A0A077ZEH1_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZEH1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 143 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
1M48Very low52.4Low214 Ų214136.9 Ų136.9100%1.05473%0.731SS**  0200-106-172.2-80.800112.4V3M1-V3 PolarHBondContact O-N 3.42Å
2E54Low51.9Low159 Ų159133.8 Ų133.874%0.74373%0.729SS**THydrogen-bonded Turntrans-88.2-4.1-162.1-70.3164.3151.300115.2N6E2-N6 PolarHBondContact O-ND2 3.4Å
3V51.4Low51.5Low114 Ų114136.3 Ų136.369%0.69174%0.741SS**THydrogen-bonded Turntrans-81.3-35.6-176.6-170.40000111.6M1 N6M1-V3 PolarHBondContact O-N 3.42Å; V3-N6 PolarHBondContact O-N 3.18Å
4E53Low51Low146 Ų146144.4 Ų144.468%0.68276%0.755SS**G310 helixtrans-72.3-35.1179.5-68.1178.9166.800111.9N6 L7 E8E4-N6 PolarHBondContact O-N 3.46Å; E4-L7 PolarHBondContact O-N 3.11Å; E4-L7 VanDerWaalsContact O-N 3.11Å; E4-E8 PolarHBondContact O-N 3.34Å
5K57.8Low50.6Low169 Ų169142.7 Ų142.774%0.73576%0.761SS**G310 helixtrans-64.6-22.3176.8-156.3178.7-176.3-176.60113.4
6N58.7Low50.5Low121 Ų121139.1 Ų139.165%0.64776%0.757SS**G310 helixtrans-90.1-11.9178.2-70.5-27.1000113.5E2 V3 E4E2-N6 PolarHBondContact O-ND2 3.4Å; V3-N6 PolarHBondContact O-N 3.18Å; E4-N6 PolarHBondContact O-N 3.46Å
7L52.4Low50.4Low117 Ų117136.8 Ų136.861%0.61376%0.761SS**THydrogen-bonded Turntrans-92.3-25.2177.3-76.6161.4000112.6E4 G9E4-L7 PolarHBondContact O-N 3.11Å; E4-L7 VanDerWaalsContact O-N 3.11Å; L7-G9 PolarHBondContact O-N 3.19Å
8E52.3Low50.5Low161 Ų161132 Ų13275%0.75274%0.738SS**THydrogen-bonded Turntrans-73.4-12.4174.8-74.2174.6152.400113.5E4E4-E8 PolarHBondContact O-N 3.34Å
9G51.6Low51.2Low64 Ų64129.4 Ų129.466%0.6673%0.726SS**THydrogen-bonded Turntrans-87.1-8.1-17800000116.7L7L7-G9 PolarHBondContact O-N 3.19Å
10T49.6Very low51.9Low115 Ų115129.1 Ų129.171%0.70673%0.728SS**SBendtrans-113-2.4-172.251.70000115.2
11V47.9Very low52.9Low126 Ų126127.4 Ų127.476%0.76472%0.717SS**SBendtrans-95.4-5.3-177-170.70000112.8
12S46.2Very low53.9Low100 Ų100121.7 Ų121.770%0.69969%0.688SS**  trans-108.656.3-172.7-171.50000114.1
13N46.3Very low54.7Low166 Ų166119 Ų11989%0.88868%0.677SS**  trans-125.475.3156.7-87-27.1000109.3
14R45.3Very low55.9Low249 Ų249120.1 Ų120.194%0.9467%0.669SS**  trans-69.2115.5159.3-82.6178.5-179.1177.90.3109
15S44.6Very low56.8Low120 Ų120119 Ų11984%0.83966%0.664SS**  trans-172.4121.7150.7-1740000105.9
16A49.2Very low57.5Low85 Ų85115.7 Ų115.770%0.70265%0.654SS**  cis-142.9167.96.300000107S18A16-S18 PolarHBondContact O-N 2.89Å
17A49.2Very low58.2Low99 Ų99115.4 Ų115.482%0.81865%0.652SS**  trans-48.7106.9177.300000110.9T19A17-T19 PolarHBondContact O-N 3.37Å; A17-T19 VanDerWaalsContact O-N 3.1Å
18S52Low59Low51 Ų51114 Ų11436%0.35764%0.644SS.*  trans-63.3115.1171-171.80000106.6A16 E22A16-S18 PolarHBondContact O-N 2.89Å; S18-E22 VanDerWaalsContact CA-OE2 3.23Å; S18-E22 WeakPolarHBondContact CA-OE2 3.46Å; S18-E22 WeakPolarHBondContact CB-OE2 3.4Å; S18-E22 WeakPolarHBondContact OG-CB 3.35Å; S18-E22 PolarHBondContact OG-OE2 2.94Å
19T63.7Low59.8Low83 Ų83108.8 Ų108.851%0.50963%0.628SS.*  trans-57.8150.5178.726.50000109.1A17 D21 E22 I23A17-T19 PolarHBondContact O-N 3.37Å; A17-T19 VanDerWaalsContact O-N 3.1Å; T19-D21 PolarHBondContact O-N 2.89Å; T19-E22 PolarHBondContact O-N 2.98Å; T19-I23 PolarHBondContact O-N 3.15Å
20T65.5Low60.6Low123 Ų123112.7 Ų112.776%0.75563%0.626SS**Hα-helixtrans-48.6-32.7178.613.30000112.6R24T20-R24 WeakPolarHBondContact O-CB 3.23Å; T20-R24 PolarHBondContact O-N 2.88Å
21D71.6Confident61.2Low94 Ų94110.4 Ų110.450%0.50361%0.613SS.*Hα-helixtrans-68.5-36.1175.5-80.6-40.8000114.7T19 R24 Q25T19-D21 PolarHBondContact O-N 2.89Å; D21-R24 WeakPolarHBondContact O-CB 3.33Å; D21-R24 PolarHBondContact O-N 2.74Å; D21-R24 IonicContact OD1-NE 2.89Å; D21-Q25 WeakPolarHBondContact O-CB 3.37Å; D21-Q25 VanDerWaalsContact O-CG 3.32Å; D21-Q25 WeakPolarHBondContact O-CG 3.36Å; D21-Q25 PolarHBondContact O-N 2.92Å
22E69.8Low61.7Low94 Ų94110.4 Ų110.444%0.43960%0.604SS.*Hα-helixtrans-71.4-37.8177.2-74.6176.3174.900111.7S18 T19 R24 Q25 N26S18-E22 VanDerWaalsContact CA-OE2 3.23Å; S18-E22 WeakPolarHBondContact CA-OE2 3.46Å; S18-E22 WeakPolarHBondContact CB-OE2 3.4Å; S18-E22 WeakPolarHBondContact OG-CB 3.35Å; S18-E22 PolarHBondContact OG-OE2 2.94Å; T19-E22 PolarHBondContact O-N 2.98Å; E22-R24 VanDerWaalsContact C-N 3.32Å; E22-Q25 PolarHBondContact O-N 3.27Å; E22-N26 WeakPolarHBondContact O-CB 3.49Å; E22-N26 PolarHBondContact O-N 2.73Å; E22-N26 PolarHBondContact O-ND2 3Å
23I71.9Confident62.2Low103 Ų103108.7 Ų108.753%0.52859%0.592SS.*Hα-helixtrans-63.1-44171.7-60.9176.2000109.3T19 N26 L27T19-I23 PolarHBondContact O-N 3.15Å; I23-N26 PolarHBondContact O-N 2.65Å; I23-L27 WeakPolarHBondContact O-CB 3.41Å; I23-L27 PolarHBondContact O-N 3.44Å
24R74.5Confident62.7Low136 Ų136107.1 Ų107.151%0.51358%0.579SS.*Hα-helixtrans-61.4-45.6176.2-166.7-174.275.280.4-1111.6T20 D21 E22 L27 M28T20-R24 WeakPolarHBondContact O-CB 3.23Å; T20-R24 PolarHBondContact O-N 2.88Å; D21-R24 WeakPolarHBondContact O-CB 3.33Å; D21-R24 PolarHBondContact O-N 2.74Å; D21-R24 IonicContact OD1-NE 2.89Å; E22-R24 VanDerWaalsContact C-N 3.32Å; R24-L27 PolarHBondContact O-N 3.48Å; R24-M28 VanDerWaalsContact O-CG 3.28Å; R24-M28 WeakPolarHBondContact O-CG 3.38Å; R24-M28 PolarHBondContact O-N 3.1Å
25Q73.7Confident63Low124 Ų124100.1 Ų100.158%0.57956%0.564SS**Hα-helixtrans-63.7-43.5177.3-78-177.110.400112D21 E22 L27 M28 A29D21-Q25 WeakPolarHBondContact O-CB 3.37Å; D21-Q25 VanDerWaalsContact O-CG 3.32Å; D21-Q25 WeakPolarHBondContact O-CG 3.36Å; D21-Q25 PolarHBondContact O-N 2.92Å; E22-Q25 PolarHBondContact O-N 3.27Å; Q25-L27 VanDerWaalsContact C-N 3.3Å; Q25-L27 PolarHBondContact O-N 3.42Å; Q25-M28 PolarHBondContact O-N 2.91Å; Q25-A29 WeakPolarHBondContact O-CB 3.13Å; Q25-A29 PolarHBondContact O-N 3.38Å
26N71.5Confident63.4Low98 Ų9896.7 Ų96.752%0.52454%0.543SS..Hα-helixtrans-63.9-36.1175.8-89.3-52000112.5E22 I23 K30E22-N26 WeakPolarHBondContact O-CB 3.49Å; E22-N26 PolarHBondContact O-N 2.73Å; E22-N26 PolarHBondContact O-ND2 3Å; I23-N26 PolarHBondContact O-N 2.65Å; N26-K30 WeakPolarHBondContact O-CB 3.35Å; N26-K30 VanDerWaalsContact O-CG 3.29Å; N26-K30 WeakPolarHBondContact O-CG 3.5Å; N26-K30 PolarHBondContact O-N 3Å
27L73.4Confident63.7Low116 Ų11699.3 Ų99.361%0.60754%0.539SS*.Hα-helixtrans-65-47.1174.8-172.666.2000110.9I23 R24 Q25 K30 T31I23-L27 WeakPolarHBondContact O-CB 3.41Å; I23-L27 PolarHBondContact O-N 3.44Å; R24-L27 PolarHBondContact O-N 3.48Å; Q25-L27 VanDerWaalsContact C-N 3.3Å; Q25-L27 PolarHBondContact O-N 3.42Å; L27-K30 PolarHBondContact O-N 3.44Å; L27-T31 PolarHBondContact O-N 3.26Å; L27-T31 PolarHBondContact O-OG1 3.08Å
28M69.5Low63.8Low88 Ų8898.5 Ų98.543%0.43353%0.526SS..Hα-helixtrans-61.1-45.7177.3-68.3-64-64.700112R24 Q25 K30 T31 E32R24-M28 VanDerWaalsContact O-CG 3.28Å; R24-M28 WeakPolarHBondContact O-CG 3.38Å; R24-M28 PolarHBondContact O-N 3.1Å; Q25-M28 PolarHBondContact O-N 2.91Å; M28-K30 VanDerWaalsContact C-N 3.32Å; M28-K30 PolarHBondContact O-N 3.23Å; M28-T31 WeakPolarHBondContact CA-OG1 3.32Å; M28-T31 PolarHBondContact O-N 2.86Å; M28-T31 PolarHBondContact O-OG1 3.3Å; M28-E32 WeakPolarHBondContact O-CG 3.4Å; M28-E32 PolarHBondContact O-N 2.99Å
29A68.6Low63.9Low51 Ų5198.3 Ų98.342%0.42153%0.527SS..Hα-helixtrans-63.7-37.2178.400000112.3Q25 S33Q25-A29 WeakPolarHBondContact O-CB 3.13Å; Q25-A29 PolarHBondContact O-N 3.38Å; A29-S33 WeakPolarHBondContact O-CB 3.28Å; A29-S33 PolarHBondContact O-N 3.3Å
30K69Low63.5Low145 Ų145101 Ų10163%0.6354%0.538SS*.Hα-helixtrans-66.5-43.4174-78.3178-178.4-179.80111.5N26 L27 M28 E32 S33 Q34N26-K30 WeakPolarHBondContact O-CB 3.35Å; N26-K30 VanDerWaalsContact O-CG 3.29Å; N26-K30 WeakPolarHBondContact O-CG 3.5Å; N26-K30 PolarHBondContact O-N 3Å; L27-K30 PolarHBondContact O-N 3.44Å; M28-K30 VanDerWaalsContact C-N 3.32Å; M28-K30 PolarHBondContact O-N 3.23Å; K30-E32 PolarHBondContact O-N 2.9Å; K30-S33 PolarHBondContact O-N 3.42Å; K30-Q34 WeakPolarHBondContact O-CB 3.49Å; K30-Q34 PolarHBondContact O-N 2.8Å
31T62Low63Low68 Ų68101.9 Ų101.942%0.41754%0.537SS..Hα-helixtrans-63.5-40.817747.40000111.8L27 M28 Q34 V35L27-T31 PolarHBondContact O-N 3.26Å; L27-T31 PolarHBondContact O-OG1 3.08Å; M28-T31 WeakPolarHBondContact CA-OG1 3.32Å; M28-T31 PolarHBondContact O-N 2.86Å; M28-T31 PolarHBondContact O-OG1 3.3Å; T31-Q34 PolarHBondContact O-N 3.03Å; T31-V35 WeakPolarHBondContact O-CB 3.27Å; T31-V35 WeakPolarHBondContact O-CG2 3.48Å; T31-V35 PolarHBondContact O-N 2.92Å
32E58Low61.8Low126 Ų12699.9 Ų99.959%0.58954%0.538SS*.Hα-helixtrans-66.9-41.7177.3-72.6171.9-16600112.2M28 K30 Q34 V35 A36M28-E32 WeakPolarHBondContact O-CG 3.4Å; M28-E32 PolarHBondContact O-N 2.99Å; K30-E32 PolarHBondContact O-N 2.9Å; E32-Q34 VanDerWaalsContact C-N 3.28Å; E32-Q34 PolarHBondContact O-N 3.24Å; E32-V35 PolarHBondContact O-N 3.04Å; E32-A36 WeakPolarHBondContact O-CB 3.38Å; E32-A36 PolarHBondContact O-N 2.97Å
33S57.1Low61Low63 Ų63101.5 Ų101.544%0.44155%0.55SS.*Hα-helixtrans-64.7-34.8176.4-170.90000112.2A29 K30 K37A29-S33 WeakPolarHBondContact O-CB 3.28Å; A29-S33 PolarHBondContact O-N 3.3Å; K30-S33 PolarHBondContact O-N 3.42Å; S33-K37 WeakPolarHBondContact O-CG 3.4Å; S33-K37 PolarHBondContact O-N 2.93Å; S33-K37 VanDerWaalsContact O-N 3.07Å
34Q56.4Low60Low133 Ų133106.3 Ų106.362%0.62156%0.563SS**Hα-helixtrans-76.6-37.9177.8-160.1142-0.100111.8K30 T31 E32 A36 K37 C38K30-Q34 WeakPolarHBondContact O-CB 3.49Å; K30-Q34 PolarHBondContact O-N 2.8Å; T31-Q34 PolarHBondContact O-N 3.03Å; E32-Q34 VanDerWaalsContact C-N 3.28Å; E32-Q34 PolarHBondContact O-N 3.24Å; Q34-A36 VanDerWaalsContact C-N 3.3Å; Q34-A36 PolarHBondContact O-N 3.43Å; Q34-K37 PolarHBondContact O-N 3.3Å; Q34-C38 WeakPolarHBondContact O-CB 3.41Å; Q34-C38 PolarHBondContact O-N 3.4Å; Q34-C38 PolarHBondContact O-SG 2.97Å; Q34-C38 VanDerWaalsContact O-SG 3.38Å
35V52Low58.9Low102 Ų102107.1 Ų107.162%0.61857%0.57SS**Hα-helixtrans-59.6-42170.7170.70000110.5T31 E32 C38 A39T31-V35 WeakPolarHBondContact O-CB 3.27Å; T31-V35 WeakPolarHBondContact O-CG2 3.48Å; T31-V35 PolarHBondContact O-N 2.92Å; E32-V35 PolarHBondContact O-N 3.04Å; V35-C38 PolarHBondContact O-N 3.3Å; V35-A39 WeakPolarHBondContact O-CB 3.29Å; V35-A39 PolarHBondContact O-N 3.36Å
36A53.8Low57.8Low48 Ų48105.4 Ų105.440%0.39757%0.565SS.*Hα-helixtrans-65.7-41.8176.300000112.7E32 Q34 A39 I40E32-A36 WeakPolarHBondContact O-CB 3.38Å; E32-A36 PolarHBondContact O-N 2.97Å; Q34-A36 VanDerWaalsContact C-N 3.3Å; Q34-A36 PolarHBondContact O-N 3.43Å; A36-A39 PolarHBondContact O-N 2.71Å; A36-I40 WeakPolarHBondContact O-CB 3.33Å; A36-I40 WeakPolarHBondContact O-CD1 3.34Å; A36-I40 WeakPolarHBondContact O-CG1 3.41Å; A36-I40 PolarHBondContact O-N 2.89Å
37K54Low57.1Low140 Ų140108.6 Ų108.661%0.60958%0.582SS**Hα-helixtrans-67.3-38.3177.5-74178.1-175.2179.70112.6S33 Q34S33-K37 WeakPolarHBondContact O-CG 3.4Å; S33-K37 PolarHBondContact O-N 2.93Å; S33-K37 VanDerWaalsContact O-N 3.07Å; Q34-K37 PolarHBondContact O-N 3.3Å
38C51.5Low56.3Low83 Ų83107.8 Ų107.856%0.56158%0.582SS**Hα-helixtrans-72.5-35.6175-68.50000112Q34 V35 L41 G42Q34-C38 WeakPolarHBondContact O-CB 3.41Å; Q34-C38 PolarHBondContact O-N 3.4Å; Q34-C38 PolarHBondContact O-SG 2.97Å; Q34-C38 VanDerWaalsContact O-SG 3.38Å; V35-C38 PolarHBondContact O-N 3.3Å; C38-L41 PolarHBondContact O-N 2.88Å; C38-G42 PolarHBondContact O-N 2.79Å
39A54.1Low55.6Low46 Ų46108.4 Ų108.438%0.3859%0.587SS.*Hα-helixtrans-69.2-33.5176.600000112.9V35 A36 L41 G42V35-A39 WeakPolarHBondContact O-CB 3.29Å; V35-A39 PolarHBondContact O-N 3.36Å; A36-A39 PolarHBondContact O-N 2.71Å; A39-L41 PolarHBondContact O-N 3.2Å; A39-G42 PolarHBondContact O-N 2.9Å
40I54.8Low55.2Low141 Ų141112.1 Ų112.172%0.72360%0.604SS**Hα-helixtrans-70.4-22.4176.6-68.5164.8000111.7A36A36-I40 WeakPolarHBondContact O-CB 3.33Å; A36-I40 WeakPolarHBondContact O-CD1 3.34Å; A36-I40 WeakPolarHBondContact O-CG1 3.41Å; A36-I40 PolarHBondContact O-N 2.89Å
41L55Low54.7Low141 Ų141111.7 Ų111.774%0.73861%0.609SS**Hα-helixtrans-95.6-8.8176.7-89.3149.7000114.1C38 A39C38-L41 PolarHBondContact O-N 2.88Å; A39-L41 PolarHBondContact O-N 3.2Å
42G47.7Very low54.6Low52 Ų52111.5 Ų111.554%0.53661%0.609SS.*Hα-helixtrans-110.70.7-170.800000116.9C38 A39C38-G42 PolarHBondContact O-N 2.79Å; A39-G42 PolarHBondContact O-N 2.9Å
43N51.9Low54.9Low128 Ų128112 Ų11268%0.68461%0.613SS**  trans-100.829.6-178.7-75.3-11.6000113.6F45N43-F45 PolarHBondContact O-N 3.11Å
44Y52.4Low55.3Low203 Ų203115.3 Ų115.380%0.79663%0.633SS**  trans-74.9102152.1-69.1-80.7000105.2D46Y44-D46 PolarHBondContact O-N 3Å
45F50.5Low55.9Low153 Ų153113.2 Ų113.267%0.67165%0.647SS**  trans-57.797.3158.8-76.7-87.3000105.6N43 D47 F56N43-F45 PolarHBondContact O-N 3.11Å; F45-D47 PolarHBondContact O-N 2.81Å; F45-D47 VanDerWaalsContact O-N 3.11Å; F45-F56 HydrophobicContact CE1-CE1 4.4Å; F45-F56 HydrophobicContact CE1-CZ 4.05Å; F45-F56 HydrophobicContact CZ-CZ 4.43Å
46D51.5Low56.5Low88 Ų88111.5 Ų111.547%0.47163%0.632SS.*  trans-68.7106.6166.6-158.1-21.5000104.8Y44 T48 D49Y44-D46 PolarHBondContact O-N 3Å; D46-T48 PolarHBondContact O-N 3.2Å; D46-T48 WeakPolarHBondContact OD1-CB 3.36Å; D46-T48 PolarHBondContact OD1-N 3.01Å; D46-T48 PolarHBondContact OD1-OG1 2.97Å; D46-T48 PolarHBondContact OD2-OG1 2.74Å; D46-D49 PolarHBondContact O-N 2.92Å
47D55.5Low57.2Low165 Ų165112.9 Ų112.988%0.88263%0.633SS**THydrogen-bonded Turntrans-59.7-2175.3-85.8-27.3000111.8F45F45-D47 PolarHBondContact O-N 2.81Å; F45-D47 VanDerWaalsContact O-N 3.11Å
48T57.6Low57.8Low99 Ų99111.8 Ų111.861%0.60762%0.624SS**THydrogen-bonded Turntrans-96.6-1.717571.10000114.9D46 V50D46-T48 PolarHBondContact O-N 3.2Å; D46-T48 WeakPolarHBondContact OD1-CB 3.36Å; D46-T48 PolarHBondContact OD1-N 3.01Å; D46-T48 PolarHBondContact OD1-OG1 2.97Å; D46-T48 PolarHBondContact OD2-OG1 2.74Å; T48-V50 WeakPolarHBondContact O-CG2 3.4Å; T48-V50 PolarHBondContact O-N 3.19Å
49D55.5Low58.6Low101 Ų101111.9 Ų111.954%0.5462%0.623SS.*  trans-67.3106.6174.8-87.4-22.5000110.7D46 D51 R58D46-D49 PolarHBondContact O-N 2.92Å; D49-D51 PolarHBondContact O-N 3.3Å; D49-R58 PolarHBondContact O-NH2 3.4Å
50V58.8Low59.5Low129 Ų129115 Ų11578%0.78263%0.632SS**SBendtrans-64.7-21.4-170.7179.50000112.7T48T48-V50 WeakPolarHBondContact O-CG2 3.4Å; T48-V50 PolarHBondContact O-N 3.19Å
51D59.3Low60.2Low136 Ų136110.3 Ų110.373%0.72761%0.611SS**SBendtrans-122.1117.5-179.7-72.3-40.2000112.1D49 M53D49-D51 PolarHBondContact O-N 3.3Å; D51-M53 PolarHBondContact O-N 2.99Å
52P60.4Low60.8Low64 Ų64112.7 Ų112.742%0.41661%0.61SS.*PPolyproline II helixtrans-62.7134.5169.325.6-30.3000109.7R58P52-R58 HydrophobicContact CB-CG 4.34Å
53M63.6Low61.9Low138 Ų138118.9 Ų118.968%0.6862%0.617SS**PPolyproline II helixtrans-48.1133.2173.1-173.2158.555.300110.1D51 G55 F56D51-M53 PolarHBondContact O-N 2.99Å; M53-G55 PolarHBondContact O-N 2.87Å; M53-G55 VanDerWaalsContact O-N 3.16Å; M53-F56 HydrophobicContact CB-CB 4.07Å; M53-F56 WeakPolarHBondContact O-CB 3.37Å; M53-F56 PolarHBondContact O-N 3.31Å
54P65Low62.9Low131 Ų131115.3 Ų115.385%0.85161%0.605SS**THydrogen-bonded Turntrans-54.9124-175.4-24.631.9000111.4
55G68.6Low63.7Low90 Ų90113.9 Ų113.993%0.92860%0.598SS**THydrogen-bonded Turntrans87.2-2.5-175.900000115.4M53 D57M53-G55 PolarHBondContact O-N 2.87Å; M53-G55 VanDerWaalsContact O-N 3.16Å; G55-D57 PolarHBondContact O-N 3.17Å
56F65.9Low64.6Low66 Ų66112.6 Ų112.629%0.28960%0.598SS.*  trans-8698.7173.5-170.4-102.7000110.9F45 M53 R58 T61F45-F56 HydrophobicContact CE1-CE1 4.4Å; F45-F56 HydrophobicContact CE1-CZ 4.05Å; F45-F56 HydrophobicContact CZ-CZ 4.43Å; M53-F56 HydrophobicContact CB-CB 4.07Å; M53-F56 WeakPolarHBondContact O-CB 3.37Å; M53-F56 PolarHBondContact O-N 3.31Å; F56-R58 HydrophobicContact CD1-CG 3.8Å; F56-R58 HydrophobicContact CE1-CG 3.84Å; F56-R58 PolarHBondContact O-N 3.07Å; F56-R58 VanDerWaalsContact O-N 3.13Å; F56-T61 HydrophobicContact CE2-CG2 4.47Å; F56-T61 WeakPolarHBondContact CE2-OG1 3.39Å; F56-T61 HydrophobicContact CZ-CG2 3.92Å; F56-T61 VanDerWaalsContact CZ-OG1 3.26Å; F56-T61 WeakPolarHBondContact CZ-OG1 3.37Å
57D68.9Low65.6Low77 Ų77112.8 Ų112.841%0.41261%0.606SS.*  trans-76.499.6171.7-173.7-5.6000110G55 T59 L60 T61G55-D57 PolarHBondContact O-N 3.17Å; D57-T59 VanDerWaalsContact CG-OG1 3.29Å; D57-T59 PolarHBondContact O-N 2.99Å; D57-T59 WeakPolarHBondContact OD1-CA 3.39Å; D57-T59 VanDerWaalsContact OD1-CB 3.3Å; D57-T59 WeakPolarHBondContact OD1-CB 3.2Å; D57-T59 PolarHBondContact OD1-N 3.35Å; D57-T59 PolarHBondContact OD1-OG1 3.1Å; D57-T59 PolarHBondContact OD2-OG1 3.1Å; D57-L60 HydrophobicContact CB-CB 3.75Å; D57-L60 PolarHBondContact O-N 2.91Å; D57-L60 PolarHBondContact OD1-N 2.68Å; D57-T61 PolarHBondContact O-N 3Å; D57-T61 PolarHBondContact O-OG1 2.99Å
58R66Low66.1Low116 Ų116107.3 Ų107.344%0.43858%0.579SS.*Hα-helixtrans-56.3-30.8174.4-71.3-177.2173.2169.40.4111.7D49 P52 F56 R62D49-R58 PolarHBondContact O-NH2 3.4Å; P52-R58 HydrophobicContact CB-CG 4.34Å; F56-R58 HydrophobicContact CD1-CG 3.8Å; F56-R58 HydrophobicContact CE1-CG 3.84Å; F56-R58 PolarHBondContact O-N 3.07Å; F56-R58 VanDerWaalsContact O-N 3.13Å; R58-R62 WeakPolarHBondContact O-CB 3.46Å; R58-R62 PolarHBondContact O-N 3.41Å
59T68.2Low66.6Low86 Ų86105.4 Ų105.453%0.52857%0.568SS.*Hα-helixtrans-75.7-36.9-179.876.10000112.1D57 R62 R63D57-T59 VanDerWaalsContact CG-OG1 3.29Å; D57-T59 PolarHBondContact O-N 2.99Å; D57-T59 WeakPolarHBondContact OD1-CA 3.39Å; D57-T59 VanDerWaalsContact OD1-CB 3.3Å; D57-T59 WeakPolarHBondContact OD1-CB 3.2Å; D57-T59 PolarHBondContact OD1-N 3.35Å; D57-T59 PolarHBondContact OD1-OG1 3.1Å; D57-T59 PolarHBondContact OD2-OG1 3.1Å; T59-R62 PolarHBondContact O-N 3.4Å; T59-R63 PolarHBondContact O-N 3.41Å
60L73.1Confident67Low111 Ų111106.7 Ų106.758%0.58158%0.58SS**Hα-helixtrans-64.1-44.1172.7-176.466.6000111D57 R62 R63 A64D57-L60 HydrophobicContact CB-CB 3.75Å; D57-L60 PolarHBondContact O-N 2.91Å; D57-L60 PolarHBondContact OD1-N 2.68Å; L60-R62 VanDerWaalsContact C-N 3.32Å; L60-R62 PolarHBondContact O-N 3.21Å; L60-R63 PolarHBondContact O-N 3.31Å; L60-A64 WeakPolarHBondContact O-CB 3.49Å; L60-A64 PolarHBondContact O-N 2.76Å
61T68Low67.5Low43 Ų43107.2 Ų107.226%0.26457%0.569SS.*Hα-helixtrans-63.5-40.2178.5-48.10000111.3F56 D57 A64 W65F56-T61 HydrophobicContact CE2-CG2 4.47Å; F56-T61 WeakPolarHBondContact CE2-OG1 3.39Å; F56-T61 HydrophobicContact CZ-CG2 3.92Å; F56-T61 VanDerWaalsContact CZ-OG1 3.26Å; F56-T61 WeakPolarHBondContact CZ-OG1 3.37Å; D57-T61 PolarHBondContact O-N 3Å; D57-T61 PolarHBondContact O-OG1 2.99Å; T61-A64 PolarHBondContact O-N 3.13Å; T61-W65 VanDerWaalsContact O-CD1 3.28Å; T61-W65 PolarHBondContact O-N 2.93Å
62R67.7Low67.5Low190 Ų190107.4 Ų107.472%0.71756%0.559SS**Hα-helixtrans-65.4-44.7175.9-159.3172.9-165.5166.55.7112.1R58 T59 L60 A64 W65 D66R58-R62 WeakPolarHBondContact O-CB 3.46Å; R58-R62 PolarHBondContact O-N 3.41Å; T59-R62 PolarHBondContact O-N 3.4Å; L60-R62 VanDerWaalsContact C-N 3.32Å; L60-R62 PolarHBondContact O-N 3.21Å; R62-A64 VanDerWaalsContact C-N 3.31Å; R62-A64 PolarHBondContact O-N 3.33Å; R62-W65 WeakPolarHBondContact O-CB 3.4Å; R62-W65 PolarHBondContact O-N 3.41Å; R62-W65 VanDerWaalsContact O-N 3.17Å; R62-D66 VanDerWaalsContact O-CG 3.29Å; R62-D66 PolarHBondContact O-N 3.07Å
63R71.8Confident67.3Low183 Ų183107.1 Ų107.169%0.69156%0.562SS**Hα-helixtrans-61.2-37.8173.2-80.7-174.1-169.4160.26113T59 L60 W65 D66 S67T59-R63 PolarHBondContact O-N 3.41Å; L60-R63 PolarHBondContact O-N 3.31Å; R63-W65 VanDerWaalsContact C-N 3.31Å; R63-D66 PolarHBondContact O-N 3.38Å; R63-S67 PolarHBondContact O-N 3.5Å; R63-S67 VanDerWaalsContact O-N 3.09Å
64A72.3Confident67.1Low52 Ų52106.9 Ų106.943%0.4356%0.563SS.*Hα-helixtrans-62.5-42176.100000110.7L60 T61 R62 S67 V68L60-A64 WeakPolarHBondContact O-CB 3.49Å; L60-A64 PolarHBondContact O-N 2.76Å; T61-A64 PolarHBondContact O-N 3.13Å; R62-A64 VanDerWaalsContact C-N 3.31Å; R62-A64 PolarHBondContact O-N 3.33Å; A64-S67 PolarHBondContact O-N 2.89Å; A64-S67 PolarHBondContact O-OG 3.48Å; A64-V68 PolarHBondContact O-N 3.38Å
65W70.7Confident66.7Low174 Ų174106.7 Ų106.766%0.65956%0.555SS**Hα-helixtrans-65.1-38.6173-84.5108.6000113.5T61 R62 R63 S67 V68T61-W65 VanDerWaalsContact O-CD1 3.28Å; T61-W65 PolarHBondContact O-N 2.93Å; R62-W65 WeakPolarHBondContact O-CB 3.4Å; R62-W65 PolarHBondContact O-N 3.41Å; R62-W65 VanDerWaalsContact O-N 3.17Å; R63-W65 VanDerWaalsContact C-N 3.31Å; W65-S67 PolarHBondContact O-N 3.03Å; W65-V68 HydrophobicContact CE3-CB 4.46Å; W65-V68 HydrophobicContact CE3-CG2 4Å; W65-V68 HydrophobicContact CZ3-CG2 4.45Å; W65-V68 VanDerWaalsContact O-CB 3.3Å; W65-V68 WeakPolarHBondContact O-CB 3.12Å; W65-V68 PolarHBondContact O-N 3.17Å; W65-V68 VanDerWaalsContact O-N 3.08Å
66D69.4Low66.1Low126 Ų126105.8 Ų105.867%0.67454%0.539SS*.Hα-helixtrans-65.6-23.7176.1-64.3-29.5000112.5R62 R63 V68R62-D66 VanDerWaalsContact O-CG 3.29Å; R62-D66 PolarHBondContact O-N 3.07Å; R63-D66 PolarHBondContact O-N 3.38Å; D66-V68 VanDerWaalsContact C-N 3.35Å
67S71.7Confident65.5Low91 Ų91109.4 Ų109.464%0.63656%0.557SS**THydrogen-bonded Turntrans-83-9.6175.176.40000114R63 A64 W65 P69R63-S67 PolarHBondContact O-N 3.5Å; R63-S67 VanDerWaalsContact O-N 3.09Å; A64-S67 PolarHBondContact O-N 2.89Å; A64-S67 PolarHBondContact O-OG 3.48Å; W65-S67 PolarHBondContact O-N 3.03Å; S67-P69 WeakPolarHBondContact O-CD 3.35Å
68V64.7Low64.8Low50 Ų50111.3 Ų111.330%0.30357%0.573SS.*SBendtrans-70.9120.9177.4175.40000108.5A64 W65 D66 T70 W72A64-V68 PolarHBondContact O-N 3.38Å; W65-V68 HydrophobicContact CE3-CB 4.46Å; W65-V68 HydrophobicContact CE3-CG2 4Å; W65-V68 HydrophobicContact CZ3-CG2 4.45Å; W65-V68 VanDerWaalsContact O-CB 3.3Å; W65-V68 WeakPolarHBondContact O-CB 3.12Å; W65-V68 PolarHBondContact O-N 3.17Å; W65-V68 VanDerWaalsContact O-N 3.08Å; D66-V68 VanDerWaalsContact C-N 3.35Å; V68-T70 PolarHBondContact O-N 3.44Å; V68-W72 HydrophobicContact CG1-CB 3.44Å; V68-W72 VanDerWaalsContact CG1-CB 3.44Å; V68-W72 HydrophobicContact CG1-CG 4Å
69P68.5Low64.4Low59 Ų59115.4 Ų115.438%0.38359%0.594SS.*  trans-55.7135.5178.9-26.234.8000111.3S67 Y71 W72S67-P69 WeakPolarHBondContact O-CD 3.35Å; P69-Y71 HydrophobicContact CB-CD1 3.41Å; P69-Y71 VanDerWaalsContact CB-CD1 3.41Å; P69-Y71 HydrophobicContact CB-CE1 3.09Å; P69-Y71 HydrophobicContact CB-CG 4.32Å; P69-Y71 HydrophobicContact CG-CE1 3.77Å; P69-Y71 PolarHBondContact O-N 2.87Å; P69-W72 WeakPolarHBondContact O-CB 3.15Å; P69-W72 PolarHBondContact O-N 3.26Å
70T65.4Low63.7Low128 Ų128122.6 Ų122.679%0.78561%0.611SS**Hα-helixtrans-53.6-23.7-175.837.30000114.5V68 W72 A73V68-T70 PolarHBondContact O-N 3.44Å; T70-W72 VanDerWaalsContact C-N 3.28Å; T70-W72 PolarHBondContact O-N 2.93Å; T70-A73 WeakPolarHBondContact O-CB 3.46Å; T70-A73 PolarHBondContact O-N 2.76Å
71Y68.2Low62.7Low140 Ų140123.4 Ų123.455%0.54962%0.621SS.*Hα-helixtrans-69.4-21.4174.770.6-98.8000113.9P69 N74 L75P69-Y71 HydrophobicContact CB-CD1 3.41Å; P69-Y71 VanDerWaalsContact CB-CD1 3.41Å; P69-Y71 HydrophobicContact CB-CE1 3.09Å; P69-Y71 HydrophobicContact CB-CG 4.32Å; P69-Y71 HydrophobicContact CG-CE1 3.77Å; P69-Y71 PolarHBondContact O-N 2.87Å; Y71-N74 PolarHBondContact O-N 2.82Å; Y71-L75 HydrophobicContact CD2-CD1 4.14Å; Y71-L75 PolarHBondContact O-N 3.41Å
72W60.2Low62.1Low141 Ų141130 Ų13053%0.53465%0.649SS.*Hα-helixtrans-72.6-30.2173.6-84.872.8000112.6V68 P69 T70 N74 L75 A76V68-W72 HydrophobicContact CG1-CB 3.44Å; V68-W72 VanDerWaalsContact CG1-CB 3.44Å; V68-W72 HydrophobicContact CG1-CG 4Å; P69-W72 WeakPolarHBondContact O-CB 3.15Å; P69-W72 PolarHBondContact O-N 3.26Å; T70-W72 VanDerWaalsContact C-N 3.28Å; T70-W72 PolarHBondContact O-N 2.93Å; W72-N74 PolarHBondContact O-N 3.17Å; W72-L75 WeakPolarHBondContact O-CB 3.3Å; W72-L75 PolarHBondContact O-N 3.06Å; W72-A76 PolarHBondContact O-N 3.2Å
73A56.3Low61.1Low57 Ų57129.6 Ų129.647%0.47166%0.655SS.*Hα-helixtrans-59.4-35172.600000110.9T70 L75 Q77T70-A73 WeakPolarHBondContact O-CB 3.46Å; T70-A73 PolarHBondContact O-N 2.76Å; A73-L75 VanDerWaalsContact C-N 3.34Å; A73-L75 PolarHBondContact O-N 2.9Å; A73-Q77 WeakPolarHBondContact O-CG 3.46Å; A73-Q77 PolarHBondContact O-N 3.31Å
74N59.2Low59.9Low133 Ų133127.1 Ų127.171%0.71166%0.661SS**Hα-helixtrans-74.7-18.9175.3-66.7-25.8000114.1Y71 W72Y71-N74 PolarHBondContact O-N 2.82Å; W72-N74 PolarHBondContact O-N 3.17Å
75L56Low59.1Low127 Ų127133.6 Ų133.667%0.66568%0.679SS**Hα-helixtrans-86.3-33.5174.4-86.9145.8000112.2Y71 W72 A73Y71-L75 HydrophobicContact CD2-CD1 4.14Å; Y71-L75 PolarHBondContact O-N 3.41Å; W72-L75 WeakPolarHBondContact O-CB 3.3Å; W72-L75 PolarHBondContact O-N 3.06Å; A73-L75 VanDerWaalsContact C-N 3.34Å; A73-L75 PolarHBondContact O-N 2.9Å
76A56.9Low58.1Low72 Ų72131.7 Ų131.760%0.59569%0.687SS**Hα-helixtrans-87.5-15.6-176.800000113.7W72 P78W72-A76 PolarHBondContact O-N 3.2Å; A76-P78 VanDerWaalsContact O-CD 3.3Å; A76-P78 WeakPolarHBondContact O-CD 3.18Å
77Q53.4Low57.3Low142 Ų142133.1 Ų133.166%0.66469%0.693SS**SBendtrans-66.2120.6171.1-65.5-138.1-17.900109.1A73 K79A73-Q77 WeakPolarHBondContact O-CG 3.46Å; A73-Q77 PolarHBondContact O-N 3.31Å; Q77-K79 PolarHBondContact O-N 2.99Å
78P52.9Low56.4Low117 Ų117132.3 Ų132.376%0.7669%0.691SS**  trans-56.5116168.122.5-29.3000106.5A76 R80A76-P78 VanDerWaalsContact O-CD 3.3Å; A76-P78 WeakPolarHBondContact O-CD 3.18Å; P78-R80 PolarHBondContact O-N 3.4Å
79K58.4Low55.5Low202 Ų202135.5 Ų135.588%0.87871%0.713SS**  trans-48.4111.4169.4-77.1-176.9177-179.50105.6Q77 T81Q77-K79 PolarHBondContact O-N 2.99Å; K79-T81 PolarHBondContact O-N 3.01Å
80R52.2Low54.7Low236 Ų236139.4 Ų139.489%0.89174%0.736SS**  trans-42.7123.7173.4-79.3-179.2171.9139.4-1.5106P78 E82P78-R80 PolarHBondContact O-N 3.4Å; R80-E82 VanDerWaalsContact C-N 3.31Å; R80-E82 PolarHBondContact O-N 3.39Å
81T52.6Low53.9Low129 Ų129141.6 Ų141.679%0.79174%0.737SS**  trans-48.2106.1169.338.20000105.9K79 Q83K79-T81 PolarHBondContact O-N 3.01Å; T81-Q83 PolarHBondContact O-N 2.78Å
82E56.5Low52.9Low182 Ų182140.1 Ų140.185%0.8575%0.754SS**  trans-48.1121.9167.1-81.6-170.8160.400105.2R80 V84R80-E82 VanDerWaalsContact C-N 3.31Å; R80-E82 PolarHBondContact O-N 3.39Å; E82-V84 PolarHBondContact O-N 3.05Å
83Q46.7Very low52.2Low180 Ų180140.2 Ų140.284%0.84177%0.765SS**  trans-38.4109.8-177.5-68.2168.4-13.700108.7T81 K85T81-Q83 PolarHBondContact O-N 2.78Å; Q83-K85 PolarHBondContact O-N 2.94Å
84V45.5Very low51.8Low132 Ų132141.2 Ų141.280%0.878%0.78SS**  trans-59.398.5164.7175.20000104.1E82 T86E82-V84 PolarHBondContact O-N 3.05Å; V84-T86 PolarHBondContact O-N 2.83Å
85K54.9Low51.7Low187 Ų187144 Ų14481%0.81379%0.786SS**  trans-50.2120.6174.1-80.9-179.7175.4178.20106.6Q83 I87Q83-K85 PolarHBondContact O-N 2.94Å; K85-I87 PolarHBondContact O-N 2.95Å; K85-I87 VanDerWaalsContact O-N 3.17Å
86T49.6Very low51.9Low135 Ų135148 Ų14883%0.82880%0.798SS**  trans-47123.1173.2-420000108.1V84 A88V84-T86 PolarHBondContact O-N 2.83Å; T86-A88 PolarHBondContact O-N 2.82Å
87I52.7Low51.9Low156 Ų156149.8 Ų149.880%0.880%0.804SS**  trans-59108172.9-63.4164.7000105.6K85K85-I87 PolarHBondContact O-N 2.95Å; K85-I87 VanDerWaalsContact O-N 3.17Å
88A53.4Low52.1Low73 Ų73153.3 Ų153.360%0.60382%0.817SS**  trans-55.5138.6176.200000109T86 V90T86-A88 PolarHBondContact O-N 2.82Å; A88-V90 PolarHBondContact O-N 3.22Å; A88-V90 VanDerWaalsContact O-N 3.17Å
89P46.7Very low52.7Low118 Ų118157.1 Ų157.177%0.76682%0.822SS**  trans-59.3123175.924.9-31.2000108.4E91P89-E91 PolarHBondContact O-N 3.43Å
90V51.5Low52.9Low141 Ų141152.7 Ų152.786%0.85582%0.816SS**  trans-67.7102.9173.5174.20000106.7A88A88-V90 PolarHBondContact O-N 3.22Å; A88-V90 VanDerWaalsContact O-N 3.17Å
91E49Very low53.3Low174 Ų174151.6 Ų151.681%0.81382%0.818SS**  trans-58.7140.1168.6-68.8-161.516200110.4P89 D93P89-E91 PolarHBondContact O-N 3.43Å; E91-D93 VanDerWaalsContact C-N 3.29Å; E91-D93 PolarHBondContact O-N 3.16Å
92A46Very low53.7Low109 Ų109149.3 Ų149.390%0.90181%0.812SS**  trans-78.275.9177.900000110
93D45.9Very low54Low142 Ų142149.5 Ų149.576%0.75981%0.813SS**  trans-144.586.5166-152.6-0.3000113.1E91 K95E91-D93 VanDerWaalsContact C-N 3.29Å; E91-D93 PolarHBondContact O-N 3.16Å; D93-K95 VanDerWaalsContact C-N 3.29Å; D93-K95 PolarHBondContact O-N 2.84Å
94G48.3Very low54.9Low78 Ų78150.6 Ų150.680%0.80482%0.815SS**SBend64.2-17.7126.600000122.4
95K55.7Low56.1Low192 Ų192154 Ų15484%0.83582%0.819SS**  trans-132.499.8-173.9-73.3-177.7-179.6173.20112.7D93 P97D93-K95 VanDerWaalsContact C-N 3.29Å; D93-K95 PolarHBondContact O-N 2.84Å; K95-P97 WeakPolarHBondContact O-CD 3.26Å
96K62.1Low56.7Low210 Ų210154.7 Ų154.791%0.91382%0.822SS**  trans-62.6121.7171.9-69.6-178.3-179.1175.70110.4
97P56.8Low57.3Low110 Ų110150.5 Ų150.571%0.71480%0.798SS**  trans-73.9132.5169.728.4-30.5000110.1K95 K99K95-P97 WeakPolarHBondContact O-CD 3.26Å; P97-K99 PolarHBondContact O-N 3.21Å; P97-K99 VanDerWaalsContact O-N 3.13Å
98K56.6Low57.9Low216 Ų216149 Ų14994%0.93979%0.79SS**  trans-63.4109173.9-73.6177.1177.3174.20109.2
99K64.9Low58.2Low197 Ų197155.4 Ų155.486%0.85780%0.799SS**  trans-74.8131.3172.6-67.7-174.2179.3-177.60109.9P97P97-K99 PolarHBondContact O-N 3.21Å; P97-K99 VanDerWaalsContact O-N 3.13Å
100S62.9Low58.6Low110 Ų110156.9 Ų156.977%0.76980%0.796SS**  trans-62.2148.1171.354.70000110.6A102S100-A102 VanDerWaalsContact C-N 3.28Å; S100-A102 PolarHBondContact O-N 3.5Å
101K61Low58.8Low212 Ų212154.4 Ų154.492%0.92278%0.784SS**  trans-65.286.2175-74.4-177.8179.2177.40109.3H103K101-H103 PolarHBondContact O-N 3.34Å
102A61.9Low59.2Low81 Ų81151.4 Ų151.467%0.66977%0.773SS**  trans-68.1122.2169.400000108.7S100 K104S100-A102 VanDerWaalsContact C-N 3.28Å; S100-A102 PolarHBondContact O-N 3.5Å; A102-K104 PolarHBondContact O-N 3.31Å
103H62.7Low60Low186 Ų186148.8 Ų148.886%0.86175%0.748SS**  trans-53.5111.9167.3-88-93000108.3K101 K105K101-H103 PolarHBondContact O-N 3.34Å; H103-K105 PolarHBondContact O-N 3.28Å
104K65.6Low61.1Low204 Ų204144.3 Ų144.389%0.88772%0.724SS**  trans-64.196.9174.6-71.7-176.6178.3-1790107.8A102 K106A102-K104 PolarHBondContact O-N 3.31Å; K104-K106 PolarHBondContact O-N 3Å
105K70Confident62.2Low203 Ų203146.1 Ų146.188%0.88372%0.722SS**PPolyproline II helixtrans-58.5119.6165.1-69.1-172.3178.1-176.70106.6H103 S107H103-K105 PolarHBondContact O-N 3.28Å; K105-S107 PolarHBondContact O-N 3.37Å
106K67.4Low63Low201 Ų201142.8 Ų142.887%0.87471%0.707SS**PPolyproline II helixtrans-62.5125.7172.3-62.5-178.1-178.1178.40106.7K104 I108K104-K106 PolarHBondContact O-N 3Å; K106-I108 PolarHBondContact O-N 3.47Å
107S63.3Low63.5Low47 Ų47138.8 Ų138.833%0.32969%0.687SS.*PPolyproline II helixtrans-62.1127175.8-177.90000108.6K105 W109 Q110K105-S107 PolarHBondContact O-N 3.37Å; S107-W109 PolarHBondContact O-N 3.4Å; S107-W109 PolarHBondContact OG-N 2.82Å; S107-Q110 VanDerWaalsContact CB-OE1 3.26Å; S107-Q110 WeakPolarHBondContact O-CB 3.18Å; S107-Q110 PolarHBondContact O-N 3.31Å
108I63.9Low64.3Low124 Ų124139 Ų13964%0.63668%0.681SS**Hα-helixtrans-61.5-27.8176.8-39.1172.1000109.6K106 Q110 S111 I112K106-I108 PolarHBondContact O-N 3.47Å; I108-Q110 VanDerWaalsContact C-N 3.29Å; I108-Q110 PolarHBondContact O-N 2.63Å; I108-S111 WeakPolarHBondContact CA-OG 3.3Å; I108-S111 PolarHBondContact O-N 3.32Å; I108-S111 VanDerWaalsContact O-N 3.07Å; I108-S111 PolarHBondContact O-OG 2.91Å; I108-I112 HydrophobicContact CG2-CD1 4.34Å; I108-I112 WeakPolarHBondContact O-CG1 3.49Å; I108-I112 PolarHBondContact O-N 3.2Å; I108-I112 VanDerWaalsContact O-N 3.1Å
109W59.4Low65.3Low209 Ų209133 Ų13379%0.79266%0.659SS**Hα-helixtrans-68.8-23.7173.5-58.5104000113.7S107 I112S107-W109 PolarHBondContact O-N 3.4Å; S107-W109 PolarHBondContact OG-N 2.82Å; W109-I112 HydrophobicContact CE3-CD1 4.33Å
110Q56.1Low65.8Low149 Ų149130.5 Ų130.570%0.69664%0.644SS**Hα-helixtrans-74.8-26.4169.6-115.9108.117.900112.1S107 I108 S113S107-Q110 VanDerWaalsContact CB-OE1 3.26Å; S107-Q110 WeakPolarHBondContact O-CB 3.18Å; S107-Q110 PolarHBondContact O-N 3.31Å; I108-Q110 VanDerWaalsContact C-N 3.29Å; I108-Q110 PolarHBondContact O-N 2.63Å; Q110-S113 WeakPolarHBondContact O-CB 3.34Å
111S56.1Low66.3Low88 Ų88127.2 Ų127.262%0.61562%0.623SS**Hα-helixtrans-84.3-23.3176.945.50000113.8I108 S113I108-S111 WeakPolarHBondContact CA-OG 3.3Å; I108-S111 PolarHBondContact O-N 3.32Å; I108-S111 VanDerWaalsContact O-N 3.07Å; I108-S111 PolarHBondContact O-OG 2.91Å; S111-S113 PolarHBondContact O-N 3.01Å; S111-S113 VanDerWaalsContact O-N 3.1Å
112I57.6Low67.1Low111 Ų111126.2 Ų126.257%0.56961%0.614SS**SBendtrans-85.638.7172.1-49.5158.7000108.9I108 W109 D114I108-I112 HydrophobicContact CG2-CD1 4.34Å; I108-I112 WeakPolarHBondContact O-CG1 3.49Å; I108-I112 PolarHBondContact O-N 3.2Å; I108-I112 VanDerWaalsContact O-N 3.1Å; W109-I112 HydrophobicContact CE3-CD1 4.33Å; I112-D114 PolarHBondContact O-N 2.78Å
113S62.6Low67.9Low54 Ų54128.9 Ų128.938%0.37862%0.616SS.*  trans-71.5102.4-177.565.90000109.5Q110 S111Q110-S113 WeakPolarHBondContact O-CB 3.34Å; S111-S113 PolarHBondContact O-N 3.01Å; S111-S113 VanDerWaalsContact O-N 3.1Å
114D67.6Low68.4Low48 Ų48124.3 Ų124.326%0.25760%0.601SS.*  trans57.199.7162.2-178.827.1000115.6I112 F116 R117 R120I112-D114 PolarHBondContact O-N 2.78Å; D114-F116 PolarHBondContact O-N 3.02Å; D114-F116 PolarHBondContact OD1-N 2.88Å; D114-F116 VanDerWaalsContact OD1-N 3.11Å; D114-R117 HydrophobicContact CB-CB 4.07Å; D114-R117 VanDerWaalsContact O-CB 3.27Å; D114-R117 WeakPolarHBondContact O-CB 3.45Å; D114-R117 PolarHBondContact O-N 3.26Å; D114-R117 WeakPolarHBondContact OD2-CA 3.45Å; D114-R117 PolarHBondContact OD2-N 3.02Å; D114-R120 IonicContact OD1-CZ 3.04Å; D114-R120 IonicContact OD1-NH2 2.71Å; D114-R120 PolarHBondContact OD1-NH2 3.45Å; D114-R120 IonicContact OD2-CZ 3.67Å; D114-R120 IonicContact OD2-NE 3.68Å; D114-R120 PolarHBondContact OD2-NE 3.33Å; D114-R120 IonicContact OD2-NH2 3.86Å; D114-R120 PolarHBondContact OD2-NH2 3.19Å
115P71.1Confident68.5Low117 Ų117117.3 Ų117.376%0.7659%0.587SS**THydrogen-bonded Turntrans-60.4-18.4177.926.3-33.8000112.8
116F73.7Confident68.1Low122 Ų122113.4 Ų113.454%0.53558%0.576SS.*THydrogen-bonded Turntrans-97.45.6177.1-57-73.3000113.5D114 L118 L119 R120D114-F116 PolarHBondContact O-N 3.02Å; D114-F116 PolarHBondContact OD1-N 2.88Å; D114-F116 VanDerWaalsContact OD1-N 3.11Å; F116-L118 PolarHBondContact O-N 3.11Å; F116-L119 HydrophobicContact CB-CB 4.47Å; F116-L119 HydrophobicContact CD1-CD2 3.96Å; F116-L119 WeakPolarHBondContact O-CB 3.36Å; F116-L119 PolarHBondContact O-N 3.13Å; F116-R120 PolarHBondContact O-N 3.06Å
117R72.8Confident67.5Low126 Ų126114.6 Ų114.648%0.47558%0.575SS.*Hα-helixtrans-56.1-43-177.9-161.8-178.596173.49.7111.5D114 A121 D131D114-R117 HydrophobicContact CB-CB 4.07Å; D114-R117 VanDerWaalsContact O-CB 3.27Å; D114-R117 WeakPolarHBondContact O-CB 3.45Å; D114-R117 PolarHBondContact O-N 3.26Å; D114-R117 WeakPolarHBondContact OD2-CA 3.45Å; D114-R117 PolarHBondContact OD2-N 3.02Å; R117-A121 WeakPolarHBondContact O-CB 3.44Å; R117-A121 PolarHBondContact O-N 3.25Å; R117-D131 IonicContact NH2-OD1 2.93Å; R117-D131 IonicContact NH2-OD2 3.78Å
118L72.4Confident67.3Low114 Ų114117.4 Ų117.460%0.59759%0.59SS**Hα-helixtrans-67.1-40.7177.3-172.569.1000112F116 A121 R122F116-L118 PolarHBondContact O-N 3.11Å; L118-A121 PolarHBondContact O-N 3.05Å; L118-R122 WeakPolarHBondContact O-CG 3.44Å; L118-R122 PolarHBondContact O-N 3.17Å; L118-R122 VanDerWaalsContact O-N 3.08Å
119L78.7Confident67.1Low90 Ų90117.3 Ų117.347%0.47160%0.601SS.*Hα-helixtrans-65.3-44.7177.3-175.265.4000111F116 A121 R122 L123F116-L119 HydrophobicContact CB-CB 4.47Å; F116-L119 HydrophobicContact CD1-CD2 3.96Å; F116-L119 WeakPolarHBondContact O-CB 3.36Å; F116-L119 PolarHBondContact O-N 3.13Å; L119-A121 PolarHBondContact O-N 3.21Å; L119-R122 PolarHBondContact O-N 3.06Å; L119-L123 HydrophobicContact CD1-CD1 4.2Å; L119-L123 HydrophobicContact CD1-CG 4.35Å; L119-L123 HydrophobicContact CD2-CD1 4.47Å; L119-L123 HydrophobicContact CG-CD1 3.89Å; L119-L123 HydrophobicContact CG-CG 4.41Å; L119-L123 WeakPolarHBondContact O-CB 3.48Å; L119-L123 WeakPolarHBondContact O-CG 3.45Å; L119-L123 PolarHBondContact O-N 2.99Å
120R75Confident67.1Low145 Ų145116.4 Ų116.455%0.54760%0.602SS.*Hα-helixtrans-60.3-43.9175-78.3-168.5-103.5-152.4-14.3112D114 F116 R122 L123 T124D114-R120 IonicContact OD1-CZ 3.04Å; D114-R120 IonicContact OD1-NH2 2.71Å; D114-R120 PolarHBondContact OD1-NH2 3.45Å; D114-R120 IonicContact OD2-CZ 3.67Å; D114-R120 IonicContact OD2-NE 3.68Å; D114-R120 PolarHBondContact OD2-NE 3.33Å; D114-R120 IonicContact OD2-NH2 3.86Å; D114-R120 PolarHBondContact OD2-NH2 3.19Å; F116-R120 PolarHBondContact O-N 3.06Å; R120-R122 VanDerWaalsContact C-N 3.31Å; R120-R122 PolarHBondContact O-N 2.88Å; R120-L123 PolarHBondContact O-N 3.4Å; R120-T124 WeakPolarHBondContact O-CB 3.3Å; R120-T124 WeakPolarHBondContact O-CG2 3.4Å; R120-T124 PolarHBondContact O-N 2.93Å; R120-T124 PolarHBondContact O-OG1 3.34Å
121A74.3Confident66.8Low41 Ų41114.6 Ų114.634%0.33960%0.598SS.*Hα-helixtrans-61.7-38.5176.900000112.3R117 L118 L119 G125R117-A121 WeakPolarHBondContact O-CB 3.44Å; R117-A121 PolarHBondContact O-N 3.25Å; L118-A121 PolarHBondContact O-N 3.05Å; L119-A121 PolarHBondContact O-N 3.21Å; A121-G125 PolarHBondContact O-N 3.29Å
122R76.6Confident66.3Low191 Ų191115.8 Ų115.872%0.72161%0.606SS**Hα-helixtrans-69.5-43.7176-73.1-179.9179.1179.9-0112.9L118 L119 R120L118-R122 WeakPolarHBondContact O-CG 3.44Å; L118-R122 PolarHBondContact O-N 3.17Å; L118-R122 VanDerWaalsContact O-N 3.08Å; L119-R122 PolarHBondContact O-N 3.06Å; R120-R122 VanDerWaalsContact C-N 3.31Å; R120-R122 PolarHBondContact O-N 2.88Å
123L78.9Confident66Low137 Ų137115.6 Ų115.672%0.71761%0.612SS**Hα-helixtrans-73.1-35.9-177.6-70.3174000113L119 R120L119-L123 HydrophobicContact CD1-CD1 4.2Å; L119-L123 HydrophobicContact CD1-CG 4.35Å; L119-L123 HydrophobicContact CD2-CD1 4.47Å; L119-L123 HydrophobicContact CG-CD1 3.89Å; L119-L123 HydrophobicContact CG-CG 4.41Å; L119-L123 WeakPolarHBondContact O-CB 3.48Å; L119-L123 WeakPolarHBondContact O-CG 3.45Å; L119-L123 PolarHBondContact O-N 2.99Å; R120-L123 PolarHBondContact O-N 3.4Å
124T72.6Confident65.4Low89 Ų89117.4 Ų117.455%0.54663%0.63SS.*Hα-helixtrans-89.9-8.4-174.959.20000113.9R120 N126R120-T124 WeakPolarHBondContact O-CB 3.3Å; R120-T124 WeakPolarHBondContact O-CG2 3.4Å; R120-T124 PolarHBondContact O-N 2.93Å; R120-T124 PolarHBondContact O-OG1 3.34Å; T124-N126 PolarHBondContact O-N 3.43Å
125G68.8Low64.1Low58 Ų58120.5 Ų120.560%0.59866%0.656SS**  trans64.3-3.6-17700000115A121 R127A121-G125 PolarHBondContact O-N 3.29Å; G125-R127 VanDerWaalsContact C-N 3.31Å; G125-R127 PolarHBondContact O-N 3.08Å
126N60.6Low63.1Low121 Ų121120.4 Ų120.465%0.64766%0.658SS**  trans-75.981179.3-97.96.4000110.4T124 T128T124-N126 PolarHBondContact O-N 3.43Å; N126-T128 VanDerWaalsContact C-N 3.29Å; N126-T128 PolarHBondContact O-N 3.09Å
127R56.2Low62Low225 Ų225125 Ų12585%0.84967%0.673SS**  trans-6988.6161.8-63.317798.4146.12.2108G125 S129G125-R127 VanDerWaalsContact C-N 3.31Å; G125-R127 PolarHBondContact O-N 3.08Å; R127-S129 PolarHBondContact O-N 3.28Å
128T57.5Low60.7Low106 Ų106123.8 Ų123.865%0.6568%0.684SS**  trans-63.5124162.856.80000107.5N126 K130N126-T128 VanDerWaalsContact C-N 3.29Å; N126-T128 PolarHBondContact O-N 3.09Å; T128-K130 PolarHBondContact O-N 3.47Å
129S59.4Low59.5Low123 Ų123125.4 Ų125.486%0.8669%0.693SS**THydrogen-bonded Turntrans-62.828.8-166.254.80000117.5R127R127-S129 PolarHBondContact O-N 3.28Å
130K61.2Low58.4Low189 Ų189130.8 Ų130.882%0.82272%0.716SS**THydrogen-bonded Turntrans-123.20.2-179.7-70.8-160.3175.6-173.60116T128 S132T128-K130 PolarHBondContact O-N 3.47Å; K130-S132 PolarHBondContact O-N 2.66Å
131D48.9Very low57.8Low112 Ų112131 Ų13160%0.59973%0.728SS**  trans-95.786.1168.6-76-21000108.6R117R117-D131 IonicContact NH2-OD1 2.93Å; R117-D131 IonicContact NH2-OD2 3.78Å
132S45.4Very low56.7Low113 Ų113136 Ų13679%0.7975%0.749SS**  trans-61124.1163.3-67.80000107.7K130 A134K130-S132 PolarHBondContact O-N 2.66Å; S132-A134 PolarHBondContact O-N 3.34Å
133P51.8Low55.6Low106 Ų106139.4 Ų139.469%0.68877%0.773SS**  trans-62.1130.9171.127-30.3000107.3S135P133-S135 PolarHBondContact O-N 3.26Å
134A49.4Very low54.4Low93 Ų93139.6 Ų139.677%0.76978%0.775SS**  trans-50.7115.6169.500000107.9S132 S136S132-A134 PolarHBondContact O-N 3.34Å; A134-S136 VanDerWaalsContact C-N 3.31Å; A134-S136 PolarHBondContact O-N 2.83Å
135S41.7Very low53.4Low113 Ų113142.2 Ų142.279%0.7979%0.787SS**  trans-68.595.4171.862.90000107.1P133 Y137P133-S135 PolarHBondContact O-N 3.26Å; S135-Y137 PolarHBondContact O-N 2.59Å; S135-Y137 VanDerWaalsContact O-N 3.15Å
136S48.6Very low52.6Low115 Ų115146.9 Ų146.980%0.80480%0.798SS**  trans-68109162.3-74.50000107.8A134A134-S136 VanDerWaalsContact C-N 3.31Å; A134-S136 PolarHBondContact O-N 2.83Å
137Y52.2Low52.1Low218 Ų218148.4 Ų148.486%0.85581%0.807SS**  trans4.7131.3155.7-90.5-103.4000119S135S135-Y137 PolarHBondContact O-N 2.59Å; S135-Y137 VanDerWaalsContact O-N 3.15Å
138S45.3Very low51.8Low100 Ų100143.6 Ų143.670%0.69980%0.804SS**  trans-37128.715850.80000114.4
139D45.5Very low51.5Low149 Ų149146.1 Ų146.180%0.79781%0.814SS**  trans-174105.4143.1-111.1-11000105.9
140Q57.4Low50.9Low203 Ų203147.8 Ų147.895%0.94981%0.811SS**  trans-161.5112.2144-77.6-139.6-47.400108.8
141D62.2Low50.1Low149 Ų149144.6 Ų144.680%0.79781%0.81SS**  trans-57157.1171.7-81.6-52.6000114.9
142D51.5Low50.2Low145 Ų145147.3 Ų147.378%0.77583%0.828SS**  trans39117.9147.5-88.8-23.6000121.2
143H51.7Low50.7Low264 Ų264150.5 Ų150.5100%1.22283%0.831SS**  -159.50128-99.7-56.2000112.2

Retrieved 143 of 143 residues in 30.1 ms (Link to these results)