A0A024RCU2_HUMAN Loading...

GPANK1

AlphaFold DB (O95872), UniProt , Accession A0A024RCU2, Species HUMAN (Homo sapiens, Human), Gene n/a, Length 356 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
1M42Very low58.7Low248 Ų248163.2 Ų163.2100%1.22287%0.869SS**  089.70-69.4-66.1161.600108.1
2S50.2Low58.9Low128 Ų128158 Ų15890%0.89587%0.866SS**  trans-123.9118-179.2-126.90000109
3R55.8Low59.2Low237 Ų237156.6 Ų156.689%0.89487%0.865SS**PPolyproline II helixtrans-82.3144.6-179.7-75.5176.2157.4176.4-6.4110.3
4P53.3Low59.5Low125 Ų125155.9 Ų155.981%0.81286%0.86SS**PPolyproline II helixtrans-78.3139.9176.632.7-31.4000110.8
5L57.9Low59.3Low175 Ų175152.6 Ų152.692%0.91685%0.848SS**PPolyproline II helixtrans-73.4125.3-179.6-70.4160000110.8
6L57.7Low59.2Low165 Ų165149.4 Ų149.486%0.86484%0.839SS**PPolyproline II helixtrans-71.3135.8169.1-84.6143.4000110.1T8L6-T8 PolarHBondContact O-N 2.86Å
7I69.3Low59Low148 Ų148149.3 Ų149.376%0.75984%0.837SS**PPolyproline II helixtrans-61.7121.5177-61.4164.9000109.5F9I7-F9 HydrophobicContact CG2-CD2 4.46Å; I7-F9 HydrophobicContact CG2-CE2 4.16Å
8T59Low59Low129 Ų129146.3 Ų146.379%0.79182%0.818SS**PPolyproline II helixtrans-100.5127.5170.252.50000110L6L6-T8 PolarHBondContact O-N 2.86Å
9F64.7Low58.8Low192 Ų192147.8 Ų147.884%0.84281%0.81SS**PPolyproline II helixtrans-87.9124.4173.9-75.7-88.6000110.8I7I7-F9 HydrophobicContact CG2-CD2 4.46Å; I7-F9 HydrophobicContact CG2-CE2 4.16Å
10T65.6Low59Low135 Ų135148.1 Ų148.183%0.82880%0.802SS**PPolyproline II helixtrans-85.8128.1169.527.20000110.8
11P70.1Confident59.2Low113 Ų113148.6 Ų148.673%0.73481%0.805SS**PPolyproline II helixtrans-67.1142.6175.3-15.228.4000112.2T13P11-T13 PolarHBondContact O-N 2.67Å
12A61.6Low60.2Low101 Ų101139.9 Ų139.984%0.83578%0.778SS**PPolyproline II helixtrans-64.6128175.500000111
13T62.9Low60.4Low140 Ų140141 Ų14186%0.85977%0.769SS**  trans-97.2-10.7-174.5-35.70000113.1P11P11-T13 PolarHBondContact O-N 2.67Å
14D63.4Low60.5Low147 Ų147136.3 Ų136.379%0.78676%0.758SS**SBendtrans-110.9129.8-177.1-111-27000112.3S16D14-S16 PolarHBondContact O-N 2.98Å; D14-S16 VanDerWaalsContact O-N 3.08Å
15P56.2Low60.6Low106 Ų106137 Ų13769%0.68875%0.75SS**  trans-79.490.9178.932.2-30.6000109.4D17P15-D17 PolarHBondContact O-N 3.05Å
16S56.8Low60.4Low101 Ų101134.6 Ų134.671%0.70675%0.745SS**  trans-79.8110.7165.660.90000109.5D14 L18D14-S16 PolarHBondContact O-N 2.98Å; D14-S16 VanDerWaalsContact O-N 3.08Å; S16-L18 PolarHBondContact O-N 2.98Å
17D56.1Low60Low148 Ų148134 Ų13479%0.79174%0.738SS**THydrogen-bonded Turntrans-60.141.4-167.5-67.6-49.3000118.4P15P15-D17 PolarHBondContact O-N 3.05Å
18L59.2Low58.7Low95 Ų95132.5 Ų132.550%0.49774%0.738SS.*THydrogen-bonded Turntrans-116.2-7.9-180-66.9173.1000114.6S16S16-L18 PolarHBondContact O-N 2.98Å
19W55.9Low58Low175 Ų175135.8 Ų135.866%0.66374%0.744SS**EExtended strand (participates in β ladder)trans-137.2114-175.7-84.162.3000109.9
20K61.5Low57Low153 Ų153135.8 Ų135.867%0.66574%0.744SS**EExtended strand (participates in β ladder)trans-125.4135.3167.2-95.5-169.5174.6-1700108.5G22 Q23K20-G22 VanDerWaalsContact C-N 3.3Å; K20-G22 PolarHBondContact O-N 3.43Å; K20-Q23 PolarHBondContact N-O 3.26Å; K20-Q23 PolarHBondContact O-N 3.25Å; K20-Q23 VanDerWaalsContact O-N 3.12Å; K20-Q23 VanDerWaalsContact O-O 3.05Å
21D63.1Low56Low160 Ų160135.6 Ų135.686%0.85675%0.745SS**THydrogen-bonded Turntrans54.638.9171.9-52.6-43.3000115.1Q23D21-Q23 PolarHBondContact O-N 2.89Å
22G64.4Low55Low64 Ų64139 Ų13966%0.6675%0.751SS**THydrogen-bonded Turntrans70.110.4177.200000114.7K20K20-G22 VanDerWaalsContact C-N 3.3Å; K20-G22 PolarHBondContact O-N 3.43Å
23Q54.4Low54.6Low151 Ų151139.4 Ų139.471%0.70675%0.748SS**EExtended strand (participates in β ladder)trans-123.8140.5174.2-62.7-152.6-600112K20 D21K20-Q23 PolarHBondContact N-O 3.26Å; K20-Q23 PolarHBondContact O-N 3.25Å; K20-Q23 VanDerWaalsContact O-N 3.12Å; K20-Q23 VanDerWaalsContact O-O 3.05Å; D21-Q23 PolarHBondContact O-N 2.89Å
24Q56.8Low54Low140 Ų140139.6 Ų139.665%0.65475%0.749SS**EExtended strand (participates in β ladder)trans-85.1124.3176-171.7176.49.500109
25Q55.9Low53.9Low138 Ų138140.2 Ų140.265%0.64575%0.751SS**PPolyproline II helixtrans-75.6139.4177-77.2-170.2-13.600111.6
26P53.6Low54.8Low126 Ų126140.7 Ų140.782%0.81875%0.748SS**PPolyproline II helixtrans-75.3139.8176.929.3-31.5000111.9
27Q48.7Very low55.9Low151 Ų151138.4 Ų138.471%0.70674%0.741SS**PPolyproline II helixtrans-82.9152179.5-75.2-137.5-9.400113.3
28P43.7Very low57.1Low118 Ų118134.3 Ų134.377%0.76673%0.727SS**PPolyproline II helixtrans-79121.8172.731.6-30.1000111
29E42.8Very low58.1Low197 Ų197132.8 Ų132.892%0.92173%0.728SS**PPolyproline II helixtrans-74.1128.9179.6-59.1-171.1-177.900111.7
30K45.4Very low59.2Low193 Ų193127 Ų12784%0.83972%0.718SS**PPolyproline II helixtrans-90.5145.2168.5-83.7177.8177.21750109.6E32K30-E32 PolarHBondContact O-N 3.3Å
31P43.2Very low60.3Low131 Ų131127.6 Ų127.685%0.85172%0.716SS**PPolyproline II helixtrans-74.5127.6-167.330.4-33.2000111.6
32E49.9Very low61.3Low184 Ų184122.8 Ų122.886%0.8670%0.698SS**PPolyproline II helixtrans-73.5135.8171.8-66-167.9153.900110.8K30 T34K30-E32 PolarHBondContact O-N 3.3Å; E32-T34 PolarHBondContact O-N 3.47Å
33S53.9Low62.3Low109 Ų109125.7 Ų125.776%0.76269%0.693SS**  trans-63.8113.5175.550.90000110.8L35S33-L35 PolarHBondContact O-N 2.94Å
34T48.4Very low63.6Low144 Ų144125.7 Ų125.788%0.88369%0.687SS**  trans-66.989.617630000111E32E32-T34 PolarHBondContact O-N 3.47Å
35L62.6Low65.2Low161 Ų161124 Ų12484%0.84368%0.679SS**  trans-84.3105.2157-77.2169000107.5S33 G37S33-L35 PolarHBondContact O-N 2.94Å; L35-G37 PolarHBondContact O-N 3.04Å
36D75Confident66.6Low116 Ų116120.2 Ų120.262%0.6267%0.672SS**  trans-61.5129.3179.8-174.210.6000110.6A38 A39D36-A38 PolarHBondContact O-N 2.91Å; D36-A39 WeakPolarHBondContact O-CB 3.46Å; D36-A39 PolarHBondContact O-N 3.12Å
37G78.7Confident67.9Low53 Ų53118.6 Ų118.655%0.54666%0.656SS.*Hα-helixtrans-60-21.5-176.400000113.5L35 R41L35-G37 PolarHBondContact O-N 3.04Å; G37-R41 PolarHBondContact O-N 3.14Å; G37-R41 VanDerWaalsContact O-N 3.13Å
38A82Confident69.4Low62 Ų62117.1 Ų117.151%0.51265%0.652SS.*Hα-helixtrans-64.9-39.2172.300000112.7D36 R41 A42D36-A38 PolarHBondContact O-N 2.91Å; A38-R41 PolarHBondContact O-N 3.04Å; A38-A42 PolarHBondContact O-N 3.31Å
39A81.2Confident70.9Confident63 Ų63113.2 Ų113.252%0.52163%0.633SS.*Hα-helixtrans-69.5-38.9178.900000111.7D36 R41 A42 F43D36-A39 WeakPolarHBondContact O-CB 3.46Å; D36-A39 PolarHBondContact O-N 3.12Å; A39-R41 VanDerWaalsContact C-N 3.35Å; A39-A42 PolarHBondContact O-N 3.05Å; A39-F43 PolarHBondContact O-N 3.02Å
40A78.2Confident71.7Confident53 Ų53110.3 Ų110.344%0.43862%0.624SS.*Hα-helixtrans-63.8-40.2174.700000111.8Y44A40-Y44 WeakPolarHBondContact O-CD2 3.28Å; A40-Y44 PolarHBondContact O-N 3.49Å
41R83.9Confident72.1Confident166 Ų166109.7 Ų109.763%0.62662%0.624SS**Hα-helixtrans-65.7-45.4177.3-175.2178.9176134.87.3112.5G37 A38 A39 F43 Y44 E45G37-R41 PolarHBondContact O-N 3.14Å; G37-R41 VanDerWaalsContact O-N 3.13Å; A38-R41 PolarHBondContact O-N 3.04Å; A39-R41 VanDerWaalsContact C-N 3.35Å; R41-F43 VanDerWaalsContact C-N 3.29Å; R41-F43 PolarHBondContact O-N 3.36Å; R41-Y44 PolarHBondContact O-N 2.92Å; R41-E45 HydrophobicContact CG-CG 4.42Å; R41-E45 IonicContact CZ-OE1 3.08Å; R41-E45 IonicContact NE-OE1 2.95Å; R41-E45 PolarHBondContact NE-OE1 2.95Å; R41-E45 IonicContact NH2-OE1 2.66Å; R41-E45 PolarHBondContact NH2-OE1 2.96Å; R41-E45 PolarHBondContact O-N 3.14Å
42A85.8Confident72.6Confident58 Ų58108.1 Ų108.148%0.47962%0.616SS.*Hα-helixtrans-61-37.5179.800000112.4A38 A39 A46A38-A42 PolarHBondContact O-N 3.31Å; A39-A42 PolarHBondContact O-N 3.05Å; A42-A46 WeakPolarHBondContact O-CB 3.09Å; A42-A46 PolarHBondContact O-N 2.93Å
43F83.8Confident72.2Confident126 Ų126104.1 Ų104.155%0.55361%0.609SS**Hα-helixtrans-62.4-47.3176.1174.7-103000112.6A39 R41 A46 L47A39-F43 PolarHBondContact O-N 3.02Å; R41-F43 VanDerWaalsContact C-N 3.29Å; R41-F43 PolarHBondContact O-N 3.36Å; F43-A46 PolarHBondContact O-N 2.94Å; F43-L47 HydrophobicContact CD1-CD1 3.94Å; F43-L47 HydrophobicContact CD2-CD1 4.38Å; F43-L47 HydrophobicContact CE1-CD1 3.37Å; F43-L47 HydrophobicContact CE2-CD1 3.88Å; F43-L47 HydrophobicContact CG-CD1 4.41Å; F43-L47 HydrophobicContact CZ-CD1 3.35Å; F43-L47 PolarHBondContact O-N 3.16Å
44Y83Confident71.7Confident151 Ų151103 Ų10359%0.59261%0.606SS**Hα-helixtrans-70.9-35.7179.5-73.2-65.2000112.9A40 R41 A46 L47 I48A40-Y44 WeakPolarHBondContact O-CD2 3.28Å; A40-Y44 PolarHBondContact O-N 3.49Å; R41-Y44 PolarHBondContact O-N 2.92Å; Y44-A46 VanDerWaalsContact C-N 3.33Å; Y44-L47 PolarHBondContact O-N 3.04Å; Y44-I48 WeakPolarHBondContact O-CG1 3.49Å; Y44-I48 PolarHBondContact O-N 3.46Å
45E89Confident71.2Confident103 Ų103102.1 Ų102.148%0.48160%0.602SS.*Hα-helixtrans-65.3-36174.5-76.1178.3175.100111.8R41 I48 G49R41-E45 HydrophobicContact CG-CG 4.42Å; R41-E45 IonicContact CZ-OE1 3.08Å; R41-E45 IonicContact NE-OE1 2.95Å; R41-E45 PolarHBondContact NE-OE1 2.95Å; R41-E45 IonicContact NH2-OE1 2.66Å; R41-E45 PolarHBondContact NH2-OE1 2.96Å; R41-E45 PolarHBondContact O-N 3.14Å; E45-I48 PolarHBondContact O-N 2.97Å; E45-G49 PolarHBondContact O-N 2.97Å
46A85.1Confident70Confident60 Ų60102.6 Ų102.650%0.49661%0.606SS.*Hα-helixtrans-65.7-42.1174.600000112.8A42 F43 Y44 I48 G49 D50A42-A46 WeakPolarHBondContact O-CB 3.09Å; A42-A46 PolarHBondContact O-N 2.93Å; F43-A46 PolarHBondContact O-N 2.94Å; Y44-A46 VanDerWaalsContact C-N 3.33Å; A46-I48 VanDerWaalsContact C-N 3.33Å; A46-I48 PolarHBondContact O-N 3.44Å; A46-G49 PolarHBondContact O-N 3.43Å; A46-D50 PolarHBondContact O-N 3.46Å; A46-D50 VanDerWaalsContact O-N 3.07Å
47L81.7Confident68.1Low92 Ų92102 Ų10248%0.48261%0.611SS.*Hα-helixtrans-61.5-37.9176.7-99.6144.8000113.1F43 Y44F43-L47 HydrophobicContact CD1-CD1 3.94Å; F43-L47 HydrophobicContact CD2-CD1 4.38Å; F43-L47 HydrophobicContact CE1-CD1 3.37Å; F43-L47 HydrophobicContact CE2-CD1 3.88Å; F43-L47 HydrophobicContact CG-CD1 4.41Å; F43-L47 HydrophobicContact CZ-CD1 3.35Å; F43-L47 PolarHBondContact O-N 3.16Å; Y44-L47 PolarHBondContact O-N 3.04Å
48I80.3Confident66.4Low119 Ų119108.3 Ų108.361%0.6163%0.626SS**Hα-helixtrans-76.8-31.1178.3-61.7165.4000111Y44 E45 A46 S52Y44-I48 WeakPolarHBondContact O-CG1 3.49Å; Y44-I48 PolarHBondContact O-N 3.46Å; E45-I48 PolarHBondContact O-N 2.97Å; A46-I48 VanDerWaalsContact C-N 3.33Å; A46-I48 PolarHBondContact O-N 3.44Å; I48-S52 PolarHBondContact O-OG 2.88Å
49G74.9Confident64Low37 Ų37117 Ų11738%0.38165%0.646SS.*Hα-helixtrans-69.5-36.6176.800000114E45 A46 S52E45-G49 PolarHBondContact O-N 2.97Å; A46-G49 PolarHBondContact O-N 3.43Å; G49-S52 PolarHBondContact O-N 2.9Å
50D60.2Low61.9Low135 Ų135118.8 Ų118.872%0.72265%0.654SS**Hα-helixtrans-70.8-32.6179.3-98.3-9.4000113A46 S52 S53A46-D50 PolarHBondContact O-N 3.46Å; A46-D50 VanDerWaalsContact O-N 3.07Å; D50-S52 VanDerWaalsContact C-N 3.25Å; D50-S52 PolarHBondContact O-N 3.02Å; D50-S53 PolarHBondContact O-N 3.41Å
51E53.6Low59.9Low180 Ų180124.9 Ų124.984%0.84167%0.674SS**Hα-helixtrans-73.4-16.6176-68.4-150.9119.200113.6
52S53Low57.5Low99 Ų99122.7 Ų122.769%0.69268%0.679SS**THydrogen-bonded Turntrans-92.2-2.7179.1-57.20000113.4I48 G49 D50I48-S52 PolarHBondContact O-OG 2.88Å; G49-S52 PolarHBondContact O-N 2.9Å; D50-S52 VanDerWaalsContact C-N 3.25Å; D50-S52 PolarHBondContact O-N 3.02Å
53S41.8Very low55.2Low100 Ų100128.3 Ų128.370%0.69970%0.696SS**  trans-10469.7-179-69.30000112.2D50D50-S53 PolarHBondContact O-N 3.41Å
54A42.9Very low53Low85 Ų85127.3 Ų127.370%0.70270%0.701SS**  trans-105.5138.9154.300000108.6D56A54-D56 PolarHBondContact O-N 2.72Å
55P39.5Very low50.5Low125 Ų125124.1 Ų124.181%0.81271%0.707SS**  trans-88.4114.1-155.733.6-31.3000111.7
56D37.1Very low48.1Very low172 Ų172130.4 Ų130.492%0.9273%0.726SS**  trans-105.7126.2159.6-96.4-33.5000110.4A54A54-D56 PolarHBondContact O-N 2.72Å
57S35.1Very low45.8Very low104 Ų104134.1 Ų134.173%0.72773%0.733SS**  trans-81.6149-171.9-65.90000111.8
58Q41.9Very low43.9Very low185 Ų185139.5 Ų139.586%0.86475%0.747SS**  trans82.997.3164.9-50.5-169.8-27.100115.8
59R32.6Very low42Very low243 Ų243141.4 Ų141.492%0.91775%0.751SS**  55.7111.380.5-162.8171.3-168.5-172.83.6110
60S37.1Very low40.3Very low101 Ų101149.5 Ų149.571%0.70677%0.77SS**  cis-169.4137.947.439.90000112.9
61Q34.6Very low39.3Very low182 Ų182150.1 Ų150.185%0.8577%0.766SS**  trans25.9134.2140.1-46.1-164.43.200118.9
62T34.4Very low38.5Very low119 Ų119149.2 Ų149.273%0.7376%0.759SS**  -175.6127.969.2-62.70000111.8
63E37.9Very low37.7Very low177 Ų177152.9 Ų152.983%0.82776%0.758SS**  trans51.6148.1144.8-63.4-69.2113.800125.7
64P36.3Very low37.5Very low104 Ų104157 Ų15768%0.67576%0.758SS**  trans-120.2-178.9-168.938.3-18.8000115.8
65A32.4Very low37.3Very low85 Ų85158.9 Ų158.970%0.70276%0.755SS**  trans85.5116.5150.100000120
66R38.4Very low37.1Very low234 Ų234160.7 Ų160.788%0.88376%0.755SS**  162.2105.6111.8-86172178.7-157.6-0.2109.1
67E36.5Very low36.9Very low139 Ų139162.3 Ų162.365%0.6575%0.753SS**  63.3111.198.9-148.6-16915200114.6
68R41.9Very low36.9Very low205 Ų205161.6 Ų161.677%0.77475%0.754SS**  166.1115114.3-87.6172.7173.1-161.9-1.3114.3
69K39.9Very low36.7Very low158 Ų158158.6 Ų158.669%0.68775%0.751SS**  57.2113.3123.2-66-179.3-176.8173.90120.7
70R39.4Very low36.7Very low207 Ų207151.7 Ų151.778%0.78175%0.746SS**  75125.6118.5-90.2-178.2160.5-171.9-1.7120.3
71K38.4Very low36.4Very low148 Ų148151.1 Ų151.164%0.64375%0.747SS**  108.9111.7123.1-87.7175.1178.41790117.3
72K37.5Very low36.3Very low162 Ų162151.7 Ų151.770%0.70475%0.75SS**  79.7115.4123.7-83.8-176.1166.4-179.80118.7
73R36.2Very low36.3Very low176 Ų176150.9 Ų150.966%0.66476%0.755SS**  91.9119.9119.4-78.2176114.2-172.94.7117.7
74R36.8Very low36.3Very low187 Ų187149.5 Ų149.571%0.70676%0.758SS**  93.1118.6124.7-86.9-174.5158.6-174.9-4.7116.9
75I38.8Very low36.3Very low124 Ų124149.1 Ų149.164%0.63676%0.764SS**  96.7109.1124.3-70.7171.4000116.2
76M35Very low36.3Very low162 Ų162154.6 Ų154.680%0.79878%0.775SS**  trans90.8131.2137.5-62.6-84.816600120.5
77K33Very low36.1Very low206 Ų206147.2 Ų147.290%0.89677%0.771SS**  trans84.6119.9148-90.3175.6168179.30119.3
78A35.3Very low36.4Very low90 Ų90145.5 Ų145.574%0.74478%0.781SS**  trans-56-173.6171.800000115.2
79P38.8Very low36.1Very low122 Ų122142 Ų14279%0.79279%0.788SS**  cis-126.2-179.1-44.629.8-11.6000111.3
80A31.7Very low35.9Very low98 Ų98137.9 Ų137.981%0.8179%0.791SS**  trans120.7128.9153.200000116.6
81A31.8Very low36.2Very low89 Ų89138.6 Ų138.674%0.73679%0.793SS**  trans68.1108148.500000119.7
82E31.6Very low36.2Very low194 Ų194141 Ų14191%0.90781%0.806SS**  52.8100.5127.8-57.8-167.614800118.4
83A35.8Very low36.5Very low101 Ų101136.5 Ų136.584%0.83581%0.806SS**  trans-153.1115.2144.700000110.8
84V36.7Very low36.8Very low148 Ų148135.2 Ų135.290%0.89781%0.808SS**  trans-53.3129.3169178.20000110.9
85A37.3Very low37.2Very low97 Ų97128.6 Ų128.680%0.80280%0.798SS**  trans-166.8120148.700000110.9
86E31.9Very low37.7Very low200 Ų200133.6 Ų133.694%0.93581%0.808SS**  trans-62.4155.7174.3-61.7-179.7132.800113.2
87G33.6Very low38.8Very low78 Ų78129 Ų12980%0.80479%0.793SS**  trans137.890.6155.300000114.7
88A43.4Very low40.3Very low103 Ų103124.1 Ų124.185%0.85178%0.775SS**  trans173.293.7135.500000111
89S36Very low42Very low133 Ų133125.2 Ų125.293%0.9377%0.765SS**  trans-25.2138.1154.4-160.80000116.1
90G36Very low43.8Very low71 Ų71122.2 Ų122.273%0.73275%0.751SS**  trans118.545.1147.900000119.9
91R45.8Very low45.9Very low221 Ų221122.6 Ų122.683%0.83474%0.736SS**  trans-165.543157.7-144.9170.6-179.1-166.1-2.2114.8G93R91-G93 PolarHBondContact O-N 2.82Å
92H36.8Very low48.3Very low199 Ų199123 Ų12392%0.92173%0.726SS**  trans-90.393.8-176.3-88.444.8000111.6
93G43.8Very low51Low68 Ų68119.9 Ų119.970%0.70171%0.709SS**SBendtrans-166.1-32.917100000115.1R91R91-G93 PolarHBondContact O-N 2.82Å
94Q43.4Very low53.5Low149 Ų149118.7 Ų118.770%0.69669%0.687SS**SBendtrans-110-23.4-174.9-70.3176.6-18.500114.6R96Q94-R96 PolarHBondContact O-N 2.97Å
95G45.2Very low56.1Low48 Ų48112.9 Ų112.950%0.49565%0.652SS.*Hα-helixtrans-70.7-26.1-176.800000114.8E99G95-E99 WeakPolarHBondContact O-CG 3.41Å
96R48.1Very low58.7Low228 Ų228113.3 Ų113.386%0.8664%0.637SS**Hα-helixtrans-72.6-29.8-179.1-99-179.2149.2-170.5-6.1113.7Q94 A100Q94-R96 PolarHBondContact O-N 2.97Å; R96-A100 PolarHBondContact O-N 3.06Å
97S59.6Low61.7Low67 Ų67110.6 Ų110.647%0.46962%0.618SS.*Hα-helixtrans-72-44.2-179.1-157.40000111.1E99 A100 E101S97-E99 PolarHBondContact O-N 3.25Å; S97-A100 PolarHBondContact O-N 2.62Å; S97-E101 WeakPolarHBondContact O-CG 3.47Å; S97-E101 PolarHBondContact O-N 3.06Å
98L62.9Low64.6Low102 Ų102106.9 Ų106.953%0.53458%0.58SS.*Hα-helixtrans-62.6-44.9-178.7-62.1175.7000111.7A100 E101 D102L98-A100 VanDerWaalsContact C-N 3.26Å; L98-A100 PolarHBondContact O-N 3.2Å; L98-E101 PolarHBondContact O-N 3.3Å; L98-D102 WeakPolarHBondContact O-CB 3.15Å; L98-D102 VanDerWaalsContact O-CG 3.27Å; L98-D102 PolarHBondContact O-N 3.39Å
99E72.1Confident67Low114 Ų114102.6 Ų102.653%0.53354%0.543SS..Hα-helixtrans-63.3-31.2177.5-67.7-72.8147.200113.1G95 S97 K103G95-E99 WeakPolarHBondContact O-CG 3.41Å; S97-E99 PolarHBondContact O-N 3.25Å; E99-K103 WeakPolarHBondContact O-CB 3.48Å; E99-K103 WeakPolarHBondContact O-CD 3.38Å; E99-K103 WeakPolarHBondContact O-CG 3.44Å; E99-K103 PolarHBondContact O-N 3.16Å
100A75.7Confident69.9Low59 Ų59102.5 Ų102.549%0.48852%0.522SS..Hα-helixtrans-75.9-40.5176.700000111.5R96 S97 L98 K103 M104R96-A100 PolarHBondContact O-N 3.06Å; S97-A100 PolarHBondContact O-N 2.62Å; L98-A100 VanDerWaalsContact C-N 3.26Å; L98-A100 PolarHBondContact O-N 3.2Å; A100-K103 PolarHBondContact O-N 3.15Å; A100-M104 WeakPolarHBondContact O-CB 3.49Å; A100-M104 PolarHBondContact O-N 3.26Å
101E75.9Confident72.7Confident105 Ų10599.3 Ų99.349%0.49149%0.489SS..Hα-helixtrans-63.9-40.6174.6-72.9173.3-178.500111.8S97 L98 M104 T105S97-E101 WeakPolarHBondContact O-CG 3.47Å; S97-E101 PolarHBondContact O-N 3.06Å; L98-E101 PolarHBondContact O-N 3.3Å; E101-M104 PolarHBondContact O-N 3.01Å; E101-T105 WeakPolarHBondContact O-CB 3.43Å; E101-T105 PolarHBondContact O-N 2.95Å; E101-T105 PolarHBondContact O-OG1 3.11Å
102D83.1Confident75.1Confident99 Ų9988.8 Ų88.853%0.52945%0.449SS..Hα-helixtrans-66-42177.2-72.2-19000111.4L98 M104 T105 H106L98-D102 WeakPolarHBondContact O-CB 3.15Å; L98-D102 VanDerWaalsContact O-CG 3.27Å; L98-D102 PolarHBondContact O-N 3.39Å; D102-M104 VanDerWaalsContact C-N 3.34Å; D102-M104 PolarHBondContact O-N 3.45Å; D102-T105 PolarHBondContact O-N 3.39Å; D102-H106 WeakPolarHBondContact O-CB 3.28Å; D102-H106 PolarHBondContact O-N 2.92Å
103K87.8Confident77.9Confident128 Ų12884.9 Ų84.956%0.55743%0.431SS*.Hα-helixtrans-63.8-40.5174.3-74.1169.5-170.2176.70111.9E99 A100 R107E99-K103 WeakPolarHBondContact O-CB 3.48Å; E99-K103 WeakPolarHBondContact O-CD 3.38Å; E99-K103 WeakPolarHBondContact O-CG 3.44Å; E99-K103 PolarHBondContact O-N 3.16Å; A100-K103 PolarHBondContact O-N 3.15Å; K103-R107 WeakPolarHBondContact O-CG 3.43Å; K103-R107 PolarHBondContact O-N 3.04Å; K103-R107 VanDerWaalsContact O-N 3.1Å
104M88.4Confident80.4Confident75 Ų7587.1 Ų87.137%0.36942%0.423SS..Hα-helixtrans-64.4-48.5176.1-176.56178.600110.7A100 E101 D102 H106 R107 I108 L123A100-M104 WeakPolarHBondContact O-CB 3.49Å; A100-M104 PolarHBondContact O-N 3.26Å; E101-M104 PolarHBondContact O-N 3.01Å; D102-M104 VanDerWaalsContact C-N 3.34Å; D102-M104 PolarHBondContact O-N 3.45Å; M104-H106 VanDerWaalsContact C-N 3.35Å; M104-H106 PolarHBondContact O-N 3.05Å; M104-R107 WeakPolarHBondContact O-CB 3.47Å; M104-R107 PolarHBondContact O-N 3.36Å; M104-R107 VanDerWaalsContact O-N 3.11Å; M104-I108 HydrophobicContact CG-CD1 4.02Å; M104-I108 WeakPolarHBondContact O-CG1 3.42Å; M104-I108 PolarHBondContact O-N 3.32Å; M104-I108 HydrophobicContact SD-CD1 4.47Å; M104-L123 HydrophobicContact CE-CD2 4.49Å; M104-L123 HydrophobicContact SD-CD2 3.67Å
105T91.6Very high82.8Confident26 Ų2680.9 Ų80.916%0.1640%0.399CS..Hα-helixtrans-55.2-50177.1-62.20000111E101 D102 R107 I108 L109 A138E101-T105 WeakPolarHBondContact O-CB 3.43Å; E101-T105 PolarHBondContact O-N 2.95Å; E101-T105 PolarHBondContact O-OG1 3.11Å; D102-T105 PolarHBondContact O-N 3.39Å; T105-R107 VanDerWaalsContact C-N 3.32Å; T105-R107 PolarHBondContact O-N 2.96Å; T105-I108 PolarHBondContact O-N 2.85Å; T105-L109 HydrophobicContact CG2-CD1 3.92Å; T105-L109 HydrophobicContact CG2-CG 4.4Å; T105-L109 VanDerWaalsContact O-CG 3.3Å; T105-L109 WeakPolarHBondContact O-CG 3.09Å; T105-L109 PolarHBondContact O-N 3.43Å; T105-A138 HydrophobicContact CG2-CB 3.71Å
106H92.6Very high85.2Confident106 Ų10681.4 Ų81.449%0.49139%0.391SS..Hα-helixtrans-62.5-35.6178.5177.6-90.5000113.1D102 M104 R110D102-H106 WeakPolarHBondContact O-CB 3.28Å; D102-H106 PolarHBondContact O-N 2.92Å; M104-H106 VanDerWaalsContact C-N 3.35Å; M104-H106 PolarHBondContact O-N 3.05Å; H106-R110 PolarHBondContact CE1-NH2 3.31Å; H106-R110 VanDerWaalsContact CE1-NH2 3.35Å; H106-R110 WeakPolarHBondContact O-CB 3.44Å; H106-R110 PolarHBondContact O-N 2.99Å
107R93.5Very high87.4Confident143 Ų14373 Ų7354%0.5436%0.362SS..Hα-helixtrans-65.9-43.6173.8-74.7176.3-177.7176.2-0.1112.2K103 M104 T105 R110 A111 L123K103-R107 WeakPolarHBondContact O-CG 3.43Å; K103-R107 PolarHBondContact O-N 3.04Å; K103-R107 VanDerWaalsContact O-N 3.1Å; M104-R107 WeakPolarHBondContact O-CB 3.47Å; M104-R107 PolarHBondContact O-N 3.36Å; M104-R107 VanDerWaalsContact O-N 3.11Å; T105-R107 VanDerWaalsContact C-N 3.32Å; T105-R107 PolarHBondContact O-N 2.96Å; R107-R110 PolarHBondContact O-N 3.12Å; R107-A111 WeakPolarHBondContact O-CB 3.45Å; R107-A111 PolarHBondContact O-N 3.29Å; R107-L123 HydrophobicContact CB-CD1 4.01Å
108I94.3Very high89.1Confident1 Ų174.3 Ų74.31%0.00537%0.37CS..Hα-helixtrans-62.3-45.8177.6-63.2166.9000110.4M104 T105 R110 A111 A112 L120 L123 L124 P146M104-I108 HydrophobicContact CG-CD1 4.02Å; M104-I108 WeakPolarHBondContact O-CG1 3.42Å; M104-I108 PolarHBondContact O-N 3.32Å; M104-I108 HydrophobicContact SD-CD1 4.47Å; T105-I108 PolarHBondContact O-N 2.85Å; I108-R110 PolarHBondContact O-N 3.19Å; I108-A111 PolarHBondContact O-N 3.21Å; I108-A112 WeakPolarHBondContact O-CB 2.92Å; I108-A112 PolarHBondContact O-N 3.18Å; I108-L120 HydrophobicContact CG2-CD2 4.25Å; I108-L123 HydrophobicContact CG1-CB 3.92Å; I108-L123 HydrophobicContact CG1-CD1 3.94Å; I108-L124 HydrophobicContact CD1-CD2 4.26Å; I108-L124 HydrophobicContact CG2-CD2 4.25Å; I108-P146 HydrophobicContact CG2-CB 4.06Å; I108-P146 HydrophobicContact CG2-CG 3.55Å
109L94.8Very high90.5Very high12 Ų1271.6 Ų71.66%0.06335%0.354CS..Hα-helixtrans-63.1-42.3179-66.5173.1000112T105 A112 Q113 D140 W144 T145 P146T105-L109 HydrophobicContact CG2-CD1 3.92Å; T105-L109 HydrophobicContact CG2-CG 4.4Å; T105-L109 VanDerWaalsContact O-CG 3.3Å; T105-L109 WeakPolarHBondContact O-CG 3.09Å; T105-L109 PolarHBondContact O-N 3.43Å; L109-A112 PolarHBondContact O-N 3.06Å; L109-Q113 WeakPolarHBondContact O-CB 3.01Å; L109-Q113 PolarHBondContact O-N 2.96Å; L109-D140 HydrophobicContact CD1-CB 3.66Å; L109-W144 WeakPolarHBondContact CD2-O 3.5Å; L109-T145 VanDerWaalsContact CD2-C 3.47Å; L109-P146 HydrophobicContact CD2-CB 4.44Å; L109-P146 HydrophobicContact CD2-CG 3.9Å
110R95.6Very high91.5Very high131 Ų13166.2 Ų66.249%0.49433%0.329SS..Hα-helixtrans-63.2-47.4175.5-177.8179.5-66.7-162.4-6.8111.9H106 R107 I108 A112 Q113 E114H106-R110 PolarHBondContact CE1-NH2 3.31Å; H106-R110 VanDerWaalsContact CE1-NH2 3.35Å; H106-R110 WeakPolarHBondContact O-CB 3.44Å; H106-R110 PolarHBondContact O-N 2.99Å; R107-R110 PolarHBondContact O-N 3.12Å; I108-R110 PolarHBondContact O-N 3.19Å; R110-A112 VanDerWaalsContact C-N 3.25Å; R110-A112 PolarHBondContact O-N 2.93Å; R110-Q113 WeakPolarHBondContact O-CB 3.35Å; R110-Q113 PolarHBondContact O-N 3.31Å; R110-Q113 VanDerWaalsContact O-N 3.13Å; R110-E114 WeakPolarHBondContact CD-OE1 3.41Å; R110-E114 HydrophobicContact CG-CG 4.33Å; R110-E114 WeakPolarHBondContact CG-OE1 3.26Å; R110-E114 WeakPolarHBondContact O-CG 3.45Å; R110-E114 PolarHBondContact O-N 2.9Å
111A95.7Very high92.3Very high4 Ų468.8 Ų68.83%0.03333%0.326CS..Hα-helixtrans-60-37.9177.900000111.6R107 I108 G115 D116 E119 L120 L123R107-A111 WeakPolarHBondContact O-CB 3.45Å; R107-A111 PolarHBondContact O-N 3.29Å; I108-A111 PolarHBondContact O-N 3.21Å; A111-G115 PolarHBondContact O-N 3.42Å; A111-D116 PolarHBondContact O-N 3.39Å; A111-E119 HydrophobicContact CB-CB 4.21Å; A111-E119 HydrophobicContact CB-CG 3.95Å; A111-L120 HydrophobicContact CB-CD2 3.97Å; A111-L120 HydrophobicContact CB-CG 3.88Å; A111-L123 HydrophobicContact CB-CD1 4.43Å
112A96.4Very high93Very high0 Ų071.3 Ų71.30%033%0.331CS..Hα-helixtrans-66.7-39.9174.200000113.5I108 L109 R110 G115 L120 P146 C149 A150 L162I108-A112 WeakPolarHBondContact O-CB 2.92Å; I108-A112 PolarHBondContact O-N 3.18Å; L109-A112 PolarHBondContact O-N 3.06Å; R110-A112 VanDerWaalsContact C-N 3.25Å; R110-A112 PolarHBondContact O-N 2.93Å; A112-G115 PolarHBondContact O-N 2.86Å; A112-L120 HydrophobicContact CB-CD1 4.45Å; A112-L120 HydrophobicContact CB-CD2 4.13Å; A112-P146 HydrophobicContact CB-CB 3.89Å; A112-P146 VanDerWaalsContact CB-O 3.27Å; A112-P146 WeakPolarHBondContact CB-O 3.39Å; A112-C149 HydrophobicContact CB-CB 4.25Å; A112-A150 HydrophobicContact CB-CB 4.3Å; A112-A150 WeakPolarHBondContact O-CA 3.47Å; A112-A150 WeakPolarHBondContact O-CB 3.45Å; A112-L162 HydrophobicContact CB-CD1 4.44Å
113Q95.9Very high93.3Very high118 Ų11867.2 Ų67.255%0.55131%0.309SS*.Hα-helixtrans-66.8-41.9176.1-174.9-179.1-8.600112.3L109 R110 G115 C149 A153 Q155L109-Q113 WeakPolarHBondContact O-CB 3.01Å; L109-Q113 PolarHBondContact O-N 2.96Å; R110-Q113 WeakPolarHBondContact O-CB 3.35Å; R110-Q113 PolarHBondContact O-N 3.31Å; R110-Q113 VanDerWaalsContact O-N 3.13Å; Q113-G115 VanDerWaalsContact C-N 3.3Å; Q113-C149 HydrophobicContact CB-CB 4.24Å; Q113-A153 HydrophobicContact CG-CB 4.27Å; Q113-A153 WeakPolarHBondContact O-CB 3.31Å; Q113-Q155 PolarHBondContact O-NE2 3.35Å
114E95.7Very high93.4Very high114 Ų11462 Ų6253%0.53329%0.287SS..Hα-helixtrans-75.6-19.2179.6-70171.7-173.300112.5R110 D116 Q155R110-E114 WeakPolarHBondContact CD-OE1 3.41Å; R110-E114 HydrophobicContact CG-CG 4.33Å; R110-E114 WeakPolarHBondContact CG-OE1 3.26Å; R110-E114 WeakPolarHBondContact O-CG 3.45Å; R110-E114 PolarHBondContact O-N 2.9Å; E114-D116 VanDerWaalsContact C-N 3.34Å; E114-Q155 PolarHBondContact O-NE2 2.92Å; E114-Q155 VanDerWaalsContact O-NE2 3.16Å
115G94.4Very high93.4Very high18 Ų1861.7 Ų61.719%0.18629%0.285CS..THydrogen-bonded Turntrans7819-175.600000113.4A111 A112 Q113 L117A111-G115 PolarHBondContact O-N 3.42Å; A112-G115 PolarHBondContact O-N 2.86Å; Q113-G115 VanDerWaalsContact C-N 3.3Å; G115-L117 PolarHBondContact O-N 3.14Å
116D95.8Very high92.8Very high60 Ų6063.9 Ų63.932%0.32130%0.299SS..  trans-74.287.4179.8-170.8-20.5000110.2A111 E114 P118 E119 L120A111-D116 PolarHBondContact O-N 3.39Å; E114-D116 VanDerWaalsContact C-N 3.34Å; D116-P118 WeakPolarHBondContact OD1-CD 3.39Å; D116-P118 WeakPolarHBondContact OD1-CG 3.42Å; D116-E119 HydrophobicContact CB-CB 4.08Å; D116-E119 PolarHBondContact O-N 3.49Å; D116-E119 WeakPolarHBondContact OD1-CB 3.46Å; D116-E119 PolarHBondContact OD1-N 3Å; D116-E119 WeakPolarHBondContact OD2-CB 3.49Å; D116-L120 WeakPolarHBondContact O-CB 3.41Å; D116-L120 WeakPolarHBondContact O-CG 3.48Å; D116-L120 PolarHBondContact O-N 2.89Å
117L94.1Very high91.8Very high50 Ų5067.3 Ų67.326%0.26232%0.315SS..Hα-helixtrans-57.8-45.8176.4-67.4-178.8000114.4G115 E119 L120 R121 A157 A158 Y161G115-L117 PolarHBondContact O-N 3.14Å; L117-E119 VanDerWaalsContact C-N 3.35Å; L117-L120 PolarHBondContact O-N 3.11Å; L117-R121 WeakPolarHBondContact O-CB 3.34Å; L117-R121 VanDerWaalsContact O-CG 3.28Å; L117-R121 WeakPolarHBondContact O-CG 3.24Å; L117-R121 PolarHBondContact O-N 2.67Å; L117-A157 HydrophobicContact CD1-CB 3.96Å; L117-A158 HydrophobicContact CD2-CB 4.23Å; L117-Y161 HydrophobicContact CD2-CG 4.45Å
118P93.9Very high90.7Very high96 Ų9667.2 Ų67.262%0.62332%0.321SS*.Hα-helixtrans-64.2-39.117918.8-26.8000112.3D116 R121 R122D116-P118 WeakPolarHBondContact OD1-CD 3.39Å; D116-P118 WeakPolarHBondContact OD1-CG 3.42Å; P118-R121 PolarHBondContact O-N 3.11Å; P118-R122 WeakPolarHBondContact O-CB 3.36Å; P118-R122 PolarHBondContact O-N 3.39Å
119E92.7Very high89Confident45 Ų4572.9 Ų72.921%0.2137%0.368CS..Hα-helixtrans-68.3-42.7175.4-174.961.6-16500111.5A111 D116 L117 R121 R122 L123A111-E119 HydrophobicContact CB-CB 4.21Å; A111-E119 HydrophobicContact CB-CG 3.95Å; D116-E119 HydrophobicContact CB-CB 4.08Å; D116-E119 PolarHBondContact O-N 3.49Å; D116-E119 WeakPolarHBondContact OD1-CB 3.46Å; D116-E119 PolarHBondContact OD1-N 3Å; D116-E119 WeakPolarHBondContact OD2-CB 3.49Å; L117-E119 VanDerWaalsContact C-N 3.35Å; E119-R121 VanDerWaalsContact C-N 3.32Å; E119-R121 PolarHBondContact O-N 3.13Å; E119-R122 PolarHBondContact O-N 3.33Å; E119-R122 IonicContact OE1-CZ 3.09Å; E119-R122 IonicContact OE1-NE 2.67Å; E119-R122 IonicContact OE1-NH2 3.46Å; E119-R122 PolarHBondContact OE1-NH2 3.29Å; E119-R122 IonicContact OE2-CZ 2.82Å; E119-R122 IonicContact OE2-NE 3.81Å; E119-R122 PolarHBondContact OE2-NE 2.97Å; E119-R122 IonicContact OE2-NH2 3.2Å; E119-R122 PolarHBondContact OE2-NH2 3.26Å; E119-L123 HydrophobicContact CG-CD1 3.91Å; E119-L123 HydrophobicContact CG-CG 4.33Å; E119-L123 VanDerWaalsContact O-CG 3.26Å; E119-L123 WeakPolarHBondContact O-CG 3.31Å; E119-L123 PolarHBondContact O-N 2.81Å
120L92.9Very high87.3Confident0 Ų076.2 Ų76.20%041%0.405CS..Hα-helixtrans-57.7-43.1173.7-84.3175.7000112.6I108 A111 A112 D116 L117 L123 L124 A158 Y161I108-L120 HydrophobicContact CG2-CD2 4.25Å; A111-L120 HydrophobicContact CB-CD2 3.97Å; A111-L120 HydrophobicContact CB-CG 3.88Å; A112-L120 HydrophobicContact CB-CD1 4.45Å; A112-L120 HydrophobicContact CB-CD2 4.13Å; D116-L120 WeakPolarHBondContact O-CB 3.41Å; D116-L120 WeakPolarHBondContact O-CG 3.48Å; D116-L120 PolarHBondContact O-N 2.89Å; L117-L120 PolarHBondContact O-N 3.11Å; L120-L123 PolarHBondContact O-N 3.29Å; L120-L124 HydrophobicContact CD2-CD1 4.28Å; L120-L124 VanDerWaalsContact O-CB 3.29Å; L120-L124 WeakPolarHBondContact O-CB 3.35Å; L120-L124 WeakPolarHBondContact O-CG 3.17Å; L120-L124 PolarHBondContact O-N 2.96Å; L120-A158 HydrophobicContact CD1-CB 3.92Å; L120-Y161 HydrophobicContact CB-CE1 4.36Å
121R92.4Very high85.7Confident113 Ų11371.7 Ų71.743%0.42640%0.399SS..Hα-helixtrans-61.2-49.1175.1-76.1169.5-178.5-93.15.3110.7L117 P118 E119 L123 L124 E125 Y161L117-R121 WeakPolarHBondContact O-CB 3.34Å; L117-R121 VanDerWaalsContact O-CG 3.28Å; L117-R121 WeakPolarHBondContact O-CG 3.24Å; L117-R121 PolarHBondContact O-N 2.67Å; P118-R121 PolarHBondContact O-N 3.11Å; E119-R121 VanDerWaalsContact C-N 3.32Å; E119-R121 PolarHBondContact O-N 3.13Å; R121-L123 VanDerWaalsContact C-N 3.28Å; R121-L123 PolarHBondContact O-N 3.45Å; R121-L124 PolarHBondContact O-N 3.37Å; R121-E125 IonicContact NH1-OE1 3.55Å; R121-E125 WeakPolarHBondContact O-CA 3.26Å; R121-E125 WeakPolarHBondContact O-CB 3.42Å; R121-E125 VanDerWaalsContact O-CG 3.23Å; R121-E125 WeakPolarHBondContact O-CG 3.42Å; R121-E125 PolarHBondContact O-N 2.94Å; R121-Y161 HydrophobicContact CG-CD2 4.48Å; R121-Y161 HydrophobicContact CG-CE1 4.19Å; R121-Y161 HydrophobicContact CG-CE2 3.68Å; R121-Y161 WeakPolarHBondContact CG-OH 3.31Å
122R90.8Very high84.1Confident158 Ų15876.5 Ų76.560%0.59644%0.439SS*.Hα-helixtrans-59.7-36.7179.7-170.2179.572.1110.9-4.4113.3P118 E119P118-R122 WeakPolarHBondContact O-CB 3.36Å; P118-R122 PolarHBondContact O-N 3.39Å; E119-R122 PolarHBondContact O-N 3.33Å; E119-R122 IonicContact OE1-CZ 3.09Å; E119-R122 IonicContact OE1-NE 2.67Å; E119-R122 IonicContact OE1-NH2 3.46Å; E119-R122 PolarHBondContact OE1-NH2 3.29Å; E119-R122 IonicContact OE2-CZ 2.82Å; E119-R122 IonicContact OE2-NE 3.81Å; E119-R122 PolarHBondContact OE2-NE 2.97Å; E119-R122 IonicContact OE2-NH2 3.2Å; E119-R122 PolarHBondContact OE2-NH2 3.26Å
123L90.8Very high83.2Confident14 Ų1478 Ų787%0.07346%0.455CS..Hα-helixtrans-81.4-34.1-178.6-64172.9000113.1M104 R107 I108 A111 E119 L120 R121 G134M104-L123 HydrophobicContact CE-CD2 4.49Å; M104-L123 HydrophobicContact SD-CD2 3.67Å; R107-L123 HydrophobicContact CB-CD1 4.01Å; I108-L123 HydrophobicContact CG1-CB 3.92Å; I108-L123 HydrophobicContact CG1-CD1 3.94Å; A111-L123 HydrophobicContact CB-CD1 4.43Å; E119-L123 HydrophobicContact CG-CD1 3.91Å; E119-L123 HydrophobicContact CG-CG 4.33Å; E119-L123 VanDerWaalsContact O-CG 3.26Å; E119-L123 WeakPolarHBondContact O-CG 3.31Å; E119-L123 PolarHBondContact O-N 2.81Å; L120-L123 PolarHBondContact O-N 3.29Å; R121-L123 VanDerWaalsContact C-N 3.28Å; R121-L123 PolarHBondContact O-N 3.45Å; L123-G134 WeakPolarHBondContact O-CA 3.47Å; L123-G134 PolarHBondContact O-N 2.79Å
124L90.1Very high82.5Confident19 Ų1973.4 Ų73.410%0.09944%0.439CS..Hα-helixtrans-94.1-27.9-175.9-66.1173.3000113.4I108 L120 R121 G134 I136 Y161 L162I108-L124 HydrophobicContact CD1-CD2 4.26Å; I108-L124 HydrophobicContact CG2-CD2 4.25Å; L120-L124 HydrophobicContact CD2-CD1 4.28Å; L120-L124 VanDerWaalsContact O-CB 3.29Å; L120-L124 WeakPolarHBondContact O-CB 3.35Å; L120-L124 WeakPolarHBondContact O-CG 3.17Å; L120-L124 PolarHBondContact O-N 2.96Å; R121-L124 PolarHBondContact O-N 3.37Å; L124-G134 WeakPolarHBondContact CD2-O 3.33Å; L124-I136 HydrophobicContact CD1-CG1 4.34Å; L124-I136 HydrophobicContact CD2-CB 4.1Å; L124-I136 HydrophobicContact CD2-CG1 4.47Å; L124-Y161 HydrophobicContact CD1-CE1 4.08Å; L124-L162 HydrophobicContact CD1-CD2 3.72Å
125E86.6Confident82.2Confident67 Ų6772.7 Ų72.731%0.31344%0.439SS..SBendtrans-77.6138.1177-66.3177.1-178.700110.4R121 H127 Y161 R165R121-E125 IonicContact NH1-OE1 3.55Å; R121-E125 WeakPolarHBondContact O-CA 3.26Å; R121-E125 WeakPolarHBondContact O-CB 3.42Å; R121-E125 VanDerWaalsContact O-CG 3.23Å; R121-E125 WeakPolarHBondContact O-CG 3.42Å; R121-E125 PolarHBondContact O-N 2.94Å; E125-H127 PolarHBondContact O-N 3.2Å; E125-Y161 PolarHBondContact OE1-OH 3.16Å; E125-R165 VanDerWaalsContact CD-NH2 3.26Å; E125-R165 VanDerWaalsContact CG-NH2 3.29Å; E125-R165 IonicContact OE1-CZ 3.73Å; E125-R165 IonicContact OE1-NH2 2.72Å; E125-R165 PolarHBondContact OE1-NH2 2.99Å
126P80.1Confident82.1Confident72 Ų7273.3 Ų73.347%0.46844%0.437SS..  trans-67122.617530-34.6000109.2E128 G131P126-E128 PolarHBondContact O-N 3.36Å; P126-G131 WeakPolarHBondContact CB-O 3.47Å
127H70.8Confident81.9Confident178 Ų17873 Ų7382%0.82444%0.436SS*.SBendtrans-66.6-21.6178-170.6-75.8000112.2E125E125-H127 PolarHBondContact O-N 3.2Å
128E71.3Confident81.7Confident142 Ų14270.9 Ų70.966%0.66443%0.425SS*.SBendtrans-130.8149.9-177.7-62.6-177.4178.700110.9P126 G130 G131P126-E128 PolarHBondContact O-N 3.36Å; E128-G130 PolarHBondContact O-N 3.38Å; E128-G131 PolarHBondContact O-N 2.99Å
129A58.2Low81.6Confident119 Ų11972.5 Ų72.598%0.98342%0.419SS*.THydrogen-bonded Turntrans-65.193.4176.100000110.1
130G58.3Low81.6Confident82 Ų8273.1 Ų73.185%0.84542%0.423SS*.THydrogen-bonded Turntrans114.8-2.4-174.500000114.9E128E128-G130 PolarHBondContact O-N 3.38Å
131G62.7Low81.5Confident36 Ų3677.2 Ų77.237%0.37146%0.458SS..  trans-68.3143172.700000111.8P126 E128 G133P126-G131 WeakPolarHBondContact CB-O 3.47Å; E128-G131 PolarHBondContact O-N 2.99Å; G131-G133 PolarHBondContact O-N 2.92Å
132A63Low81.4Confident105 Ų10577.8 Ų77.887%0.86846%0.464SS*.  trans-75.9113.516600000108.2
133G76.2Confident81.4Confident32 Ų3276 Ų7633%0.3346%0.457SS..  trans-62.3167.8169.300000111.5G131G131-G133 PolarHBondContact O-N 2.92Å
134G82.7Confident81.6Confident21 Ų2176.8 Ų76.822%0.21646%0.459CS..  trans-55.9146.617300000112L123 L124 I136L123-G134 WeakPolarHBondContact O-CA 3.47Å; L123-G134 PolarHBondContact O-N 2.79Å; L124-G134 WeakPolarHBondContact CD2-O 3.33Å; G134-I136 PolarHBondContact O-N 2.82Å; G134-I136 VanDerWaalsContact O-N 3.1Å
135N88.3Confident81.8Confident100 Ų10076.1 Ų76.154%0.53546%0.455SS..  trans-68.1110.8179-178.40.4000110.3N137 A138N135-N137 PolarHBondContact O-N 2.62Å; N135-N137 WeakPolarHBondContact OD1-CA 3.2Å; N135-N137 PolarHBondContact OD1-N 2.89Å; N135-A138 HydrophobicContact CB-CB 4.21Å; N135-A138 VanDerWaalsContact O-CB 3.24Å; N135-A138 WeakPolarHBondContact O-CB 3.41Å; N135-A138 PolarHBondContact O-N 2.97Å; N135-A138 VanDerWaalsContact O-N 3.07Å
136I91.6Very high82.2Confident30 Ų3072.9 Ų72.915%0.15444%0.44CS..THydrogen-bonded Turntrans-61.3-27.1178.2-167.7164.4000113.2L124 G134 P146 L162 R165 A167L124-I136 HydrophobicContact CD1-CG1 4.34Å; L124-I136 HydrophobicContact CD2-CB 4.1Å; L124-I136 HydrophobicContact CD2-CG1 4.47Å; G134-I136 PolarHBondContact O-N 2.82Å; G134-I136 VanDerWaalsContact O-N 3.1Å; I136-P146 WeakPolarHBondContact O-CD 3.43Å; I136-P146 WeakPolarHBondContact O-CG 3.5Å; I136-L162 HydrophobicContact CD1-CD2 4.18Å; I136-L162 HydrophobicContact CG1-CD2 3.96Å; I136-R165 HydrophobicContact CD1-CB 3.39Å; I136-A167 HydrophobicContact CD1-CB 3.96Å; I136-A167 HydrophobicContact CG1-CB 4Å
137N92.2Very high83Confident55 Ų5569.6 Ų69.629%0.29442%0.419SS..THydrogen-bonded Turntrans-103.826.8178.7-61.3-45000111.5N135 A168N135-N137 PolarHBondContact O-N 2.62Å; N135-N137 WeakPolarHBondContact OD1-CA 3.2Å; N135-N137 PolarHBondContact OD1-N 2.89Å; N137-A168 WeakPolarHBondContact OD1-CB 3.41Å; N137-A168 PolarHBondContact OD1-N 3.1Å
138A90.9Very high84.2Confident4 Ų461.2 Ų61.23%0.03338%0.38CS..  trans-58.2146.3173.400000110.6T105 N135 P146T105-A138 HydrophobicContact CG2-CB 3.71Å; N135-A138 HydrophobicContact CB-CB 4.21Å; N135-A138 VanDerWaalsContact O-CB 3.24Å; N135-A138 WeakPolarHBondContact O-CB 3.41Å; N135-A138 PolarHBondContact O-N 2.97Å; N135-A138 VanDerWaalsContact O-N 3.07Å; A138-P146 VanDerWaalsContact O-CD 3.31Å; A138-P146 WeakPolarHBondContact O-CD 3.41Å
139R92.1Very high85.4Confident131 Ų13155.1 Ų55.149%0.49435%0.353SS..  trans-131.3138.4-176.8-73.8-176.6-68.6-162-0.3110.6W143 W144 T145R139-W143 VanDerWaalsContact CZ-CE3 3.41Å; R139-W144 WeakPolarHBondContact CA-O 3.26Å; R139-T145 HydrophobicContact CG-CG2 3.82Å
140D91.2Very high87.2Confident57 Ų5749.4 Ų49.431%0.30531%0.306SS..  trans-82.2-174.1170.174.5-3.3000112.4L109 F142 W143 W144L109-D140 HydrophobicContact CD1-CB 3.66Å; D140-F142 PolarHBondContact O-N 3.29Å; D140-F142 VanDerWaalsContact O-N 3.13Å; D140-F142 VanDerWaalsContact OD1-C 3.29Å; D140-F142 WeakPolarHBondContact OD1-CA 3.23Å; D140-F142 PolarHBondContact OD1-N 2.71Å; D140-W143 PolarHBondContact O-N 3.41Å; D140-W143 PolarHBondContact OD1-N 2.91Å; D140-W144 PolarHBondContact N-O 2.98Å; D140-W144 WeakPolarHBondContact OD1-CB 3.12Å; D140-W144 PolarHBondContact OD1-N 3.4Å
141A90.7Very high89Confident87 Ų8745.5 Ų45.572%0.71927%0.266SS*.THydrogen-bonded Turntrans-60.6-18.5177.300000114.3
142F90.3Very high90.6Very high125 Ų12549.8 Ų49.855%0.54827%0.27SS..THydrogen-bonded Turntrans-104.29.9178.8-60.4-75.6000112.4D140 W144 L175D140-F142 PolarHBondContact O-N 3.29Å; D140-F142 VanDerWaalsContact O-N 3.13Å; D140-F142 VanDerWaalsContact OD1-C 3.29Å; D140-F142 WeakPolarHBondContact OD1-CA 3.23Å; D140-F142 PolarHBondContact OD1-N 2.71Å; F142-W144 VanDerWaalsContact CB-CD1 3.4Å; F142-W144 PolarHBondContact O-N 3.21Å; F142-L175 HydrophobicContact CD1-CD2 4.41Å; F142-L175 PolarHBondContact O-N 3.2Å
143W91.8Very high92.2Very high121 Ų12146.3 Ų46.346%0.45824%0.242SC..  trans66.120.9-177.8-58.276.2000114.5R139 D140 T145R139-W143 VanDerWaalsContact CZ-CE3 3.41Å; D140-W143 PolarHBondContact O-N 3.41Å; D140-W143 PolarHBondContact OD1-N 2.91Å; W143-T145 PolarHBondContact O-N 2.87Å
144W94.3Very high93.2Very high30 Ų3045.8 Ų45.811%0.11424%0.236CC..  trans-71.5126.2175.9-74.961.9000110.4L109 R139 D140 F142 M148 R152 E174 L183L109-W144 WeakPolarHBondContact CD2-O 3.5Å; R139-W144 WeakPolarHBondContact CA-O 3.26Å; D140-W144 PolarHBondContact N-O 2.98Å; D140-W144 WeakPolarHBondContact OD1-CB 3.12Å; D140-W144 PolarHBondContact OD1-N 3.4Å; F142-W144 VanDerWaalsContact CB-CD1 3.4Å; F142-W144 PolarHBondContact O-N 3.21Å; W144-M148 HydrophobicContact CE3-CB 3.82Å; W144-M148 HydrophobicContact CZ3-CB 4.11Å; W144-R152 HydrophobicContact CH2-CB 4.29Å; W144-R152 HydrophobicContact CH2-CG 4.41Å; W144-R152 VanDerWaalsContact CZ2-NH1 3.26Å; W144-R152 HydrophobicContact CZ3-CB 3.97Å; W144-R152 HydrophobicContact CZ3-CG 4.47Å; W144-E174 HydrophobicContact CZ2-CG 4.49Å; W144-L183 HydrophobicContact CH2-CD1 3.68Å; W144-L183 HydrophobicContact CH2-CD2 3.87Å; W144-L183 HydrophobicContact CH2-CG 4.32Å; W144-L183 HydrophobicContact CZ2-CD1 4.26Å; W144-L183 HydrophobicContact CZ2-CD2 4.24Å; W144-L183 HydrophobicContact CZ3-CD1 3.94Å
145T95.1Very high93.9Very high4 Ų447.7 Ų47.73%0.02524%0.24CC..  trans-92.4160.1170.660.10000110.9L109 R139 W143 L147 M148 C149 V172L109-T145 VanDerWaalsContact CD2-C 3.47Å; R139-T145 HydrophobicContact CG-CG2 3.82Å; W143-T145 PolarHBondContact O-N 2.87Å; T145-L147 PolarHBondContact O-N 3.24Å; T145-L147 VanDerWaalsContact O-N 3.16Å; T145-M148 HydrophobicContact CG2-SD 4.35Å; T145-M148 WeakPolarHBondContact O-CB 3.48Å; T145-M148 PolarHBondContact O-N 3.38Å; T145-M148 VanDerWaalsContact OG1-CG 3.27Å; T145-M148 WeakPolarHBondContact OG1-CG 3.39Å; T145-M148 PolarHBondContact OG1-N 2.86Å; T145-M148 PolarHBondContact OG1-SD 3.2Å; T145-C149 PolarHBondContact O-N 3.09Å; T145-V172 HydrophobicContact CG2-CG1 3.78Å
146P95.6Very high94.2Very high0 Ų044 Ų440%023%0.225CC..Hα-helixtrans-53.5-36.5172.9-27.836000112I108 L109 A112 I136 A138 C149 A150 L162I108-P146 HydrophobicContact CG2-CB 4.06Å; I108-P146 HydrophobicContact CG2-CG 3.55Å; L109-P146 HydrophobicContact CD2-CB 4.44Å; L109-P146 HydrophobicContact CD2-CG 3.9Å; A112-P146 HydrophobicContact CB-CB 3.89Å; A112-P146 VanDerWaalsContact CB-O 3.27Å; A112-P146 WeakPolarHBondContact CB-O 3.39Å; I136-P146 WeakPolarHBondContact O-CD 3.43Å; I136-P146 WeakPolarHBondContact O-CG 3.5Å; A138-P146 VanDerWaalsContact O-CD 3.31Å; A138-P146 WeakPolarHBondContact O-CD 3.41Å; P146-C149 PolarHBondContact O-N 3.18Å; P146-A150 WeakPolarHBondContact O-CB 3.31Å; P146-A150 PolarHBondContact O-N 3.13Å; P146-L162 HydrophobicContact CB-CD1 3.96Å; P146-L162 HydrophobicContact CB-CD2 4.15Å
147L96.1Very high94.4Very high3 Ų345.3 Ų45.32%0.01624%0.241CC..Hα-helixtrans-63.7-42.3176.4-174.566.3000112.2T145 A150 A151 V159 L162 L163 W169 A180T145-L147 PolarHBondContact O-N 3.24Å; T145-L147 VanDerWaalsContact O-N 3.16Å; L147-A150 PolarHBondContact O-N 3.16Å; L147-A151 WeakPolarHBondContact O-CB 3.39Å; L147-A151 PolarHBondContact O-N 3.39Å; L147-V159 HydrophobicContact CD1-CB 4.43Å; L147-V159 HydrophobicContact CD1-CG1 4Å; L147-V159 HydrophobicContact CD1-CG2 4.35Å; L147-L162 HydrophobicContact CB-CD1 4.49Å; L147-L162 HydrophobicContact CD1-CB 4.25Å; L147-L163 HydrophobicContact CD1-CD1 4.4Å; L147-L163 HydrophobicContact CD1-CD2 4.04Å; L147-L163 HydrophobicContact CD1-CG 3.92Å; L147-L163 HydrophobicContact CD2-CD2 3.83Å; L147-W169 HydrophobicContact CD2-CB 3.42Å; L147-W169 VanDerWaalsContact CD2-CB 3.42Å; L147-A180 HydrophobicContact CD2-CB 4.24Å; L147-A180 HydrophobicContact CG-CB 4.12Å
148M96.1Very high94.6Very high1 Ų142.8 Ų42.81%0.00523%0.227CC..Hα-helixtrans-65.5-41.5176.4-70165171.100112.1W144 T145 A151 R152 V172 C173 E174 A180 L183W144-M148 HydrophobicContact CE3-CB 3.82Å; W144-M148 HydrophobicContact CZ3-CB 4.11Å; T145-M148 HydrophobicContact CG2-SD 4.35Å; T145-M148 WeakPolarHBondContact O-CB 3.48Å; T145-M148 PolarHBondContact O-N 3.38Å; T145-M148 VanDerWaalsContact OG1-CG 3.27Å; T145-M148 WeakPolarHBondContact OG1-CG 3.39Å; T145-M148 PolarHBondContact OG1-N 2.86Å; T145-M148 PolarHBondContact OG1-SD 3.2Å; M148-A151 PolarHBondContact O-N 3.03Å; M148-R152 WeakPolarHBondContact O-CB 3.19Å; M148-R152 PolarHBondContact O-N 3.18Å; M148-V172 HydrophobicContact CE-CB 4.45Å; M148-V172 HydrophobicContact CE-CG1 3.89Å; M148-V172 WeakPolarHBondContact CE-O 3.27Å; M148-C173 VanDerWaalsContact CE-C 3.46Å; M148-E174 HydrophobicContact CE-CB 4.42Å; M148-E174 HydrophobicContact SD-CB 4.08Å; M148-A180 HydrophobicContact CG-CB 4.01Å; M148-L183 HydrophobicContact CB-CD1 3.81Å; M148-L183 HydrophobicContact CG-CD1 3.83Å; M148-L183 HydrophobicContact SD-CD1 4.44Å
149C95.8Very high94.8Very high14 Ų1442.6 Ų42.610%0.09523%0.225CC..Hα-helixtrans-60.7-47.9175.2-69.70000111.5A112 Q113 T145 P146 A153A112-C149 HydrophobicContact CB-CB 4.25Å; Q113-C149 HydrophobicContact CB-CB 4.24Å; T145-C149 PolarHBondContact O-N 3.09Å; P146-C149 PolarHBondContact O-N 3.18Å; C149-A153 VanDerWaalsContact O-CB 3.29Å; C149-A153 WeakPolarHBondContact O-CB 3.31Å; C149-A153 PolarHBondContact O-N 3.26Å; C149-A153 VanDerWaalsContact O-N 3.11Å
150A96.7Very high94.9Very high0 Ų039.1 Ų39.10%022%0.221CC..Hα-helixtrans-64.4-41.4177.300000112.2A112 P146 L147 A153 G154 Q155 A158 V159 L162A112-A150 HydrophobicContact CB-CB 4.3Å; A112-A150 WeakPolarHBondContact O-CA 3.47Å; A112-A150 WeakPolarHBondContact O-CB 3.45Å; P146-A150 WeakPolarHBondContact O-CB 3.31Å; P146-A150 PolarHBondContact O-N 3.13Å; L147-A150 PolarHBondContact O-N 3.16Å; A150-A153 PolarHBondContact O-N 3.46Å; A150-G154 PolarHBondContact O-N 2.96Å; A150-G154 VanDerWaalsContact O-N 3.14Å; A150-Q155 HydrophobicContact CB-CB 4.31Å; A150-Q155 PolarHBondContact O-N 3.1Å; A150-A158 HydrophobicContact CB-CB 3.99Å; A150-V159 HydrophobicContact CB-CG2 3.71Å; A150-L162 HydrophobicContact CB-CD1 4.19Å
151A96.6Very high95Very high0 Ų037.5 Ų37.50%021%0.211CC..Hα-helixtrans-65.5-46.3-179.400000112.2L147 M148 A153 G154 V159 A180 A184 V192L147-A151 WeakPolarHBondContact O-CB 3.39Å; L147-A151 PolarHBondContact O-N 3.39Å; M148-A151 PolarHBondContact O-N 3.03Å; A151-A153 VanDerWaalsContact C-N 3.31Å; A151-A153 PolarHBondContact O-N 2.96Å; A151-G154 PolarHBondContact O-N 2.98Å; A151-V159 HydrophobicContact CB-CG2 4.44Å; A151-A180 HydrophobicContact CB-CB 4.16Å; A151-A180 VanDerWaalsContact CB-O 3.31Å; A151-A180 WeakPolarHBondContact CB-O 3.38Å; A151-A184 HydrophobicContact CB-CB 4.18Å; A151-A184 WeakPolarHBondContact O-CB 3.5Å; A151-V192 HydrophobicContact CB-CG1 4.27Å
152R96.3Very high95.2Very high125 Ų12533.4 Ų33.447%0.47218%0.177SC..Hα-helixtrans-66.7-31.2176.4-177.6162.8-176.9-175.89.9113.1W144 M148 G154 L183 A187 F189W144-R152 HydrophobicContact CH2-CB 4.29Å; W144-R152 HydrophobicContact CH2-CG 4.41Å; W144-R152 VanDerWaalsContact CZ2-NH1 3.26Å; W144-R152 HydrophobicContact CZ3-CB 3.97Å; W144-R152 HydrophobicContact CZ3-CG 4.47Å; M148-R152 WeakPolarHBondContact O-CB 3.19Å; M148-R152 PolarHBondContact O-N 3.18Å; R152-G154 VanDerWaalsContact C-N 3.29Å; R152-L183 HydrophobicContact CB-CB 4.42Å; R152-A187 HydrophobicContact CG-CB 4.16Å; R152-A187 VanDerWaalsContact O-CB 3.24Å; R152-A187 WeakPolarHBondContact O-CB 3.4Å; R152-F189 WeakPolarHBondContact O-CE2 3.47Å
153A96.7Very high95.3Very high32 Ų3228 Ų2826%0.26415%0.154SC..THydrogen-bonded Turntrans-81.4-617700000113.6Q113 C149 A150 A151 Q155Q113-A153 HydrophobicContact CG-CB 4.27Å; Q113-A153 WeakPolarHBondContact O-CB 3.31Å; C149-A153 VanDerWaalsContact O-CB 3.29Å; C149-A153 WeakPolarHBondContact O-CB 3.31Å; C149-A153 PolarHBondContact O-N 3.26Å; C149-A153 VanDerWaalsContact O-N 3.11Å; A150-A153 PolarHBondContact O-N 3.46Å; A151-A153 VanDerWaalsContact C-N 3.31Å; A151-A153 PolarHBondContact O-N 2.96Å; A153-Q155 VanDerWaalsContact C-N 3.32Å; A153-Q155 HydrophobicContact CB-CG 3.8Å
154G96.5Very high95.3Very high21 Ų2124.5 Ų24.522%0.21616%0.155CC..THydrogen-bonded Turntrans75.618.4-178.800000114.2A150 A151 R152 G156 F189A150-G154 PolarHBondContact O-N 2.96Å; A150-G154 VanDerWaalsContact O-N 3.14Å; A151-G154 PolarHBondContact O-N 2.98Å; R152-G154 VanDerWaalsContact C-N 3.29Å; G154-G156 VanDerWaalsContact C-N 3.33Å; G154-G156 PolarHBondContact O-N 2.97Å; G154-F189 VanDerWaalsContact CA-CG 3.46Å
155Q97Very high95Very high62 Ų6229 Ų2929%0.2917%0.172SC..  trans-8272.8-174-59.4-66.1-3.100111.4Q113 E114 A150 A153 A157 A158 V159Q113-Q155 PolarHBondContact O-NE2 3.35Å; E114-Q155 PolarHBondContact O-NE2 2.92Å; E114-Q155 VanDerWaalsContact O-NE2 3.16Å; A150-Q155 HydrophobicContact CB-CB 4.31Å; A150-Q155 PolarHBondContact O-N 3.1Å; A153-Q155 VanDerWaalsContact C-N 3.32Å; A153-Q155 HydrophobicContact CB-CG 3.8Å; Q155-A157 PolarHBondContact O-N 3.39Å; Q155-A157 VanDerWaalsContact O-N 3.14Å; Q155-A158 HydrophobicContact CB-CB 3.9Å; Q155-A158 PolarHBondContact O-N 3.5Å; Q155-V159 WeakPolarHBondContact O-CG2 3.5Å; Q155-V159 PolarHBondContact O-N 2.85Å
156G95.3Very high94.7Very high21 Ų2129.9 Ų29.922%0.21618%0.182CC..Hα-helixtrans-54.8-35.2-175.900000114.3G154 V159 S160 M195G154-G156 VanDerWaalsContact C-N 3.33Å; G154-G156 PolarHBondContact O-N 2.97Å; G156-V159 PolarHBondContact O-N 2.96Å; G156-S160 WeakPolarHBondContact O-CB 3.28Å; G156-S160 PolarHBondContact O-N 3.21Å; G156-S160 PolarHBondContact O-OG 2.94Å; G156-M195 VanDerWaalsContact O-SD 3.4Å
157A95.4Very high94.5Very high59 Ų5930 Ų3049%0.48818%0.184SC..Hα-helixtrans-69.2-40.4177.700000112.5L117 Q155 S160 Y161L117-A157 HydrophobicContact CD1-CB 3.96Å; Q155-A157 PolarHBondContact O-N 3.39Å; Q155-A157 VanDerWaalsContact O-N 3.14Å; A157-S160 PolarHBondContact O-N 2.97Å; A157-Y161 WeakPolarHBondContact O-CB 3.3Å; A157-Y161 PolarHBondContact O-N 3.4Å
158A96Very high94.2Very high1 Ų131.7 Ų31.71%0.00820%0.198CC..Hα-helixtrans-67.9-39.217500000111.3L117 L120 A150 Q155 Y161 L162L117-A158 HydrophobicContact CD2-CB 4.23Å; L120-A158 HydrophobicContact CD1-CB 3.92Å; A150-A158 HydrophobicContact CB-CB 3.99Å; Q155-A158 HydrophobicContact CB-CB 3.9Å; Q155-A158 PolarHBondContact O-N 3.5Å; A158-Y161 PolarHBondContact O-N 3.02Å; A158-L162 WeakPolarHBondContact O-CB 3.15Å; A158-L162 VanDerWaalsContact O-CG 3.26Å; A158-L162 WeakPolarHBondContact O-CG 3.29Å; A158-L162 PolarHBondContact O-N 3.03Å
159V95.7Very high93.7Very high0 Ų035 Ų350%021%0.21CC..Hα-helixtrans-60.5-48.9174171.50000111.1L147 A150 A151 Q155 G156 Y161 L162 L163 V192 M195 V196L147-V159 HydrophobicContact CD1-CB 4.43Å; L147-V159 HydrophobicContact CD1-CG1 4Å; L147-V159 HydrophobicContact CD1-CG2 4.35Å; A150-V159 HydrophobicContact CB-CG2 3.71Å; A151-V159 HydrophobicContact CB-CG2 4.44Å; Q155-V159 WeakPolarHBondContact O-CG2 3.5Å; Q155-V159 PolarHBondContact O-N 2.85Å; G156-V159 PolarHBondContact O-N 2.96Å; V159-Y161 VanDerWaalsContact C-N 3.3Å; V159-Y161 PolarHBondContact O-N 3.35Å; V159-L162 PolarHBondContact O-N 2.95Å; V159-L163 HydrophobicContact CG1-CD1 3.58Å; V159-L163 HydrophobicContact CG1-CG 4.32Å; V159-L163 WeakPolarHBondContact O-CB 3.45Å; V159-L163 VanDerWaalsContact O-CG 3.31Å; V159-L163 WeakPolarHBondContact O-CG 3.43Å; V159-L163 PolarHBondContact O-N 3.23Å; V159-V192 HydrophobicContact CB-CG1 4.36Å; V159-V192 HydrophobicContact CG1-CG1 4.31Å; V159-V192 HydrophobicContact CG2-CG1 3.76Å; V159-M195 HydrophobicContact CB-SD 4.09Å; V159-M195 HydrophobicContact CG1-CG 4.26Å; V159-M195 HydrophobicContact CG1-SD 3.74Å; V159-V196 HydrophobicContact CG1-CG2 3.74Å
160S93.9Very high93.2Very high59 Ų5939.4 Ų39.441%0.41324%0.237SC..Hα-helixtrans-57.3-43.3176-65.90000112G156 A157 G164 M195G156-S160 WeakPolarHBondContact O-CB 3.28Å; G156-S160 PolarHBondContact O-N 3.21Å; G156-S160 PolarHBondContact O-OG 2.94Å; A157-S160 PolarHBondContact O-N 2.97Å; S160-G164 PolarHBondContact O-N 3.29Å; S160-M195 PolarHBondContact OG-SD 3.13Å
161Y94Very high92.7Very high23 Ų2343.1 Ų43.19%0.0927%0.274CS..Hα-helixtrans-65.1-47.5178.5177.6-102.3000112.4L117 L120 R121 L124 E125 A157 A158 V159 G164 R165L117-Y161 HydrophobicContact CD2-CG 4.45Å; L120-Y161 HydrophobicContact CB-CE1 4.36Å; R121-Y161 HydrophobicContact CG-CD2 4.48Å; R121-Y161 HydrophobicContact CG-CE1 4.19Å; R121-Y161 HydrophobicContact CG-CE2 3.68Å; R121-Y161 WeakPolarHBondContact CG-OH 3.31Å; L124-Y161 HydrophobicContact CD1-CE1 4.08Å; E125-Y161 PolarHBondContact OE1-OH 3.16Å; A157-Y161 WeakPolarHBondContact O-CB 3.3Å; A157-Y161 PolarHBondContact O-N 3.4Å; A158-Y161 PolarHBondContact O-N 3.02Å; V159-Y161 VanDerWaalsContact C-N 3.3Å; V159-Y161 PolarHBondContact O-N 3.35Å; Y161-G164 PolarHBondContact O-N 3.5Å; Y161-R165 HydrophobicContact CE1-CG 4.16Å; Y161-R165 HydrophobicContact CE2-CG 4.07Å; Y161-R165 WeakPolarHBondContact O-CG 3.4Å; Y161-R165 PolarHBondContact O-N 3.4Å; Y161-R165 PolarHBondContact OH-NE 3.21Å; Y161-R165 VanDerWaalsContact OH-NE 3.11Å
162L93.6Very high92.4Very high0 Ų044.4 Ų44.40%028%0.282CS..Hα-helixtrans-64.1-44.5-179.9-71.8169.3000111.6A112 L124 I136 P146 L147 A150 A158 V159 R165 G166 A167A112-L162 HydrophobicContact CB-CD1 4.44Å; L124-L162 HydrophobicContact CD1-CD2 3.72Å; I136-L162 HydrophobicContact CD1-CD2 4.18Å; I136-L162 HydrophobicContact CG1-CD2 3.96Å; P146-L162 HydrophobicContact CB-CD1 3.96Å; P146-L162 HydrophobicContact CB-CD2 4.15Å; L147-L162 HydrophobicContact CB-CD1 4.49Å; L147-L162 HydrophobicContact CD1-CB 4.25Å; A150-L162 HydrophobicContact CB-CD1 4.19Å; A158-L162 WeakPolarHBondContact O-CB 3.15Å; A158-L162 VanDerWaalsContact O-CG 3.26Å; A158-L162 WeakPolarHBondContact O-CG 3.29Å; A158-L162 PolarHBondContact O-N 3.03Å; V159-L162 PolarHBondContact O-N 2.95Å; L162-R165 PolarHBondContact O-N 3.41Å; L162-G166 PolarHBondContact O-N 3.5Å; L162-A167 HydrophobicContact CB-CB 3.95Å; L162-A167 WeakPolarHBondContact O-CB 3.44Å; L162-A167 PolarHBondContact O-N 3.11Å
163L93.2Very high92.2Very high11 Ų1141 Ų416%0.05828%0.277CS..Hα-helixtrans-65.1-39.9176.6-68.6172000111.7L147 V159 R165 G166 W169 V196 S199L147-L163 HydrophobicContact CD1-CD1 4.4Å; L147-L163 HydrophobicContact CD1-CD2 4.04Å; L147-L163 HydrophobicContact CD1-CG 3.92Å; L147-L163 HydrophobicContact CD2-CD2 3.83Å; V159-L163 HydrophobicContact CG1-CD1 3.58Å; V159-L163 HydrophobicContact CG1-CG 4.32Å; V159-L163 WeakPolarHBondContact O-CB 3.45Å; V159-L163 VanDerWaalsContact O-CG 3.31Å; V159-L163 WeakPolarHBondContact O-CG 3.43Å; V159-L163 PolarHBondContact O-N 3.23Å; L163-R165 PolarHBondContact O-N 2.76Å; L163-G166 PolarHBondContact O-N 3.26Å; L163-G166 VanDerWaalsContact O-N 3.12Å; L163-W169 HydrophobicContact CD2-CB 3.91Å; L163-W169 HydrophobicContact CD2-CG 3.82Å; L163-V196 HydrophobicContact CD1-CG2 4.27Å; L163-S199 VanDerWaalsContact CD1-OG 3.26Å; L163-S199 WeakPolarHBondContact CD1-OG 3.3Å
164G91.3Very high92.1Very high48 Ų4840.3 Ų40.350%0.49527%0.268SS..Hα-helixtrans-64.4-23.9174.300000114S160 Y161S160-G164 PolarHBondContact O-N 3.29Å; Y161-G164 PolarHBondContact O-N 3.5Å
165R88.2Confident91.9Very high125 Ų12545 Ų4547%0.47229%0.288SS..THydrogen-bonded Turntrans-90.40.3175.2-72.6-71.2-165.9178.6-4.1114E125 I136 Y161 L162 L163E125-R165 VanDerWaalsContact CD-NH2 3.26Å; E125-R165 VanDerWaalsContact CG-NH2 3.29Å; E125-R165 IonicContact OE1-CZ 3.73Å; E125-R165 IonicContact OE1-NH2 2.72Å; E125-R165 PolarHBondContact OE1-NH2 2.99Å; I136-R165 HydrophobicContact CD1-CB 3.39Å; Y161-R165 HydrophobicContact CE1-CG 4.16Å; Y161-R165 HydrophobicContact CE2-CG 4.07Å; Y161-R165 WeakPolarHBondContact O-CG 3.4Å; Y161-R165 PolarHBondContact O-N 3.4Å; Y161-R165 PolarHBondContact OH-NE 3.21Å; Y161-R165 VanDerWaalsContact OH-NE 3.11Å; L162-R165 PolarHBondContact O-N 3.41Å; L163-R165 PolarHBondContact O-N 2.76Å
166G88.3Confident91.6Very high22 Ų2245.6 Ų45.623%0.22730%0.299CS..THydrogen-bonded Turntrans87.227.6179.200000114.6L162 L163 A168L162-G166 PolarHBondContact O-N 3.5Å; L163-G166 PolarHBondContact O-N 3.26Å; L163-G166 VanDerWaalsContact O-N 3.12Å; G166-A168 PolarHBondContact O-N 2.6Å
167A91.1Very high91.5Very high4 Ų446.7 Ų46.73%0.03331%0.31CS..  trans-57.5132.3170.900000110.8I136 L162 W169I136-A167 HydrophobicContact CD1-CB 3.96Å; I136-A167 HydrophobicContact CG1-CB 4Å; L162-A167 HydrophobicContact CB-CB 3.95Å; L162-A167 WeakPolarHBondContact O-CB 3.44Å; L162-A167 PolarHBondContact O-N 3.11Å; A167-W169 PolarHBondContact O-N 3Å
168A89.8Confident91.4Very high38 Ų3847.2 Ų47.231%0.31430%0.299SS..  trans-72115.4179.900000109.9N137 G166 V172N137-A168 WeakPolarHBondContact OD1-CB 3.41Å; N137-A168 PolarHBondContact OD1-N 3.1Å; G166-A168 PolarHBondContact O-N 2.6Å; A168-V172 HydrophobicContact CB-CG2 3.81Å
169W86Confident91.3Very high71 Ų7149.4 Ų49.427%0.26931%0.311SS..  trans-116.8-23.5-179.665.2-90.8000113L147 L163 A167 V196 S199L147-W169 HydrophobicContact CD2-CB 3.42Å; L147-W169 VanDerWaalsContact CD2-CB 3.42Å; L163-W169 HydrophobicContact CD2-CB 3.91Å; L163-W169 HydrophobicContact CD2-CG 3.82Å; A167-W169 PolarHBondContact O-N 3Å; W169-V196 HydrophobicContact CB-CG1 4.3Å; W169-V196 HydrophobicContact CE3-CG1 4.29Å; W169-S199 WeakPolarHBondContact CZ2-O 3.34Å
170V86.1Confident91.3Very high106 Ų10649.6 Ų49.664%0.64231%0.313SS*.SBendtrans-83.1124.1178.2-174.30000110.3V172V170-V172 PolarHBondContact O-N 3.23Å
171G86.1Confident91.3Very high77 Ų7747 Ų4779%0.79429%0.294SS*.SBendtrans71.97.1174.900000115.1
172V90.4Very high91.4Very high27 Ų2749.5 Ų49.516%0.16431%0.307CS..  trans-95.1114.2176.5-1730000108.7T145 M148 A168 V170T145-V172 HydrophobicContact CG2-CG1 3.78Å; M148-V172 HydrophobicContact CE-CB 4.45Å; M148-V172 HydrophobicContact CE-CG1 3.89Å; M148-V172 WeakPolarHBondContact CE-O 3.27Å; A168-V172 HydrophobicContact CB-CG2 3.81Å; V170-V172 PolarHBondContact O-N 3.23Å
173C92.9Very high91.5Very high54 Ų5449.6 Ų49.637%0.36531%0.307SS..  trans-122150.7179.3-61.20000111M148 G177 R178M148-C173 VanDerWaalsContact CE-C 3.46Å; C173-G177 PolarHBondContact SG-O 3.42Å; C173-G177 VanDerWaalsContact SG-O 3.4Å; C173-R178 VanDerWaalsContact CA-O 3.26Å; C173-R178 WeakPolarHBondContact CA-O 3.44Å
174E93.1Very high91.7Very high17 Ų1749 Ų498%0.07931%0.305CS..  trans-78.8-179.1170.360.467.4-131.200111.6W144 M148 S176 G177 R178 L183W144-E174 HydrophobicContact CZ2-CG 4.49Å; M148-E174 HydrophobicContact CE-CB 4.42Å; M148-E174 HydrophobicContact SD-CB 4.08Å; E174-S176 VanDerWaalsContact C-N 3.3Å; E174-S176 PolarHBondContact O-N 2.74Å; E174-S176 WeakPolarHBondContact OE1-CA 3.29Å; E174-S176 VanDerWaalsContact OE1-CB 3.26Å; E174-S176 WeakPolarHBondContact OE1-CB 3.39Å; E174-S176 PolarHBondContact OE1-N 3.01Å; E174-S176 PolarHBondContact OE1-OG 3.04Å; E174-S176 PolarHBondContact OE2-N 3.07Å; E174-S176 PolarHBondContact OE2-OG 2.95Å; E174-S176 VanDerWaalsContact OE2-OG 3.05Å; E174-G177 WeakPolarHBondContact O-CA 3.35Å; E174-G177 PolarHBondContact O-N 3.05Å; E174-G177 PolarHBondContact OE1-N 3.23Å; E174-G177 VanDerWaalsContact OE1-N 3.13Å; E174-R178 HydrophobicContact CG-CB 4.32Å; E174-R178 PolarHBondContact N-O 3.33Å; E174-R178 WeakPolarHBondContact OE1-CB 3.29Å; E174-R178 PolarHBondContact OE1-N 3.07Å; E174-R178 IonicContact OE1-NE 2.82Å; E174-L183 HydrophobicContact CG-CD1 4.1Å; E174-L183 HydrophobicContact CG-CD2 4.42Å
175L92.5Very high91.9Very high121 Ų12150.8 Ų50.863%0.63430%0.3SS*.THydrogen-bonded Turntrans-58.4-31.1-173.9-173.262.4000115.3F142 G177F142-L175 HydrophobicContact CD1-CD2 4.41Å; F142-L175 PolarHBondContact O-N 3.2Å; L175-G177 VanDerWaalsContact C-N 3.28Å
176S91.8Very high92.3Very high74 Ų7450.2 Ų50.252%0.51730%0.302SS..THydrogen-bonded Turntrans-84.45.7171.865.40000114.3E174 R178E174-S176 VanDerWaalsContact C-N 3.3Å; E174-S176 PolarHBondContact O-N 2.74Å; E174-S176 WeakPolarHBondContact OE1-CA 3.29Å; E174-S176 VanDerWaalsContact OE1-CB 3.26Å; E174-S176 WeakPolarHBondContact OE1-CB 3.39Å; E174-S176 PolarHBondContact OE1-N 3.01Å; E174-S176 PolarHBondContact OE1-OG 3.04Å; E174-S176 PolarHBondContact OE2-N 3.07Å; E174-S176 PolarHBondContact OE2-OG 2.95Å; E174-S176 VanDerWaalsContact OE2-OG 3.05Å; S176-R178 PolarHBondContact OG-NE 3.35Å; S176-R178 VanDerWaalsContact OG-NE 3.1Å; S176-R178 PolarHBondContact OG-NH2 3.11Å
177G92.9Very high92.6Very high44 Ų4451.1 Ų51.145%0.45431%0.308SS..SBendtrans85.98.1173.200000114.9C173 E174 L175C173-G177 PolarHBondContact SG-O 3.42Å; C173-G177 VanDerWaalsContact SG-O 3.4Å; E174-G177 WeakPolarHBondContact O-CA 3.35Å; E174-G177 PolarHBondContact O-N 3.05Å; E174-G177 PolarHBondContact OE1-N 3.23Å; E174-G177 VanDerWaalsContact OE1-N 3.13Å; L175-G177 VanDerWaalsContact C-N 3.28Å
178R92.9Very high92.9Very high69 Ų6953.5 Ų53.526%0.2633%0.333SS..  trans-86.5138.5-178.4-66.6178.2-73.2-163.10.5112.5C173 E174 S176 Q182 L183 E186C173-R178 VanDerWaalsContact CA-O 3.26Å; C173-R178 WeakPolarHBondContact CA-O 3.44Å; E174-R178 HydrophobicContact CG-CB 4.32Å; E174-R178 PolarHBondContact N-O 3.33Å; E174-R178 WeakPolarHBondContact OE1-CB 3.29Å; E174-R178 PolarHBondContact OE1-N 3.07Å; E174-R178 IonicContact OE1-NE 2.82Å; S176-R178 PolarHBondContact OG-NE 3.35Å; S176-R178 VanDerWaalsContact OG-NE 3.1Å; S176-R178 PolarHBondContact OG-NH2 3.11Å; R178-Q182 HydrophobicContact CB-CB 4.3Å; R178-L183 HydrophobicContact CB-CD2 4.01Å; R178-L183 HydrophobicContact CB-CG 4.1Å; R178-E186 WeakPolarHBondContact CD-OE1 3.48Å; R178-E186 WeakPolarHBondContact CD-OE2 3.49Å; R178-E186 IonicContact CZ-OE1 3.5Å; R178-E186 IonicContact CZ-OE2 2.78Å; R178-E186 VanDerWaalsContact CZ-OE2 3.24Å; R178-E186 IonicContact NE-OE1 2.92Å; R178-E186 IonicContact NE-OE2 2.62Å; R178-E186 IonicContact NH1-OE1 3.29Å; R178-E186 PolarHBondContact NH1-OE1 3.05Å; R178-E186 IonicContact NH1-OE2 3.95Å; R178-E186 PolarHBondContact NH1-OE2 3.25Å
179D94.2Very high93.2Very high48 Ų4855.5 Ų55.526%0.25733%0.334SS..  trans-82.5170.4172.469.231.3000111.5A181 Q182 L183D179-A181 PolarHBondContact O-N 2.93Å; D179-A181 WeakPolarHBondContact OD1-CA 3.33Å; D179-A181 WeakPolarHBondContact OD1-CB 3.48Å; D179-A181 PolarHBondContact OD1-N 3.4Å; D179-Q182 PolarHBondContact O-N 2.95Å; D179-Q182 WeakPolarHBondContact OD1-CB 3.33Å; D179-Q182 VanDerWaalsContact OD1-CG 3.31Å; D179-Q182 WeakPolarHBondContact OD1-CG 3.37Å; D179-Q182 PolarHBondContact OD1-N 3.1Å; D179-L183 VanDerWaalsContact O-CG 3.31Å; D179-L183 WeakPolarHBondContact O-CG 3.18Å; D179-L183 PolarHBondContact O-N 3.38Å; D179-L183 VanDerWaalsContact O-N 3.09Å
180A95Very high93.6Very high4 Ų456.4 Ų56.43%0.03335%0.349CS..Hα-helixtrans-62.2-30.1-179.800000113.3L147 M148 A151 A184 V196L147-A180 HydrophobicContact CD2-CB 4.24Å; L147-A180 HydrophobicContact CG-CB 4.12Å; M148-A180 HydrophobicContact CG-CB 4.01Å; A151-A180 HydrophobicContact CB-CB 4.16Å; A151-A180 VanDerWaalsContact CB-O 3.31Å; A151-A180 WeakPolarHBondContact CB-O 3.38Å; A180-A184 PolarHBondContact O-N 3.4Å; A180-V196 HydrophobicContact CB-CG1 4.38Å
181A94.9Very high94.1Very high3 Ų356.3 Ų56.33%0.02534%0.342CS..Hα-helixtrans-73.5-42.6179.900000111.6D179 L183 A184 E185 A193 V196 R197D179-A181 PolarHBondContact O-N 2.93Å; D179-A181 WeakPolarHBondContact OD1-CA 3.33Å; D179-A181 WeakPolarHBondContact OD1-CB 3.48Å; D179-A181 PolarHBondContact OD1-N 3.4Å; A181-L183 VanDerWaalsContact C-N 3.34Å; A181-A184 WeakPolarHBondContact O-CB 3.46Å; A181-A184 PolarHBondContact O-N 2.81Å; A181-E185 WeakPolarHBondContact O-CG 2.94Å; A181-E185 PolarHBondContact O-N 3.23Å; A181-A193 HydrophobicContact CB-CB 4.36Å; A181-A193 WeakPolarHBondContact O-CB 3.31Å; A181-V196 HydrophobicContact CB-CB 4.37Å; A181-V196 HydrophobicContact CB-CG1 4.27Å; A181-R197 HydrophobicContact CB-CG 4Å
182Q95.3Very high94.6Very high77 Ų7753.1 Ų53.136%0.3631%0.307SS..Hα-helixtrans-62.4-41.3174.4-72.1175.2-10.100111.1R178 D179 A184 E185 E186R178-Q182 HydrophobicContact CB-CB 4.3Å; D179-Q182 PolarHBondContact O-N 2.95Å; D179-Q182 WeakPolarHBondContact OD1-CB 3.33Å; D179-Q182 VanDerWaalsContact OD1-CG 3.31Å; D179-Q182 WeakPolarHBondContact OD1-CG 3.37Å; D179-Q182 PolarHBondContact OD1-N 3.1Å; Q182-A184 VanDerWaalsContact C-N 3.29Å; Q182-A184 PolarHBondContact O-N 3.4Å; Q182-E185 PolarHBondContact O-N 3.13Å; Q182-E186 WeakPolarHBondContact O-CB 3.18Å; Q182-E186 VanDerWaalsContact O-CG 3.31Å; Q182-E186 WeakPolarHBondContact O-CG 3.34Å; Q182-E186 PolarHBondContact O-N 2.96Å
183L95.7Very high94.8Very high1 Ų151.9 Ų51.91%0.00530%0.3CS..Hα-helixtrans-63-35.3175.2-68.5172.3000112.6W144 M148 R152 E174 R178 D179 A181 A187W144-L183 HydrophobicContact CH2-CD1 3.68Å; W144-L183 HydrophobicContact CH2-CD2 3.87Å; W144-L183 HydrophobicContact CH2-CG 4.32Å; W144-L183 HydrophobicContact CZ2-CD1 4.26Å; W144-L183 HydrophobicContact CZ2-CD2 4.24Å; W144-L183 HydrophobicContact CZ3-CD1 3.94Å; M148-L183 HydrophobicContact CB-CD1 3.81Å; M148-L183 HydrophobicContact CG-CD1 3.83Å; M148-L183 HydrophobicContact SD-CD1 4.44Å; R152-L183 HydrophobicContact CB-CB 4.42Å; E174-L183 HydrophobicContact CG-CD1 4.1Å; E174-L183 HydrophobicContact CG-CD2 4.42Å; R178-L183 HydrophobicContact CB-CD2 4.01Å; R178-L183 HydrophobicContact CB-CG 4.1Å; D179-L183 VanDerWaalsContact O-CG 3.31Å; D179-L183 WeakPolarHBondContact O-CG 3.18Å; D179-L183 PolarHBondContact O-N 3.38Å; D179-L183 VanDerWaalsContact O-N 3.09Å; A181-L183 VanDerWaalsContact C-N 3.34Å; L183-A187 WeakPolarHBondContact O-CB 3.29Å; L183-A187 PolarHBondContact O-N 3.23Å
184A96.6Very high94.9Very high0 Ų055.1 Ų55.10%030%0.304CS..Hα-helixtrans-70.8-40.9173.700000112.2A151 A180 A181 Q182 A187 G188 F189 V192 A193A151-A184 HydrophobicContact CB-CB 4.18Å; A151-A184 WeakPolarHBondContact O-CB 3.5Å; A180-A184 PolarHBondContact O-N 3.4Å; A181-A184 WeakPolarHBondContact O-CB 3.46Å; A181-A184 PolarHBondContact O-N 2.81Å; Q182-A184 VanDerWaalsContact C-N 3.29Å; Q182-A184 PolarHBondContact O-N 3.4Å; A184-A187 PolarHBondContact O-N 3.3Å; A184-G188 PolarHBondContact O-N 3.06Å; A184-F189 PolarHBondContact O-N 2.84Å; A184-V192 HydrophobicContact CB-CB 4.26Å; A184-V192 HydrophobicContact CB-CG1 4.22Å; A184-A193 HydrophobicContact CB-CB 4Å
185E96.2Very high94.9Very high85 Ų8556.5 Ų56.540%0.39731%0.311SS..Hα-helixtrans-62.1-45.5175.9-73177.5160.200111.7A181 Q182 A187 G188 A193 R197A181-E185 WeakPolarHBondContact O-CG 2.94Å; A181-E185 PolarHBondContact O-N 3.23Å; Q182-E185 PolarHBondContact O-N 3.13Å; E185-A187 VanDerWaalsContact C-N 3.28Å; E185-A187 PolarHBondContact O-N 3.05Å; E185-G188 PolarHBondContact O-N 2.46Å; E185-G188 VanDerWaalsContact O-N 3.11Å; E185-A193 HydrophobicContact CG-CB 3.55Å; E185-R197 IonicContact OE1-CZ 2.87Å; E185-R197 IonicContact OE1-NH1 3.51Å; E185-R197 PolarHBondContact OE1-NH1 3.44Å; E185-R197 IonicContact OE1-NH2 3.87Å; E185-R197 PolarHBondContact OE1-NH2 2.75Å; E185-R197 IonicContact OE2-CZ 2.79Å; E185-R197 IonicContact OE2-NH2 3.6Å; E185-R197 PolarHBondContact OE2-NH2 3.24Å
186E95.8Very high94.9Very high112 Ų11250.9 Ų50.952%0.52328%0.282SS..Hα-helixtrans-63.9-32.6177-73.3179.8167.900113.3R178 Q182 G188R178-E186 WeakPolarHBondContact CD-OE1 3.48Å; R178-E186 WeakPolarHBondContact CD-OE2 3.49Å; R178-E186 IonicContact CZ-OE1 3.5Å; R178-E186 IonicContact CZ-OE2 2.78Å; R178-E186 VanDerWaalsContact CZ-OE2 3.24Å; R178-E186 IonicContact NE-OE1 2.92Å; R178-E186 IonicContact NE-OE2 2.62Å; R178-E186 IonicContact NH1-OE1 3.29Å; R178-E186 PolarHBondContact NH1-OE1 3.05Å; R178-E186 IonicContact NH1-OE2 3.95Å; R178-E186 PolarHBondContact NH1-OE2 3.25Å; Q182-E186 WeakPolarHBondContact O-CB 3.18Å; Q182-E186 VanDerWaalsContact O-CG 3.31Å; Q182-E186 WeakPolarHBondContact O-CG 3.34Å; Q182-E186 PolarHBondContact O-N 2.96Å; E186-G188 VanDerWaalsContact C-N 3.28Å
187A95.7Very high94.8Very high42 Ų4253.7 Ų53.735%0.34728%0.281SS..Hα-helixtrans-79.4-8.8176.600000113.5R152 L183 A184 E185 F189R152-A187 HydrophobicContact CG-CB 4.16Å; R152-A187 VanDerWaalsContact O-CB 3.24Å; R152-A187 WeakPolarHBondContact O-CB 3.4Å; L183-A187 WeakPolarHBondContact O-CB 3.29Å; L183-A187 PolarHBondContact O-N 3.23Å; A184-A187 PolarHBondContact O-N 3.3Å; E185-A187 VanDerWaalsContact C-N 3.28Å; E185-A187 PolarHBondContact O-N 3.05Å; A187-F189 HydrophobicContact CB-CD2 3.71Å; A187-F189 HydrophobicContact CB-CE2 3.94Å
188G96.3Very high94.6Very high53 Ų5357.3 Ų57.355%0.54629%0.286SS..THydrogen-bonded Turntrans89.122-179.600000114.8A184 E185 E186 P190A184-G188 PolarHBondContact O-N 3.06Å; E185-G188 PolarHBondContact O-N 2.46Å; E185-G188 VanDerWaalsContact O-N 3.11Å; E186-G188 VanDerWaalsContact C-N 3.28Å; G188-P190 WeakPolarHBondContact O-CD 3.12Å
189F96.9Very high94.1Very high80 Ų8055.4 Ų55.435%0.35128%0.284SS..  trans-113.568.2179-56.5-64.1000112.3R152 G154 A184 A187 E191 V192 A193R152-F189 WeakPolarHBondContact O-CE2 3.47Å; G154-F189 VanDerWaalsContact CA-CG 3.46Å; A184-F189 PolarHBondContact O-N 2.84Å; A187-F189 HydrophobicContact CB-CD2 3.71Å; A187-F189 HydrophobicContact CB-CE2 3.94Å; F189-E191 VanDerWaalsContact C-N 3.25Å; F189-E191 PolarHBondContact O-N 3.03Å; F189-V192 HydrophobicContact CB-CB 4.15Å; F189-V192 HydrophobicContact CB-CG2 4.15Å; F189-V192 PolarHBondContact O-N 3.15Å; F189-V192 VanDerWaalsContact O-N 3.14Å; F189-A193 PolarHBondContact O-N 3.2Å; F189-A193 VanDerWaalsContact O-N 3.16Å
190P95.1Very high92.8Very high90 Ų9061 Ų6158%0.58431%0.308SS*.Hα-helixtrans-63.7-29.4-176.527.2-35.7000113.1G188 V192 A193 R194G188-P190 WeakPolarHBondContact O-CD 3.12Å; P190-V192 VanDerWaalsContact C-N 3.32Å; P190-V192 PolarHBondContact O-N 3.16Å; P190-A193 WeakPolarHBondContact O-CB 3.48Å; P190-A193 PolarHBondContact O-N 3.01Å; P190-R194 WeakPolarHBondContact O-CB 3.26Å; P190-R194 PolarHBondContact O-N 3.33Å
191E95.4Very high91.1Very high105 Ų10563.2 Ų63.249%0.49133%0.331SS..Hα-helixtrans-63.1-39.6176.2-174.257.3-147.800111.8F189 R194 M195F189-E191 VanDerWaalsContact C-N 3.25Å; F189-E191 PolarHBondContact O-N 3.03Å; E191-R194 PolarHBondContact O-N 3.14Å; E191-R194 IonicContact OE1-CZ 3.46Å; E191-R194 IonicContact OE1-NE 2.6Å; E191-R194 IonicContact OE1-NH2 2.67Å; E191-R194 PolarHBondContact OE1-NH2 2.82Å; E191-R194 IonicContact OE2-CZ 3.29Å; E191-R194 VanDerWaalsContact OE2-CZ 3.29Å; E191-R194 IonicContact OE2-NE 3.24Å; E191-R194 IonicContact OE2-NH2 2.86Å; E191-R194 PolarHBondContact OE2-NH2 3.02Å; E191-M195 PolarHBondContact O-N 3.03Å
192V96.2Very high89.2Confident9 Ų968.8 Ų68.86%0.05536%0.356CS..Hα-helixtrans-71.7-38.6176.8178.80000110.6A151 V159 A184 F189 P190 R194 M195 V196A151-V192 HydrophobicContact CB-CG1 4.27Å; V159-V192 HydrophobicContact CB-CG1 4.36Å; V159-V192 HydrophobicContact CG1-CG1 4.31Å; V159-V192 HydrophobicContact CG2-CG1 3.76Å; A184-V192 HydrophobicContact CB-CB 4.26Å; A184-V192 HydrophobicContact CB-CG1 4.22Å; F189-V192 HydrophobicContact CB-CB 4.15Å; F189-V192 HydrophobicContact CB-CG2 4.15Å; F189-V192 PolarHBondContact O-N 3.15Å; F189-V192 VanDerWaalsContact O-N 3.14Å; P190-V192 VanDerWaalsContact C-N 3.32Å; P190-V192 PolarHBondContact O-N 3.16Å; V192-R194 VanDerWaalsContact C-N 3.31Å; V192-R194 PolarHBondContact O-N 3.41Å; V192-M195 WeakPolarHBondContact O-CB 3.27Å; V192-M195 PolarHBondContact O-N 2.86Å; V192-V196 WeakPolarHBondContact O-CG2 3.02Å; V192-V196 PolarHBondContact O-N 2.82Å
193A95.4Very high86.9Confident1 Ų170.6 Ų70.61%0.00837%0.373CS..Hα-helixtrans-60.6-41.6173.400000112.1A181 A184 E185 F189 P190 V196 R197A181-A193 HydrophobicContact CB-CB 4.36Å; A181-A193 WeakPolarHBondContact O-CB 3.31Å; A184-A193 HydrophobicContact CB-CB 4Å; E185-A193 HydrophobicContact CG-CB 3.55Å; F189-A193 PolarHBondContact O-N 3.2Å; F189-A193 VanDerWaalsContact O-N 3.16Å; P190-A193 WeakPolarHBondContact O-CB 3.48Å; P190-A193 PolarHBondContact O-N 3.01Å; A193-V196 PolarHBondContact O-N 3.5Å; A193-R197 WeakPolarHBondContact O-CG 3.29Å; A193-R197 PolarHBondContact O-N 2.97Å
194R94.9Very high84.4Confident122 Ų12280.6 Ų80.646%0.4641%0.411SS..Hα-helixtrans-60.9-48.6173.6-175.7175.669.7174.43.6111.3P190 E191 V192 V196 R197 E198P190-R194 WeakPolarHBondContact O-CB 3.26Å; P190-R194 PolarHBondContact O-N 3.33Å; E191-R194 PolarHBondContact O-N 3.14Å; E191-R194 IonicContact OE1-CZ 3.46Å; E191-R194 IonicContact OE1-NE 2.6Å; E191-R194 IonicContact OE1-NH2 2.67Å; E191-R194 PolarHBondContact OE1-NH2 2.82Å; E191-R194 IonicContact OE2-CZ 3.29Å; E191-R194 VanDerWaalsContact OE2-CZ 3.29Å; E191-R194 IonicContact OE2-NE 3.24Å; E191-R194 IonicContact OE2-NH2 2.86Å; E191-R194 PolarHBondContact OE2-NH2 3.02Å; V192-R194 VanDerWaalsContact C-N 3.31Å; V192-R194 PolarHBondContact O-N 3.41Å; R194-V196 VanDerWaalsContact C-N 3.3Å; R194-V196 PolarHBondContact O-N 3.31Å; R194-R197 PolarHBondContact O-N 3.23Å; R194-R197 VanDerWaalsContact O-N 3.15Å; R194-E198 VanDerWaalsContact CD-OE1 3.28Å; R194-E198 WeakPolarHBondContact CD-OE1 3.24Å; R194-E198 HydrophobicContact CG-CG 4.04Å; R194-E198 WeakPolarHBondContact CG-OE1 3.4Å; R194-E198 WeakPolarHBondContact CG-OE2 3.31Å; R194-E198 WeakPolarHBondContact O-CB 3.5Å; R194-E198 WeakPolarHBondContact O-CG 3.46Å; R194-E198 PolarHBondContact O-N 2.87Å
195M93.1Very high81.8Confident46 Ų4684.1 Ų84.123%0.22744%0.436CS..Hα-helixtrans-55.2-42.7177-175.8-174.6-67.600112.4G156 V159 S160 E191 V192 S199G156-M195 VanDerWaalsContact O-SD 3.4Å; V159-M195 HydrophobicContact CB-SD 4.09Å; V159-M195 HydrophobicContact CG1-CG 4.26Å; V159-M195 HydrophobicContact CG1-SD 3.74Å; S160-M195 PolarHBondContact OG-SD 3.13Å; E191-M195 PolarHBondContact O-N 3.03Å; V192-M195 WeakPolarHBondContact O-CB 3.27Å; V192-M195 PolarHBondContact O-N 2.86Å; M195-S199 WeakPolarHBondContact O-CB 3.46Å; M195-S199 PolarHBondContact O-N 3.18Å; M195-S199 PolarHBondContact O-OG 3.42Å
196V92.3Very high79.5Confident3 Ų384.9 Ų84.92%0.01845%0.448CS..Hα-helixtrans-67-44.1177.41760000111.6V159 L163 W169 A180 A181 V192 A193 R194V159-V196 HydrophobicContact CG1-CG2 3.74Å; L163-V196 HydrophobicContact CD1-CG2 4.27Å; W169-V196 HydrophobicContact CB-CG1 4.3Å; W169-V196 HydrophobicContact CE3-CG1 4.29Å; A180-V196 HydrophobicContact CB-CG1 4.38Å; A181-V196 HydrophobicContact CB-CB 4.37Å; A181-V196 HydrophobicContact CB-CG1 4.27Å; V192-V196 WeakPolarHBondContact O-CG2 3.02Å; V192-V196 PolarHBondContact O-N 2.82Å; A193-V196 PolarHBondContact O-N 3.5Å; R194-V196 VanDerWaalsContact C-N 3.3Å; R194-V196 PolarHBondContact O-N 3.31Å
197R90.8Very high77.2Confident134 Ų13487.9 Ų87.951%0.50646%0.462SS..Hα-helixtrans-68.6-36.8-179.3-73.3-178.3-179.6151.88.5113.5A181 E185 A193 R194 S199A181-R197 HydrophobicContact CB-CG 4Å; E185-R197 IonicContact OE1-CZ 2.87Å; E185-R197 IonicContact OE1-NH1 3.51Å; E185-R197 PolarHBondContact OE1-NH1 3.44Å; E185-R197 IonicContact OE1-NH2 3.87Å; E185-R197 PolarHBondContact OE1-NH2 2.75Å; E185-R197 IonicContact OE2-CZ 2.79Å; E185-R197 IonicContact OE2-NH2 3.6Å; E185-R197 PolarHBondContact OE2-NH2 3.24Å; A193-R197 WeakPolarHBondContact O-CG 3.29Å; A193-R197 PolarHBondContact O-N 2.97Å; R194-R197 PolarHBondContact O-N 3.23Å; R194-R197 VanDerWaalsContact O-N 3.15Å; R197-S199 VanDerWaalsContact C-N 3.35Å
198E88.7Confident74.8Confident120 Ų12092.7 Ų92.756%0.56148%0.482SS*.Hα-helixtrans-84.3-10.5-177.9-68.7177177.100113R194 H200R194-E198 VanDerWaalsContact CD-OE1 3.28Å; R194-E198 WeakPolarHBondContact CD-OE1 3.24Å; R194-E198 HydrophobicContact CG-CG 4.04Å; R194-E198 WeakPolarHBondContact CG-OE1 3.4Å; R194-E198 WeakPolarHBondContact CG-OE2 3.31Å; R194-E198 WeakPolarHBondContact O-CB 3.5Å; R194-E198 WeakPolarHBondContact O-CG 3.46Å; R194-E198 PolarHBondContact O-N 2.87Å; E198-H200 PolarHBondContact O-N 3.28Å
199S81.6Confident72.1Confident29 Ų29100.1 Ų100.120%0.20349%0.493CS..  trans-70.9106-178-75.80000111.7L163 W169 M195 R197 G201L163-S199 VanDerWaalsContact CD1-OG 3.26Å; L163-S199 WeakPolarHBondContact CD1-OG 3.3Å; W169-S199 WeakPolarHBondContact CZ2-O 3.34Å; M195-S199 WeakPolarHBondContact O-CB 3.46Å; M195-S199 PolarHBondContact O-N 3.18Å; M195-S199 PolarHBondContact O-OG 3.42Å; R197-S199 VanDerWaalsContact C-N 3.35Å; S199-G201 PolarHBondContact O-N 3.19Å
200H67.1Low69.6Low166 Ų166100.5 Ų100.577%0.76951%0.505SS*.  trans-69.5101.4164.5-54.7-63.2000108.1E198 E202E198-H200 PolarHBondContact O-N 3.28Å; H200-E202 PolarHBondContact O-N 3.45Å
201G59.9Low67.5Low50 Ų50101.7 Ų101.752%0.51551%0.514SS..SBendtrans-42.8127.5-177.800000112.3S199S199-G201 PolarHBondContact O-N 3.19Å
202E53.8Low65.3Low119 Ų119102.4 Ų102.456%0.55653%0.525SS*.  trans63.878.3-178.8-62.8176.5-178.800116.3H200 R204H200-E202 PolarHBondContact O-N 3.45Å; E202-R204 PolarHBondContact O-N 3.28Å
203T46.8Very low63.4Low116 Ų116104.8 Ų104.871%0.71254%0.541SS*.  trans-70.388.3145.4-56.10000107.3S205T203-S205 PolarHBondContact O-N 3.34Å
204R43.2Very low61.9Low210 Ų210108.4 Ų108.479%0.79257%0.566SS**  trans-50.7110.1166.4-75.6-174.4169.3-164.3-4.2107.6E202 P206E202-R204 PolarHBondContact O-N 3.28Å; R204-P206 WeakPolarHBondContact O-CD 3.34Å; R204-P206 VanDerWaalsContact O-N 3.13Å
205S43.5Very low61Low75 Ų75107.7 Ų107.752%0.52457%0.571SS.*  trans-50.8122.5169.9175.30000107.8T203 E207T203-S205 PolarHBondContact O-N 3.34Å; S205-E207 PolarHBondContact O-N 3.24Å
206P47.7Very low60.4Low100 Ų100110.4 Ų110.465%0.64958%0.583SS**G310 helixtrans-65.4-4.4-175.724.6-32.6000113.5R204R204-P206 WeakPolarHBondContact O-CD 3.34Å; R204-P206 VanDerWaalsContact O-N 3.13Å
207E47.7Very low60.2Low175 Ų175115.8 Ų115.882%0.81860%0.604SS**G310 helixtrans-89.2-5.1-171-50-170.5167.600113.9S205S205-E207 PolarHBondContact O-N 3.24Å
208N45.4Very low60.1Low144 Ų144109.9 Ų109.977%0.7758%0.583SS**G310 helixtrans-121.835.8170.4-150.16.9000112S210N208-S210 VanDerWaalsContact C-N 3.27Å; N208-S210 PolarHBondContact O-N 2.64Å
209R39.5Very low60Low209 Ų209112 Ų11279%0.78959%0.593SS**  trans-67.198.1153.1-82.4-173.4178.3-1680.1106.4
210S44Very low60.1Low87 Ų87115.1 Ų115.161%0.60861%0.607SS**  trans-38.3128.1149.5-47.80000106.8N208 T212N208-S210 VanDerWaalsContact C-N 3.27Å; N208-S210 PolarHBondContact O-N 2.64Å; S210-T212 PolarHBondContact O-N 3.07Å
211P51.7Low61Low116 Ų116108.2 Ų108.275%0.75358%0.577SS**  trans-49.5125.3-177.220.3-31000106.5P213P211-P213 WeakPolarHBondContact O-CA 3.47Å; P211-P213 WeakPolarHBondContact O-CD 3.41Å
212T49Very low62.1Low120 Ų120111.4 Ų111.474%0.73658%0.583SS**  trans-32.3106.2-179.9380000108.3S210 S214S210-T212 PolarHBondContact O-N 3.07Å; T212-S214 PolarHBondContact O-N 3.42Å
213P54.9Low63.6Low58 Ų58109 Ų10938%0.37758%0.576SS.*  trans-59.4118-16919.2-30.8000106.2P211 L215 Q226P211-P213 WeakPolarHBondContact O-CA 3.47Å; P211-P213 WeakPolarHBondContact O-CD 3.41Å; P213-L215 PolarHBondContact O-N 3.16Å; P213-Q226 HydrophobicContact CB-CB 4.1Å; P213-Q226 WeakPolarHBondContact CB-O 3.4Å; P213-Q226 HydrophobicContact CG-CB 3.69Å; P213-Q226 HydrophobicContact CG-CG 3.99Å
214S64.6Low65.5Low78 Ų78109.4 Ų109.455%0.54557%0.57SS.*  trans-48.9120178.153.10000107.2T212 Q216T212-S214 PolarHBondContact O-N 3.42Å; S214-Q216 WeakPolarHBondContact O-CG 3.49Å; S214-Q216 PolarHBondContact O-N 3.49Å; S214-Q216 PolarHBondContact OG-NE2 3.46Å
215L76.3Confident67.6Low107 Ų107101.3 Ų101.356%0.5654%0.54SS*.  trans-57.3107.6175.7-78.3158.3000107.8P213 H224 Q226P213-L215 PolarHBondContact O-N 3.16Å; L215-H224 HydrophobicContact CB-CB 4.49Å; L215-H224 HydrophobicContact CD2-CB 3.94Å; L215-Q226 HydrophobicContact CD2-CG 3.78Å; L215-Q226 HydrophobicContact CG-CG 4.42Å
216Q80.7Confident69.4Low103 Ų103103.1 Ų103.148%0.48154%0.541SS..EExtended strand (participates in β ladder)trans-91.4139.4174.9-64.9-64-35.700107.9S214 H224 F225S214-Q216 WeakPolarHBondContact O-CG 3.49Å; S214-Q216 PolarHBondContact O-N 3.49Å; S214-Q216 PolarHBondContact OG-NE2 3.46Å; Q216-H224 CarbonylContact O-C 3.56Å; Q216-H224 VanDerWaalsContact O-CA 3.31Å; Q216-H224 WeakPolarHBondContact O-CA 3.45Å; Q216-F225 HydrophobicContact CB-CD1 4.45Å; Q216-F225 HydrophobicContact CB-CD2 4.39Å; Q216-F225 HydrophobicContact CB-CE1 3.88Å; Q216-F225 HydrophobicContact CB-CE2 3.85Å; Q216-F225 HydrophobicContact CB-CZ 3.56Å; Q216-F225 PolarHBondContact N-O 2.95Å; Q216-F225 VanDerWaalsContact O-CD1 3.28Å; Q216-F225 WeakPolarHBondContact O-CD1 3.42Å; Q216-F225 PolarHBondContact O-N 3.17Å
217Y88.2Confident71Confident115 Ų115104 Ų10445%0.45154%0.54SS..EExtended strand (participates in β ladder)trans-94.5132.5177-176.9-104.6000109.9E219 D222 H224Y217-E219 HydrophobicContact CD1-CG 4.41Å; Y217-E219 HydrophobicContact CE1-CG 4.41Å; Y217-D222 WeakPolarHBondContact OH-CA 3.42Å; Y217-D222 PolarHBondContact OH-OD1 3.21Å; Y217-H224 AromaticContact CD2-CE1 3.6Å; Y217-H224 AromaticContact CD2-ND1 3.87Å; Y217-H224 AromaticContact CD2-NE2 3.68Å
218C88.9Confident72.7Confident10 Ų10101 Ų1017%0.06854%0.538CS..EExtended strand (participates in β ladder)trans-100.3115.3173.1-175.10000110.6N220 C221 D222 T223 F225 H230 H236C218-N220 PolarHBondContact O-N 3.41Å; C218-C221 HydrophobicContact CB-CB 4.12Å; C218-C221 PolarHBondContact O-N 3.32Å; C218-D222 WeakPolarHBondContact O-CA 3.18Å; C218-D222 PolarHBondContact O-N 3.34Å; C218-T223 PolarHBondContact N-O 2.72Å; C218-F225 HydrophobicContact CB-CD1 3.84Å; C218-F225 HydrophobicContact CB-CE1 3.69Å; C218-H230 VanDerWaalsContact CB-NE2 3.29Å; C218-H230 WeakPolarHBondContact CB-NE2 3.26Å; C218-H230 PolarHBondContact SG-NE2 3.42Å; C218-H230 VanDerWaalsContact SG-NE2 3.41Å; C218-H236 PolarHBondContact SG-CE1 3.05Å; C218-H236 PolarHBondContact SG-ND1 2.91Å
219E86.2Confident74.5Confident166 Ų16699.2 Ų99.278%0.77653%0.529SS*.THydrogen-bonded Turntrans-65.4-19.7176.4-61.6-177.4165.300113.8Y217Y217-E219 HydrophobicContact CD1-CG 4.41Å; Y217-E219 HydrophobicContact CE1-CG 4.41Å
220N83.4Confident76.9Confident94 Ų9490.2 Ų90.250%0.50350%0.496SS..THydrogen-bonded Turntrans-87.4-24.4178.6-62.994.3000113.2C218 L240C218-N220 PolarHBondContact O-N 3.41Å; N220-L240 HydrophobicContact CB-CD2 3.72Å; N220-L240 VanDerWaalsContact ND2-CD2 3.35Å; N220-L240 WeakPolarHBondContact ND2-CD2 3.47Å
221C85.6Confident78.7Confident21 Ų2195 Ų9514%0.14250%0.5CS..THydrogen-bonded Turntrans-111.3-3.4-176.9-62.20000112.6C218 T223 H236C218-C221 HydrophobicContact CB-CB 4.12Å; C218-C221 PolarHBondContact O-N 3.32Å; C221-T223 WeakPolarHBondContact CB-OG1 3.42Å; C221-T223 WeakPolarHBondContact O-CG2 3.35Å; C221-T223 PolarHBondContact O-N 3.05Å; C221-T223 PolarHBondContact O-OG1 3.29Å; C221-T223 VanDerWaalsContact O-OG1 3.11Å; C221-H236 PolarHBondContact SG-ND1 2.76Å
222D83.8Confident80.4Confident117 Ų11794.5 Ų94.563%0.62650%0.495SS*.THydrogen-bonded Turntrans44.135.7-171.6-66.4-26.9000113.7Y217 C218Y217-D222 WeakPolarHBondContact OH-CA 3.42Å; Y217-D222 PolarHBondContact OH-OD1 3.21Å; C218-D222 WeakPolarHBondContact O-CA 3.18Å; C218-D222 PolarHBondContact O-N 3.34Å
223T84.6Confident82.2Confident69 Ų6990.5 Ų90.542%0.42347%0.472SS..EExtended strand (participates in β ladder)trans-135.1146.9-174.243.70000111.5C218 C221C218-T223 PolarHBondContact N-O 2.72Å; C221-T223 WeakPolarHBondContact CB-OG1 3.42Å; C221-T223 WeakPolarHBondContact O-CG2 3.35Å; C221-T223 PolarHBondContact O-N 3.05Å; C221-T223 PolarHBondContact O-OG1 3.29Å; C221-T223 VanDerWaalsContact O-OG1 3.11Å
224H87.1Confident83.6Confident123 Ų12393.6 Ų93.657%0.56949%0.49SS*.EExtended strand (participates in β ladder)trans-83.5134.7170.6-65.8-84.4000110.1L215 Q216 Y217L215-H224 HydrophobicContact CB-CB 4.49Å; L215-H224 HydrophobicContact CD2-CB 3.94Å; Q216-H224 CarbonylContact O-C 3.56Å; Q216-H224 VanDerWaalsContact O-CA 3.31Å; Q216-H224 WeakPolarHBondContact O-CA 3.45Å; Y217-H224 AromaticContact CD2-CE1 3.6Å; Y217-H224 AromaticContact CD2-ND1 3.87Å; Y217-H224 AromaticContact CD2-NE2 3.68Å
225F86.5Confident84.6Confident40 Ų4093 Ų9318%0.17549%0.49CS..EExtended strand (participates in β ladder)trans-128.4154.4178.466.1-89.4000111Q216 C218 D227 H230Q216-F225 HydrophobicContact CB-CD1 4.45Å; Q216-F225 HydrophobicContact CB-CD2 4.39Å; Q216-F225 HydrophobicContact CB-CE1 3.88Å; Q216-F225 HydrophobicContact CB-CE2 3.85Å; Q216-F225 HydrophobicContact CB-CZ 3.56Å; Q216-F225 PolarHBondContact N-O 2.95Å; Q216-F225 VanDerWaalsContact O-CD1 3.28Å; Q216-F225 WeakPolarHBondContact O-CD1 3.42Å; Q216-F225 PolarHBondContact O-N 3.17Å; C218-F225 HydrophobicContact CB-CD1 3.84Å; C218-F225 HydrophobicContact CB-CE1 3.69Å; F225-D227 VanDerWaalsContact CD2-O 3.29Å; F225-D227 WeakPolarHBondContact CD2-O 3.19Å; F225-H230 HydrophobicContact CB-CB 3.91Å; F225-H230 HydrophobicContact CD1-CB 4.13Å; F225-H230 AromaticContact CD1-CD2 3.3Å; F225-H230 WeakPolarHBondContact CD1-CD2 3.33Å; F225-H230 AromaticContact CD1-CE1 3.97Å; F225-H230 AromaticContact CD1-CG 3.52Å; F225-H230 AromaticContact CD1-ND1 3.94Å; F225-H230 AromaticContact CD1-NE2 3.64Å; F225-H230 HydrophobicContact CD2-CB 3.19Å; F225-H230 AromaticContact CD2-CD2 3.99Å; F225-H230 AromaticContact CD2-CG 3.57Å; F225-H230 HydrophobicContact CE1-CB 4.48Å; F225-H230 AromaticContact CE1-CD2 3.44Å; F225-H230 VanDerWaalsContact CE1-CD2 3.44Å; F225-H230 WeakPolarHBondContact CE1-CD2 3.39Å; F225-H230 AromaticContact CE1-NE2 3.99Å; F225-H230 HydrophobicContact CE2-CB 3.6Å; F225-H230 HydrophobicContact CG-CB 3.47Å; F225-H230 VanDerWaalsContact CG-CB 3.47Å; F225-H230 AromaticContact CG-CD2 3.6Å; F225-H230 AromaticContact CG-CG 3.28Å; F225-H230 AromaticContact CG-ND1 3.7Å; F225-H230 HydrophobicContact CZ-CB 4.23Å; F225-H230 AromaticContact CZ-CD2 3.81Å
226Q82.5Confident85.1Confident114 Ų11488.2 Ų88.253%0.53347%0.465SS..  trans-110.8-22.4177.2-71.1179.63200112.1P213 L215P213-Q226 HydrophobicContact CB-CB 4.1Å; P213-Q226 WeakPolarHBondContact CB-O 3.4Å; P213-Q226 HydrophobicContact CG-CB 3.69Å; P213-Q226 HydrophobicContact CG-CG 3.99Å; L215-Q226 HydrophobicContact CD2-CG 3.78Å; L215-Q226 HydrophobicContact CG-CG 4.42Å
227D80.9Confident85.3Confident119 Ų11987.9 Ų87.964%0.63647%0.465SS*.  trans-78.9133.2-173.7-57.5-38.8000111.7F225 N229 H230F225-D227 VanDerWaalsContact CD2-O 3.29Å; F225-D227 WeakPolarHBondContact CD2-O 3.19Å; D227-N229 PolarHBondContact O-N 2.93Å; D227-N229 VanDerWaalsContact O-N 3.13Å; D227-H230 WeakPolarHBondContact O-CB 3.45Å; D227-H230 PolarHBondContact O-N 3.29Å
228S82.6Confident85Confident112 Ų11287.4 Ų87.478%0.78347%0.47SS*.THydrogen-bonded Turntrans-58.9-25.2171.659.70000112.8
229N84.2Confident84.7Confident106 Ų10689.1 Ų89.157%0.56748%0.483SS*.THydrogen-bonded Turntrans-958.9-175.3-59-14.3000112.8D227 R231 T232 S233D227-N229 PolarHBondContact O-N 2.93Å; D227-N229 VanDerWaalsContact O-N 3.13Å; N229-R231 VanDerWaalsContact C-N 3.26Å; N229-R231 PolarHBondContact O-N 3.06Å; N229-T232 PolarHBondContact O-N 3.04Å; N229-T232 PolarHBondContact O-OG1 3.44Å; N229-S233 PolarHBondContact O-N 3.09Å
230H88.7Confident84.4Confident20 Ų2085 Ų859%0.09347%0.465CS..G310 helixtrans-51.6-45.7179.817176.3000112.2C218 F225 D227 T232 S233 H236C218-H230 VanDerWaalsContact CB-NE2 3.29Å; C218-H230 WeakPolarHBondContact CB-NE2 3.26Å; C218-H230 PolarHBondContact SG-NE2 3.42Å; C218-H230 VanDerWaalsContact SG-NE2 3.41Å; F225-H230 HydrophobicContact CB-CB 3.91Å; F225-H230 HydrophobicContact CD1-CB 4.13Å; F225-H230 AromaticContact CD1-CD2 3.3Å; F225-H230 WeakPolarHBondContact CD1-CD2 3.33Å; F225-H230 AromaticContact CD1-CE1 3.97Å; F225-H230 AromaticContact CD1-CG 3.52Å; F225-H230 AromaticContact CD1-ND1 3.94Å; F225-H230 AromaticContact CD1-NE2 3.64Å; F225-H230 HydrophobicContact CD2-CB 3.19Å; F225-H230 AromaticContact CD2-CD2 3.99Å; F225-H230 AromaticContact CD2-CG 3.57Å; F225-H230 HydrophobicContact CE1-CB 4.48Å; F225-H230 AromaticContact CE1-CD2 3.44Å; F225-H230 VanDerWaalsContact CE1-CD2 3.44Å; F225-H230 WeakPolarHBondContact CE1-CD2 3.39Å; F225-H230 AromaticContact CE1-NE2 3.99Å; F225-H230 HydrophobicContact CE2-CB 3.6Å; F225-H230 HydrophobicContact CG-CB 3.47Å; F225-H230 VanDerWaalsContact CG-CB 3.47Å; F225-H230 AromaticContact CG-CD2 3.6Å; F225-H230 AromaticContact CG-CG 3.28Å; F225-H230 AromaticContact CG-ND1 3.7Å; F225-H230 HydrophobicContact CZ-CB 4.23Å; F225-H230 AromaticContact CZ-CD2 3.81Å; D227-H230 WeakPolarHBondContact O-CB 3.45Å; D227-H230 PolarHBondContact O-N 3.29Å; H230-T232 PolarHBondContact O-N 3.31Å; H230-S233 VanDerWaalsContact O-CB 3.29Å; H230-S233 WeakPolarHBondContact O-CB 3.35Å; H230-S233 PolarHBondContact O-N 3.1Å; H230-S233 PolarHBondContact O-OG 3Å; H230-H236 AromaticContact CD2-ND1 3.73Å; H230-H236 AromaticContact NE2-CG 3.98Å; H230-H236 AromaticContact NE2-ND1 3.21Å; H230-H236 PolarHBondContact NE2-ND1 2.95Å; H230-H236 WeakPolarHBondContact O-CB 3.5Å
231R82.8Confident83.8Confident186 Ų18683.8 Ų83.870%0.70246%0.464SS*.G310 helixtrans-65.3-20.2-178-59.3-176.383.51617114.3N229 H236N229-R231 VanDerWaalsContact C-N 3.26Å; N229-R231 PolarHBondContact O-N 3.06Å; R231-H236 PolarHBondContact O-CD2 3.28Å
232T86.9Confident82.8Confident106 Ų10689.8 Ų89.865%0.6549%0.49SS*.G310 helixtrans-103.7-6175.555.40000112.7N229 H230N229-T232 PolarHBondContact O-N 3.04Å; N229-T232 PolarHBondContact O-OG1 3.44Å; H230-T232 PolarHBondContact O-N 3.31Å
233S87.1Confident81.6Confident37 Ų3786 Ų8626%0.25948%0.478SS..SBendtrans-62144.2178.276.70000110.7N229 H230 A235 H236 L237N229-S233 PolarHBondContact O-N 3.09Å; H230-S233 VanDerWaalsContact O-CB 3.29Å; H230-S233 WeakPolarHBondContact O-CB 3.35Å; H230-S233 PolarHBondContact O-N 3.1Å; H230-S233 PolarHBondContact O-OG 3Å; S233-A235 PolarHBondContact O-N 3.32Å; S233-H236 PolarHBondContact O-N 3Å; S233-H236 VanDerWaalsContact O-N 3.15Å; S233-H236 WeakPolarHBondContact OG-CB 3.41Å; S233-H236 PolarHBondContact OG-N 2.97Å; S233-H236 VanDerWaalsContact OG-N 3.14Å; S233-L237 WeakPolarHBondContact O-CG 3.32Å; S233-L237 PolarHBondContact O-N 3.17Å
234T84.3Confident80.2Confident123 Ų12389.1 Ų89.176%0.75550%0.5SS*.Hα-helixtrans-56.4-33.1174.7510000111.7L238T234-L238 WeakPolarHBondContact O-CB 3.48Å; T234-L238 PolarHBondContact O-N 3.42Å
235A85.1Confident78.6Confident64 Ų6490.2 Ų90.253%0.52951%0.505SS..Hα-helixtrans-63.3-48.4176.200000112.2S233 L238 S239S233-A235 PolarHBondContact O-N 3.32Å; A235-L238 PolarHBondContact O-N 3.45Å; A235-S239 PolarHBondContact O-N 3.34Å; A235-S239 PolarHBondContact O-OG 3.32Å
236H87Confident76.8Confident8 Ų891.7 Ų91.74%0.03752%0.519CS..Hα-helixtrans-63.7-44.6176.7179.686.1000111.9C218 C221 H230 R231 S233 L238 S239 L240C218-H236 PolarHBondContact SG-CE1 3.05Å; C218-H236 PolarHBondContact SG-ND1 2.91Å; C221-H236 PolarHBondContact SG-ND1 2.76Å; H230-H236 AromaticContact CD2-ND1 3.73Å; H230-H236 AromaticContact NE2-CG 3.98Å; H230-H236 AromaticContact NE2-ND1 3.21Å; H230-H236 PolarHBondContact NE2-ND1 2.95Å; H230-H236 WeakPolarHBondContact O-CB 3.5Å; R231-H236 PolarHBondContact O-CD2 3.28Å; S233-H236 PolarHBondContact O-N 3Å; S233-H236 VanDerWaalsContact O-N 3.15Å; S233-H236 WeakPolarHBondContact OG-CB 3.41Å; S233-H236 PolarHBondContact OG-N 2.97Å; S233-H236 VanDerWaalsContact OG-N 3.14Å; H236-L238 VanDerWaalsContact C-N 3.26Å; H236-L238 PolarHBondContact O-N 3.46Å; H236-S239 PolarHBondContact O-N 3.12Å; H236-L240 WeakPolarHBondContact O-CG 3.42Å; H236-L240 PolarHBondContact O-N 3.39Å
237L85.2Confident75.3Confident95 Ų9592.1 Ų92.150%0.49753%0.531SS..Hα-helixtrans-61-35.5176.8-65.9175.3000112.3S233 L240 S241S233-L237 WeakPolarHBondContact O-CG 3.32Å; S233-L237 PolarHBondContact O-N 3.17Å; L237-L240 HydrophobicContact CD2-CD1 4.44Å; L237-L240 PolarHBondContact O-N 3Å; L237-S241 PolarHBondContact O-N 3.05Å; L237-S241 VanDerWaalsContact O-N 3.16Å
238L82.3Confident73.8Confident105 Ų10592.9 Ų92.955%0.5554%0.535SS..Hα-helixtrans-70.5-42177-152.377.4000111.6T234 A235 H236 L240 S241 Q242T234-L238 WeakPolarHBondContact O-CB 3.48Å; T234-L238 PolarHBondContact O-N 3.42Å; A235-L238 PolarHBondContact O-N 3.45Å; H236-L238 VanDerWaalsContact C-N 3.26Å; H236-L238 PolarHBondContact O-N 3.46Å; L238-L240 VanDerWaalsContact C-N 3.3Å; L238-L240 PolarHBondContact O-N 2.96Å; L238-S241 WeakPolarHBondContact O-CB 3.22Å; L238-S241 PolarHBondContact O-N 3.41Å; L238-S241 PolarHBondContact O-OG 2.95Å; L238-Q242 PolarHBondContact O-N 3.37Å
239S83Confident72.4Confident47 Ų4790.2 Ų90.233%0.32951%0.512SS..Hα-helixtrans-59.8-40.8173.5-65.50000112A235 H236 S241 Q242A235-S239 PolarHBondContact O-N 3.34Å; A235-S239 PolarHBondContact O-OG 3.32Å; H236-S239 PolarHBondContact O-N 3.12Å; S239-S241 VanDerWaalsContact C-N 3.26Å; S239-S241 PolarHBondContact O-N 3.23Å; S239-Q242 PolarHBondContact O-N 3Å
240L79.2Confident71.1Confident78 Ų7889.3 Ų89.341%0.40851%0.512SS..Hα-helixtrans-60.8-34.9173.9-69.8174.8000112.6N220 H236 L237 L238 Q242N220-L240 HydrophobicContact CB-CD2 3.72Å; N220-L240 VanDerWaalsContact ND2-CD2 3.35Å; N220-L240 WeakPolarHBondContact ND2-CD2 3.47Å; H236-L240 WeakPolarHBondContact O-CG 3.42Å; H236-L240 PolarHBondContact O-N 3.39Å; L237-L240 HydrophobicContact CD2-CD1 4.44Å; L237-L240 PolarHBondContact O-N 3Å; L238-L240 VanDerWaalsContact C-N 3.3Å; L238-L240 PolarHBondContact O-N 2.96Å; L240-Q242 VanDerWaalsContact C-N 3.29Å; L240-Q242 PolarHBondContact O-N 3.16Å
241S70.2Confident69.6Low69 Ų6992.4 Ų92.448%0.48353%0.529SS..Hα-helixtrans-73.3-19.4179.575.70000114L237 L238 S239 G243L237-S241 PolarHBondContact O-N 3.05Å; L237-S241 VanDerWaalsContact O-N 3.16Å; L238-S241 WeakPolarHBondContact O-CB 3.22Å; L238-S241 PolarHBondContact O-N 3.41Å; L238-S241 PolarHBondContact O-OG 2.95Å; S239-S241 VanDerWaalsContact C-N 3.26Å; S239-S241 PolarHBondContact O-N 3.23Å; S241-G243 VanDerWaalsContact C-N 3.31Å
242Q64.7Low68.7Low148 Ų14887.1 Ų87.169%0.69253%0.532SS*.THydrogen-bonded Turntrans-85.32.6179-68.1-173.114.400114.1L238 S239 L240L238-Q242 PolarHBondContact O-N 3.37Å; S239-Q242 PolarHBondContact O-N 3Å; L240-Q242 VanDerWaalsContact C-N 3.29Å; L240-Q242 PolarHBondContact O-N 3.16Å
243G59Low67.8Low36 Ų3685.1 Ų85.137%0.37152%0.519SS..SBendtrans-52147.4169.800000110.9S241 Q245S241-G243 VanDerWaalsContact C-N 3.31Å; G243-Q245 VanDerWaalsContact C-N 3.33Å; G243-Q245 PolarHBondContact O-N 3.11Å
244P55.7Low67Low135 Ų13587 Ų8788%0.87753%0.531SS*.  trans-59.794.1-173.723.6-32.7000110.2
245Q52.9Low66.7Low147 Ų14785.4 Ų85.469%0.68752%0.517SS*.  trans-66.8129.1170.7-68.2-66.7-9.900106.7G243G243-Q245 VanDerWaalsContact C-N 3.33Å; G243-Q245 PolarHBondContact O-N 3.11Å
246P49.3Very low66.4Low70 Ų7086.6 Ų86.646%0.45552%0.521SS..  trans-56.5127.1174.122.5-30.7000108N248 L249 I255P246-N248 PolarHBondContact O-N 3.26Å; P246-L249 HydrophobicContact CG-CD1 4.19Å; P246-I255 HydrophobicContact CG-CD1 4.32Å
247P50.5Low66.3Low123 Ų12387.9 Ų87.980%0.79953%0.531SS*.THydrogen-bonded Turntrans-68.115.3-162.621.6-31.8000116.4
248N49.1Very low66.3Low135 Ų13588 Ų8872%0.72254%0.538SS*.THydrogen-bonded Turntrans-139.637.2-165.9-65.9-46.3000115.9P246 P250P246-N248 PolarHBondContact O-N 3.26Å; N248-P250 VanDerWaalsContact O-CD 3.25Å; N248-P250 WeakPolarHBondContact O-CD 3.35Å
249L54Low66.5Low56 Ų5684.6 Ų84.629%0.29353%0.528SS..  trans-105.897.7164.6-82.1115000111.6P246 L251 I255 F260P246-L249 HydrophobicContact CG-CD1 4.19Å; L249-L251 PolarHBondContact O-N 3.37Å; L249-I255 HydrophobicContact CD1-CD1 3.63Å; L249-I255 HydrophobicContact CD1-CG1 3.62Å; L249-I255 HydrophobicContact CD2-CG1 3.95Å; L249-I255 HydrophobicContact CG-CG1 4.45Å; L249-F260 HydrophobicContact CD2-CD2 4.45Å; L249-F260 HydrophobicContact CD2-CE2 3.66Å; L249-F260 HydrophobicContact CD2-CZ 3.89Å
250P55.8Low66.5Low88 Ų8883.1 Ų83.157%0.57152%0.515SS*.THydrogen-bonded Turntrans-64.6-7.8-174.65.2-7.3000115.4N248N248-P250 VanDerWaalsContact O-CD 3.25Å; N248-P250 WeakPolarHBondContact O-CD 3.35Å
251L58Low66.8Low85 Ų8585.1 Ų85.145%0.44552%0.521SS..THydrogen-bonded Turntrans-116.13.2-172.1-82.897.9000115.9L249 V253L249-L251 PolarHBondContact O-N 3.37Å; L251-V253 HydrophobicContact CB-CG2 4.39Å; L251-V253 PolarHBondContact O-N 3.37Å
252G64.3Low67.5Low74 Ų7487.5 Ų87.576%0.76353%0.528SS*.  trans61.99.7177.200000115.2
253V68Low68.5Low64 Ų6483.5 Ų83.539%0.38851%0.511SS..  trans-88.5123.1174.3-173.10000108.1L251 F260L251-V253 HydrophobicContact CB-CG2 4.39Å; L251-V253 PolarHBondContact O-N 3.37Å; V253-F260 HydrophobicContact CG1-CB 4.41Å
254P70.6Confident69.7Low78 Ų7885.4 Ų85.451%0.50651%0.512SS..  trans-65.7139-179.726.2-33.1000110.5S256 S257P254-S256 PolarHBondContact O-N 3.44Å; P254-S257 VanDerWaalsContact O-CB 3.22Å; P254-S257 WeakPolarHBondContact O-CB 3.4Å; P254-S257 PolarHBondContact O-N 3.27Å
255I76.2Confident71.1Confident89 Ų8989.5 Ų89.546%0.45651%0.51SS..THydrogen-bonded Turntrans-55.8-26.8178.6-53.1169.2000111.5P246 L249 S257 F260P246-I255 HydrophobicContact CG-CD1 4.32Å; L249-I255 HydrophobicContact CD1-CD1 3.63Å; L249-I255 HydrophobicContact CD1-CG1 3.62Å; L249-I255 HydrophobicContact CD2-CG1 3.95Å; L249-I255 HydrophobicContact CG-CG1 4.45Å; I255-S257 VanDerWaalsContact C-N 3.28Å; I255-S257 PolarHBondContact O-N 3.44Å; I255-F260 HydrophobicContact CB-CD1 4.36Å; I255-F260 HydrophobicContact CB-CE1 4.28Å; I255-F260 HydrophobicContact CG1-CE1 4.45Å; I255-F260 HydrophobicContact CG2-CD1 4.01Å; I255-F260 HydrophobicContact CG2-CE1 3.76Å
256S80.1Confident72.6Confident88 Ų8885.8 Ų85.862%0.61551%0.511SS*.THydrogen-bonded Turntrans-71.2-18.717858.30000114P254P254-S256 PolarHBondContact O-N 3.44Å
257S84.8Confident74.2Confident36 Ų3685.4 Ų85.425%0.25252%0.52SS..SBendtrans-60.9132.4-177177.50000111.3P254 I255 G259 F260 K261P254-S257 VanDerWaalsContact O-CB 3.22Å; P254-S257 WeakPolarHBondContact O-CB 3.4Å; P254-S257 PolarHBondContact O-N 3.27Å; I255-S257 VanDerWaalsContact C-N 3.28Å; I255-S257 PolarHBondContact O-N 3.44Å; S257-G259 PolarHBondContact O-N 3.23Å; S257-G259 PolarHBondContact OG-N 3.44Å; S257-F260 WeakPolarHBondContact O-CB 3.47Å; S257-F260 PolarHBondContact O-N 2.95Å; S257-K261 PolarHBondContact O-N 2.82Å
258P85.9Confident75.7Confident98 Ų9881 Ų8164%0.63649%0.488SS*.Hα-helixtrans-53-34.9171.6-25.634000112.7K261 L262P258-K261 PolarHBondContact O-N 3.38Å; P258-L262 WeakPolarHBondContact O-CG 3.25Å; P258-L262 PolarHBondContact O-N 2.89Å
259G84.4Confident77.2Confident33 Ų3380.2 Ų80.234%0.3448%0.48SS..Hα-helixtrans-65.1-39.3177.300000113.1S257 L262 L263S257-G259 PolarHBondContact O-N 3.23Å; S257-G259 PolarHBondContact OG-N 3.44Å; G259-L262 PolarHBondContact O-N 3.05Å; G259-L263 WeakPolarHBondContact O-CG 3.26Å; G259-L263 PolarHBondContact O-N 3.34Å
260F83.5Confident78.3Confident15 Ų1580.3 Ų80.37%0.06648%0.483CS..Hα-helixtrans-64.4-42.5175.5-174-96.5000111.1L249 V253 I255 S257 L262 L263 L264 W268 P270L249-F260 HydrophobicContact CD2-CD2 4.45Å; L249-F260 HydrophobicContact CD2-CE2 3.66Å; L249-F260 HydrophobicContact CD2-CZ 3.89Å; V253-F260 HydrophobicContact CG1-CB 4.41Å; I255-F260 HydrophobicContact CB-CD1 4.36Å; I255-F260 HydrophobicContact CB-CE1 4.28Å; I255-F260 HydrophobicContact CG1-CE1 4.45Å; I255-F260 HydrophobicContact CG2-CD1 4.01Å; I255-F260 HydrophobicContact CG2-CE1 3.76Å; S257-F260 WeakPolarHBondContact O-CB 3.47Å; S257-F260 PolarHBondContact O-N 2.95Å; F260-L262 VanDerWaalsContact C-N 3.33Å; F260-L262 PolarHBondContact O-N 3.44Å; F260-L263 PolarHBondContact O-N 3.44Å; F260-L264 HydrophobicContact CD1-CD1 3.83Å; F260-L264 HydrophobicContact CD1-CG 4.32Å; F260-L264 HydrophobicContact CE1-CD1 3.41Å; F260-L264 VanDerWaalsContact CE1-CD1 3.41Å; F260-L264 HydrophobicContact CE1-CD2 4.49Å; F260-L264 HydrophobicContact CE1-CG 4Å; F260-L264 HydrophobicContact CZ-CD1 4.17Å; F260-L264 HydrophobicContact CZ-CD2 4.47Å; F260-L264 HydrophobicContact CZ-CG 4.39Å; F260-L264 WeakPolarHBondContact O-CG 3.19Å; F260-L264 PolarHBondContact O-N 3.48Å; F260-W268 HydrophobicContact CD2-CZ3 4.35Å; F260-W268 AromaticContact CE2-CZ3 3.92Å; F260-W268 HydrophobicContact CE2-CZ3 3.92Å; F260-P270 HydrophobicContact CE2-CG 4.44Å; F260-P270 HydrophobicContact CZ-CG 4.09Å
261K85Confident79.2Confident121 Ų12177.9 Ų77.953%0.52647%0.474SS..Hα-helixtrans-64.8-35.7175.6-64.4177-177173.40112.6S257 P258 R265S257-K261 PolarHBondContact O-N 2.82Å; P258-K261 PolarHBondContact O-N 3.38Å; K261-R265 WeakPolarHBondContact O-CB 3.47Å; K261-R265 WeakPolarHBondContact O-CG 3.3Å; K261-R265 PolarHBondContact O-N 2.92Å
262L86.5Confident80.2Confident118 Ų11877.9 Ų77.962%0.61847%0.473SS*.Hα-helixtrans-67.3-41.9175-77.3167.1000112P258 G259 F260 R265 G266P258-L262 WeakPolarHBondContact O-CG 3.25Å; P258-L262 PolarHBondContact O-N 2.89Å; G259-L262 PolarHBondContact O-N 3.05Å; F260-L262 VanDerWaalsContact C-N 3.33Å; F260-L262 PolarHBondContact O-N 3.44Å; L262-R265 PolarHBondContact O-N 2.92Å; L262-G266 PolarHBondContact O-N 3.38Å
263L84.6Confident80.9Confident65 Ų6574.5 Ų74.534%0.3444%0.439SS..Hα-helixtrans-60.6-48.3175.5-78164.5000111.5G259 F260 R265 G266 G267 W268 L274G259-L263 WeakPolarHBondContact O-CG 3.26Å; G259-L263 PolarHBondContact O-N 3.34Å; F260-L263 PolarHBondContact O-N 3.44Å; L263-R265 VanDerWaalsContact C-N 3.31Å; L263-R265 PolarHBondContact O-N 3.32Å; L263-G266 CarbonylContact O-C 3.56Å; L263-G266 WeakPolarHBondContact O-CA 3.43Å; L263-G266 PolarHBondContact O-N 3.22Å; L263-G267 PolarHBondContact O-N 2.81Å; L263-W268 HydrophobicContact CB-CB 4.18Å; L263-W268 HydrophobicContact CB-CD2 4.17Å; L263-W268 HydrophobicContact CB-CE3 3.77Å; L263-W268 HydrophobicContact CB-CG 4.38Å; L263-W268 HydrophobicContact CD1-CE3 4.42Å; L263-W268 HydrophobicContact CD2-CB 4.26Å; L263-W268 HydrophobicContact CD2-CD2 4.4Å; L263-W268 HydrophobicContact CD2-CG 4.18Å; L263-W268 WeakPolarHBondContact O-CB 3.02Å; L263-W268 PolarHBondContact O-N 3.49Å; L263-W268 VanDerWaalsContact O-N 3.11Å; L263-L274 HydrophobicContact CD2-CD2 3.44Å; L263-L274 VanDerWaalsContact CD2-CD2 3.44Å
264L84.5Confident81.5Confident76 Ų7677.1 Ų77.140%0.39845%0.45SS..Hα-helixtrans-59.2-41.8175.5-70.2178.3000112.1F260 G266 G267 P270F260-L264 HydrophobicContact CD1-CD1 3.83Å; F260-L264 HydrophobicContact CD1-CG 4.32Å; F260-L264 HydrophobicContact CE1-CD1 3.41Å; F260-L264 VanDerWaalsContact CE1-CD1 3.41Å; F260-L264 HydrophobicContact CE1-CD2 4.49Å; F260-L264 HydrophobicContact CE1-CG 4Å; F260-L264 HydrophobicContact CZ-CD1 4.17Å; F260-L264 HydrophobicContact CZ-CD2 4.47Å; F260-L264 HydrophobicContact CZ-CG 4.39Å; F260-L264 WeakPolarHBondContact O-CG 3.19Å; F260-L264 PolarHBondContact O-N 3.48Å; L264-G266 PolarHBondContact O-N 2.92Å; L264-G267 PolarHBondContact O-N 3.31Å; L264-G267 VanDerWaalsContact O-N 3.17Å; L264-P270 HydrophobicContact CD2-CG 4.27Å
265R85.8Confident81.8Confident220 Ų22075.2 Ų75.283%0.8345%0.445SS*.Hα-helixtrans-63.8-28.3174.6-81.6-177.7170.5-178.5-2.8113.1K261 L262 L263 G267K261-R265 WeakPolarHBondContact O-CB 3.47Å; K261-R265 WeakPolarHBondContact O-CG 3.3Å; K261-R265 PolarHBondContact O-N 2.92Å; L262-R265 PolarHBondContact O-N 2.92Å; L263-R265 VanDerWaalsContact C-N 3.31Å; L263-R265 PolarHBondContact O-N 3.32Å; R265-G267 VanDerWaalsContact C-N 3.26Å; R265-G267 PolarHBondContact O-N 2.83Å
266G83.2Confident81.8Confident69 Ų6977.6 Ų77.671%0.71147%0.466SS*.THydrogen-bonded Turntrans-81.45.217600000114.7L262 L263 L264L262-G266 PolarHBondContact O-N 3.38Å; L263-G266 CarbonylContact O-C 3.56Å; L263-G266 WeakPolarHBondContact O-CA 3.43Å; L263-G266 PolarHBondContact O-N 3.22Å; L264-G266 PolarHBondContact O-N 2.92Å
267G83Confident81.7Confident63 Ų6383.1 Ų83.165%0.64947%0.473SS*.THydrogen-bonded Turntrans78.417.9-178.700000114.3L263 L264 R265L263-G267 PolarHBondContact O-N 2.81Å; L264-G267 PolarHBondContact O-N 3.31Å; L264-G267 VanDerWaalsContact O-N 3.17Å; R265-G267 VanDerWaalsContact C-N 3.26Å; R265-G267 PolarHBondContact O-N 2.83Å
268W82.3Confident81.4Confident29 Ų2982.4 Ų82.411%0.1147%0.471CS..PPolyproline II helixtrans-83.3128.3173.2177.684000110.7F260 L263 P270 M272F260-W268 HydrophobicContact CD2-CZ3 4.35Å; F260-W268 AromaticContact CE2-CZ3 3.92Å; F260-W268 HydrophobicContact CE2-CZ3 3.92Å; L263-W268 HydrophobicContact CB-CB 4.18Å; L263-W268 HydrophobicContact CB-CD2 4.17Å; L263-W268 HydrophobicContact CB-CE3 3.77Å; L263-W268 HydrophobicContact CB-CG 4.38Å; L263-W268 HydrophobicContact CD1-CE3 4.42Å; L263-W268 HydrophobicContact CD2-CB 4.26Å; L263-W268 HydrophobicContact CD2-CD2 4.4Å; L263-W268 HydrophobicContact CD2-CG 4.18Å; L263-W268 WeakPolarHBondContact O-CB 3.02Å; L263-W268 PolarHBondContact O-N 3.49Å; L263-W268 VanDerWaalsContact O-N 3.11Å; W268-P270 HydrophobicContact CH2-CB 4.34Å; W268-P270 HydrophobicContact CZ3-CB 4.28Å; W268-P270 HydrophobicContact CZ3-CG 4.13Å; W268-M272 PolarHBondContact NE1-O 2.87Å
269E80.7Confident81.1Confident120 Ų12084.8 Ų84.856%0.56147%0.474SS*.PPolyproline II helixtrans-96136.9175.5-71.9-66150.900111.3G271 M272E269-G271 PolarHBondContact O-N 3.13Å; E269-G271 VanDerWaalsContact O-N 3.16Å; E269-M272 HydrophobicContact CB-CG 4.06Å; E269-M272 HydrophobicContact CB-SD 3.94Å; E269-M272 HydrophobicContact CG-SD 4.46Å; E269-M272 WeakPolarHBondContact O-CB 3.15Å; E269-M272 PolarHBondContact O-N 3.17Å
270P76.6Confident80.8Confident57 Ų5784.6 Ų84.637%0.3747%0.472SS..THydrogen-bonded Turntrans-54.8119.8176.5-25.434.7000112.7F260 L264 W268F260-P270 HydrophobicContact CE2-CG 4.44Å; F260-P270 HydrophobicContact CZ-CG 4.09Å; L264-P270 HydrophobicContact CD2-CG 4.27Å; W268-P270 HydrophobicContact CH2-CB 4.34Å; W268-P270 HydrophobicContact CZ3-CB 4.28Å; W268-P270 HydrophobicContact CZ3-CG 4.13Å
271G76.1Confident80.3Confident37 Ų3793.3 Ų93.338%0.38150%0.504SS..THydrogen-bonded Turntrans103.2-12.7-17800000114.3E269 A282E269-G271 PolarHBondContact O-N 3.13Å; E269-G271 VanDerWaalsContact O-N 3.16Å; G271-A282 WeakPolarHBondContact O-CB 3.46Å
272M78Confident79.8Confident86 Ų8689 Ų8942%0.42449%0.492SS..SBendtrans-80.4153.8168.8-64.7-16986.200111.5W268 E269W268-M272 PolarHBondContact NE1-O 2.87Å; E269-M272 HydrophobicContact CB-CG 4.06Å; E269-M272 HydrophobicContact CB-SD 3.94Å; E269-M272 HydrophobicContact CG-SD 4.46Å; E269-M272 WeakPolarHBondContact O-CB 3.15Å; E269-M272 PolarHBondContact O-N 3.17Å
273G79.6Confident79.1Confident3 Ų389.5 Ų89.53%0.03150%0.495CS..PPolyproline II helixtrans-61.6154.4168.300000113.2G275 G278 G280G273-G275 PolarHBondContact O-N 3.31Å; G273-G278 PolarHBondContact N-O 3.29Å; G273-G278 WeakPolarHBondContact O-CA 3.2Å; G273-G280 WeakPolarHBondContact CA-O 3.35Å
274L79.6Confident78.5Confident118 Ų11891.2 Ų91.262%0.61851%0.51SS*.SBendtrans-68.7116.2167.3-69170.3000109.8L263 G280L263-L274 HydrophobicContact CD2-CD2 3.44Å; L263-L274 VanDerWaalsContact CD2-CD2 3.44Å; L274-G280 WeakPolarHBondContact O-CA 3.33Å; L274-G280 PolarHBondContact O-N 3.19Å
275G78.2Confident77.9Confident39 Ų3994 Ų9440%0.40252%0.523SS..SBendtrans163.2159.817600000111.8G273 R277 G278G273-G275 PolarHBondContact O-N 3.31Å; G275-R277 PolarHBondContact O-N 3.33Å; G275-G278 PolarHBondContact O-N 2.77Å
276P74.9Confident77.2Confident139 Ų13985.6 Ų85.690%0.90350%0.497SS*.THydrogen-bonded Turntrans-62.6-17.9-175.422.8-32.1000114.2
277R78.3Confident76.7Confident204 Ų20486.7 Ų86.777%0.7749%0.491SS*.THydrogen-bonded Turntrans-120.311.4174.3-60.2-178.7-177.7-1301.7113G275 E279G275-R277 PolarHBondContact O-N 3.33Å; R277-E279 VanDerWaalsContact C-N 3.32Å; R277-E279 HydrophobicContact CB-CG 4.04Å; R277-E279 WeakPolarHBondContact CD-OE1 3.25Å
278G78.1Confident76.2Confident20 Ų2086.8 Ų86.821%0.20648%0.479CS..SBendtrans74.118.6-173.400000115.1G273 G275 G280G273-G278 PolarHBondContact N-O 3.29Å; G273-G278 WeakPolarHBondContact O-CA 3.2Å; G275-G278 PolarHBondContact O-N 2.77Å; G278-G280 PolarHBondContact O-N 3.46Å
279E79.8Confident75.7Confident149 Ų14989 Ų8970%0.69649%0.492SS*.  trans-69-12.9-175.4-71.3170-168.100114.7R277R277-E279 VanDerWaalsContact C-N 3.32Å; R277-E279 HydrophobicContact CB-CG 4.04Å; R277-E279 WeakPolarHBondContact CD-OE1 3.25Å
280G77.5Confident75.4Confident29 Ų2987.5 Ų87.530%0.29948%0.484SS..SBendtrans-65.1168.1-179.700000113.8G273 L274 G278 A282G273-G280 WeakPolarHBondContact CA-O 3.35Å; L274-G280 WeakPolarHBondContact O-CA 3.33Å; L274-G280 PolarHBondContact O-N 3.19Å; G278-G280 PolarHBondContact O-N 3.46Å; G280-A282 PolarHBondContact O-N 3.22Å
281R74.9Confident75.1Confident197 Ų19791.2 Ų91.274%0.74349%0.49SS*.  trans-75.9119.9171.5-63.9179.2-178.9-130.80.3108.8
282A74.5Confident75Confident32 Ų3293 Ų9326%0.26449%0.491SS..SBendtrans-76.5-33.9172.800000111.9G271 G280G271-A282 WeakPolarHBondContact O-CB 3.46Å; G280-A282 PolarHBondContact O-N 3.22Å
283N70.4Confident74.9Confident128 Ų12896.6 Ų96.668%0.68451%0.507SS*.SBendtrans-89.2147.4-179.9-64.2-34.5000110.9
284P72.3Confident74.9Confident101 Ų10199.6 Ų99.666%0.65652%0.52SS*.PPolyproline II helixtrans-57.5152.7174.325.1-33.9000111.2
285I73Confident74.7Confident133 Ų13396.3 Ų96.368%0.68252%0.515SS*.PPolyproline II helixtrans-60.4122.8178.1-61.3170.9000108.1T287I285-T287 PolarHBondContact O-N 2.92Å
286P70.6Confident74.4Confident44 Ų44102.3 Ų102.329%0.28654%0.537SS..PPolyproline II helixtrans-65.3125.818028.4-34.7000109P304 V306P286-P304 HydrophobicContact CB-CB 4.07Å; P286-P304 HydrophobicContact CG-CB 4.04Å; P286-P304 HydrophobicContact CG-CG 4.23Å; P286-V306 HydrophobicContact CB-CG2 4.12Å
287T72.8Confident74.2Confident93 Ų9399.3 Ų99.357%0.57153%0.532SS*.PPolyproline II helixtrans-94150.1178.355.90000110.4I285 R305I285-T287 PolarHBondContact O-N 2.92Å; T287-R305 CarbonylContact O-C 3.57Å
288V71.9Confident74Confident65 Ų6597.2 Ų97.239%0.39453%0.525SS..  trans-116.9124.4172.8-162.50000108.8K290 P302 P304V288-K290 PolarHBondContact O-N 2.84Å; V288-P302 HydrophobicContact CG1-CB 4.36Å; V288-P302 HydrophobicContact CG1-CG 3.96Å; V288-P304 HydrophobicContact CG2-CB 3.47Å; V288-P304 VanDerWaalsContact CG2-CB 3.47Å
289L72.5Confident73.7Confident74 Ų74104 Ų10439%0.38754%0.544SS..  trans-69103.1170.3-175.770.5000109R291 F309L289-R291 HydrophobicContact CD2-CG 4.3Å; L289-R291 HydrophobicContact CG-CG 4.34Å; L289-R291 PolarHBondContact O-N 3.37Å; L289-F309 HydrophobicContact CD2-CE2 3.88Å; L289-F309 HydrophobicContact CD2-CZ 3.79Å
290K73.4Confident73.2Confident90 Ų90102.8 Ų102.839%0.39155%0.552SS.*  trans-70.2121.2174.3-164.6177.9179.6170.40109.8V288 D292 E294 L296V288-K290 PolarHBondContact O-N 2.84Å; K290-D292 WeakPolarHBondContact CE-OD2 3.42Å; K290-D292 WeakPolarHBondContact CG-OD1 3.45Å; K290-E294 WeakPolarHBondContact CE-O 3.38Å; K290-E294 PolarHBondContact NZ-O 3.25Å; K290-L296 HydrophobicContact CD-CD2 4.39Å
291R71.6Confident72.6Confident135 Ų135105.5 Ų105.551%0.50957%0.572SS.*  trans-115.5-8.3178.6-72.7-174.3171.5168-3.2113.3L289 R315L289-R291 HydrophobicContact CD2-CG 4.3Å; L289-R291 HydrophobicContact CG-CG 4.34Å; L289-R291 PolarHBondContact O-N 3.37Å; R291-R315 PolarHBondContact NH2-O 2.78Å
292D73.7Confident72.2Confident73 Ų73100 Ų10039%0.3956%0.562SS.*SBendtrans-86.8162.3176.558.5-60.2000111.4K290 E294K290-D292 WeakPolarHBondContact CE-OD2 3.42Å; K290-D292 WeakPolarHBondContact CG-OD1 3.45Å; D292-E294 HydrophobicContact CB-CG 4.42Å; D292-E294 WeakPolarHBondContact OD2-CB 3.27Å; D292-E294 PolarHBondContact OD2-N 2.82Å
293Q76.1Confident71.8Confident162 Ų162106.7 Ų106.776%0.75759%0.587SS**  trans-100.79.3174.2-62.7-171.2-15.700112
294E78.5Confident71.5Confident66 Ų66104.1 Ų104.131%0.30858%0.578SS.*SBendtrans-73.7160.3-179.3-56.5-177.2162.700109.8K290 D292 Y298 R299K290-E294 WeakPolarHBondContact CE-O 3.38Å; K290-E294 PolarHBondContact NZ-O 3.25Å; D292-E294 HydrophobicContact CB-CG 4.42Å; D292-E294 WeakPolarHBondContact OD2-CB 3.27Å; D292-E294 PolarHBondContact OD2-N 2.82Å; E294-Y298 HydrophobicContact CB-CD1 3.99Å; E294-Y298 HydrophobicContact CB-CG 4.49Å; E294-Y298 HydrophobicContact CG-CD1 4.08Å; E294-R299 IonicContact OE1-CZ 3.4Å; E294-R299 IonicContact OE1-NE 3.38Å; E294-R299 PolarHBondContact OE1-NE 3.34Å; E294-R299 IonicContact OE1-NH1 3.94Å; E294-R299 IonicContact OE1-NH2 3.63Å; E294-R299 VanDerWaalsContact OE2-CD 3.25Å; E294-R299 WeakPolarHBondContact OE2-CD 3.31Å; E294-R299 IonicContact OE2-NE 3.47Å; E294-R299 PolarHBondContact OE2-NE 2.85Å
295G75.1Confident71Confident50 Ų50108.4 Ų108.452%0.51558%0.581SS.*PPolyproline II helixtrans-66.1157.2174.700000111.8G297 Y298G295-G297 PolarHBondContact O-N 3.37Å; G295-Y298 PolarHBondContact O-N 2.98Å
296L71.9Confident70.5Confident164 Ų164105.8 Ų105.886%0.85957%0.571SS**THydrogen-bonded Turntrans-61.6129.5163.6-67.2169.9000107.8K290K290-L296 HydrophobicContact CD-CD2 4.39Å
297G71.9Confident70Confident77 Ų77106.4 Ų106.479%0.79457%0.574SS**THydrogen-bonded Turntrans89.7-4.8179.600000116.5G295 R299G295-G297 PolarHBondContact O-N 3.37Å; G297-R299 VanDerWaalsContact C-N 3.34Å; G297-R299 PolarHBondContact O-N 3.06Å
298Y73.8Confident69.7Low159 Ų159109.8 Ų109.862%0.62458%0.583SS**SBendtrans-68.4-30.7-178.1-177.1-111.1000113.9E294 G295E294-Y298 HydrophobicContact CB-CD1 3.99Å; E294-Y298 HydrophobicContact CB-CG 4.49Å; E294-Y298 HydrophobicContact CG-CD1 4.08Å; G295-Y298 PolarHBondContact O-N 2.98Å
299R70.9Confident69.6Low163 Ų163110.1 Ų110.162%0.61558%0.579SS**SBendtrans-134.9158.9175.1-66.3-174.1-178.5-169.50.6109.6E294 G297 A301E294-R299 IonicContact OE1-CZ 3.4Å; E294-R299 IonicContact OE1-NE 3.38Å; E294-R299 PolarHBondContact OE1-NE 3.34Å; E294-R299 IonicContact OE1-NH1 3.94Å; E294-R299 IonicContact OE1-NH2 3.63Å; E294-R299 VanDerWaalsContact OE2-CD 3.25Å; E294-R299 WeakPolarHBondContact OE2-CD 3.31Å; E294-R299 IonicContact OE2-NE 3.47Å; E294-R299 PolarHBondContact OE2-NE 2.85Å; G297-R299 VanDerWaalsContact C-N 3.34Å; G297-R299 PolarHBondContact O-N 3.06Å; R299-A301 PolarHBondContact O-N 3.26Å; R299-A301 VanDerWaalsContact O-N 3.13Å
300S69.8Low69.5Low123 Ų123110.9 Ų110.986%0.8659%0.588SS**SBendtrans-47.7122.9172.1-53.20000109.4
301A65.6Low69.4Low86 Ų86110.6 Ų110.671%0.71160%0.603SS**PPolyproline II helixtrans-54.5131.8-171.400000110.2R299 Q303R299-A301 PolarHBondContact O-N 3.26Å; R299-A301 VanDerWaalsContact O-N 3.13Å; A301-Q303 PolarHBondContact O-N 3.29Å
302P66.8Low68.9Low83 Ų83116 Ų11654%0.53962%0.624SS.*PPolyproline II helixtrans-54.8142174.321.4-31.8000109.9V288 P304V288-P302 HydrophobicContact CG1-CB 4.36Å; V288-P302 HydrophobicContact CG1-CG 3.96Å; P302-P304 WeakPolarHBondContact O-CD 3.38Å; P302-P304 VanDerWaalsContact O-N 3.08Å
303Q65.2Low69Low171 Ų171114.7 Ų114.780%0.79962%0.617SS**PPolyproline II helixtrans-54.1118.4-177.7-73.5-167.6-7.800110.3A301 R305A301-Q303 PolarHBondContact O-N 3.29Å; Q303-R305 PolarHBondContact O-N 3.21Å
304P64.6Low69Low75 Ų75112.5 Ų112.549%0.48761%0.614SS.*PPolyproline II helixtrans-70.2119.7-173.427.7-34.2000110.4P286 V288 P302P286-P304 HydrophobicContact CB-CB 4.07Å; P286-P304 HydrophobicContact CG-CB 4.04Å; P286-P304 HydrophobicContact CG-CG 4.23Å; V288-P304 HydrophobicContact CG2-CB 3.47Å; V288-P304 VanDerWaalsContact CG2-CB 3.47Å; P302-P304 WeakPolarHBondContact O-CD 3.38Å; P302-P304 VanDerWaalsContact O-N 3.08Å
305R60.5Low68.8Low190 Ų190117.7 Ų117.772%0.71763%0.631SS**  trans-119.9130.3176-77.1176.965.2-166.61.1108.4T287 Q303 T307T287-R305 CarbonylContact O-C 3.57Å; Q303-R305 PolarHBondContact O-N 3.21Å; R305-T307 PolarHBondContact O-N 3.41Å
306V62.6Low68.6Low79 Ų79117.1 Ų117.148%0.47962%0.622SS.*  trans-56.9100.9170.2-179.40000108.4P286 H308P286-V306 HydrophobicContact CB-CG2 4.12Å; V306-H308 WeakPolarHBondContact CG1-CD2 3.45Å; V306-H308 WeakPolarHBondContact CG1-NE2 3.28Å; V306-H308 PolarHBondContact O-N 3.07Å
307T61.8Low68.5Low56 Ų56115.5 Ų115.534%0.34462%0.618SS.*  trans-95.676.6178.243.40000108R305 F309R305-T307 PolarHBondContact O-N 3.41Å; T307-F309 PolarHBondContact O-N 3.42Å
308H65.5Low68.3Low164 Ų164114.6 Ų114.676%0.75960%0.603SS**  trans-78.7108.8163.7-64.2-52.3000107.7V306V306-H308 WeakPolarHBondContact CG1-CD2 3.45Å; V306-H308 WeakPolarHBondContact CG1-NE2 3.28Å; V306-H308 PolarHBondContact O-N 3.07Å
309F69Low68.1Low73 Ų73110 Ų11032%0.3260%0.604SS.*PPolyproline II helixtrans-82136.6166-63.1-82.2000108.1L289 T307 D313 R315 A316L289-F309 HydrophobicContact CD2-CE2 3.88Å; L289-F309 HydrophobicContact CD2-CZ 3.79Å; T307-F309 PolarHBondContact O-N 3.42Å; F309-D313 HydrophobicContact CB-CB 4.05Å; F309-D313 HydrophobicContact CD1-CB 4.4Å; F309-R315 HydrophobicContact CE1-CB 4.35Å; F309-A316 HydrophobicContact CB-CB 4.01Å; F309-A316 HydrophobicContact CD1-CB 3.96Å; F309-A316 HydrophobicContact CD2-CB 3.8Å; F309-A316 HydrophobicContact CE1-CB 4.39Å; F309-A316 HydrophobicContact CE2-CB 4.26Å; F309-A316 HydrophobicContact CG-CB 3.64Å
310P70.7Confident67.8Low89 Ų89112.4 Ų112.458%0.57861%0.613SS**PPolyproline II helixtrans-62155.9169.724-27.7000110W312 D313P310-W312 PolarHBondContact O-N 3.48Å; P310-D313 HydrophobicContact CG-CB 3.97Å; P310-D313 WeakPolarHBondContact O-CB 3.42Å; P310-D313 PolarHBondContact O-N 3.24Å; P310-D313 VanDerWaalsContact O-N 3.09Å
311A71.6Confident67.5Low85 Ų85115.6 Ų115.670%0.70262%0.615SS**THydrogen-bonded Turntrans-53.1135.2173.800000109.4D313A311-D313 VanDerWaalsContact C-N 3.32Å; A311-D313 PolarHBondContact O-N 3.04Å
312W60.8Low67.3Low249 Ų249120.1 Ų120.194%0.94361%0.613SS**THydrogen-bonded Turntrans70.313.6-178.4-42.897.5000116.4P310 T314P310-W312 PolarHBondContact O-N 3.48Å; W312-T314 PolarHBondContact O-N 3.18Å; W312-T314 VanDerWaalsContact O-N 3.1Å
313D76.9Confident67.1Low45 Ų45121.5 Ų121.524%0.24162%0.622CS.*  trans-69.7108.7171.7-165.9-11.4000111.1F309 P310 A311 R315 A316F309-D313 HydrophobicContact CB-CB 4.05Å; F309-D313 HydrophobicContact CD1-CB 4.4Å; P310-D313 HydrophobicContact CG-CB 3.97Å; P310-D313 WeakPolarHBondContact O-CB 3.42Å; P310-D313 PolarHBondContact O-N 3.24Å; P310-D313 VanDerWaalsContact O-N 3.09Å; A311-D313 VanDerWaalsContact C-N 3.32Å; A311-D313 PolarHBondContact O-N 3.04Å; D313-R315 PolarHBondContact O-N 2.85Å; D313-R315 VanDerWaalsContact O-N 3.12Å; D313-R315 WeakPolarHBondContact OD1-CB 3.38Å; D313-R315 VanDerWaalsContact OD1-CG 3.26Å; D313-R315 WeakPolarHBondContact OD1-CG 3.21Å; D313-R315 PolarHBondContact OD1-N 3.16Å; D313-A316 VanDerWaalsContact O-CB 3.3Å; D313-A316 WeakPolarHBondContact O-CB 3.22Å; D313-A316 PolarHBondContact O-N 3.21Å
314T75.4Confident66.9Low115 Ų115117.5 Ų117.571%0.70661%0.611SS**G310 helixtrans-61.2-20.7177.354.40000112.6W312 A316 V317 A318W312-T314 PolarHBondContact O-N 3.18Å; W312-T314 VanDerWaalsContact O-N 3.1Å; T314-A316 PolarHBondContact O-N 3.35Å; T314-V317 PolarHBondContact O-N 3.32Å; T314-A318 PolarHBondContact O-N 3.03Å
315R73.4Confident66.6Low176 Ų176123.1 Ų123.166%0.66462%0.623SS**G310 helixtrans-67.2-21.7175.4-61.2174.2172.4-174.9-0.6112.9R291 F309 D313 V317R291-R315 PolarHBondContact NH2-O 2.78Å; F309-R315 HydrophobicContact CE1-CB 4.35Å; D313-R315 PolarHBondContact O-N 2.85Å; D313-R315 VanDerWaalsContact O-N 3.12Å; D313-R315 WeakPolarHBondContact OD1-CB 3.38Å; D313-R315 VanDerWaalsContact OD1-CG 3.26Å; D313-R315 WeakPolarHBondContact OD1-CG 3.21Å; D313-R315 PolarHBondContact OD1-N 3.16Å; R315-V317 VanDerWaalsContact C-N 3.26Å; R315-V317 PolarHBondContact O-N 3.08Å
316A71.1Confident66.5Low38 Ų38119.9 Ų119.931%0.31462%0.623SS.*G310 helixtrans-65.3-33175.600000111.8F309 D313 T314F309-A316 HydrophobicContact CB-CB 4.01Å; F309-A316 HydrophobicContact CD1-CB 3.96Å; F309-A316 HydrophobicContact CD2-CB 3.8Å; F309-A316 HydrophobicContact CE1-CB 4.39Å; F309-A316 HydrophobicContact CE2-CB 4.26Å; F309-A316 HydrophobicContact CG-CB 3.64Å; D313-A316 VanDerWaalsContact O-CB 3.3Å; D313-A316 WeakPolarHBondContact O-CB 3.22Å; D313-A316 PolarHBondContact O-N 3.21Å; T314-A316 PolarHBondContact O-N 3.35Å
317V70.3Confident66.2Low129 Ų129121 Ų12178%0.78264%0.641SS**THydrogen-bonded Turntrans-107.3-13.7-174.3-169.30000112.5T314 R315 G319T314-V317 PolarHBondContact O-N 3.32Å; R315-V317 VanDerWaalsContact C-N 3.26Å; R315-V317 PolarHBondContact O-N 3.08Å; V317-G319 PolarHBondContact O-N 2.87Å
318A68.1Low66Low58 Ų58123.4 Ų123.448%0.47966%0.656SS.*  trans-59.298.3178.300000111.4T314T314-A318 PolarHBondContact O-N 3.03Å
319G69.2Low65.5Low63 Ų63118.4 Ų118.465%0.64963%0.634SS**  trans-68.4159.6167.800000110.7V317 E321V317-G319 PolarHBondContact O-N 2.87Å; G319-E321 PolarHBondContact O-N 3.45Å
320R65Low65.5Low213 Ų213118.2 Ų118.280%0.80464%0.642SS**  trans-62.5122.4167.9-69.6-177-179.7-93.93.4108R322R320-R322 PolarHBondContact O-N 2.84Å
321E63.2Low65.2Low191 Ų191124 Ų12489%0.89365%0.652SS**  trans-56.7111.9170.5-71.4-169.1164.300108.4G319 P323G319-E321 PolarHBondContact O-N 3.45Å; E321-P323 WeakPolarHBondContact O-CD 3.33Å
322R62.4Low65.4Low181 Ų181130 Ų13068%0.68366%0.657SS**PPolyproline II helixtrans-76.3121.6174-84.2178.4158.2-172.8-6.5107.1R320R320-R322 PolarHBondContact O-N 2.84Å
323P62.7Low66.1Low112 Ų112122.3 Ų122.373%0.72763%0.631SS**PPolyproline II helixtrans-58.4137171.924.4-32.1000108.7E321 R325E321-P323 WeakPolarHBondContact O-CD 3.33Å; P323-R325 PolarHBondContact O-N 2.9Å
324P59.9Low66.2Low86 Ų86124 Ų12456%0.55864%0.638SS**PPolyproline II helixtrans-58.4132.2176.924.4-32.2000108.7V326P324-V326 PolarHBondContact O-N 3.46Å
325R58Low66.6Low194 Ų194125.2 Ų125.273%0.73263%0.63SS**PPolyproline II helixtrans-67.6124.8174.2-68.7179.8174.4-171.6-3.2107.5P323 A327 T328P323-R325 PolarHBondContact O-N 2.9Å; R325-A327 PolarHBondContact O-N 3.41Å; R325-T328 PolarHBondContact O-N 2.94Å; R325-T328 PolarHBondContact O-OG1 3.01Å
326V59Low67.1Low121 Ų121123 Ų12373%0.73362%0.621SS**G310 helixtrans-52.4-31.7178.2-176.90000111.2P324 T328P324-V326 PolarHBondContact O-N 3.46Å; V326-T328 VanDerWaalsContact C-N 3.27Å; V326-T328 PolarHBondContact O-N 3.47Å
327A57.1Low67.7Low102 Ų102128.2 Ų128.284%0.84363%0.633SS**G310 helixtrans-68.4-12.7177.400000116R325R325-A327 PolarHBondContact O-N 3.41Å
328T57Low68.5Low108 Ų108126.6 Ų126.666%0.66362%0.617SS**G310 helixtrans-103.2-8.2-177.432.80000114.6R325 V326R325-T328 PolarHBondContact O-N 2.94Å; R325-T328 PolarHBondContact O-OG1 3.01Å; V326-T328 VanDerWaalsContact C-N 3.27Å; V326-T328 PolarHBondContact O-N 3.47Å
329L55.4Low69.5Low59 Ų59127.7 Ų127.731%0.30961%0.612SS.*SBendtrans-86.2120.4177.2-63.3-179.4000108.9E333L329-E333 HydrophobicContact CD2-CG 4.22Å
330S67.6Low70.4Confident69 Ų69130.7 Ų130.748%0.48361%0.607SS.*  trans-61.6147169.685.20000108.7R332 E333 E334S330-R332 PolarHBondContact O-N 2.96Å; S330-R332 PolarHBondContact OG-N 3.13Å; S330-E333 PolarHBondContact O-N 3.25Å; S330-E334 PolarHBondContact O-N 2.79Å
331W65.8Low71.6Confident209 Ų209124.2 Ų124.279%0.79259%0.589SS**Hα-helixtrans-42.7-33.7173.1177.9-96.2000113.7R335W331-R335 WeakPolarHBondContact O-CB 3.41Å; W331-R335 PolarHBondContact O-N 3.44Å; W331-R335 VanDerWaalsContact O-N 3.13Å
332R74.1Confident72.9Confident212 Ų212120.2 Ų120.280%0.857%0.565SS**Hα-helixtrans-66.8-35.7178.2-127.4179.8-165.2178.73.3113.4S330 R336S330-R332 PolarHBondContact O-N 2.96Å; S330-R332 PolarHBondContact OG-N 3.13Å; R332-R336 PolarHBondContact O-N 3.18Å
333E77Confident74.3Confident87 Ų87114.1 Ų114.141%0.40755%0.554SS.*Hα-helixtrans-82.8-35.6-176.4-164.8136.6-137.900111.8L329 S330 R336 R337L329-E333 HydrophobicContact CD2-CG 4.22Å; S330-E333 PolarHBondContact O-N 3.25Å; E333-R336 PolarHBondContact O-N 2.99Å; E333-R336 IonicContact OE1-CZ 3.9Å; E333-R336 IonicContact OE1-NH2 2.89Å; E333-R336 PolarHBondContact OE1-NH2 3.02Å; E333-R337 WeakPolarHBondContact O-CB 3.34Å; E333-R337 PolarHBondContact O-N 3.41Å
334E78.2Confident75.6Confident80 Ų80116.5 Ų116.537%0.37455%0.548SS..Hα-helixtrans-59.3-49168.8-172.1166.3-136.400110.8S330 R336 R337 E338S330-E334 PolarHBondContact O-N 2.79Å; E334-R336 VanDerWaalsContact C-N 3.31Å; E334-R336 PolarHBondContact O-N 2.73Å; E334-R337 WeakPolarHBondContact O-CA 3.4Å; E334-R337 WeakPolarHBondContact O-CB 3.33Å; E334-R337 PolarHBondContact O-N 3.24Å; E334-E338 PolarHBondContact O-N 3.39Å
335R83.8Confident77Confident141 Ų141116.1 Ų116.153%0.53254%0.539SS..Hα-helixtrans-58.7-40.9175.9-155.2-17493.7-178.34.3112.8W331 R337 E338 E339W331-R335 WeakPolarHBondContact O-CB 3.41Å; W331-R335 PolarHBondContact O-N 3.44Å; W331-R335 VanDerWaalsContact O-N 3.13Å; R335-R337 VanDerWaalsContact C-N 3.3Å; R335-R337 PolarHBondContact O-N 2.9Å; R335-E338 PolarHBondContact O-N 3.29Å; R335-E339 IonicContact CZ-OE1 3.56Å; R335-E339 IonicContact NE-OE1 3.78Å; R335-E339 PolarHBondContact NE-OE1 2.95Å; R335-E339 IonicContact NH2-OE1 2.79Å; R335-E339 PolarHBondContact NH2-OE1 3.37Å; R335-E339 WeakPolarHBondContact O-CB 3.42Å; R335-E339 VanDerWaalsContact O-CG 3.28Å; R335-E339 WeakPolarHBondContact O-CG 3.5Å; R335-E339 PolarHBondContact O-N 2.79Å
336R84.9Confident78.4Confident129 Ų129114.4 Ų114.449%0.48753%0.533SS..Hα-helixtrans-65-35.4176.3-169.2179.670.5153.5-5.7111.7R332 E333 E334 K340R332-R336 PolarHBondContact O-N 3.18Å; E333-R336 PolarHBondContact O-N 2.99Å; E333-R336 IonicContact OE1-CZ 3.9Å; E333-R336 IonicContact OE1-NH2 2.89Å; E333-R336 PolarHBondContact OE1-NH2 3.02Å; E334-R336 VanDerWaalsContact C-N 3.31Å; E334-R336 PolarHBondContact O-N 2.73Å; R336-K340 WeakPolarHBondContact O-CG 3.5Å; R336-K340 PolarHBondContact O-N 3.41Å; R336-K340 VanDerWaalsContact O-N 3.13Å
337R82.2Confident79.7Confident149 Ų149114 Ų11456%0.56253%0.526SS*.Hα-helixtrans-70.4-45.7177.2-164.5172.8-174.1-88.40.3110.9E333 E334 R335 E339 K340 D341E333-R337 WeakPolarHBondContact O-CB 3.34Å; E333-R337 PolarHBondContact O-N 3.41Å; E334-R337 WeakPolarHBondContact O-CA 3.4Å; E334-R337 WeakPolarHBondContact O-CB 3.33Å; E334-R337 PolarHBondContact O-N 3.24Å; R335-R337 VanDerWaalsContact C-N 3.3Å; R335-R337 PolarHBondContact O-N 2.9Å; R337-E339 VanDerWaalsContact C-N 3.34Å; R337-E339 PolarHBondContact O-N 2.99Å; R337-K340 WeakPolarHBondContact O-CB 3.49Å; R337-K340 PolarHBondContact O-N 3.04Å; R337-K340 VanDerWaalsContact O-N 3.17Å; R337-D341 IonicContact NH1-OD2 3.32Å; R337-D341 VanDerWaalsContact O-CG 3.29Å; R337-D341 PolarHBondContact O-N 2.66Å
338E87.2Confident81.1Confident95 Ų95112.7 Ų112.744%0.44451%0.505SS..Hα-helixtrans-61.5-38.7174.3-69.6179.5177.900113.3E334 R335 D341 R342E334-E338 PolarHBondContact O-N 3.39Å; R335-E338 PolarHBondContact O-N 3.29Å; E338-D341 PolarHBondContact O-N 3.3Å; E338-R342 WeakPolarHBondContact O-CB 3.49Å; E338-R342 PolarHBondContact O-N 3.3Å; E338-R342 IonicContact OE2-NH2 3.67Å
339E89Confident82.4Confident81 Ų81113.2 Ų113.238%0.37950%0.495SS..Hα-helixtrans-64.1-40.5175-76.5168.5-166.900111.2R335 R337 A343R335-E339 IonicContact CZ-OE1 3.56Å; R335-E339 IonicContact NE-OE1 3.78Å; R335-E339 PolarHBondContact NE-OE1 2.95Å; R335-E339 IonicContact NH2-OE1 2.79Å; R335-E339 PolarHBondContact NH2-OE1 3.37Å; R335-E339 WeakPolarHBondContact O-CB 3.42Å; R335-E339 VanDerWaalsContact O-CG 3.28Å; R335-E339 WeakPolarHBondContact O-CG 3.5Å; R335-E339 PolarHBondContact O-N 2.79Å; R337-E339 VanDerWaalsContact C-N 3.34Å; R337-E339 PolarHBondContact O-N 2.99Å; E339-A343 VanDerWaalsContact O-CB 3.31Å; E339-A343 WeakPolarHBondContact O-CB 2.96Å; E339-A343 PolarHBondContact O-N 2.91Å
340K89.8Confident83.8Confident125 Ų125114 Ų11454%0.54350%0.502SS..Hα-helixtrans-65.6-44.5173.4-76.8179.9177.2-170.60112.2R336 R337 A343 W344R336-K340 WeakPolarHBondContact O-CG 3.5Å; R336-K340 PolarHBondContact O-N 3.41Å; R336-K340 VanDerWaalsContact O-N 3.13Å; R337-K340 WeakPolarHBondContact O-CB 3.49Å; R337-K340 PolarHBondContact O-N 3.04Å; R337-K340 VanDerWaalsContact O-N 3.17Å; K340-A343 PolarHBondContact O-N 3.04Å; K340-W344 WeakPolarHBondContact O-CB 3.08Å; K340-W344 PolarHBondContact O-N 3.44Å
341D90.1Very high84.4Confident78 Ų78119.6 Ų119.642%0.41751%0.514SS..Hα-helixtrans-64.2-42.3178.9-67.3-12.9000110.2R337 E338 A343 W344 E345R337-D341 IonicContact NH1-OD2 3.32Å; R337-D341 VanDerWaalsContact O-CG 3.29Å; R337-D341 PolarHBondContact O-N 2.66Å; E338-D341 PolarHBondContact O-N 3.3Å; D341-A343 PolarHBondContact O-N 3.23Å; D341-W344 PolarHBondContact O-N 3.45Å; D341-E345 WeakPolarHBondContact O-CB 3.15Å; D341-E345 PolarHBondContact O-N 3.49Å
342R90.7Very high85.2Confident106 Ų106115 Ų11540%0.450%0.502SS..Hα-helixtrans-64-36.9172.2-89.2-178.1-88.7126.7-4.5113.4E338 R346E338-R342 WeakPolarHBondContact O-CB 3.49Å; E338-R342 PolarHBondContact O-N 3.3Å; E338-R342 IonicContact OE2-NH2 3.67Å; R342-R346 WeakPolarHBondContact O-CG 3.37Å; R342-R346 PolarHBondContact O-N 3.05Å; R342-R346 VanDerWaalsContact O-N 3.08Å
343A91.4Very high85.1Confident54 Ų54111.5 Ų111.545%0.44650%0.5SS..Hα-helixtrans-68.7-44176.500000110.8E339 K340 D341 R346 D347E339-A343 VanDerWaalsContact O-CB 3.31Å; E339-A343 WeakPolarHBondContact O-CB 2.96Å; E339-A343 PolarHBondContact O-N 2.91Å; K340-A343 PolarHBondContact O-N 3.04Å; D341-A343 PolarHBondContact O-N 3.23Å; A343-R346 PolarHBondContact O-N 3.47Å; A343-D347 WeakPolarHBondContact O-CB 3.43Å; A343-D347 PolarHBondContact O-N 3.21Å
344W89.8Confident84.6Confident162 Ų162113.2 Ų113.261%0.61451%0.511SS*.Hα-helixtrans-62.5-42.1175179.277.1000112K340 D341 R346 D347 L348K340-W344 WeakPolarHBondContact O-CB 3.08Å; K340-W344 PolarHBondContact O-N 3.44Å; D341-W344 PolarHBondContact O-N 3.45Å; W344-R346 VanDerWaalsContact C-N 3.35Å; W344-R346 PolarHBondContact O-N 3.37Å; W344-D347 PolarHBondContact O-N 2.62Å; W344-L348 HydrophobicContact CH2-CD1 4.35Å; W344-L348 HydrophobicContact CH2-CD2 4.18Å; W344-L348 HydrophobicContact CZ2-CD1 3.95Å; W344-L348 HydrophobicContact CZ3-CD2 4.47Å; W344-L348 VanDerWaalsContact O-CB 3.27Å; W344-L348 WeakPolarHBondContact O-CB 3.34Å; W344-L348 PolarHBondContact O-N 3.34Å
345E89.6Confident83.3Confident78 Ų78116.6 Ų116.636%0.36453%0.527SS..Hα-helixtrans-65.8-37177-164.3-167.6161.800112.2D341 R349D341-E345 WeakPolarHBondContact O-CB 3.15Å; D341-E345 PolarHBondContact O-N 3.49Å; E345-R349 WeakPolarHBondContact O-CG 3.25Å; E345-R349 PolarHBondContact O-N 3.47Å; E345-R349 IonicContact OE1-CZ 3.57Å; E345-R349 IonicContact OE1-NH1 3.59Å; E345-R349 PolarHBondContact OE1-NH1 3.38Å; E345-R349 IonicContact OE1-NH2 3.61Å; E345-R349 PolarHBondContact OE1-NH2 3.13Å; E345-R349 IonicContact OE2-NH1 2.76Å
346R86.1Confident81.7Confident157 Ų157123.1 Ų123.159%0.59256%0.559SS**Hα-helixtrans-62.4-52.2170.7-78.6-172.6-175.698.6-3.3111R342 A343 W344 L348 R349 T350R342-R346 WeakPolarHBondContact O-CG 3.37Å; R342-R346 PolarHBondContact O-N 3.05Å; R342-R346 VanDerWaalsContact O-N 3.08Å; A343-R346 PolarHBondContact O-N 3.47Å; W344-R346 VanDerWaalsContact C-N 3.35Å; W344-R346 PolarHBondContact O-N 3.37Å; R346-L348 VanDerWaalsContact C-N 3.27Å; R346-L348 PolarHBondContact O-N 3.39Å; R346-R349 WeakPolarHBondContact O-CB 3.41Å; R346-R349 PolarHBondContact O-N 3.13Å; R346-T350 PolarHBondContact O-N 3.41Å; R346-T350 PolarHBondContact O-OG1 2.94Å
347D87.9Confident81.5Confident112 Ų112122.8 Ų122.860%0.59956%0.563SS**Hα-helixtrans-59.1-40-179.3-161.440.6000111.6A343 W344 T350 Y351A343-D347 WeakPolarHBondContact O-CB 3.43Å; A343-D347 PolarHBondContact O-N 3.21Å; W344-D347 PolarHBondContact O-N 2.62Å; D347-T350 PolarHBondContact O-N 3.44Å; D347-Y351 VanDerWaalsContact O-CB 3.25Å; D347-Y351 WeakPolarHBondContact O-CB 3.45Å; D347-Y351 PolarHBondContact O-N 3.07Å
348L85.8Confident81.5Confident76 Ų76121.4 Ų121.440%0.39856%0.563SS.*Hα-helixtrans-62.8-44.2173.6-166.189.1000111.8W344 R346 Y351 M352W344-L348 HydrophobicContact CH2-CD1 4.35Å; W344-L348 HydrophobicContact CH2-CD2 4.18Å; W344-L348 HydrophobicContact CZ2-CD1 3.95Å; W344-L348 HydrophobicContact CZ3-CD2 4.47Å; W344-L348 VanDerWaalsContact O-CB 3.27Å; W344-L348 WeakPolarHBondContact O-CB 3.34Å; W344-L348 PolarHBondContact O-N 3.34Å; R346-L348 VanDerWaalsContact C-N 3.27Å; R346-L348 PolarHBondContact O-N 3.39Å; L348-Y351 PolarHBondContact O-N 3.22Å; L348-M352 WeakPolarHBondContact O-CB 3.13Å; L348-M352 WeakPolarHBondContact O-CG 3.21Å; L348-M352 PolarHBondContact O-N 3.08Å
349R84.7Confident81.2Confident118 Ų118122.9 Ų122.945%0.44557%0.57SS.*Hα-helixtrans-62.9-42.6176.2-79.4-173.1179.899.34.4111.9E345 R346 M352 N353 L354E345-R349 WeakPolarHBondContact O-CG 3.25Å; E345-R349 PolarHBondContact O-N 3.47Å; E345-R349 IonicContact OE1-CZ 3.57Å; E345-R349 IonicContact OE1-NH1 3.59Å; E345-R349 PolarHBondContact OE1-NH1 3.38Å; E345-R349 IonicContact OE1-NH2 3.61Å; E345-R349 PolarHBondContact OE1-NH2 3.13Å; E345-R349 IonicContact OE2-NH1 2.76Å; R346-R349 WeakPolarHBondContact O-CB 3.41Å; R346-R349 PolarHBondContact O-N 3.13Å; R349-M352 PolarHBondContact O-N 2.8Å; R349-N353 PolarHBondContact O-N 3.42Å; R349-L354 PolarHBondContact O-N 3.39Å; R349-L354 VanDerWaalsContact O-N 3.16Å
350T84.3Confident80.7Confident75 Ų75125.4 Ų125.446%0.4658%0.581SS.*Hα-helixtrans-65.3-44.2177.5-42.30000110.8R346 D347 M352 N353R346-T350 PolarHBondContact O-N 3.41Å; R346-T350 PolarHBondContact O-OG1 2.94Å; D347-T350 PolarHBondContact O-N 3.44Å; T350-M352 VanDerWaalsContact C-N 3.34Å; T350-M352 PolarHBondContact O-N 3Å; T350-N353 PolarHBondContact O-N 3.2Å
351Y80.3Confident80.1Confident187 Ų187125.4 Ų125.473%0.73358%0.583SS**Hα-helixtrans-62-39.3176.5-179.8-100.1000112.8D347 L348 N353D347-Y351 VanDerWaalsContact O-CB 3.25Å; D347-Y351 WeakPolarHBondContact O-CB 3.45Å; D347-Y351 PolarHBondContact O-N 3.07Å; L348-Y351 PolarHBondContact O-N 3.22Å; Y351-N353 VanDerWaalsContact C-N 3.29Å; Y351-N353 PolarHBondContact O-N 3.43Å
352M82Confident79.5Confident112 Ų112128.5 Ų128.555%0.55259%0.594SS**THydrogen-bonded Turntrans-84.84.5-179-62.3-65-78.800113.6L348 R349 T350 L354L348-M352 WeakPolarHBondContact O-CB 3.13Å; L348-M352 WeakPolarHBondContact O-CG 3.21Å; L348-M352 PolarHBondContact O-N 3.08Å; R349-M352 PolarHBondContact O-N 2.8Å; T350-M352 VanDerWaalsContact C-N 3.34Å; T350-M352 PolarHBondContact O-N 3Å; M352-L354 HydrophobicContact CB-CD1 3.87Å; M352-L354 HydrophobicContact CB-CG 4Å; M352-L354 PolarHBondContact O-N 3.48Å
353N72.5Confident78.7Confident140 Ų140130.1 Ų130.175%0.74961%0.608SS**THydrogen-bonded Turntrans48.840.4-176.9-70.5-41.3000113.4R349 T350 Y351 E355R349-N353 PolarHBondContact O-N 3.42Å; T350-N353 PolarHBondContact O-N 3.2Å; Y351-N353 VanDerWaalsContact C-N 3.29Å; Y351-N353 PolarHBondContact O-N 3.43Å; N353-E355 PolarHBondContact O-N 3.12Å
354L65.6Low77.7Confident123 Ų123136 Ų13664%0.64462%0.621SS**  trans-8718.6-179.5-73.3168000113.3R349 M352 F356R349-L354 PolarHBondContact O-N 3.39Å; R349-L354 VanDerWaalsContact O-N 3.16Å; M352-L354 HydrophobicContact CB-CD1 3.87Å; M352-L354 HydrophobicContact CB-CG 4Å; M352-L354 PolarHBondContact O-N 3.48Å; L354-F356 PolarHBondContact O-N 3.2Å
355E51.9Low76.7Confident150 Ų150133.8 Ų133.870%0.70162%0.621SS**  trans-88.490.8176.1-72.3-174.7165.200110.7N353N353-E355 PolarHBondContact O-N 3.12Å
356F49.9Very low75.5Confident278 Ų278138.9 Ų138.9100%1.21965%0.645SS**  trans-123.80151.9-84.6-75.7000109.3L354L354-F356 PolarHBondContact O-N 3.2Å

Retrieved 356 of 356 residues in 465.2 ms (Link to these results)