 D169 I170D162-T166 WeakPolarHBondContact O-CB 3.35Å; D162-T166 WeakPolarHBondContact O-CG2 3.23Å; D162-T166 PolarHBondContact O-N 2.89Å; D162-T166 PolarHBondContact O-OG1 2.92Å; I163-T166 PolarHBondContact O-OG1 3.34Å; I163-T166 VanDerWaalsContact O-OG1 3.05Å; T166-D169 PolarHBondContact O-N 3.39Å; T166-I170 VanDerWaalsContact O-CB 3.32Å; T166-I170 WeakPolarHBondContact O-CB 3.49Å; T166-I170 WeakPolarHBondContact O-CD1 3.43Å; T166-I170 WeakPolarHBondContact O-CG1 3.49Å; T166-I170 PolarHBondContact O-N 2.79Å
167V69.6Low64.7Low72 Ų72102.9 Ų102.944%0.43650%0.504SS..Hα-helixtrans-65.6-42.7173.4170.10000111.8I163 Y164 I170 H171I163-V167 WeakPolarHBondContact O-CB 3.48Å; I163-V167 VanDerWaalsContact O-CG2 3.26Å; I163-V167 WeakPolarHBondContact O-CG2 3.24Å; I163-V167 PolarHBondContact O-N 3.32Å; Y164-V167 PolarHBondContact O-N 2.9Å; V167-I170 PolarHBondContact O-N 3.47Å; V167-H171 WeakPolarHBondContact O-CB 3.14Å; V167-H171 PolarHBondContact O-CD2 3.35Å; V167-H171 PolarHBondContact O-N 2.97Å
168I71.4Confident64.7Low108 Ų108103 Ų10355%0.55450%0.502SS*.Hα-helixtrans-65.4-41.9176.3-70.9164.7000110.8Y164 S165 H171 T172Y164-I168 VanDerWaalsContact O-CB 3.3Å; Y164-I168 WeakPolarHBondContact O-CB 3.32Å; Y164-I168 WeakPolarHBondContact O-CD1 3.4Å; Y164-I168 WeakPolarHBondContact O-CG1 3.12Å; Y164-I168 PolarHBondContact O-N 2.88Å; S165-I168 PolarHBondContact O-N 2.81Å; I168-H171 PolarHBondContact O-N 3.45Å; I168-T172 VanDerWaalsContact O-CB 3.31Å; I168-T172 WeakPolarHBondContact O-CB 3.17Å; I168-T172 PolarHBondContact O-N 2.79Å; I168-T172 PolarHBondContact O-OG1 3.2Å
169D71.7Confident64.5Low86 Ų86107.5 Ų107.546%0.4651%0.512SS..Hα-helixtrans-66-45175.5-171.346.7000111.4S165 T166 H171 T172 L173S165-D169 VanDerWaalsContact O-CB 3.31Å; S165-D169 WeakPolarHBondContact O-CB 3.19Å; S165-D169 PolarHBondContact O-N 3.18Å; T166-D169 PolarHBondContact O-N 3.39Å; D169-H171 VanDerWaalsContact C-N 3.29Å; D169-H171 PolarHBondContact O-N 3.18Å; D169-T172 CarbonylContact O-C 3.55Å; D169-T172 PolarHBondContact O-N 2.64Å; D169-T172 VanDerWaalsContact O-N 3.07Å; D169-L173 VanDerWaalsContact O-CB 3.3Å; D169-L173 WeakPolarHBondContact O-CB 3.25Å; D169-L173 VanDerWaalsContact O-CG 3.24Å; D169-L173 WeakPolarHBondContact O-CG 3.22Å; D169-L173 PolarHBondContact O-N 2.91Å; D169-L173 WeakPolarHBondContact OD2-CD1 3.31Å
170I75.3Confident64.5Low90 Ų90108 Ų10846%0.46251%0.514SS..Hα-helixtrans-58.4-39.4174.2-72.4163.7000111.8T166 V167 R174T166-I170 VanDerWaalsContact O-CB 3.32Å; T166-I170 WeakPolarHBondContact O-CB 3.49Å; T166-I170 WeakPolarHBondContact O-CD1 3.43Å; T166-I170 WeakPolarHBondContact O-CG1 3.49Å; T166-I170 PolarHBondContact O-N 2.79Å; V167-I170 PolarHBondContact O-N 3.47Å; I170-R174 PolarHBondContact O-N 3.06Å
171H67.7Low64.1Low92 Ų92108.9 Ų108.943%0.42652%0.519SS..Hα-helixtrans-69.5-40.6173.8-90.9-107.6000112.2V167 I168 D169 R174 I175V167-H171 WeakPolarHBondContact O-CB 3.14Å; V167-H171 PolarHBondContact O-CD2 3.35Å; V167-H171 PolarHBondContact O-N 2.97Å; I168-H171 PolarHBondContact O-N 3.45Å; D169-H171 VanDerWaalsContact C-N 3.29Å; D169-H171 PolarHBondContact O-N 3.18Å; H171-R174 PolarHBondContact CD2-NH2 2.85Å; H171-R174 VanDerWaalsContact CD2-NH2 3.34Å; H171-R174 PolarHBondContact NE2-NH2 3.37Å; H171-R174 PolarHBondContact O-N 2.89Å; H171-I175 WeakPolarHBondContact O-CB 3.36Å; H171-I175 WeakPolarHBondContact O-CD1 3.23Å; H171-I175 VanDerWaalsContact O-CG1 3.24Å; H171-I175 WeakPolarHBondContact O-CG1 3.35Å; H171-I175 PolarHBondContact O-N 3.48Å
172T67.1Low63.4Low77 Ų77104.6 Ų104.647%0.47251%0.511SS..Hα-helixtrans-64.4-41.1177.1-59.40000111.1I168 D169 I175 K176I168-T172 VanDerWaalsContact O-CB 3.31Å; I168-T172 WeakPolarHBondContact O-CB 3.17Å; I168-T172 PolarHBondContact O-N 2.79Å; I168-T172 PolarHBondContact O-OG1 3.2Å; D169-T172 CarbonylContact O-C 3.55Å; D169-T172 PolarHBondContact O-N 2.64Å; D169-T172 VanDerWaalsContact O-N 3.07Å; T172-I175 PolarHBondContact O-N 3.22Å; T172-K176 WeakPolarHBondContact O-CB 3.24Å; T172-K176 PolarHBondContact O-N 3.28Å
173L64.4Low62.8Low86 Ų86102.5 Ų102.545%0.4551%0.512SS..Hα-helixtrans-65.5-48.3175-71.5170.9000111.4D169 I175 K176 E177D169-L173 VanDerWaalsContact O-CB 3.3Å; D169-L173 WeakPolarHBondContact O-CB 3.25Å; D169-L173 VanDerWaalsContact O-CG 3.24Å; D169-L173 WeakPolarHBondContact O-CG 3.22Å; D169-L173 PolarHBondContact O-N 2.91Å; D169-L173 WeakPolarHBondContact OD2-CD1 3.31Å; L173-I175 PolarHBondContact O-N 2.79Å; L173-K176 PolarHBondContact O-N 3.2Å; L173-E177 VanDerWaalsContact O-CB 3.25Å; L173-E177 WeakPolarHBondContact O-CB 3.38Å; L173-E177 PolarHBondContact O-N 3.5Å
174R61.8Low61.6Low130 Ų130106.5 Ų106.549%0.49153%0.532SS..Hα-helixtrans-61.3-40.7174.7-95.7-168.8-72.31290.2112.7I170 H171 K176 E177 Q178I170-R174 PolarHBondContact O-N 3.06Å; H171-R174 PolarHBondContact CD2-NH2 2.85Å; H171-R174 VanDerWaalsContact CD2-NH2 3.34Å; H171-R174 PolarHBondContact NE2-NH2 3.37Å; H171-R174 PolarHBondContact O-N 2.89Å; R174-K176 VanDerWaalsContact C-N 3.35Å; R174-E177 PolarHBondContact O-N 3.43Å; R174-Q178 WeakPolarHBondContact O-CB 3.49Å; R174-Q178 PolarHBondContact O-N 3.43Å
175I65.1Low60.7Low109 Ų109109.8 Ų109.856%0.55954%0.544SS*.Hα-helixtrans-66.3-38.6176.2-70.9166.5000110.9H171 T172 L173 R179H171-I175 WeakPolarHBondContact O-CB 3.36Å; H171-I175 WeakPolarHBondContact O-CD1 3.23Å; H171-I175 VanDerWaalsContact O-CG1 3.24Å; H171-I175 WeakPolarHBondContact O-CG1 3.35Å; H171-I175 PolarHBondContact O-N 3.48Å; T172-I175 PolarHBondContact O-N 3.22Å; L173-I175 PolarHBondContact O-N 2.79Å; I175-R179 VanDerWaalsContact O-CB 3.31Å; I175-R179 WeakPolarHBondContact O-CB 3.3Å; I175-R179 PolarHBondContact O-N 2.98Å
176K61.3Low59.9Low121 Ų121112.5 Ų112.553%0.52656%0.558SS.*Hα-helixtrans-68.3-42.2176.5-175.2178.8-180-177.90112.1T172 L173 R174 R179 Q180T172-K176 WeakPolarHBondContact O-CB 3.24Å; T172-K176 PolarHBondContact O-N 3.28Å; L173-K176 PolarHBondContact O-N 3.2Å; R174-K176 VanDerWaalsContact C-N 3.35Å; K176-R179 CarbonylContact O-C 3.24Å; K176-R179 PolarHBondContact O-N 2.87Å; K176-Q180 WeakPolarHBondContact O-CG 3.38Å; K176-Q180 PolarHBondContact O-N 2.73Å
177E57.3Low58.6Low116 Ų116112.8 Ų112.854%0.54257%0.573SS.*Hα-helixtrans-63.9-45.7174.7-175.5173.9-143.600110.9L173 R174 R179 Q180 M181L173-E177 VanDerWaalsContact O-CB 3.25Å; L173-E177 WeakPolarHBondContact O-CB 3.38Å; L173-E177 PolarHBondContact O-N 3.5Å; R174-E177 PolarHBondContact O-N 3.43Å; E177-R179 VanDerWaalsContact C-N 3.29Å; E177-R179 PolarHBondContact O-N 2.91Å; E177-Q180 PolarHBondContact O-N 2.73Å; E177-M181 HydrophobicContact CG-CE 3.96Å; E177-M181 PolarHBondContact O-N 2.83Å
178Q53.8Low57.4Low113 Ų113117.2 Ų117.253%0.52859%0.594SS.*Hα-helixtrans-61.3-36173.5-167.1172.57.800112.1R174 M181 N182R174-Q178 WeakPolarHBondContact O-CB 3.49Å; R174-Q178 PolarHBondContact O-N 3.43Å; Q178-M181 VanDerWaalsContact O-CG 3.23Å; Q178-M181 WeakPolarHBondContact O-CG 3.49Å; Q178-N182 WeakPolarHBondContact O-CB 3.15Å; Q178-N182 PolarHBondContact O-N 3.3Å; Q178-N182 VanDerWaalsContact O-N 3.15Å; Q178-N182 PolarHBondContact O-OD1 2.95Å
179R54.4Low55.8Low206 Ų206121.4 Ų121.478%0.77761%0.613SS**Hα-helixtrans-73.8-26.9173.6-162.7172.2-172.1173.93.2113I175 K176 E177 G183I175-R179 VanDerWaalsContact O-CB 3.31Å; I175-R179 WeakPolarHBondContact O-CB 3.3Å; I175-R179 PolarHBondContact O-N 2.98Å; K176-R179 CarbonylContact O-C 3.24Å; K176-R179 PolarHBondContact O-N 2.87Å; E177-R179 VanDerWaalsContact C-N 3.29Å; E177-R179 PolarHBondContact O-N 2.91Å; R179-G183 PolarHBondContact O-N 3.39Å; R179-G183 VanDerWaalsContact O-N 3.15Å
180Q54.5Low54Low128 Ų128120.8 Ų120.860%0.59863%0.627SS**Hα-helixtrans-77.3-42.1175.3-78.1177.8-36.400112.2K176 E177 G183K176-Q180 WeakPolarHBondContact O-CG 3.38Å; K176-Q180 PolarHBondContact O-N 2.73Å; E177-Q180 PolarHBondContact O-N 2.73Å; Q180-G183 PolarHBondContact O-N 3.07Å
181M52.3Low52.1Low106 Ų106125.4 Ų125.452%0.52265%0.647SS.*Hα-helixtrans-64.6-40.7173.264.8-175.670.800111.9E177 Q178 G183 M184E177-M181 HydrophobicContact CG-CE 3.96Å; E177-M181 PolarHBondContact O-N 2.83Å; Q178-M181 VanDerWaalsContact O-CG 3.23Å; Q178-M181 WeakPolarHBondContact O-CG 3.49Å; M181-G183 PolarHBondContact O-N 3.47Å; M181-M184 PolarHBondContact O-N 3.01Å
182N50.3Low50.6Low104 Ų104127.8 Ų127.856%0.55667%0.668SS**Hα-helixtrans-69.9-18.9175.4-70.31.8000113.2Q178 M184Q178-N182 WeakPolarHBondContact O-CB 3.15Å; Q178-N182 PolarHBondContact O-N 3.3Å; Q178-N182 VanDerWaalsContact O-N 3.15Å; Q178-N182 PolarHBondContact O-OD1 2.95Å; N182-M184 VanDerWaalsContact C-N 3.35Å
183G51.1Low49.1Very low55 Ų55133.1 Ų133.157%0.56769%0.688SS**Hα-helixtrans-77-16.6178.500000114.5R179 Q180 M181R179-G183 PolarHBondContact O-N 3.39Å; R179-G183 VanDerWaalsContact O-N 3.15Å; Q180-G183 PolarHBondContact O-N 3.07Å; M181-G183 PolarHBondContact O-N 3.47Å
184M45Very low47.8Very low156 Ų156136.2 Ų136.277%0.76871%0.71SS**SBendtrans-83.9-22-174.2-154.569.378.200113.8M181 N182M181-M184 PolarHBondContact O-N 3.01Å; N182-M184 VanDerWaalsContact C-N 3.35Å
185Y45.8Very low46.5Very low214 Ų214139.6 Ų139.684%0.83973%0.728SS**SBendtrans-96.1-10.4-171.8-83.3-83.6000115.2
186T48Very low44.8Very low130 Ų130143.3 Ų143.380%0.79874%0.743SS**SBendtrans-97.318-177.2-28.50000113.2
187G43.8Very low43.4Very low69 Ų69145.4 Ų145.471%0.71176%0.76SS**SBendtrans-104.53.7-173.300000116.4
188L44.1Very low42.2Very low166 Ų166143.4 Ų143.487%0.86977%0.77SS**SBendtrans-13850.1-168.5-158.278.8000114.8
189M37.8Very low41.2Very low195 Ų195143.5 Ų143.596%0.96178%0.784SS**SBendtrans-161.6146.3156.3-109.7-166.986.700110.4
190G33.6Very low40.4Very low73 Ų73139.5 Ų139.575%0.75379%0.787SS**  trans105.552.7166.800000116.6
191E36Very low39.6Very low188 Ų188139.3 Ų139.388%0.87980%0.799SS**  trans-81.9129.7152.9179177.3-123.500109.2
192T35.7Very low38.9Very low141 Ų141138.6 Ų138.687%0.86581%0.81SS**  trans-173.6141.71529.10000109.7
193E35.2Very low38.4Very low189 Ų189139.3 Ų139.388%0.88382%0.823SS**  trans-88.2130.8-173.2-53.7177.4109.900112.8
194V37.4Very low37.8Very low152 Ų152148.4 Ų148.492%0.92184%0.84SS**  trans-138.6135153.1-1790000109.2
195K33.4Very low37.6Very low201 Ų201148.8 Ų148.887%0.87484%0.844SS**  trans-124.995.3-165.4177.9-171.3179.6179.10111.3
196Q31Very low37.2Very low187 Ų187142.8 Ų142.887%0.87484%0.839SS**  trans-155.9148.7160.5-121.6171.41500115.7
197N30.5Very low36.5Very low165 Ų165140.8 Ų140.888%0.88284%0.835SS**  trans-42.5138.1-171.5-54-11.1000117.6
198G33Very low36.1Very low73 Ų73144.5 Ų144.575%0.75384%0.839SS**  trans-168.6120.8164.700000111.9
199S31.7Very low35.6Very low116 Ų116142.5 Ų142.581%0.81183%0.834SS**  trans-34.5127.7-17651.80000117.5C201S199-C201 PolarHBondContact O-N 3.34Å
200S38.3Very low35.7Very low122 Ų122141 Ų14185%0.85383%0.828SS**  trans-68.6118.2167.4175.70000111.7
201C37.3Very low35.5Very low123 Ų123141.2 Ų141.283%0.83182%0.823SS**  trans-130.1125.6163.7-92.50000109.5S199S199-C201 PolarHBondContact O-N 3.34Å
202A37.5Very low35.1Very low91 Ų91138 Ų13875%0.75282%0.821SS**  trans-92.9140.4-172.300000112.9
203S40.5Very low34.8Very low119 Ų119141.8 Ų141.883%0.83283%0.826SS**  trans-134.451.1164.3-77.70000111.7L205S203-L205 VanDerWaalsContact C-N 3.29Å; S203-L205 PolarHBondContact O-N 3.42Å; S203-L205 VanDerWaalsContact O-N 3.15Å
204R37.4Very low34.4Very low247 Ų247138.7 Ų138.793%0.93283%0.825SS**  trans-80.775.3164.4-72.7-177.568.6-150.82.1109.7A206R204-A206 PolarHBondContact O-N 2.87Å
205L41.7Very low33.9Very low164 Ų164134.5 Ų134.586%0.85981%0.813SS**  trans-72.6122.3169.4-72.9175.4000109.9S203S203-L205 VanDerWaalsContact C-N 3.29Å; S203-L205 PolarHBondContact O-N 3.42Å; S203-L205 VanDerWaalsContact O-N 3.15Å
206A36.6Very low33.6Very low87 Ų87134.1 Ų134.172%0.71981%0.812SS**  trans-58.6136.1174.500000110.1R204R204-A206 PolarHBondContact O-N 2.87Å
207A34.2Very low33.5Very low88 Ų88134.8 Ų134.873%0.72781%0.806SS**  59.2615900000112.2T209A207-T209 PolarHBondContact O-N 2.89Å
208N35Very low33.3Very low148 Ų148132.2 Ų132.279%0.79180%0.801SS**  trans-84.684.2171.3-161.6-5.3000109.7
209T33.5Very low32.9Very low124 Ų124133.2 Ų133.276%0.76180%0.796SS**  trans-11992.8-179.3-56.10000109.5A207 A211A207-T209 PolarHBondContact O-N 2.89Å; T209-A211 PolarHBondContact O-N 3.1Å
210I40Very low32.7Very low162 Ų162136.3 Ų136.383%0.83180%0.796SS**  trans-87.697.3-177.8-11.1175.6000110.3
211A29.7Very low32.2Very low79 Ų79140 Ų14065%0.65379%0.791SS**  trans-155.8134.3165.100000111.6T209T209-A211 PolarHBondContact O-N 3.1Å
212S28.6Very low31.7Very low119 Ų119142.9 Ų142.983%0.83280%0.795SS**  trans56.4104.3158.5-550000119.2
213F28.4Very low31.1Very low221 Ų221145.1 Ų145.197%0.96979%0.794SS**  trans-108.3139.5147.2-94.7-80000110.3
214S26.6Very low30.5Very low124 Ų124143.9 Ų143.987%0.86779%0.785SS**  trans-155.5139.6176.8179.70000109.5
215G26.9Very low29.9Very low65 Ų65136.9 Ų136.967%0.6777%0.774SS**  trans103.2114.4178.800000113
216F27Very low29.4Very low193 Ų193134.5 Ų134.585%0.84677%0.766SS**  89.9134.178.2-154-134.8000109.6
217R28.8Very low29.2Very low200 Ų200137.9 Ų137.976%0.75577%0.767SS**  cis-170.2137.841.9-177175.1-170.7-134.11.9112.9
218S26.2Very low29.2Very low111 Ų111142.1 Ų142.178%0.77677%0.772SS**  trans63.4150.7149.7-176.20000119
219S26.1Very low29Very low94 Ų94142.7 Ų142.766%0.65778%0.775SS**  cis-171.4141.4-20.4167.80000108.2
220F26.5Very low29Very low182 Ų182144.6 Ų144.680%0.79878%0.775SS**  trans-154.4172.2134-131.6-97.2000110.8
221R26.9Very low28.5Very low200 Ų200144 Ų14476%0.75577%0.773SS**  trans-75.3144.9-156-55175.6-163.7-164.21.9114.9
222M28.8Very low28.3Very low183 Ų183147.7 Ų147.790%0.90178%0.778SS**  trans-88.5144.2144-173.184.4163.600107.2
223D23.4Very low28.4Very low137 Ų137148.7 Ų148.773%0.73377%0.773SS**  trans-141.3165.5166.5-138.3-33.6000109.4
224S27.8Very low28.4Very low94 Ų94144.9 Ų144.966%0.65776%0.763SS**  trans-131.5151.5-152.6600000118.6
225S25.7Very low28.4Very low99 Ų99145 Ų14569%0.69275%0.75SS**  trans75.3146143.466.10000121.6
226V31.2Very low28.5Very low114 Ų114147.5 Ų147.569%0.69176%0.757SS**  trans63.6148.9166.1-124.80000114
227E32.1Very low28.7Very low159 Ų159146 Ų14674%0.74375%0.751SS**  cis-124.914716.3-46.2-87.110400109.5
228E33.4Very low28.6Very low177 Ų177142.1 Ų142.183%0.82775%0.754SS**  74.1141.777.5-51.3-139.1129.900118.3
229D32.5Very low28.7Very low159 Ų159142.1 Ų142.185%0.8575%0.754SS**  trans88.1158.3160.7-132-7.9000123.1
230E32.3Very low28.8Very low164 Ų164141.2 Ų141.277%0.76676%0.76SS**  trans-103.3171.2-155-61.3-168.2124.800117.3
231L28.8Very low28.8Very low150 Ų150140.6 Ų140.679%0.78576%0.759SS**  142.598127.5-72.7177.2000117
232M27.1Very low28.9Very low157 Ų157137.7 Ų137.777%0.77376%0.757SS**  48.3131.8119.5-83.6-64.6-147.100124.4
233L29.8Very low29.1Very low139 Ų139137 Ų13773%0.72875%0.754SS**  trans74.3153.5150.1-58167.7000117.6
234N28.7Very low30.1Very low141 Ų141135.4 Ų135.475%0.75475%0.751SS**  cis-152.1-177.62.4-138.1-19.9000115.3
235E27.2Very low30.8Very low126 Ų126136.1 Ų136.159%0.58975%0.754SS**  trans-51.7151.3178.2-133.9-141.6107.700118.2K237E235-K237 VanDerWaalsContact OE1-CD 3.28Å; E235-K237 WeakPolarHBondContact OE1-CD 3.33Å; E235-K237 WeakPolarHBondContact OE1-CE 3.31Å; E235-K237 WeakPolarHBondContact OE1-CG 3.05Å; E235-K237 IonicContact OE1-NZ 2.84Å; E235-K237 PolarHBondContact OE1-NZ 3.42Å; E235-K237 IonicContact OE2-NZ 2.76Å; E235-K237 PolarHBondContact OE2-NZ 3.41Å
236S28.1Very low30.9Very low118 Ų118138.8 Ų138.883%0.82576%0.759SS**  -165.2138.6125.4700000114.7
237K31.5Very low31.1Very low163 Ų163140.7 Ų140.771%0.70977%0.765SS**  trans-69.1157.1177.4-57.7124.1174.8121.80114.6E235E235-K237 VanDerWaalsContact OE1-CD 3.28Å; E235-K237 WeakPolarHBondContact OE1-CD 3.33Å; E235-K237 WeakPolarHBondContact OE1-CE 3.31Å; E235-K237 WeakPolarHBondContact OE1-CG 3.05Å; E235-K237 IonicContact OE1-NZ 2.84Å; E235-K237 PolarHBondContact OE1-NZ 3.42Å; E235-K237 IonicContact OE2-NZ 2.76Å; E235-K237 PolarHBondContact OE2-NZ 3.41Å
238S26.5Very low31Very low118 Ų118137.6 Ų137.683%0.82576%0.761SS**  162.8144.5105.2-164.80000116.4
239S28Very low30.6Very low111 Ų111136 Ų13678%0.77676%0.758SS**  trans-24.4153.8162.1-167.60000120.7
240G28.4Very low30.6Very low75 Ų75133 Ų13377%0.77375%0.749SS**  trans179.2110.5162.500000116.8
241H27.6Very low30.7Very low168 Ų168130.5 Ų130.578%0.77875%0.75SS**  trans-74.5149.7179.4-95.6-123.9000116
242L29Very low30.8Very low139 Ų139127.9 Ų127.973%0.72875%0.75SS**  trans57.9118.3138.5-61.9169.9000123.1
243M32.5Very low30.8Very low168 Ų168125.7 Ų125.783%0.82875%0.75SS**  trans74.4142.7142.9-67.8-70.2104.800121.7
244P44.6Very low31.2Very low105 Ų105124.4 Ų124.468%0.68275%0.748SS**  trans-94174.5175.540.7-36.8000112.7
245P41.8Very low31.3Very low108 Ų108126.7 Ų126.770%0.70175%0.751SS**  -158.4156.7112.139.2-20.5000118.9
246L28.5Very low31.5Very low156 Ų156123.6 Ų123.682%0.81775%0.753SS**  trans68.2156152.9-58.2155.3000117.9
247L34Very low31.5Very low153 Ų153125.7 Ų125.780%0.80175%0.754SS**  cis-159.3-176.9-3-125.3170.1000111.9
248S29.8Very low31.4Very low95 Ų95127.8 Ų127.866%0.66476%0.759SS**  trans77.7133.9168.3-176.80000116.2
249D26.9Very low32.2Very low144 Ų144127.2 Ų127.277%0.7775%0.752SS**  cis-156.9168.7-3.1-123.1-55.4000116.1
250S32.3Very low32.8Very low94 Ų94127.4 Ų127.466%0.65775%0.751SS**  trans68.6112.1157.4-104.70000125
251S32.9Very low32.9Very low113 Ų113129.6 Ų129.679%0.7976%0.755SS**  68.7153.1118-52.50000123.4
252A32Very low33Very low94 Ų94126.9 Ų126.978%0.77776%0.755SS**  cis-179.9120.5-48.100000111.9
253S26.8Very low33.1Very low112 Ų112129.5 Ų129.578%0.78376%0.76SS**  trans-173.5123.9155.4-162.40000109.1
254V38.6Very low33Very low111 Ų111127.3 Ų127.367%0.67376%0.756SS**  cis8712732.5-175.40000111.8
255F30.8Very low32.3Very low190 Ų190127.9 Ų127.983%0.83376%0.758SS**  cis-143.9173.39.1-126.4-41.6000112.1
256G30.3Very low31.8Very low60 Ų60129.8 Ų129.862%0.61976%0.762SS**  trans-155.7157.6162.800000111.3
257L29.4Very low31.9Very low163 Ų163129.6 Ų129.685%0.85376%0.762SS**  trans-150158.2-178.3-60.8170.8000109.3
258Y28.1Very low31.8Very low207 Ų207132.2 Ų132.281%0.81277%0.767SS**  cis172.9129-29.5-160.4-83.3000104.7
259P43.9Very low31.8Very low105 Ų105134 Ų13468%0.68277%0.774SS**  trans-94.6157.7178.636.9-34.1000112.4
260P40Very low31.9Very low115 Ų115132.7 Ų132.775%0.74778%0.776SS**  -161.4179.710441.4-22000118.6
261S30.2Very low31.7Very low122 Ų122131.5 Ų131.585%0.85378%0.779SS**  trans87.4166.8148.981.50000120.6
262S31.6Very low31.6Very low111 Ų111131.7 Ų131.778%0.77678%0.78SS**  trans-154.7148-158.155.70000114.6
263K30.7Very low31.7Very low194 Ų194137 Ų13784%0.84379%0.786SS**  trans176.8127.2145.3-104.7169.1-176.6-178.80115.2
264T30.1Very low31.8Very low122 Ų122141.8 Ų141.875%0.74879%0.792SS**  trans53.1154.4139.255.20000125
265T30.7Very low31.4Very low117 Ų117142.4 Ų142.472%0.71880%0.8SS**  trans75.593.6155.438.70000121.1
266D30.2Very low31.3Very low147 Ų147142.7 Ų142.779%0.78680%0.804SS**  55.6144.5119.6-50.2-23.7000124.8
267D30.3Very low31.5Very low152 Ų152145.1 Ų145.181%0.81381%0.807SS**  trans48.8100.9154.4-74.9-5.9000121.6
268K32.9Very low31.7Very low208 Ų208146.2 Ų146.290%0.90481%0.805SS**  -167.1152.797.3-111.8164.6-176.4160.80117.3
269T29.3Very low31.8Very low133 Ų133141.5 Ų141.582%0.81680%0.802SS**  trans-65.3131.8174.6-460000113.6
270S29.2Very low31.6Very low116 Ų116144.2 Ų144.281%0.81181%0.809SS**  165.7145.7117.552.50000115.6
271G27.8Very low31.5Very low70 Ų70145.4 Ų145.472%0.72281%0.814SS**  trans68.289.6143.500000120.9
272S31.6Very low31.4Very low116 Ų116144.7 Ų144.781%0.81181%0.809SS**  168.4141.19253.40000115.8K274S272-K274 PolarHBondContact O-N 3.33Å
273K32.3Very low31.6Very low206 Ų206144 Ų14490%0.89681%0.805SS**  trans30.582.4150.7-61.9-177.5180179.10118.4
274K28.8Very low32Very low212 Ų212139.4 Ų139.492%0.92280%0.797SS**  trans-59130.4154.9-167177.3-172.6178.90109.6S272S272-K274 PolarHBondContact O-N 3.33Å
275C30.9Very low32.5Very low125 Ų125141.4 Ų141.485%0.84580%0.801SS**  trans-124.1160170-136.50000110.2
276E28.5Very low32.7Very low196 Ų196140.9 Ų140.992%0.91680%0.802SS**  trans-92.8153.6-147.1-162.6162.3-17800115.1
277T34.8Very low33Very low110 Ų110138.1 Ų138.168%0.67580%0.8SS**  trans-111.4128.2-178.4-37.10000110
278K33.5Very low33.5Very low187 Ų187139.4 Ų139.481%0.81380%0.799SS**  163140.9126.4-85.6149.2-162.7172.30113.7
279S31.1Very low34.2Very low107 Ų107135.6 Ų135.675%0.74879%0.793SS**  trans11122.1139.3-169.40000118.6
280I39.7Very low34.6Very low162 Ų162136.9 Ų136.983%0.83179%0.794SS**  trans-123.388.1157.3-53.3179000109
281V36.9Very low35.3Very low140 Ų140137 Ų13785%0.84879%0.792SS**  trans-100.7122.3142.5174.80000105.2
282S29.6Very low35.8Very low107 Ų107140.2 Ų140.275%0.74880%0.797SS**  trans-145.9145.5170.6-165.10000111.1
283S34.1Very low36.7Very low98 Ų98141.5 Ų141.569%0.68579%0.794SS**  trans-97.3157.7-173.950.30000112.2
284S39.5Very low37.5Very low97 Ų97140.2 Ų140.268%0.67879%0.788SS**  trans43.2112.5146.560.90000119.3
285I40Very low38.9Very low164 Ų164137.5 Ų137.584%0.84178%0.783SS**  -177.7134.4114-92.7152.4000109.2
286S35.3Very low39.6Very low105 Ų105138 Ų13873%0.73478%0.777SS**  trans-146.3108.7165.6-170.30000108.1
287A37.8Very low40.4Very low90 Ų90136 Ų13674%0.74477%0.772SS**  trans-114.384.7-168.800000111.2
288F40.7Very low40.8Very low179 Ų179135.9 Ų135.979%0.78578%0.775SS**  trans-96.594.1173.7-85.9-81.1000111.8
289T46.1Very low41.1Very low127 Ų127132.4 Ų132.478%0.77977%0.77SS**  trans32.2101.314858.20000118.3
290L39.3Very low41.6Very low160 Ų160134.4 Ų134.484%0.83877%0.77SS**  trans-84146.5160.2-67175.7000111
291P42.7Very low41.5Very low118 Ų118133.4 Ų133.477%0.76677%0.767SS**  trans-73.1127.2174.829.6-33.5000111.3I293P291-I293 PolarHBondContact O-N 3.15Å
292V38.2Very low41.8Very low139 Ų139135.4 Ų135.484%0.84277%0.766SS**  trans-74108.9-179.31800000110.7K294V292-K294 PolarHBondContact O-N 3.49Å
293I50.2Low42.5Very low143 Ų143135.6 Ų135.673%0.73377%0.765SS**  trans-78.5107.3169.1-61.5176.5000108.1P291 L295P291-I293 PolarHBondContact O-N 3.15Å; I293-L295 HydrophobicContact CG2-CD2 4.26Å; I293-L295 PolarHBondContact O-N 3.15Å
294K50.2Low42.4Very low179 Ų179135.6 Ų135.678%0.77877%0.765SS**  trans-74.7101.4177.8-176.8177.6178.2178.60110.3V292V292-K294 PolarHBondContact O-N 3.49Å
295L58.1Low42.5Very low154 Ų154138.9 Ų138.981%0.80677%0.774SS**  trans-76.8144.4169.2-61.6179.7000110.5I293I293-L295 HydrophobicContact CG2-CD2 4.26Å; I293-L295 PolarHBondContact O-N 3.15Å
296N45.6Very low42.4Very low137 Ų137137.3 Ų137.373%0.73377%0.767SS**  trans-90.7117.4-179.7-75.6-33.1000111C298N296-C298 PolarHBondContact O-N 2.92Å; N296-C298 VanDerWaalsContact O-N 3.1Å
297N45.2Very low42.4Very low152 Ų152139.3 Ų139.381%0.81377%0.769SS**  trans3263.4149.6-154.375.1000117.7
298C42.3Very low42.3Very low109 Ų109143.3 Ų143.374%0.73678%0.777SS**  trans-94.4109.6155.9-66.30000108.1N296 I300N296-C298 PolarHBondContact O-N 2.92Å; N296-C298 VanDerWaalsContact O-N 3.1Å; C298-I300 HydrophobicContact CB-CG1 4.39Å; C298-I300 PolarHBondContact O-N 3.22Å
299V40.9Very low42.1Very low114 Ų114140.6 Ų140.669%0.69177%0.774SS**  trans-66.9121.5158.6174.70000106.2
300I41.9Very low41.8Very low148 Ų148142.7 Ų142.776%0.75978%0.775SS**  trans-116110.2169.6-64174.7000104.2C298 E302C298-I300 HydrophobicContact CB-CG1 4.39Å; C298-I300 PolarHBondContact O-N 3.22Å; I300-E302 PolarHBondContact O-N 3.32Å
301D37.6Very low41.5Very low142 Ų142143.1 Ų143.176%0.75978%0.779SS**  trans-63.8134175.9-64.2-55.8000109.6P303D301-P303 WeakPolarHBondContact O-CD 3.33Å
302E42.2Very low41.2Very low181 Ų181141.1 Ų141.185%0.84677%0.772SS**  trans-93.7111.3-173.3-175.8165.5-137.900110I300 S304I300-E302 PolarHBondContact O-N 3.32Å; E302-S304 PolarHBondContact O-N 3.37Å; E302-S304 VanDerWaalsContact O-N 3.08Å
303P44.4Very low41Very low111 Ų111141.2 Ų141.272%0.72177%0.768SS**  trans-76.796.9174.430.8-32.6000109.3D301 I305D301-P303 WeakPolarHBondContact O-CD 3.33Å; P303-I305 PolarHBondContact O-N 3.17Å
304S31.3Very low40Very low98 Ų98141.1 Ų141.169%0.68577%0.769SS**  trans-56.3118.6175.156.40000111.4E302E302-S304 PolarHBondContact O-N 3.37Å; E302-S304 VanDerWaalsContact O-N 3.08Å
305I43.3Very low39.1Very low167 Ų167139.2 Ų139.286%0.85677%0.766SS**  trans-102.455.7178.951167.2000112P303P303-I305 PolarHBondContact O-N 3.17Å
306D37.9Very low37.7Very low130 Ų130142.1 Ų142.170%0.69577%0.772SS**  trans-92.9139.7173.8-71.9-47.1000112
307N34.4Very low36.8Very low148 Ų148140.4 Ų140.479%0.79177%0.771SS**  trans66.399.9172.7-44.9-71.8000116.4
308I36.7Very low36Very low174 Ų174145 Ų14589%0.89278%0.777SS**  -154.3105.1105.8-85.8140.1000106.5
309T35.5Very low35.3Very low121 Ų121145.3 Ų145.374%0.74278%0.781SS**  trans-141.9126165.4-65.90000104.6
310E40.6Very low34.7Very low171 Ų171150.7 Ų150.780%0.79979%0.789SS**  trans-15.6133-17858.3-136.412000119.4
311D32.3Very low34Very low170 Ų170150.5 Ų150.591%0.90979%0.789SS**  -157.7158.4128-122-27.7000112.5
312A37Very low33.7Very low75 Ų75152.1 Ų152.162%0.6280%0.797SS**  trans-117.3166.2-177.800000112.7
313D33.1Very low32.9Very low142 Ų142149 Ų14976%0.75980%0.795SS**  trans46.9107.6161-55.5-27.5000118.6
314N29.2Very low32.6Very low141 Ų141151.2 Ų151.275%0.75480%0.798SS**  -178.9147.993.7-99.4-75000116.3
315L31.9Very low32.5Very low138 Ų138153.1 Ų153.172%0.72380%0.801SS**  trans51.3119.8145.2-66.3164.7000121.5
316K28.5Very low32.1Very low215 Ų215149.8 Ų149.894%0.93579%0.792SS**  trans-130.594.9137.1-166.9161.3-169.81650111.8
317S27.3Very low31.8Very low102 Ų102150.7 Ų150.771%0.71380%0.796SS**  trans-88.8135.6-177.149.70000113.5
318R28.3Very low31.5Very low247 Ų247150.2 Ų150.293%0.93280%0.798SS**  trans-165.5133.6167.6-162.2162.4-173.9-178.21.9106.8
319S26.3Very low31.5Very low116 Ų116146 Ų14681%0.81179%0.789SS**  cis-142.2-176.213.941.80000114.2
320R28.8Very low31.8Very low227 Ų227145.7 Ų145.786%0.85779%0.789SS**  trans-94.2145.5-160.4-51.6165.1-171.9132.9-1.4115.3
321N28.3Very low31.3Very low145 Ų145145.5 Ų145.578%0.77579%0.793SS**  57.5161127.8-54.31.1000123.7
322L29.6Very low31.1Very low175 Ų175140.9 Ų140.992%0.91678%0.778SS**  trans86.6139.1172.8-55.7165.8000115
323S26.3Very low30.6Very low117 Ų117144.4 Ų144.482%0.81879%0.787SS**  cis-150.6-169.6-2.8-157.10000112.3
324M37.6Very low30.6Very low156 Ų156143.6 Ų143.677%0.76879%0.787SS**  trans-85.3169.1-168.2-80.4-178.557.400118.6
325D30.3Very low30.6Very low139 Ų139142.9 Ų142.974%0.74379%0.793SS**  trans73.8142.8155.7-76.5-23.4000120
326S35.4Very low30.4Very low96 Ų96144.8 Ų144.867%0.67180%0.798SS**  cis-166.6174.8-14.9-165.60000112
327L31.4Very low30.3Very low150 Ų150138.8 Ų138.879%0.78578%0.783SS**  trans111.7104.5153.1-58.2-178.9000121.2
328V28.1Very low30.4Very low138 Ų138143.5 Ų143.584%0.83679%0.791SS**  trans78.7136.6132.2-179.40000120.1
329A35.2Very low30.5Very low85 Ų85140.3 Ų140.370%0.70279%0.787SS**  trans-110.8-163.6-178.200000109.8
330P42.2Very low31.4Very low115 Ų115140.3 Ų140.375%0.74778%0.784SS**  cis-126-162.52.144.9-26.6000111.7
331L29.6Very low31.3Very low166 Ų166135.6 Ų135.687%0.86978%0.781SS**  cis-143.2-1514.4-165.437.8000110
332A29.2Very low31.4Very low74 Ų74133.5 Ų133.561%0.61278%0.777SS**  trans-147.5165.7-173.400000112.7
333D26.1Very low31.6Very low148 Ų148131.2 Ų131.279%0.79177%0.771SS**  trans57.6140.4149-77.7-42000125.3
334T32.3Very low31.8Very low125 Ų125131.3 Ų131.377%0.76777%0.766SS**  trans19.313315358.10000122.6
335S29.3Very low31.8Very low126 Ų126131.1 Ų131.188%0.88177%0.767SS**  -177.4-174.511940.90000112.5
336E28.7Very low32.5Very low178 Ų178129.5 Ų129.583%0.83277%0.765SS**  trans-92.9144.8-156.9-52.2-179.3119.400116.8
337S27.3Very low32.2Very low89 Ų89134.3 Ų134.362%0.62277%0.768SS**  trans74.8150.513573.20000123.5
338F28.7Very low32.1Very low201 Ų201134.5 Ų134.588%0.88277%0.77SS**  trans87.6154.3162.4-62.5-69.2000122.3
339Q31Very low32.1Very low181 Ų181135.7 Ų135.785%0.84677%0.766SS**  trans-80.7-179.1-164.3-95.4-177.3-8.400114.8
340P43.3Very low31.9Very low115 Ų115136.4 Ų136.475%0.74777%0.766SS**  cis-122-159.214.726.20.1000112.8
341V27.8Very low31.4Very low129 Ų129139.3 Ų139.378%0.78277%0.773SS**  cis-146.2162.921-179.60000111.6
342S29.8Very low31.4Very low100 Ų100135 Ų13570%0.69977%0.769SS**  trans-57.6156.3177.4-42.10000116.3
343T34.1Very low31.4Very low128 Ų128140.5 Ų140.579%0.78578%0.782SS**  -161.7137.386.123.10000115.1
344V31.3Very low31.5Very low118 Ų118138.4 Ų138.472%0.71578%0.779SS**  trans5298.5147.6-173.10000117.8
345L36.8Very low31.4Very low152 Ų152140.2 Ų140.280%0.79678%0.783SS**  68.6149.277.6-70.3169.6000115.7
346P45.2Very low31.4Very low106 Ų106139.2 Ų139.269%0.68878%0.776SS**  cis-131.4-157.4-22.944.7-27.6000110
347R29.7Very low31.4Very low196 Ų196135.3 Ų135.374%0.7477%0.768SS**  cis-156.9158.4-9.8-146.6-179.4175.294-0.1109.1
348N27.8Very low31.6Very low154 Ų154137.6 Ų137.682%0.82477%0.769SS**  trans-117155.2158.3-66.1-42.8000109.6
349H28.9Very low31.6Very low164 Ų164137.2 Ų137.276%0.75976%0.763SS**  trans-179.4162.2136.850.7-73.8000113
350S30.8Very low31.7Very low100 Ų100137.6 Ų137.670%0.69976%0.762SS**  trans-136.3-174.3174.158.10000109.6
351I31.9Very low31.2Very low176 Ų176136.8 Ų136.890%0.90376%0.759SS**  trans82.7133.2176.9-51.3163.2000114.6
352G29Very low31.3Very low75 Ų75135.4 Ų135.477%0.77376%0.755SS**  trans151.4104.6173.600000112.6
353E29.9Very low31.5Very low189 Ų189138.5 Ų138.588%0.88376%0.76SS**  trans-92.1146.8177.6-58.2171.2111.600111.6
354S27.7Very low31.2Very low105 Ų105136.1 Ų136.173%0.73475%0.754SS**  153.3128.6126.7-73.20000115.8
355L30.3Very low31.3Very low163 Ų163138.5 Ų138.585%0.85376%0.762SS**  trans58.2157.4144-82.295.2000123.7
356S29.7Very low31.1Very low105 Ų105134.4 Ų134.473%0.73476%0.756SS**  trans79113158.172.40000121
357S27.8Very low31.1Very low96 Ų96136 Ų13667%0.67177%0.766SS**  trans10.4148.1130.461.60000119.2
358Q31.6Very low31.2Very low137 Ų137130.3 Ų130.364%0.6477%0.769SS**  cis-174.7162.548.8-147.3167.321.400112.7
359Y30.3Very low31.7Very low192 Ų192130.6 Ų130.675%0.75378%0.777SS**  trans59.8127.9166.9-54.6-59.8000117.8
360K32.8Very low31.9Very low190 Ų190126.5 Ų126.583%0.82678%0.779SS**  -151.7138.755.6-96.9-179.6177.31740114.7
361S31.7Very low32.2Very low98 Ų98130.6 Ų130.669%0.68579%0.787SS**  trans24.3141.1137.459.10000121.5
362S30.6Very low32.2Very low100 Ų100129.2 Ų129.270%0.69978%0.78SS**  cis180150.2-1.144.60000112.4
363M33.6Very low32.5Very low164 Ų164133.3 Ų133.381%0.80878%0.784SS**  trans51.7119.1150.8-58.7-72.692.400118.6
364A28.5Very low32.6Very low79 Ų79129.7 Ų129.765%0.65378%0.779SS**  67.114471.700000113.3
365L33.8Very low33.4Very low168 Ų168131 Ų13188%0.8879%0.785SS**  cis-128.1174.314.7-87.780.3000112.4
366G31.1Very low33.3Very low65 Ų65126.8 Ų126.867%0.6778%0.782SS**  trans-109.8-152.8153.300000110.5
367P46.4Very low33.4Very low139 Ų139126.9 Ų126.990%0.90379%0.789SS**  cis-118.8-178.1-19.540.7-27.1000111.7
368G31.8Very low33.6Very low78 Ų78127 Ų12780%0.80480%0.796SS**  trans-167.9128.5172.800000115.1
369T38.6Very low33.7Very low160 Ų160130.2 Ų130.298%0.98280%0.802SS**  trans-83.8135.8178.3-360000110.9
370G32.8Very low33.9Very low78 Ų78130.4 Ų130.480%0.80480%0.801SS**  trans-166146.4175.900000111.9
371Q36.3Very low34Very low185 Ų185127.7 Ų127.786%0.86479%0.792SS**  trans-123.9166-172.9-165.2166.9100111
372L33.2Very low34.3Very low147 Ų147132.3 Ų132.377%0.7780%0.8SS**  trans83.7139.9159.9-93.9158.8000119.9
373L34.3Very low34.3Very low161 Ų161131 Ų13184%0.84380%0.802SS**  trans80.8125.2161.5-57.2175.7000121.3
374S31.7Very low34.6Very low113 Ų113127.9 Ų127.979%0.7980%0.797SS**  trans-71.4170.6155.5-460000110.3
375P44.4Very low35.2Very low132 Ų132130.8 Ų130.886%0.85780%0.801SS**  cis-147-166.833.843.6-22.4000116
376G27.7Very low35.3Very low76 Ų76129.9 Ų129.978%0.78480%0.803SS**  trans138.989.2155.200000117
377A32.1Very low36.1Very low107 Ų107131.7 Ų131.788%0.88481%0.805SS**  trans-49.5153.2178.400000118.2
378A33.3Very low35.7Very low99 Ų99132.1 Ų132.182%0.81880%0.799SS**  trans-152.8127.7137.600000114.8
379R33.6Very low35.8Very low204 Ų204136.4 Ų136.477%0.7780%0.798SS**  trans74.893.7140.1-159.7178.9-164.2-86.57.2121.3
380R34.5Very low35.6Very low195 Ų195135.6 Ų135.674%0.73679%0.787SS**  trans59.4134132.8-59.7175.5-166.8-179.83117.9
381Q33.9Very low36Very low134 Ų134139.8 Ų139.863%0.62679%0.79SS**  cis-156.2177.410.1-114.8160.7-10300107.5
382F37.4Very low36Very low194 Ų194135.7 Ų135.785%0.85178%0.781SS**  cis-118.4-97.916.8-136.8-65.4000113.8
383G31.9Very low35.8Very low72 Ų72132.8 Ų132.874%0.74277%0.773SS**  trans-173.9160.8-179.500000111.8
384S40Very low35.6Very low100 Ų100134.3 Ų134.370%0.69978%0.776SS**  trans-141.7158.9-173.4630000111.8
385N39.8Very low35.7Very low140 Ų140134.2 Ų134.275%0.74978%0.775SS**  trans54.4114158.4-51-19.5000118.7
386T36.2Very low35.1Very low149 Ų149138.1 Ų138.191%0.91478%0.779SS**  174.3166.8112.632.60000112.1
387S47.7Very low35.6Very low103 Ų103139.9 Ų139.972%0.7278%0.779SS**  trans-89.8159.9-169.348.40000115
388L37.9Very low35.8Very low148 Ų148142.3 Ų142.378%0.77578%0.776SS**  175.5178.7118.4-94.8173.9000114.3
389H34.9Very low35.8Very low167 Ų167144.4 Ų144.477%0.77377%0.774SS**  trans81130.7176.7-67.3-95.2000118
390L34Very low36.2Very low143 Ų143142.2 Ų142.275%0.74978%0.777SS**  cis9482.922.1-76.9160.7000117.9
391L41.8Very low36.2Very low166 Ų166138.9 Ų138.987%0.86977%0.773SS**  trans-144.4127.9136.6-66.7178.3000104.7
392S34.8Very low36.1Very low99 Ų99142.9 Ų142.969%0.69278%0.783SS**  cis69.9128.841.1-145.50000112.5
393S30.4Very low35.9Very low86 Ų86136.9 Ų136.960%0.60178%0.776SS**  cis-157.3143.38.6-12.60000111.5
394H30.3Very low36.4Very low193 Ų193140.1 Ų140.189%0.89478%0.784SS**  172.9130.4118.9-97.9-66.4000112.4
395S32.4Very low36.1Very low111 Ų111141.1 Ų141.178%0.77679%0.791SS**  trans-115.7151.2168.650.40000110.2
396K33.3Very low35.8Very low214 Ų214140.6 Ų140.693%0.9379%0.793SS**  trans-153.1136.4157.7-123.4171.5-175.7176.90110.1
397S36.5Very low35.5Very low113 Ų113141 Ų14179%0.7979%0.788SS**  trans-95157.7-176.445.90000111.8
398L37.9Very low34.7Very low158 Ų158142 Ų14283%0.82779%0.791SS**  trans-150.8124.7135.7-131.8168.3000109.1L400L398-L400 HydrophobicContact CD2-CG 4.16Å
399D32.5Very low34.3Very low144 Ų144141.1 Ų141.177%0.7779%0.791SS**  trans-100.8120.8171.4167.832.7000107.9
400L42Very low34.1Very low157 Ų157141.9 Ų141.982%0.82280%0.795SS**  trans-148134.2161.2-83.8-173.1000111.2L398L398-L400 HydrophobicContact CD2-CG 4.16Å
401D33.8Very low34Very low125 Ų125140.1 Ų140.167%0.66880%0.801SS**  trans-53163.8173.4171.945.8000115
402R31.6Very low33.5Very low218 Ų218139.2 Ų139.282%0.82379%0.792SS**  trans89.6104.9150.1-152.6179.2-124.2112.6-8119.6
403G34.3Very low33.4Very low68 Ų68141.7 Ų141.770%0.70179%0.793SS**  trans125.4132.1140.700000116.3
404P42.9Very low33.4Very low141 Ų141148.5 Ų148.592%0.91681%0.805SS**  trans-80.9132.6172.132.9-32.3000110.9
405S32.8Very low33.5Very low121 Ų121147.4 Ų147.485%0.84680%0.798SS**  trans-147.3151.8169.4-163.40000111.9
406T33.8Very low33.6Very low128 Ų128150.5 Ų150.579%0.78580%0.8SS**  trans-88.6115.2-162.951.30000112.9T408T406-T408 PolarHBondContact O-N 3.49Å
407L28.9Very low34Very low158 Ų158146.4 Ų146.483%0.82780%0.795SS**  trans-83105.9173-175.264.1000111.4V409L407-V409 PolarHBondContact O-N 3.08Å
408T31.4Very low34.2Very low125 Ų125145.7 Ų145.777%0.76779%0.79SS**  trans-75.7113.7168.651.20000110.5T406T406-T408 PolarHBondContact O-N 3.49Å
409V30.3Very low34.2Very low129 Ų129148.9 Ų148.978%0.78279%0.791SS**  trans-82.1127.5175.9177.30000110L407L407-V409 PolarHBondContact O-N 3.08Å
410Q30.1Very low34.8Very low182 Ų182148.4 Ų148.485%0.8580%0.796SS**  trans-69.8144168.6-74.7-166.59.500111
411A32.8Very low34.4Very low106 Ų106151.7 Ų151.788%0.87680%0.797SS**  trans-112.897.4172.900000110.4
412E30.1Very low35Very low148 Ų148153.7 Ų153.769%0.69281%0.807SS**  trans-91.2149.7167.6-17456.7-105.600110.1
413Q33.4Very low35.3Very low151 Ų151150.3 Ų150.371%0.70681%0.805SS**  trans-47.4147-164.8-67.7163.452.100118.1
414R30Very low35.7Very low228 Ų228157.3 Ų157.386%0.8681%0.811SS**  -168.5130.596.6-98.3158.3-171.1179.44116.3
415K32.3Very low35.4Very low170 Ų170157.8 Ų157.874%0.73981%0.806SS**  trans42.7103.6150.6-62.7-173.2174.4-176.30119.2
416H34.5Very low35.6Very low177 Ų177159.1 Ų159.182%0.81980%0.803SS**  15194.3110.8-76.7-63.1000112.5
417P42.2Very low36.5Very low127 Ų127158.7 Ų158.783%0.82581%0.806SS**  trans-108.1130.2171.329-14.6000114.1
418S40.3Very low37.3Very low98 Ų98160.6 Ų160.669%0.68581%0.807SS**  trans-46.2150.2164.650.80000117.6
419W38Very low37.8Very low225 Ų225158.2 Ų158.285%0.85281%0.808SS**  trans50.9120.3137.3-69.565.2000119.7R421W419-R421 PolarHBondContact O-N 3.24Å
420P44.3Very low38Very low134 Ų134163.8 Ų163.887%0.8782%0.816SS**  trans-65.6119.3169-16.530.3000112.1
421R34.1Very low38.6Very low226 Ų226163.4 Ų163.485%0.85382%0.817SS**  trans-108.9134.8158.2-95.8-172.3164.185.5-0.5109.5W419W419-R421 PolarHBondContact O-N 3.24Å
422L47.6Very low38.9Very low168 Ų168165.6 Ų165.688%0.8881%0.806SS**  trans-92.6106.3-177.4177.476.8000110
423D37.5Very low39.7Very low146 Ų146167 Ų16778%0.78182%0.817SS**  trans-136.886.9167.4-95.6-52.7000112.6
424R42.3Very low39.8Very low216 Ų216166.5 Ų166.582%0.81582%0.815SS**  35.694.1123.9-169.9-177.8-173.2174.41.6117.5
425N37.7Very low40Very low151 Ų151163 Ų16381%0.80781%0.813SS**  -179.699.5126.4-94.4-12.1000113.9
426N37.1Very low40.4Very low149 Ų149164.1 Ų164.180%0.79782%0.818SS**  trans-155.5117.7138.4-167-15.9000109.5K428N426-K428 PolarHBondContact OD1-N 3.15Å
427S52.3Low40.5Very low119 Ų119163.9 Ų163.983%0.83282%0.818SS**  trans-131.771.5177.258.60000110.2
428K44.9Very low40.3Very low197 Ų197165.2 Ų165.286%0.85782%0.818SS**  trans-153.1113.3175.5-140.7171.3-174.6178.20109.8N426N426-K428 PolarHBondContact OD1-N 3.15Å
429G41.3Very low40.8Very low76 Ų76166.1 Ų166.178%0.78482%0.822SS**  trans1553.9178.800000119.3M431G429-M431 PolarHBondContact O-N 3.34Å
430Y35.2Very low40.5Very low245 Ų245163.7 Ų163.796%0.96182%0.822SS**  trans-80.899.7172.2-75.7-72.9000111.2
431M42.2Very low40Very low174 Ų174162.3 Ų162.386%0.85781%0.807SS**PPolyproline II helixtrans-91.9120.6160.5-91.1-115.456.800109.7G429G429-M431 PolarHBondContact O-N 3.34Å
432K40Very low39.9Very low153 Ų153161.3 Ų161.367%0.66580%0.803SS**PPolyproline II helixtrans-69124.2170.5173.8-165.6177-140.20108.7E434K432-E434 IonicContact NZ-OE2 3.89Å; K432-E434 PolarHBondContact NZ-OE2 3.09Å
433L45.9Very low39.1Very low176 Ų176160.4 Ų160.492%0.92180%0.799SS**PPolyproline II helixtrans-91.6154.4158-138.183.5000109.3
434E36Very low38.8Very low142 Ų142161 Ų16166%0.66480%0.801SS**  trans-121.1153.1-164.4-166156126.800111.5K432K432-E434 IonicContact NZ-OE2 3.89Å; K432-E434 PolarHBondContact NZ-OE2 3.09Å
435N35.1Very low38.3Very low153 Ų153157.1 Ų157.182%0.81880%0.801SS**  trans-61.3134.3178.1-63.9-23.3000111.2
436K39.6Very low38.1Very low194 Ų194155.7 Ų155.784%0.84380%0.8SS**  trans-146148.1145.9-71.1-155.1173.3-168.50109.7
437E37.4Very low37.9Very low173 Ų173156.7 Ų156.781%0.80880%0.8SS**  trans-80.7173.9-173-61.591.4160.400114.7
438D38.4Very low37.1Very low154 Ų154157 Ų15782%0.82480%0.796SS**  trans-60-178.3175.8-55.7-79.1000114.3
439P49.1Very low36.7Very low118 Ų118151.9 Ų151.977%0.76679%0.791SS**  cis-132.7170.9-3.340.5-25.2000115.7
440M33.2Very low36.8Very low173 Ų173155.4 Ų155.485%0.85279%0.79SS**  trans-156.4149.9134.6-115.8-54.5-6900114
441D33Very low37.3Very low105 Ų105152.5 Ų152.556%0.56178%0.783SS**  trans-86.5162.6-165.3-179.833000115
442R32.5Very low38Very low205 Ų205151.7 Ų151.777%0.77477%0.774SS**  trans73.3133.3170.2-40.3-176.8-176.1175-3.6115.3
443L29.7Very low38.4Very low150 Ų150151.1 Ų151.179%0.78578%0.779SS**  cis-149.4154.842.5-82.1163.8000115
444L31.7Very low39.4Very low159 Ų159147 Ų14783%0.83275%0.753SS**  trans59.997.9151.7-71.7164.1000120.1
445V31.5Very low41.4Very low133 Ų133143.5 Ų143.581%0.80674%0.741SS**  trans-75.9136.2162.1168.40000112
446P33.9Very low43Very low121 Ų121142 Ų14279%0.78673%0.733SS**  trans-98.9118150.4-1230.8000112.4
447Q33Very low44.6Very low171 Ų171140.2 Ų140.280%0.79973%0.726SS**  trans5.4117.7164.5-66.9-68.5-9.600119.4A449Q447-A449 PolarHBondContact O-N 3.06Å
448V35.3Very low46.1Very low124 Ų124136 Ų13675%0.75271%0.706SS**  trans-64.7121.4159.9174.70000109.1I450V448-I450 PolarHBondContact O-N 2.97Å
449A37.6Very low47.8Very low91 Ų91133 Ų13375%0.75269%0.686SS**  trans-62.5111.4175.500000110.7Q447 K451Q447-A449 PolarHBondContact O-N 3.06Å; A449-K451 PolarHBondContact O-N 3.39Å; A449-K451 VanDerWaalsContact O-N 3.09Å
450I42Very low48.8Very low149 Ų149133.1 Ų133.176%0.76468%0.679SS**  trans-60.9114.7-178-62.3172.2000109.4V448 K452V448-I450 PolarHBondContact O-N 2.97Å; I450-K452 VanDerWaalsContact C-N 3.29Å; I450-K452 PolarHBondContact O-N 2.87Å
451K45.9Very low50.5Low185 Ų185130.6 Ų130.680%0.80467%0.668SS**  trans-73.880178.7-163.3-177-175.2-171.70110A449 D453A449-K451 PolarHBondContact O-N 3.39Å; A449-K451 VanDerWaalsContact O-N 3.09Å; K451-D453 PolarHBondContact O-N 3.39Å
452K56.5Low52.2Low157 Ų157130.6 Ų130.668%0.68367%0.667SS**  trans-67.1121.2173-99.3-177.6173.3179.30110I450 F454I450-K452 VanDerWaalsContact C-N 3.29Å; I450-K452 PolarHBondContact O-N 2.87Å; K452-F454 HydrophobicContact CB-CE2 4.34Å; K452-F454 HydrophobicContact CB-CZ 4.4Å; K452-F454 WeakPolarHBondContact O-CD2 3.2Å; K452-F454 PolarHBondContact O-N 2.85Å
453D49Very low53.6Low141 Ų141125.4 Ų125.475%0.75465%0.653SS**  trans-76.886.8176.4-75-49.3000111.3K451 T455K451-D453 PolarHBondContact O-N 3.39Å; D453-T455 PolarHBondContact O-N 3.3Å
454F67.8Low54.9Low90 Ų90122.4 Ų122.440%0.39565%0.645SS.*  trans-57.4120.7175.9-67.2-77000111.4K452 E458 K459 M462K452-F454 HydrophobicContact CB-CE2 4.34Å; K452-F454 HydrophobicContact CB-CZ 4.4Å; K452-F454 WeakPolarHBondContact O-CD2 3.2Å; K452-F454 PolarHBondContact O-N 2.85Å; F454-E458 HydrophobicContact CD1-CG 4.19Å; F454-K459 HydrophobicContact CB-CG 4.18Å; F454-K459 WeakPolarHBondContact O-CE 3.29Å; F454-K459 PolarHBondContact O-NZ 3.42Å; F454-M462 HydrophobicContact CD1-CE 4.42Å; F454-M462 HydrophobicContact CG-CE 4.39Å
455T76.3Confident56Low67 Ų67125.1 Ų125.141%0.41164%0.644SS.*  trans-67.4152.1179.863.30000111.1D453 K457 E458 K459D453-T455 PolarHBondContact O-N 3.3Å; T455-K457 PolarHBondContact O-N 3.13Å; T455-K457 VanDerWaalsContact O-N 3.13Å; T455-K457 VanDerWaalsContact OG1-CE 3.29Å; T455-K457 WeakPolarHBondContact OG1-CE 3.33Å; T455-K457 WeakPolarHBondContact OG1-CG 3.48Å; T455-E458 WeakPolarHBondContact O-CA 3.09Å; T455-E458 WeakPolarHBondContact O-CB 3.37Å; T455-E458 PolarHBondContact O-N 3.1Å; T455-K459 PolarHBondContact O-N 3.28Å; T455-K459 VanDerWaalsContact O-N 3.16Å
456N69.9Low56.9Low121 Ų121122.8 Ų122.865%0.64763%0.633SS**Hα-helixtrans-59.1-31.6-172.9-76.1-10.9000114E458 K459 L460N456-E458 VanDerWaalsContact C-N 3.27Å; N456-E458 PolarHBondContact O-N 3.24Å; N456-K459 PolarHBondContact O-N 3.36Å; N456-L460 PolarHBondContact O-N 3.38Å
457K72.4Confident57.7Low157 Ų157123.8 Ų123.868%0.68363%0.627SS**Hα-helixtrans-60-34.2172.157178.2-179.1178.80113.5T455 L461T455-K457 PolarHBondContact O-N 3.13Å; T455-K457 VanDerWaalsContact O-N 3.13Å; T455-K457 VanDerWaalsContact OG1-CE 3.29Å; T455-K457 WeakPolarHBondContact OG1-CE 3.33Å; T455-K457 WeakPolarHBondContact OG1-CG 3.48Å; K457-L461 WeakPolarHBondContact O-CG 3.5Å; K457-L461 PolarHBondContact O-N 2.88Å
458E70.3Confident58.5Low84 Ų84122 Ų12239%0.39362%0.623SS.*Hα-helixtrans-81.7-36.4-178.2-161.5172.7178.600111.2F454 T455 N456 L461 M462F454-E458 HydrophobicContact CD1-CG 4.19Å; T455-E458 WeakPolarHBondContact O-CA 3.09Å; T455-E458 WeakPolarHBondContact O-CB 3.37Å; T455-E458 PolarHBondContact O-N 3.1Å; N456-E458 VanDerWaalsContact C-N 3.27Å; N456-E458 PolarHBondContact O-N 3.24Å; E458-L461 PolarHBondContact O-N 3.37Å; E458-M462 PolarHBondContact O-N 3.16Å
459K73.6Confident58.8Low93 Ų93123.6 Ų123.640%0.40463%0.628SS.*Hα-helixtrans-60.7-43.4169.2-68.2170.9175.7147.30111.9F454 T455 N456 M462 I463F454-K459 HydrophobicContact CB-CG 4.18Å; F454-K459 WeakPolarHBondContact O-CE 3.29Å; F454-K459 PolarHBondContact O-NZ 3.42Å; T455-K459 PolarHBondContact O-N 3.28Å; T455-K459 VanDerWaalsContact O-N 3.16Å; N456-K459 PolarHBondContact O-N 3.36Å; K459-M462 HydrophobicContact CG-CE 4.29Å; K459-M462 PolarHBondContact O-N 3.02Å; K459-I463 WeakPolarHBondContact O-CG1 3.39Å; K459-I463 PolarHBondContact O-N 3.2Å; K459-I463 VanDerWaalsContact O-N 3.1Å
460L69Low59.4Low119 Ų119127 Ų12762%0.62363%0.632SS**Hα-helixtrans-60.8-41.6174-81.3161.5000112.5N456 I463 S464N456-L460 PolarHBondContact O-N 3.38Å; L460-I463 PolarHBondContact O-N 2.9Å; L460-S464 WeakPolarHBondContact O-CB 3.22Å; L460-S464 PolarHBondContact O-N 3.03Å
461L68.5Low59.4Low120 Ų120124.6 Ų124.663%0.62863%0.629SS**Hα-helixtrans-65.5-35.2176-79.9164.1000113.4K457 E458 R465K457-L461 WeakPolarHBondContact O-CG 3.5Å; K457-L461 PolarHBondContact O-N 2.88Å; E458-L461 PolarHBondContact O-N 3.37Å; L461-R465 PolarHBondContact O-N 3.11Å
462M69Low59.4Low106 Ų106125.4 Ų125.452%0.52263%0.633SS.*Hα-helixtrans-66.7-43.8173.7-71.9-173.3-73.200111.9F454 E458 K459 R465F454-M462 HydrophobicContact CD1-CE 4.42Å; F454-M462 HydrophobicContact CG-CE 4.39Å; E458-M462 PolarHBondContact O-N 3.16Å; K459-M462 HydrophobicContact CG-CE 4.29Å; K459-M462 PolarHBondContact O-N 3.02Å; M462-R465 PolarHBondContact O-N 2.91Å
463I63.5Low58.9Low95 Ų95126 Ų12649%0.48764%0.638SS.*Hα-helixtrans-65.5-42.2177.1-63.8162.5000111.1K459 L460 R465 S466 H467K459-I463 WeakPolarHBondContact O-CG1 3.39Å; K459-I463 PolarHBondContact O-N 3.2Å; K459-I463 VanDerWaalsContact O-N 3.1Å; L460-I463 PolarHBondContact O-N 2.9Å; I463-R465 PolarHBondContact O-N 3.17Å; I463-R465 VanDerWaalsContact O-N 3.11Å; I463-S466 PolarHBondContact O-N 3.42Å; I463-S466 VanDerWaalsContact O-N 3.17Å; I463-S466 PolarHBondContact O-OG 3.28Å; I463-H467 PolarHBondContact O-CD2 3.45Å; I463-H467 VanDerWaalsContact O-CD2 3.28Å
464S56.5Low58.6Low88 Ų88127.3 Ų127.362%0.61564%0.639SS**Hα-helixtrans-61.8-21.5179.8-170.50000113.7L460L460-S464 WeakPolarHBondContact O-CB 3.22Å; L460-S464 PolarHBondContact O-N 3.03Å
465R53.4Low57.4Low215 Ų215130.1 Ų130.181%0.81166%0.658SS**Hα-helixtrans-87.4-18.6178-88.3-177.5165158.9-3.5114.6L461 M462 I463L461-R465 PolarHBondContact O-N 3.11Å; M462-R465 PolarHBondContact O-N 2.91Å; I463-R465 PolarHBondContact O-N 3.17Å; I463-R465 VanDerWaalsContact O-N 3.11Å
466S52.4Low56Low84 Ų84134.9 Ų134.959%0.58768%0.676SS**Hα-helixtrans-81.8-11.7-177.148.60000115I463I463-S466 PolarHBondContact O-N 3.42Å; I463-S466 VanDerWaalsContact O-N 3.17Å; I463-S466 PolarHBondContact O-OG 3.28Å
467H50.3Low54.8Low142 Ų142137.9 Ų137.966%0.65768%0.683SS**THydrogen-bonded Turntrans-91.31.8-174.2-70.3-70.5000115.4I463I463-H467 PolarHBondContact O-CD2 3.45Å; I463-H467 VanDerWaalsContact O-CD2 3.28Å
468N48.4Very low53.5Low133 Ų133137.7 Ų137.771%0.71169%0.689SS**SBendtrans-100.910.4-165.9-135.757.2000115.6
469N43.4Very low52.4Low158 Ų158137.9 Ų137.985%0.84570%0.699SS**SBendtrans-121.822.8-174.4-70-25.7000113.4
470L48.3Very low50.9Low163 Ų163140.1 Ų140.185%0.85372%0.716SS**SBendtrans-139.535.2-169.4-134.6172000112.9
471S42.5Very low49.7Very low98 Ų98141.9 Ų141.969%0.68573%0.726SS**SBendtrans-142.936.7-173.671.50000114
472F45.6Very low48.7Very low203 Ų203144.3 Ų144.389%0.8974%0.739SS**SBendtrans-13913.3-178.1-135.7-92.3000115.8
473E46Very low47.4Very low170 Ų170148.7 Ų148.779%0.79476%0.755SS**SBendtrans-121.819.1-178.7-66.5-176.211800113.6
474H42.9Very low46.2Very low168 Ų168155.5 Ų155.578%0.77877%0.774SS**SBendtrans-123.6-4.8-173.9-82.83.4000116.5
475D44.1Very low45.4Very low149 Ų149155 Ų15580%0.79778%0.783SS**SBendtrans-93.4-17.7179.8-79.7-44000114.9
476E46.8Very low44.8Very low167 Ų167150.9 Ų150.978%0.7878%0.782SS**G310 helixtrans-77.3-23.7-175-64.3-160141.300114.5L478 S479E476-L478 PolarHBondContact O-N 3.39Å; E476-S479 PolarHBondContact O-OG 3.31Å
477F43.4Very low44.3Very low184 Ų184152.3 Ų152.381%0.80779%0.792SS**G310 helixtrans-84.1-2.8-171.1-75.4-78.1000115.9
478L44.5Very low43.8Very low153 Ų153154.9 Ų154.980%0.80180%0.804SS**G310 helixtrans-101.8-3.4-175.6-75.6172000115.3E476E476-L478 PolarHBondContact O-N 3.39Å
479S47.3Very low43.7Very low87 Ų87153.9 Ų153.961%0.60880%0.803SS**SBendtrans-82.2-27.6-172.556.40000115.3E476E476-S479 PolarHBondContact O-OG 3.31Å
480N43.7Very low43.6Very low141 Ų141156.4 Ų156.475%0.75480%0.801SS**SBendtrans-96.410.8-158.8-77.3-36.9000117.1
481N43.1Very low43Very low156 Ų156160.2 Ų160.283%0.83481%0.811SS**SBendtrans-127.728.3-172.3-100.1-74.9000116.4
482L46.9Very low43Very low170 Ų170163.4 Ų163.489%0.8982%0.817SS**  trans-149.470.8173.3-155.278.5000116.7
483K41.6Very low42.9Very low198 Ų198161.3 Ų161.386%0.86181%0.813SS**  trans-144.1103.1145.1-147.4170.2-173.8-179.10114.1
484R38.1Very low42.7Very low239 Ų239160.8 Ų160.890%0.90281%0.814SS**  trans-67.5140.5167.8-157.3175.8-159153.55108.9
485G40.9Very low42.7Very low77 Ų77160.4 Ų160.479%0.79482%0.817SS**  trans-65.8144.6-172.300000114.6
486T41.2Very low42.6Very low129 Ų129161.1 Ų161.179%0.79182%0.818SS**  trans-129.4106.6163.748.90000107.6E488T486-E488 PolarHBondContact O-N 3.46Å
487S40.4Very low42.3Very low113 Ų113160.7 Ų160.779%0.7982%0.82SS**  trans-73.7115.4174.651.60000109.9
488E40.3Very low42.2Very low196 Ų196159 Ų15992%0.91682%0.821SS**  trans-81.1133.5172.7-170.6162.5-150.300109.9T486T486-E488 PolarHBondContact O-N 3.46Å
489T46.5Very low42Very low113 Ų113159.5 Ų159.569%0.69382%0.823SS**  trans-139125.1-176.757.40000111.3
490R40.6Very low41.6Very low210 Ų210165.5 Ų165.579%0.79284%0.841SS**  trans66.2153.3170.9-86.1168.7158.5167.2-5.5115.8
491F36Very low41.4Very low244 Ų244167.7 Ų167.7100%1.0785%0.849SS**  cis-123.705.2-105.7-73.2000111.8

Retrieved 491 of 491 residues in 1531.9 ms (Link to these results)