A0A077ZL51_TRITR Loading...

V-type proton ATPase 116 kDa subunit a isoform 2

AlphaFold DB , UniProt , Accession A0A077ZL51, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 137 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
1M49.2Very low62Low249 Ų249117.2 Ų117.2100%1.22764%0.638SS**  092.40-73.2-167.2161.900107.5
2S48.8Very low61.9Low83 Ų83117.5 Ų117.558%0.5864%0.638SS**  trans-103.3120.3172.4-172.40000105.6D6S2-D6 PolarHBondContact OG-OD2 3.07Å
3S62.5Low62.1Low98 Ų98118.7 Ų118.769%0.68564%0.636SS**  trans-155.2-4.9-169.8-164.50000118.9
4K60.1Low62Low174 Ų174115.7 Ų115.776%0.75763%0.629SS**SBendtrans-138.3-35.3171.7-82.3-177.6175.1162.40113.2V7 V8K4-V7 PolarHBondContact O-N 3.21Å; K4-V8 PolarHBondContact O-N 3.15Å
5D65.6Low61.7Low123 Ų123118.8 Ų118.866%0.65864%0.638SS**Hα-helixtrans-70.8-31.2178.3-62.1-48.1000113.4R9D5-R9 WeakPolarHBondContact O-CG 3.5Å; D5-R9 PolarHBondContact O-N 2.88Å; D5-R9 VanDerWaalsContact O-N 3.08Å
6D66.5Low61.4Low81 Ų81118.2 Ų118.243%0.43364%0.639SS.*Hα-helixtrans-64.8-42.7175.8-100.2-23.7000111.8S2 V8 R9 T10S2-D6 PolarHBondContact OG-OD2 3.07Å; D6-V8 VanDerWaalsContact C-N 3.32Å; D6-V8 PolarHBondContact O-N 2.87Å; D6-R9 PolarHBondContact O-N 2.68Å; D6-T10 PolarHBondContact O-N 3.31Å; D6-T10 PolarHBondContact O-OG1 3.26Å
7V65.4Low61.1Low102 Ų102121.8 Ų121.862%0.61865%0.651SS**Hα-helixtrans-65.3-37.5-178.1-177.40000111.2K4 A11K4-V7 PolarHBondContact O-N 3.21Å; V7-A11 VanDerWaalsContact O-CB 3.32Å; V7-A11 WeakPolarHBondContact O-CB 3.19Å; V7-A11 PolarHBondContact O-N 3.1Å
8V66.5Low60.6Low87 Ų87121.1 Ų121.153%0.52766%0.657SS.*Hα-helixtrans-71.8-37.7177.5179.90000111.3K4 D6 A11 L12K4-V8 PolarHBondContact O-N 3.15Å; D6-V8 VanDerWaalsContact C-N 3.32Å; D6-V8 PolarHBondContact O-N 2.87Å; V8-A11 PolarHBondContact O-N 3.21Å; V8-L12 HydrophobicContact CG1-CD1 4.14Å; V8-L12 PolarHBondContact O-N 2.84Å; V8-L12 VanDerWaalsContact O-N 3.08Å
9R67.7Low60Low154 Ų154125.2 Ų125.258%0.58167%0.672SS**Hα-helixtrans-65.5-46.8173.2-74.4-176.6-161.5161.86.1111.9D5 D6 A11 L12 E13D5-R9 WeakPolarHBondContact O-CG 3.5Å; D5-R9 PolarHBondContact O-N 2.88Å; D5-R9 VanDerWaalsContact O-N 3.08Å; D6-R9 PolarHBondContact O-N 2.68Å; R9-A11 VanDerWaalsContact C-N 3.27Å; R9-A11 PolarHBondContact O-N 3.44Å; R9-L12 PolarHBondContact O-N 2.63Å; R9-L12 VanDerWaalsContact O-N 3.1Å; R9-E13 WeakPolarHBondContact O-CB 3.22Å; R9-E13 WeakPolarHBondContact O-CG 3.4Å; R9-E13 PolarHBondContact O-N 2.97Å
10T65.9Low59.6Low88 Ų88123.9 Ų123.954%0.5467%0.673SS.*Hα-helixtrans-61.1-36.9177.1-46.80000111.8D6 S14D6-T10 PolarHBondContact O-N 3.31Å; D6-T10 PolarHBondContact O-OG1 3.26Å; T10-S14 WeakPolarHBondContact O-CB 3.41Å; T10-S14 PolarHBondContact O-N 3.24Å; T10-S14 VanDerWaalsContact O-N 3.07Å
11A63.5Low59.3Low50 Ų50122.7 Ų122.741%0.41368%0.68SS.*Hα-helixtrans-71-28.3176.700000113.5V7 V8 R9 S14 H15V7-A11 VanDerWaalsContact O-CB 3.32Å; V7-A11 WeakPolarHBondContact O-CB 3.19Å; V7-A11 PolarHBondContact O-N 3.1Å; V8-A11 PolarHBondContact O-N 3.21Å; R9-A11 VanDerWaalsContact C-N 3.27Å; R9-A11 PolarHBondContact O-N 3.44Å; A11-S14 PolarHBondContact O-OG 2.91Å; A11-H15 PolarHBondContact O-CD2 3.4Å
12L61.3Low59.4Low121 Ų121119.5 Ų119.563%0.63466%0.662SS**Hα-helixtrans-83.7-33.9175.3-77.7167.4000112.4V8 R9 S14 H15V8-L12 HydrophobicContact CG1-CD1 4.14Å; V8-L12 PolarHBondContact O-N 2.84Å; V8-L12 VanDerWaalsContact O-N 3.08Å; R9-L12 PolarHBondContact O-N 2.63Å; R9-L12 VanDerWaalsContact O-N 3.1Å; L12-S14 VanDerWaalsContact C-N 3.3Å; L12-H15 PolarHBondContact O-N 2.93Å
13E64.3Low59.6Low133 Ų133123.7 Ų123.762%0.62167%0.672SS**Hα-helixtrans-72.2-22.6174.8-73.4172.4173.800112.3R9 H15 T16R9-E13 WeakPolarHBondContact O-CB 3.22Å; R9-E13 WeakPolarHBondContact O-CG 3.4Å; R9-E13 PolarHBondContact O-N 2.97Å; E13-H15 VanDerWaalsContact C-N 3.28Å; E13-H15 PolarHBondContact O-N 2.98Å; E13-T16 PolarHBondContact O-OG1 3.26Å
14S61Low59.1Low77 Ų77127.3 Ų127.354%0.53868%0.678SS.*THydrogen-bonded Turntrans-78.2-4.8176.472.50000114.9T10 A11 L12T10-S14 WeakPolarHBondContact O-CB 3.41Å; T10-S14 PolarHBondContact O-N 3.24Å; T10-S14 VanDerWaalsContact O-N 3.07Å; A11-S14 PolarHBondContact O-OG 2.91Å; L12-S14 VanDerWaalsContact C-N 3.3Å
15H56.5Low58.9Low162 Ų162125 Ų12575%0.7568%0.679SS**THydrogen-bonded Turntrans-112.36-177.7-74.5-57000114.4A11 L12 E13A11-H15 PolarHBondContact O-CD2 3.4Å; L12-H15 PolarHBondContact O-N 2.93Å; E13-H15 VanDerWaalsContact C-N 3.28Å; E13-H15 PolarHBondContact O-N 2.98Å
16T57.1Low58.6Low109 Ų109125.9 Ų125.967%0.66968%0.683SS**SBendtrans-104.51.3179.750.20000114.3E13E13-T16 PolarHBondContact O-OG1 3.26Å
17E57.5Low58.1Low179 Ų179127 Ų12784%0.83670%0.695SS**SBendtrans-107.166.5172.6-75.4-173.5155.400111.8
18S51.3Low57.6Low109 Ų109125.2 Ų125.276%0.76269%0.687SS**  trans-163.863.9151.2-84.10000108.7S20S18-S20 PolarHBondContact O-N 3.14Å
19E49.4Very low57.2Low200 Ų200127 Ų12794%0.93569%0.692SS**  trans-71.568.2153.3-167.9177.917000107.4
20S51.5Low56.5Low99 Ų99125.2 Ų125.269%0.69269%0.694SS**  trans-100.1113.3166.9-106.10000106.6S18 E22S18-S20 PolarHBondContact O-N 3.14Å; S20-E22 PolarHBondContact O-N 3.37Å
21A54.3Low56Low99 Ų99125.2 Ų125.282%0.81870%0.698SS**  trans-55.782.817500000111.3Q23A21-Q23 PolarHBondContact O-N 2.91Å
22E51.6Low55.6Low182 Ų182129.1 Ų129.185%0.8571%0.711SS**  trans-69.297.2146.2-67.3-165.2170.100104.8S20 E24S20-E22 PolarHBondContact O-N 3.37Å; E22-E24 VanDerWaalsContact C-N 3.29Å; E22-E24 PolarHBondContact O-N 2.93Å
23Q53Low55.5Low171 Ų171127.3 Ų127.380%0.79970%0.702SS**  trans-45.9106.3158.6-79.1176.9-1000106A21 T25A21-Q23 PolarHBondContact O-N 2.91Å; Q23-T25 PolarHBondContact O-N 3.45Å
24E50.3Low55.2Low174 Ų174123.1 Ų123.181%0.81369%0.686SS**  trans-58.294.9159.1-74.5-170.8156.600104.9E22 L26E22-E24 VanDerWaalsContact C-N 3.29Å; E22-E24 PolarHBondContact O-N 2.93Å; E24-L26 PolarHBondContact O-N 3.44Å
25T56.3Low55.1Low126 Ų126123.4 Ų123.477%0.77370%0.701SS**  trans-56.291.815924.50000105.3Q23Q23-T25 PolarHBondContact O-N 3.45Å
26L59.7Low55Low140 Ų140118 Ų11873%0.73368%0.677SS**  trans-46.5125.6162.8-69170.3000105.3E24 S28E24-L26 PolarHBondContact O-N 3.44Å; L26-S28 PolarHBondContact O-N 2.92Å
27P56Low54.9Low105 Ų105117.2 Ų117.268%0.68267%0.674SS**  trans-55.610817321.4-29.8000106.6I29P27-I29 PolarHBondContact O-N 2.66Å
28S55Low54.8Low65 Ų65114.6 Ų114.646%0.45566%0.664SS.*  trans-57.9133-178-159.60000106.7L26 D30 S31L26-S28 PolarHBondContact O-N 2.92Å; S28-D30 PolarHBondContact O-N 2.97Å; S28-D30 PolarHBondContact OG-OD2 3.07Å; S28-S31 WeakPolarHBondContact O-CB 3.44Å; S28-S31 PolarHBondContact O-N 2.74Å; S28-S31 PolarHBondContact O-OG 2.74Å
29I57.1Low54.8Low123 Ų123117.1 Ų117.163%0.63166%0.664SS**G310 helixtrans-54.1-25.4177.1-69.2167.4000110.2P27 S31 L32 L33P27-I29 PolarHBondContact O-N 2.66Å; I29-S31 PolarHBondContact O-N 2.84Å; I29-L32 WeakPolarHBondContact O-CA 3.32Å; I29-L32 WeakPolarHBondContact O-CB 3.34Å; I29-L32 PolarHBondContact O-N 2.91Å; I29-L33 PolarHBondContact O-N 2.76Å
30D53.1Low55.1Low117 Ų117115.9 Ų115.963%0.62666%0.658SS**G310 helixtrans-59.1-26.7174.1-53-44.1000113.9S28 L32S28-D30 PolarHBondContact O-N 2.97Å; S28-D30 PolarHBondContact OG-OD2 3.07Å; D30-L32 VanDerWaalsContact C-N 3.34Å
31S56.9Low55.5Low89 Ų89116.8 Ų116.862%0.62266%0.655SS**G310 helixtrans-77.5-19.7173.566.70000113.4S28 I29S28-S31 WeakPolarHBondContact O-CB 3.44Å; S28-S31 PolarHBondContact O-N 2.74Å; S28-S31 PolarHBondContact O-OG 2.74Å; I29-S31 PolarHBondContact O-N 2.84Å
32L54.1Low55.6Low131 Ų131114.8 Ų114.869%0.68663%0.631SS**THydrogen-bonded Turntrans-88.1-13174.6-63171.5000112.4I29 D30 P34I29-L32 WeakPolarHBondContact O-CA 3.32Å; I29-L32 WeakPolarHBondContact O-CB 3.34Å; I29-L32 PolarHBondContact O-N 2.91Å; D30-L32 VanDerWaalsContact C-N 3.34Å; L32-P34 VanDerWaalsContact O-CD 3.23Å; L32-P34 WeakPolarHBondContact O-CD 3.4Å
33L58.8Low56.1Low84 Ų84116.6 Ų116.644%0.4463%0.631SS.*SBendtrans-89.2102.9171.3-66.2174.4000107.5I29 G35 L36I29-L33 PolarHBondContact O-N 2.76Å; L33-G35 PolarHBondContact O-N 2.79Å; L33-L36 HydrophobicContact CD2-CD1 4.46Å
34P58.8Low57.2Low44 Ų44112.2 Ų112.229%0.28661%0.613SS.*  trans-57.5114.9178.522.9-32.3000108.1L32 L36L32-P34 VanDerWaalsContact O-CD 3.23Å; L32-P34 WeakPolarHBondContact O-CD 3.4Å; P34-L36 VanDerWaalsContact O-CA 3.32Å; P34-L36 WeakPolarHBondContact O-CA 3.37Å; P34-L36 WeakPolarHBondContact O-CG 3.48Å; P34-L36 PolarHBondContact O-N 2.67Å
35G58.2Low58.7Low83 Ų83109.7 Ų109.786%0.85660%0.602SS**  trans-17.374.1-174.300000115L33L33-G35 PolarHBondContact O-N 2.79Å
36L55.8Low60Low49 Ų49110.1 Ų110.126%0.25760%0.595SS.*  trans-65.6134.7-172.1-85.4165.6000105.9L33 P34 I38 L51L33-L36 HydrophobicContact CD2-CD1 4.46Å; P34-L36 VanDerWaalsContact O-CA 3.32Å; P34-L36 WeakPolarHBondContact O-CA 3.37Å; P34-L36 WeakPolarHBondContact O-CG 3.48Å; P34-L36 PolarHBondContact O-N 2.67Å; L36-I38 HydrophobicContact CB-CG1 3.82Å; L36-I38 WeakPolarHBondContact O-CG1 3.25Å; L36-I38 PolarHBondContact O-N 3.13Å; L36-L51 HydrophobicContact CD2-CD1 3.23Å; L36-L51 HydrophobicContact CD2-CD2 3.33Å; L36-L51 HydrophobicContact CD2-CG 3.87Å; L36-L51 HydrophobicContact CG-CD1 4.47Å
37P55Low60.9Low93 Ų93105.4 Ų105.460%0.60457%0.573SS**  trans-65.580.9163.327-30.4000107Q39 L42P37-Q39 PolarHBondContact O-N 2.87Å; P37-L42 WeakPolarHBondContact O-CD1 3.08Å
38I53.8Low62.1Low123 Ų123103.4 Ų103.463%0.63156%0.557SS**  trans-75.762.5172.3-52.7166.5000105.7L36L36-I38 HydrophobicContact CB-CG1 3.82Å; L36-I38 WeakPolarHBondContact O-CG1 3.25Å; L36-I38 PolarHBondContact O-N 3.13Å
39Q52.3Low63.6Low162 Ų162108 Ų10876%0.75756%0.564SS**SBendtrans-170.6107.3172.1-101.313754.200108.8P37 D41P37-Q39 PolarHBondContact O-N 2.87Å; Q39-D41 PolarHBondContact O-N 3.28Å; Q39-D41 VanDerWaalsContact O-N 3.07Å
40E56.4Low64.9Low174 Ų174106 Ų10681%0.81356%0.558SS**SBendtrans79.1-36.4156.4-62.5167.6-17900119.2
41D58.5Low66.3Low118 Ų118102.4 Ų102.463%0.63154%0.538SS*.G310 helixtrans-91.7-1.3-175.9-97.1-15.2000116.1Q39 Y43 N44 S47Q39-D41 PolarHBondContact O-N 3.28Å; Q39-D41 VanDerWaalsContact O-N 3.07Å; D41-Y43 PolarHBondContact O-N 2.9Å; D41-N44 PolarHBondContact O-N 2.91Å; D41-S47 VanDerWaalsContact O-CB 3.22Å; D41-S47 WeakPolarHBondContact O-CB 3.45Å; D41-S47 PolarHBondContact O-OG 3.24Å
42L57Low67.6Low57 Ų57105.1 Ų105.130%0.29854%0.539SS..G310 helixtrans-71.3-4.6179.3-87.9148000114.4P37 L48 L51P37-L42 WeakPolarHBondContact O-CD1 3.08Å; L42-L48 HydrophobicContact CD2-CD2 3.83Å; L42-L48 WeakPolarHBondContact O-CG 3.34Å; L42-L51 HydrophobicContact CD2-CD2 3.87Å
43Y62.3Low69.1Low221 Ų221101 Ų10187%0.86752%0.523SS*.G310 helixtrans-89.5-6.9177.7-67.8-76.5000114D41D41-Y43 PolarHBondContact O-N 2.9Å
44N75Confident70.4Confident79 Ų7999.3 Ų99.342%0.42252%0.517SS..SBendtrans-85.3130.8172.9-178.215.3000110.5D41 E46 S47 L48D41-N44 PolarHBondContact O-N 2.91Å; N44-E46 PolarHBondContact O-N 2.83Å; N44-E46 PolarHBondContact OD1-N 3.25Å; N44-S47 WeakPolarHBondContact O-CB 3.23Å; N44-S47 PolarHBondContact O-N 3.38Å; N44-S47 VanDerWaalsContact O-N 3.14Å; N44-L48 PolarHBondContact O-N 3.15Å; N44-L48 VanDerWaalsContact O-N 3.1Å
45E81.9Confident71.7Confident121 Ų12198.9 Ų98.957%0.56551%0.513SS*.Hα-helixtrans-57.2-36.8178.3-168.3-173.1157.100111.7L48 R49E45-L48 PolarHBondContact O-N 3.07Å; E45-R49 WeakPolarHBondContact O-CB 3.42Å; E45-R49 VanDerWaalsContact O-CG 3.25Å; E45-R49 WeakPolarHBondContact O-CG 3.46Å; E45-R49 PolarHBondContact O-N 3.31Å; E45-R49 IonicContact OE1-CZ 3.2Å; E45-R49 IonicContact OE1-NE 2.91Å; E45-R49 PolarHBondContact OE1-NE 3.18Å; E45-R49 IonicContact OE1-NH2 2.66Å; E45-R49 PolarHBondContact OE1-NH2 3.05Å
46E84.1Confident73.2Confident134 Ų13496.7 Ų96.763%0.62649%0.49SS*.Hα-helixtrans-67.6-39.9178.4-173.5172.9-164.600112.5N44 R49 T50N44-E46 PolarHBondContact O-N 2.83Å; N44-E46 PolarHBondContact OD1-N 3.25Å; E46-R49 PolarHBondContact O-N 3.42Å; E46-T50 WeakPolarHBondContact O-CB 3.33Å; E46-T50 PolarHBondContact O-N 2.96Å; E46-T50 PolarHBondContact O-OG1 3.07Å
47S78.6Confident74.8Confident41 Ų41101.8 Ų101.829%0.28751%0.506SS..Hα-helixtrans-62.8-44.5175.2-58.70000111D41 N44 T50 L51D41-S47 VanDerWaalsContact O-CB 3.22Å; D41-S47 WeakPolarHBondContact O-CB 3.45Å; D41-S47 PolarHBondContact O-OG 3.24Å; N44-S47 WeakPolarHBondContact O-CB 3.23Å; N44-S47 PolarHBondContact O-N 3.38Å; N44-S47 VanDerWaalsContact O-N 3.14Å; S47-T50 PolarHBondContact O-N 3.35Å; S47-L51 WeakPolarHBondContact O-CB 3.45Å; S47-L51 PolarHBondContact O-N 3.09Å
48L82.2Confident76.4Confident63 Ų63101.2 Ų101.233%0.3350%0.496SS..Hα-helixtrans-63.4-44.5175.6-72172.2000112L42 N44 E45 T50 L51 F52L42-L48 HydrophobicContact CD2-CD2 3.83Å; L42-L48 WeakPolarHBondContact O-CG 3.34Å; N44-L48 PolarHBondContact O-N 3.15Å; N44-L48 VanDerWaalsContact O-N 3.1Å; E45-L48 PolarHBondContact O-N 3.07Å; L48-T50 VanDerWaalsContact C-N 3.33Å; L48-T50 PolarHBondContact O-N 3.31Å; L48-L51 PolarHBondContact O-N 2.85Å; L48-F52 HydrophobicContact CB-CE2 4.41Å; L48-F52 WeakPolarHBondContact O-CD2 3.46Å; L48-F52 PolarHBondContact O-N 2.92Å
49R85.5Confident78.3Confident163 Ų163100.6 Ų100.662%0.61549%0.492SS*.Hα-helixtrans-60.1-44.2177-76.3171.7179.1-89.52.6111.6E45 E46 A53E45-R49 WeakPolarHBondContact O-CB 3.42Å; E45-R49 VanDerWaalsContact O-CG 3.25Å; E45-R49 WeakPolarHBondContact O-CG 3.46Å; E45-R49 PolarHBondContact O-N 3.31Å; E45-R49 IonicContact OE1-CZ 3.2Å; E45-R49 IonicContact OE1-NE 2.91Å; E45-R49 PolarHBondContact OE1-NE 3.18Å; E45-R49 IonicContact OE1-NH2 2.66Å; E45-R49 PolarHBondContact OE1-NH2 3.05Å; E46-R49 PolarHBondContact O-N 3.42Å; R49-A53 VanDerWaalsContact O-CB 3.3Å; R49-A53 WeakPolarHBondContact O-CB 3.44Å; R49-A53 PolarHBondContact O-N 3.32Å
50T84.8Confident80.2Confident80 Ų8096.6 Ų96.649%0.49148%0.476SS..Hα-helixtrans-63.5-44.4177.7-58.90000110.8E46 S47 L48 A53 V54E46-T50 WeakPolarHBondContact O-CB 3.33Å; E46-T50 PolarHBondContact O-N 2.96Å; E46-T50 PolarHBondContact O-OG1 3.07Å; S47-T50 PolarHBondContact O-N 3.35Å; L48-T50 VanDerWaalsContact C-N 3.33Å; L48-T50 PolarHBondContact O-N 3.31Å; T50-A53 PolarHBondContact O-N 3.44Å; T50-V54 HydrophobicContact CG2-CG2 4.43Å; T50-V54 WeakPolarHBondContact O-CG2 3.3Å; T50-V54 PolarHBondContact O-N 3.21Å
51L81.5Confident82Confident41 Ų4194.4 Ų94.422%0.21547%0.466CS..Hα-helixtrans-59.2-53.5176.7173.457.1000111.9L36 L42 S47 L48 A53 V54 T55L36-L51 HydrophobicContact CD2-CD1 3.23Å; L36-L51 HydrophobicContact CD2-CD2 3.33Å; L36-L51 HydrophobicContact CD2-CG 3.87Å; L36-L51 HydrophobicContact CG-CD1 4.47Å; L42-L51 HydrophobicContact CD2-CD2 3.87Å; S47-L51 WeakPolarHBondContact O-CB 3.45Å; S47-L51 PolarHBondContact O-N 3.09Å; L48-L51 PolarHBondContact O-N 2.85Å; L51-A53 PolarHBondContact O-N 3.1Å; L51-V54 PolarHBondContact O-N 3.08Å; L51-V54 VanDerWaalsContact O-N 3.15Å; L51-T55 WeakPolarHBondContact CD1-OG1 3.47Å; L51-T55 WeakPolarHBondContact O-CB 3.46Å; L51-T55 PolarHBondContact O-N 3.41Å; L51-T55 PolarHBondContact O-OG1 3.46Å; L51-T55 VanDerWaalsContact O-OG1 3.13Å
52F84.8Confident83.8Confident147 Ų14793.3 Ų93.365%0.64546%0.463SS*.Hα-helixtrans-59.2-35.2177.5-75.7-61.1000112.3L48 G56L48-F52 HydrophobicContact CB-CE2 4.41Å; L48-F52 WeakPolarHBondContact O-CD2 3.46Å; L48-F52 PolarHBondContact O-N 2.92Å; F52-G56 WeakPolarHBondContact O-CA 3.25Å; F52-G56 PolarHBondContact O-N 2.87Å
53A86.4Confident85.6Confident43 Ų4397.8 Ų97.836%0.35548%0.48SS..Hα-helixtrans-68.6-41.3176.600000112.5R49 T50 L51 R57R49-A53 VanDerWaalsContact O-CB 3.3Å; R49-A53 WeakPolarHBondContact O-CB 3.44Å; R49-A53 PolarHBondContact O-N 3.32Å; T50-A53 PolarHBondContact O-N 3.44Å; L51-A53 PolarHBondContact O-N 3.1Å; A53-R57 WeakPolarHBondContact O-CG 3.34Å; A53-R57 PolarHBondContact O-N 2.86Å; A53-R57 PolarHBondContact O-NH1 3.44Å
54V85.2Confident87.3Confident50 Ų5094.3 Ų94.330%0.30347%0.465SS..Hα-helixtrans-68.2-56.2177.3173.90000110.1T50 L51 G56 R57 E58T50-V54 HydrophobicContact CG2-CG2 4.43Å; T50-V54 WeakPolarHBondContact O-CG2 3.3Å; T50-V54 PolarHBondContact O-N 3.21Å; L51-V54 PolarHBondContact O-N 3.08Å; L51-V54 VanDerWaalsContact O-N 3.15Å; V54-G56 VanDerWaalsContact C-N 3.28Å; V54-G56 PolarHBondContact O-N 3.2Å; V54-R57 WeakPolarHBondContact O-CB 3.32Å; V54-R57 PolarHBondContact O-N 3.48Å; V54-E58 PolarHBondContact O-N 2.85Å; V54-E58 VanDerWaalsContact O-N 3.09Å
55T85.9Confident88.3Confident35 Ų3598.4 Ų98.422%0.21548%0.475CS..Hα-helixtrans-61.1-38.2180-52.50000111.4L51 R57 E58 I59L51-T55 WeakPolarHBondContact CD1-OG1 3.47Å; L51-T55 WeakPolarHBondContact O-CB 3.46Å; L51-T55 PolarHBondContact O-N 3.41Å; L51-T55 PolarHBondContact O-OG1 3.46Å; L51-T55 VanDerWaalsContact O-OG1 3.13Å; T55-R57 VanDerWaalsContact C-N 3.34Å; T55-R57 PolarHBondContact O-N 3.25Å; T55-E58 PolarHBondContact O-N 3.39Å; T55-I59 HydrophobicContact CG2-CD1 3.87Å; T55-I59 HydrophobicContact CG2-CG1 4.37Å; T55-I59 WeakPolarHBondContact O-CB 3.46Å; T55-I59 VanDerWaalsContact O-CG1 3.25Å; T55-I59 WeakPolarHBondContact O-CG1 3.45Å; T55-I59 PolarHBondContact O-N 2.88Å
56G90Very high89.1Confident36 Ų3697.8 Ų97.837%0.37148%0.475SS..Hα-helixtrans-62.2-37.7175.700000113.3F52 V54 L60F52-G56 WeakPolarHBondContact O-CA 3.25Å; F52-G56 PolarHBondContact O-N 2.87Å; V54-G56 VanDerWaalsContact C-N 3.28Å; V54-G56 PolarHBondContact O-N 3.2Å; G56-L60 WeakPolarHBondContact O-CB 3.44Å; G56-L60 PolarHBondContact O-N 2.88Å
57R89.5Confident89.7Confident156 Ų15698.5 Ų98.559%0.58948%0.476SS*.Hα-helixtrans-67.3-44.6174.2-76.6-171.2-59.6-95.65.2111.8A53 V54 T55 L60 E61A53-R57 WeakPolarHBondContact O-CG 3.34Å; A53-R57 PolarHBondContact O-N 2.86Å; A53-R57 PolarHBondContact O-NH1 3.44Å; V54-R57 WeakPolarHBondContact O-CB 3.32Å; V54-R57 PolarHBondContact O-N 3.48Å; T55-R57 VanDerWaalsContact C-N 3.34Å; T55-R57 PolarHBondContact O-N 3.25Å; R57-L60 PolarHBondContact O-N 2.85Å; R57-E61 WeakPolarHBondContact O-CB 3.48Å; R57-E61 PolarHBondContact O-N 3.37Å
58E89.8Confident90.6Very high82 Ų82102.8 Ų102.838%0.38349%0.486SS..Hα-helixtrans-62.6-43.1178.5-69.3173171.500112V54 T55 L60 E61 T62V54-E58 PolarHBondContact O-N 2.85Å; V54-E58 VanDerWaalsContact O-N 3.09Å; T55-E58 PolarHBondContact O-N 3.39Å; E58-L60 VanDerWaalsContact C-N 3.34Å; E58-L60 PolarHBondContact O-N 3.13Å; E58-E61 PolarHBondContact O-N 2.89Å; E58-T62 WeakPolarHBondContact O-CB 3.35Å; E58-T62 PolarHBondContact O-N 2.65Å; E58-T62 PolarHBondContact O-OG1 3.02Å
59I92.3Very high91.4Very high109 Ų109103.2 Ų103.256%0.55949%0.488SS*.Hα-helixtrans-61.1-44.9174.3-70.1168.6000110.4T55 E61 T62 K63T55-I59 HydrophobicContact CG2-CD1 3.87Å; T55-I59 HydrophobicContact CG2-CG1 4.37Å; T55-I59 WeakPolarHBondContact O-CB 3.46Å; T55-I59 VanDerWaalsContact O-CG1 3.25Å; T55-I59 WeakPolarHBondContact O-CG1 3.45Å; T55-I59 PolarHBondContact O-N 2.88Å; I59-E61 PolarHBondContact O-N 3Å; I59-T62 PolarHBondContact O-N 2.89Å; I59-K63 WeakPolarHBondContact O-CB 3.5Å; I59-K63 PolarHBondContact O-N 3.47Å
60L93.4Very high92Very high78 Ų7898.8 Ų98.841%0.40848%0.479SS..Hα-helixtrans-64.4-41179.6-178.460.4000111.9G56 R57 E58 K63 R64G56-L60 WeakPolarHBondContact O-CB 3.44Å; G56-L60 PolarHBondContact O-N 2.88Å; R57-L60 PolarHBondContact O-N 2.85Å; E58-L60 VanDerWaalsContact C-N 3.34Å; E58-L60 PolarHBondContact O-N 3.13Å; L60-K63 PolarHBondContact O-N 3.08Å; L60-R64 WeakPolarHBondContact O-CG 3.36Å; L60-R64 PolarHBondContact O-N 3.5Å
61E94.3Very high92.6Very high129 Ų12999.4 Ų99.460%0.60348%0.479SS*.Hα-helixtrans-64.6-45.9175.6-178168-170.400111.7R57 E58 I59 K63 R64 R65R57-E61 WeakPolarHBondContact O-CB 3.48Å; R57-E61 PolarHBondContact O-N 3.37Å; E58-E61 PolarHBondContact O-N 2.89Å; I59-E61 PolarHBondContact O-N 3Å; E61-K63 VanDerWaalsContact C-N 3.32Å; E61-K63 PolarHBondContact O-N 3.48Å; E61-R64 WeakPolarHBondContact O-CB 3.34Å; E61-R64 PolarHBondContact O-N 3.48Å; E61-R64 VanDerWaalsContact O-N 3.13Å; E61-R65 PolarHBondContact O-N 3.22Å
62T94.5Very high93.4Very high94 Ų94102.4 Ų102.458%0.57749%0.492SS*.Hα-helixtrans-59.2-43.7175.8-590000111E58 I59 R64 R65 L66E58-T62 WeakPolarHBondContact O-CB 3.35Å; E58-T62 PolarHBondContact O-N 2.65Å; E58-T62 PolarHBondContact O-OG1 3.02Å; I59-T62 PolarHBondContact O-N 2.89Å; T62-R64 PolarHBondContact O-N 3.48Å; T62-R65 PolarHBondContact O-N 3.25Å; T62-L66 WeakPolarHBondContact O-CB 3.32Å; T62-L66 PolarHBondContact O-N 3.38Å
63K96.3Very high94Very high151 Ų151100.5 Ų100.566%0.65749%0.487SS*.Hα-helixtrans-60.4-42.5174.6-177.1178.8179.8177.20112.2I59 L60 E61 K67I59-K63 WeakPolarHBondContact O-CB 3.5Å; I59-K63 PolarHBondContact O-N 3.47Å; L60-K63 PolarHBondContact O-N 3.08Å; E61-K63 VanDerWaalsContact C-N 3.32Å; E61-K63 PolarHBondContact O-N 3.48Å; K63-K67 PolarHBondContact O-N 3.07Å
64R96.9Very high94.5Very high148 Ų148101.8 Ų101.856%0.55849%0.487SS*.Hα-helixtrans-65.3-41.5176.1-72.8173.2-174.6162.8-0.2111.6L60 E61 T62 K67 R68L60-R64 WeakPolarHBondContact O-CG 3.36Å; L60-R64 PolarHBondContact O-N 3.5Å; E61-R64 WeakPolarHBondContact O-CB 3.34Å; E61-R64 PolarHBondContact O-N 3.48Å; E61-R64 VanDerWaalsContact O-N 3.13Å; T62-R64 PolarHBondContact O-N 3.48Å; R64-K67 PolarHBondContact O-N 2.96Å; R64-R68 PolarHBondContact O-N 3.35Å; R64-R68 VanDerWaalsContact O-N 3.14Å
65R97.3Very high95.1Very high166 Ų166105.6 Ų105.663%0.62650%0.502SS*.Hα-helixtrans-62.3-47.1176.2-176.4178.5179-178-1.5111.1E61 T62 K67 R68 I69E61-R65 PolarHBondContact O-N 3.22Å; T62-R65 PolarHBondContact O-N 3.25Å; R65-K67 VanDerWaalsContact C-N 3.32Å; R65-K67 PolarHBondContact O-N 3.36Å; R65-R68 PolarHBondContact O-N 3.16Å; R65-R68 VanDerWaalsContact O-N 3.16Å; R65-I69 HydrophobicContact CG-CD1 4.08Å; R65-I69 WeakPolarHBondContact O-CG1 3.34Å; R65-I69 PolarHBondContact O-N 3.41Å
66L97.7Very high95.7Very high108 Ų108110.8 Ų110.857%0.56552%0.519SS*.Hα-helixtrans-58.7-44.4176.6-177.561.4000111.4T62 R68 I69 V70T62-L66 WeakPolarHBondContact O-CB 3.32Å; T62-L66 PolarHBondContact O-N 3.38Å; L66-R68 VanDerWaalsContact C-N 3.31Å; L66-R68 PolarHBondContact O-N 3.26Å; L66-I69 PolarHBondContact O-N 3.38Å; L66-V70 HydrophobicContact CD1-CG2 4.37Å; L66-V70 WeakPolarHBondContact O-CG2 3.45Å; L66-V70 PolarHBondContact O-N 3.39Å
67K97.6Very high96Very high148 Ų148113.8 Ų113.864%0.64352%0.523SS*.Hα-helixtrans-58.2-41.2176.4-172.6177.4-179.9-179.10112.4K63 R64 R65 L71K63-K67 PolarHBondContact O-N 3.07Å; R64-K67 PolarHBondContact O-N 2.96Å; R65-K67 VanDerWaalsContact C-N 3.32Å; R65-K67 PolarHBondContact O-N 3.36Å; K67-L71 WeakPolarHBondContact O-CG 3.33Å; K67-L71 PolarHBondContact O-N 2.91Å; K67-L71 VanDerWaalsContact O-N 3.17Å
68R97.7Very high96.4Very high132 Ų132112.4 Ų112.450%0.49852%0.521SS..Hα-helixtrans-63.8-48.1176.3-71.7-172.4-65.1-99.93111.8R64 R65 L66 V70 L71 E72R64-R68 PolarHBondContact O-N 3.35Å; R64-R68 VanDerWaalsContact O-N 3.14Å; R65-R68 PolarHBondContact O-N 3.16Å; R65-R68 VanDerWaalsContact O-N 3.16Å; L66-R68 VanDerWaalsContact C-N 3.31Å; L66-R68 PolarHBondContact O-N 3.26Å; R68-V70 VanDerWaalsContact C-N 3.3Å; R68-V70 PolarHBondContact O-N 3.44Å; R68-L71 PolarHBondContact O-N 3.14Å; R68-L71 VanDerWaalsContact O-N 3.13Å; R68-E72 PolarHBondContact O-N 3.15Å
69I97.6Very high96.8Very high71 Ų71113.8 Ų113.836%0.36453%0.526SS..Hα-helixtrans-58.4-43.7178.7-66.3167.4000110.8R65 L66 L71 E72 L73R65-I69 HydrophobicContact CG-CD1 4.08Å; R65-I69 WeakPolarHBondContact O-CG1 3.34Å; R65-I69 PolarHBondContact O-N 3.41Å; L66-I69 PolarHBondContact O-N 3.38Å; I69-L71 VanDerWaalsContact C-N 3.34Å; I69-L71 PolarHBondContact O-N 3.02Å; I69-E72 PolarHBondContact O-N 3.42Å; I69-L73 HydrophobicContact CG2-CD1 4.1Å; I69-L73 HydrophobicContact CG2-CG 4.39Å; I69-L73 WeakPolarHBondContact O-CG 3.47Å; I69-L73 PolarHBondContact O-N 3.13Å
70V97.6Very high97Very high70 Ų70112.3 Ų112.342%0.42452%0.522SS..Hα-helixtrans-61.9-41.3178171.30000111.7L66 R68 L73 I74L66-V70 HydrophobicContact CD1-CG2 4.37Å; L66-V70 WeakPolarHBondContact O-CG2 3.45Å; L66-V70 PolarHBondContact O-N 3.39Å; R68-V70 VanDerWaalsContact C-N 3.3Å; R68-V70 PolarHBondContact O-N 3.44Å; V70-L73 PolarHBondContact O-N 3.09Å; V70-I74 HydrophobicContact CG1-CD1 4.13Å; V70-I74 WeakPolarHBondContact O-CG1 3.33Å; V70-I74 PolarHBondContact O-N 3.07Å; V70-I74 VanDerWaalsContact O-N 3.09Å
71L97.9Very high97.1Very high94 Ų94114.6 Ų114.649%0.49253%0.529SS..Hα-helixtrans-64.9-43.8176.4-70172.1000111.8K67 R68 I69 L73 I74 E75K67-L71 WeakPolarHBondContact O-CG 3.33Å; K67-L71 PolarHBondContact O-N 2.91Å; K67-L71 VanDerWaalsContact O-N 3.17Å; R68-L71 PolarHBondContact O-N 3.14Å; R68-L71 VanDerWaalsContact O-N 3.13Å; I69-L71 VanDerWaalsContact C-N 3.34Å; I69-L71 PolarHBondContact O-N 3.02Å; L71-L73 VanDerWaalsContact C-N 3.33Å; L71-L73 PolarHBondContact O-N 3.24Å; L71-I74 PolarHBondContact O-N 3.17Å; L71-E75 PolarHBondContact O-N 2.88Å; L71-E75 VanDerWaalsContact O-N 3.07Å
72E97.8Very high97.2Very high104 Ų104117 Ų11749%0.48653%0.532SS..Hα-helixtrans-59.4-43.4174.9-72.5173.7-163.300111.4R68 I69 I74 E75 Y76R68-E72 PolarHBondContact O-N 3.15Å; I69-E72 PolarHBondContact O-N 3.42Å; E72-I74 VanDerWaalsContact C-N 3.34Å; E72-I74 PolarHBondContact O-N 3.3Å; E72-E75 WeakPolarHBondContact O-CB 3.13Å; E72-E75 PolarHBondContact O-N 2.97Å; E72-E75 VanDerWaalsContact O-N 3.15Å; E72-Y76 HydrophobicContact CB-CE2 4.47Å; E72-Y76 WeakPolarHBondContact O-CD2 3.49Å; E72-Y76 PolarHBondContact O-N 3.43Å
73L97.9Very high97.2Very high106 Ų106117.6 Ų117.656%0.55553%0.53SS*.Hα-helixtrans-61.5-39.9177.1-73174.4000112.5I69 V70 L71 E75 Y76 E77I69-L73 HydrophobicContact CG2-CD1 4.1Å; I69-L73 HydrophobicContact CG2-CG 4.39Å; I69-L73 WeakPolarHBondContact O-CG 3.47Å; I69-L73 PolarHBondContact O-N 3.13Å; V70-L73 PolarHBondContact O-N 3.09Å; L71-L73 VanDerWaalsContact C-N 3.33Å; L71-L73 PolarHBondContact O-N 3.24Å; L73-E75 VanDerWaalsContact C-N 3.33Å; L73-E75 PolarHBondContact O-N 3.49Å; L73-Y76 PolarHBondContact O-N 2.66Å; L73-E77 WeakPolarHBondContact O-CB 3.15Å; L73-E77 PolarHBondContact O-N 2.88Å
74I97.8Very high97.1Very high70 Ų70118 Ų11836%0.35953%0.527SS..Hα-helixtrans-63.3-40.3175-68.2164.6000110.8V70 L71 E72 E77 K78V70-I74 HydrophobicContact CG1-CD1 4.13Å; V70-I74 WeakPolarHBondContact O-CG1 3.33Å; V70-I74 PolarHBondContact O-N 3.07Å; V70-I74 VanDerWaalsContact O-N 3.09Å; L71-I74 PolarHBondContact O-N 3.17Å; E72-I74 VanDerWaalsContact C-N 3.34Å; E72-I74 PolarHBondContact O-N 3.3Å; I74-E77 PolarHBondContact O-N 3.12Å; I74-K78 WeakPolarHBondContact O-CG 3.46Å; I74-K78 PolarHBondContact O-N 3.36Å; I74-K78 VanDerWaalsContact O-N 3.07Å
75E97.6Very high96.9Very high131 Ų131113.8 Ų113.861%0.61252%0.524SS*.Hα-helixtrans-66.5-42.4176.2-70.8-177.7176.600112.2L71 E72 L73 K78 K79L71-E75 PolarHBondContact O-N 2.88Å; L71-E75 VanDerWaalsContact O-N 3.07Å; E72-E75 WeakPolarHBondContact O-CB 3.13Å; E72-E75 PolarHBondContact O-N 2.97Å; E72-E75 VanDerWaalsContact O-N 3.15Å; L73-E75 VanDerWaalsContact C-N 3.33Å; L73-E75 PolarHBondContact O-N 3.49Å; E75-K78 PolarHBondContact O-N 2.95Å; E75-K79 PolarHBondContact O-N 3.33Å
76Y97.7Very high96.6Very high144 Ų144108.8 Ų108.857%0.56552%0.518SS*.Hα-helixtrans-60.4-44.2173.3-81.4-64.2000111.6E72 L73 K78 K79 V80E72-Y76 HydrophobicContact CB-CE2 4.47Å; E72-Y76 WeakPolarHBondContact O-CD2 3.49Å; E72-Y76 PolarHBondContact O-N 3.43Å; L73-Y76 PolarHBondContact O-N 2.66Å; Y76-K78 VanDerWaalsContact C-N 3.34Å; Y76-K78 PolarHBondContact O-N 2.86Å; Y76-K79 WeakPolarHBondContact O-CB 3.38Å; Y76-K79 PolarHBondContact O-N 3.33Å; Y76-K79 VanDerWaalsContact O-N 3.12Å; Y76-V80 WeakPolarHBondContact O-CG2 3.35Å; Y76-V80 PolarHBondContact O-N 3.07Å
77E97.4Very high96.3Very high98 Ų98109.3 Ų109.346%0.45852%0.521SS..Hα-helixtrans-58.8-45.6176.6-167.8-165.6165.600111.3L73 I74 K79 V80 K81L73-E77 WeakPolarHBondContact O-CB 3.15Å; L73-E77 PolarHBondContact O-N 2.88Å; I74-E77 PolarHBondContact O-N 3.12Å; E77-K79 VanDerWaalsContact C-N 3.33Å; E77-K79 PolarHBondContact O-N 3.46Å; E77-V80 PolarHBondContact O-N 3.44Å; E77-K81 WeakPolarHBondContact O-CG 3.37Å; E77-K81 PolarHBondContact O-N 2.86Å; E77-K81 WeakPolarHBondContact OE1-CE 3.36Å; E77-K81 IonicContact OE1-NZ 2.66Å; E77-K81 PolarHBondContact OE1-NZ 3.42Å
78K97.4Very high95.8Very high128 Ų128108.1 Ų108.156%0.55752%0.517SS*.Hα-helixtrans-61-40.3174.9-71.5173.7-177.9178.20112I74 E75 Y76 R82I74-K78 WeakPolarHBondContact O-CG 3.46Å; I74-K78 PolarHBondContact O-N 3.36Å; I74-K78 VanDerWaalsContact O-N 3.07Å; E75-K78 PolarHBondContact O-N 2.95Å; Y76-K78 VanDerWaalsContact C-N 3.34Å; Y76-K78 PolarHBondContact O-N 2.86Å; K78-R82 WeakPolarHBondContact O-CG 3.35Å; K78-R82 PolarHBondContact O-N 2.92Å; K78-R82 VanDerWaalsContact O-N 3.11Å
79K97.4Very high95Very high110 Ų110108.5 Ų108.548%0.47853%0.525SS..Hα-helixtrans-64.5-45.4176.9-173.7179.2178.3-177.90111.3E75 Y76 E77 K81 R82 M83E75-K79 PolarHBondContact O-N 3.33Å; Y76-K79 WeakPolarHBondContact O-CB 3.38Å; Y76-K79 PolarHBondContact O-N 3.33Å; Y76-K79 VanDerWaalsContact O-N 3.12Å; E77-K79 VanDerWaalsContact C-N 3.33Å; E77-K79 PolarHBondContact O-N 3.46Å; K79-K81 PolarHBondContact O-N 3.43Å; K79-R82 PolarHBondContact O-N 2.93Å; K79-M83 HydrophobicContact CG-SD 4.23Å; K79-M83 WeakPolarHBondContact O-CG 3.44Å; K79-M83 PolarHBondContact O-N 3.31Å
80V96.9Very high93.9Very high78 Ų78107.5 Ų107.547%0.47353%0.532SS..Hα-helixtrans-61.9-43.2177.3171.60000111.1Y76 E77 R82 M83 R84Y76-V80 WeakPolarHBondContact O-CG2 3.35Å; Y76-V80 PolarHBondContact O-N 3.07Å; E77-V80 PolarHBondContact O-N 3.44Å; V80-R82 PolarHBondContact O-N 3.49Å; V80-M83 PolarHBondContact O-N 3.41Å; V80-R84 WeakPolarHBondContact O-CB 3.43Å; V80-R84 PolarHBondContact O-N 3.49Å
81K96.5Very high92.1Very high127 Ų127108.3 Ų108.355%0.55254%0.537SS*.Hα-helixtrans-60-43.9175.6-74.5177.9-176.5169.50112.2E77 K79 R84 A85E77-K81 WeakPolarHBondContact O-CG 3.37Å; E77-K81 PolarHBondContact O-N 2.86Å; E77-K81 WeakPolarHBondContact OE1-CE 3.36Å; E77-K81 IonicContact OE1-NZ 2.66Å; E77-K81 PolarHBondContact OE1-NZ 3.42Å; K79-K81 PolarHBondContact O-N 3.43Å; K81-R84 PolarHBondContact O-N 3.32Å; K81-A85 PolarHBondContact O-N 2.99Å
82R95.1Very high90.2Very high178 Ų178108 Ų10867%0.67254%0.542SS*.Hα-helixtrans-63.5-44.9175.7-74.2-173.9-70.7165.4-3.9112.5K78 K79 V80 R84 A85 A86K78-R82 WeakPolarHBondContact O-CG 3.35Å; K78-R82 PolarHBondContact O-N 2.92Å; K78-R82 VanDerWaalsContact O-N 3.11Å; K79-R82 PolarHBondContact O-N 2.93Å; V80-R82 PolarHBondContact O-N 3.49Å; R82-R84 VanDerWaalsContact C-N 3.34Å; R82-R84 PolarHBondContact O-N 3.2Å; R82-A85 PolarHBondContact O-N 3.33Å; R82-A86 PolarHBondContact O-N 3.4Å
83M94.5Very high88.2Confident108 Ų108110 Ų11053%0.53256%0.556SS.*Hα-helixtrans-63.3-40.9176.8-72.3177.565.800111.9K79 V80 A86 L87K79-M83 HydrophobicContact CG-SD 4.23Å; K79-M83 WeakPolarHBondContact O-CG 3.44Å; K79-M83 PolarHBondContact O-N 3.31Å; V80-M83 PolarHBondContact O-N 3.41Å; M83-A86 PolarHBondContact O-N 2.93Å; M83-L87 WeakPolarHBondContact O-CB 3.42Å; M83-L87 WeakPolarHBondContact O-CG 3.34Å; M83-L87 PolarHBondContact O-N 3.27Å
84R94.8Very high86.2Confident160 Ų160113.2 Ų113.260%0.60457%0.568SS**Hα-helixtrans-62.6-43.1175.7-175.7-178.2-67.1-175.9-1.9111.7V80 K81 R82 L87 H88V80-R84 WeakPolarHBondContact O-CB 3.43Å; V80-R84 PolarHBondContact O-N 3.49Å; K81-R84 PolarHBondContact O-N 3.32Å; R82-R84 VanDerWaalsContact C-N 3.34Å; R82-R84 PolarHBondContact O-N 3.2Å; R84-L87 PolarHBondContact O-N 2.98Å; R84-H88 PolarHBondContact O-CD2 3.49Å; R84-H88 VanDerWaalsContact O-CD2 3.32Å; R84-H88 PolarHBondContact O-N 3.03Å
85A92.8Very high84.1Confident59 Ų59118.6 Ų118.649%0.48859%0.592SS.*Hα-helixtrans-62.4-46.817600000111.8K81 R82 L87 H88 E89K81-A85 PolarHBondContact O-N 2.99Å; R82-A85 PolarHBondContact O-N 3.33Å; A85-L87 VanDerWaalsContact C-N 3.32Å; A85-L87 PolarHBondContact O-N 3.11Å; A85-H88 PolarHBondContact O-N 3.33Å; A85-E89 PolarHBondContact O-N 3.41Å
86A91.4Very high81.8Confident60 Ų60115.3 Ų115.350%0.49659%0.593SS.*Hα-helixtrans-62.8-37177.400000112.8R82 M83 G90R82-A86 PolarHBondContact O-N 3.4Å; M83-A86 PolarHBondContact O-N 2.93Å; A86-G90 PolarHBondContact O-N 2.98Å
87L90.3Very high79.2Confident119 Ų119117 Ų11762%0.62361%0.606SS**Hα-helixtrans-65-45.2173.3-78166.2000111.6M83 R84 A85 E89 G90 T91M83-L87 WeakPolarHBondContact O-CB 3.42Å; M83-L87 WeakPolarHBondContact O-CG 3.34Å; M83-L87 PolarHBondContact O-N 3.27Å; R84-L87 PolarHBondContact O-N 2.98Å; A85-L87 VanDerWaalsContact C-N 3.32Å; A85-L87 PolarHBondContact O-N 3.11Å; L87-E89 PolarHBondContact O-N 2.88Å; L87-G90 PolarHBondContact O-N 3.45Å; L87-T91 WeakPolarHBondContact O-CG2 3.37Å; L87-T91 PolarHBondContact O-N 3.42Å; L87-T91 PolarHBondContact O-OG1 3.45Å
88H87.2Confident77.1Confident123 Ų123121.6 Ų121.657%0.56963%0.627SS**Hα-helixtrans-63.4-40.1177.5-82.9-55.8000112.8R84 A85 T91 S92R84-H88 PolarHBondContact O-CD2 3.49Å; R84-H88 VanDerWaalsContact O-CD2 3.32Å; R84-H88 PolarHBondContact O-N 3.03Å; A85-H88 PolarHBondContact O-N 3.33Å; H88-T91 WeakPolarHBondContact CA-OG1 3.46Å; H88-T91 PolarHBondContact O-N 2.94Å; H88-T91 PolarHBondContact O-OG1 3.47Å; H88-S92 WeakPolarHBondContact O-CB 3.34Å; H88-S92 PolarHBondContact O-N 2.92Å
89E82.6Confident75Confident141 Ų141120.9 Ų120.966%0.65964%0.635SS**Hα-helixtrans-65.5-43.8174.9-171.4174.3-169.900111.5A85 L87 T91 S92 L93A85-E89 PolarHBondContact O-N 3.41Å; L87-E89 PolarHBondContact O-N 2.88Å; E89-T91 VanDerWaalsContact C-N 3.35Å; E89-T91 PolarHBondContact O-N 3.2Å; E89-S92 PolarHBondContact O-N 2.94Å; E89-L93 PolarHBondContact O-N 3.45Å
90G73.3Confident72.7Confident50 Ų50120.9 Ų120.952%0.51565%0.649SS.*Hα-helixtrans-64.2-34.6175.500000113.8A86 L87A86-G90 PolarHBondContact O-N 2.98Å; L87-G90 PolarHBondContact O-N 3.45Å
91T60.9Low70.1Confident86 Ų86121.8 Ų121.853%0.52867%0.665SS.*Hα-helixtrans-76.5-25.617452.50000113.1L87 H88 E89 L93L87-T91 WeakPolarHBondContact O-CG2 3.37Å; L87-T91 PolarHBondContact O-N 3.42Å; L87-T91 PolarHBondContact O-OG1 3.45Å; H88-T91 WeakPolarHBondContact CA-OG1 3.46Å; H88-T91 PolarHBondContact O-N 2.94Å; H88-T91 PolarHBondContact O-OG1 3.47Å; E89-T91 VanDerWaalsContact C-N 3.35Å; E89-T91 PolarHBondContact O-N 3.2Å; T91-L93 VanDerWaalsContact C-N 3.31Å; T91-L93 PolarHBondContact O-N 2.99Å
92S57.9Low67.9Low87 Ų87126 Ų12661%0.60868%0.677SS**Hα-helixtrans-77.6-15.1-178.3-169.30000113.5H88 E89 E94H88-S92 WeakPolarHBondContact O-CB 3.34Å; H88-S92 PolarHBondContact O-N 2.92Å; E89-S92 PolarHBondContact O-N 2.94Å; S92-E94 VanDerWaalsContact C-N 3.34Å
93L56Low65.6Low147 Ų147123.8 Ų123.877%0.7769%0.686SS**THydrogen-bonded Turntrans-81.6-7.4-180-99.7156.7000114.2E89 T91E89-L93 PolarHBondContact O-N 3.45Å; T91-L93 VanDerWaalsContact C-N 3.31Å; T91-L93 PolarHBondContact O-N 2.99Å
94E54.2Low63.8Low174 Ų174124.5 Ų124.581%0.81370%0.696SS**THydrogen-bonded Turntrans-106.2-1.4-179.8-72.4-101.414400113.9S92S92-E94 VanDerWaalsContact C-N 3.34Å
95E53.6Low61.5Low183 Ų183125 Ų12586%0.85571%0.711SS**SBendtrans-106.116.4-176.1-70.7-166.6154.800115.4
96G49.1Very low59.7Low61 Ų61126.6 Ų126.663%0.62972%0.724SS**SBendtrans-147.467.2-172.900000117.2
97E44.2Very low57.8Low181 Ų181127.8 Ų127.885%0.84673%0.734SS**  trans173.484.3134.9-101.8176.1149.200111.4P99E97-P99 VanDerWaalsContact C-CD 3.47Å
98H52.2Low56Low194 Ų194128.7 Ų128.790%0.89874%0.739SS**  trans-111.484.9157-79.8-67.7000109.5S100H98-S100 PolarHBondContact O-N 3.47Å; H98-S100 VanDerWaalsContact O-N 3.14Å
99P54Low54.3Low112 Ų112129.2 Ų129.273%0.72775%0.747SS**  trans-74.8101.9158.528.6-27.6000108.6E97 A101E97-P99 VanDerWaalsContact C-CD 3.47Å; P99-A101 PolarHBondContact O-N 3.39Å
100S48.6Very low52.9Low110 Ų110127.6 Ų127.677%0.76975%0.751SS**  trans-14.2121.5162-168.50000115.5H98 R102H98-S100 PolarHBondContact O-N 3.47Å; H98-S100 VanDerWaalsContact O-N 3.14Å; S100-R102 PolarHBondContact O-N 3.09Å
101A42.9Very low51.7Low97 Ų97131.5 Ų131.580%0.80276%0.764SS**  trans-54.6121.6164.300000110.9P99P99-A101 PolarHBondContact O-N 3.39Å
102R50Low51.1Low216 Ų216133 Ų13382%0.81578%0.779SS**  trans-143.2104.7158.9-140.7-179.8-172.3-1781.6107.5S100 T104S100-R102 PolarHBondContact O-N 3.09Å; R102-T104 PolarHBondContact O-N 3.49Å
103P47.9Very low50.5Low132 Ų132135 Ų13586%0.85779%0.787SS**  trans-75.9105.7171.229.7-26.2000106.4
104T56.3Low50.2Low123 Ų123133.7 Ų133.776%0.75579%0.79SS**  trans-100.1105.5170.9-21.40000106.9R102 A106R102-T104 PolarHBondContact O-N 3.49Å; T104-A106 PolarHBondContact O-N 3.25Å
105D46.8Very low50.2Low170 Ų170130.7 Ų130.791%0.90980%0.795SS**  trans-63.6111.5172.9-151.1-2.3000108.3
106A54.1Low50.1Low92 Ų92132 Ų13276%0.7679%0.792SS**  trans-155.4118168.300000109.1T104T104-A106 PolarHBondContact O-N 3.25Å
107A52.5Low50.3Low86 Ų86138.7 Ų138.771%0.71180%0.804SS**  trans-66159.3-170.800000114.8
108D51.3Low50.9Low137 Ų137137.8 Ų137.873%0.73380%0.799SS**  trans60.498.4138.8-82.7-16.5000118
109N53Low50.5Low135 Ų135140.5 Ų140.572%0.72280%0.802SS**  163.8119.897.1-76.9-35.3000113.5
110S52.6Low50.6Low106 Ų106138 Ų13874%0.74180%0.797SS**  trans66.6100.5133.4-52.80000121.3
111V48.2Very low50.9Low133 Ų133140.8 Ų140.881%0.80680%0.803SS**  34.8114.9125.3-174.70000118.3
112S48.6Very low51.6Low118 Ų118145.2 Ų145.283%0.82581%0.807SS**  -165.8128.6117.8-89.50000113.3
113T44.2Very low52.1Low128 Ų128140.4 Ų140.479%0.78580%0.804SS**  trans-60.4133.9170.646.50000112.2
114S49.7Very low52.8Low120 Ų120142.2 Ų142.284%0.83981%0.805SS**  trans-158.396.3150.1-85.70000110.4R116S114-R116 PolarHBondContact O-N 3.14Å
115A54.3Low53.2Low111 Ų111142.1 Ų142.192%0.91781%0.807SS**  trans-66.7108.3160.500000108.2
116R52.9Low53.3Low209 Ų209137.2 Ų137.279%0.78980%0.797SS**  trans-112.1105.6170-164.2172.4-165.6165.74.6109S114 H118S114-R116 PolarHBondContact O-N 3.14Å; R116-H118 PolarHBondContact O-N 3.28Å
117K51.6Low53.2Low203 Ų203140.3 Ų140.388%0.88380%0.8SS**  trans-58.7116.4165.5-66.6-173176.7-174.80108.4
118H57.1Low53.3Low161 Ų161142.1 Ų142.175%0.74581%0.808SS**  trans-115.6105.4158.1-107-76.6000108.6R116R116-H118 PolarHBondContact O-N 3.28Å
119R44.2Very low53.4Low252 Ų252140 Ų14095%0.95181%0.809SS**  trans-74.4116.3163.1-164.1-177.9-158.3-171.93.6105.7
120G55.3Low53.6Low60 Ų60138.3 Ų138.362%0.61981%0.814SS**  trans-154.496.9170.400000105.6
121D54.9Low53.8Low168 Ų168141 Ų14190%0.89882%0.82SS**  68.676.2105.7-83.7-15.8000111
122E59Low54.4Low189 Ų189140.9 Ų140.988%0.88382%0.815SS**PPolyproline II helixtrans-93.1128.2154.2-94.9-169.3152.500108.7
123P59.4Low55Low116 Ų116141.5 Ų141.575%0.75382%0.816SS**PPolyproline II helixtrans-82131176.732.6-29.8000109.8P125P123-P125 WeakPolarHBondContact O-CD 3.33Å
124L63Low55.8Low169 Ų169143 Ų14389%0.88581%0.814SS**PPolyproline II helixtrans-82.1118.9166.6-69.1173.5000109.3G126L124-G126 PolarHBondContact O-N 3.08Å; L124-G126 VanDerWaalsContact O-N 3.08Å
125P64.2Low56.2Low122 Ų122143.2 Ų143.279%0.79281%0.811SS**  trans-78.190.8165.530.8-29.9000108.9P123 N127P123-P125 WeakPolarHBondContact O-CD 3.33Å; P125-N127 PolarHBondContact O-N 3.31Å
126G50Low56.1Low67 Ų67146 Ų14669%0.69181%0.81SS**  trans-83.980.5167.200000110.4L124 S128L124-G126 PolarHBondContact O-N 3.08Å; L124-G126 VanDerWaalsContact O-N 3.08Å; G126-S128 PolarHBondContact O-N 3.17Å
127N51.2Low55.9Low157 Ų157147 Ų14784%0.8483%0.831SS**  trans-85.892.3166.7-88.54.7000109.1P125 A129P125-N127 PolarHBondContact O-N 3.31Å; N127-A129 PolarHBondContact O-N 3.31Å; N127-A129 VanDerWaalsContact O-N 3.09Å
128S54.5Low56.1Low124 Ų124144.2 Ų144.287%0.86783%0.829SS**  trans-65.997.9161.1-61.40000108.7G126 A130G126-S128 PolarHBondContact O-N 3.17Å; S128-A130 PolarHBondContact O-N 3.25Å
129A53.4Low56Low92 Ų92143.3 Ų143.376%0.7683%0.833SS**  trans-78.5110.5169.100000109N127N127-A129 PolarHBondContact O-N 3.31Å; N127-A129 VanDerWaalsContact O-N 3.09Å
130A57.3Low56.7Low100 Ų100137.3 Ų137.383%0.82683%0.826SS**  trans13.3106.7151.600000117.9S128S128-A130 PolarHBondContact O-N 3.25Å
131D56.3Low56.8Low161 Ų161141.8 Ų141.886%0.86184%0.839SS**  trans-92.5144.5149.7-86.9-46000109.6
132D62.5Low56.9Low131 Ų131140.2 Ų140.270%0.70184%0.835SS**  trans73.7120.6170.2-80.7-37.1000120.5
133P60.3Low56.7Low132 Ų132136.9 Ų136.986%0.85783%0.832SS**  -121.2117.7107.233.7-29.7000112.8T135P133-T135 PolarHBondContact O-N 3.24Å
134E61.5Low56.5Low159 Ų159138.4 Ų138.474%0.74384%0.837SS**  trans-61.1124.1161.8-85.1-171.1132.800111.2
135T58.5Low56.1Low125 Ų125136.1 Ų136.177%0.76783%0.834SS**  trans46.1115.1138.256.20000121P133P133-T135 PolarHBondContact O-N 3.24Å
136D51.9Low55.4Low168 Ų168137.3 Ų137.390%0.89884%0.837SS**  trans-39124.3154.8-139.1-1.7000113.7
137N47.4Very low55.9Low231 Ų231143.6 Ų143.6100%1.23585%0.851SS**  trans-153.90155.2-140.825.1000109.5

Retrieved 137 of 137 residues in 42.1 ms (Link to these results)