A0A087XXU9_POEFO Loading...

Neuropeptide FF-amide peptide precursor

AlphaFold DB , UniProt , Accession A0A087XXU9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 133 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
1M62.4Low78.8Confident182 Ų18298.6 Ų98.690%0.89758%0.583SS**  0125.40-78.7167.669.700107.8T3 V6 L63M1-T3 PolarHBondContact O-N 3Å; M1-V6 HydrophobicContact CE-CG2 4.05Å; M1-L63 HydrophobicContact SD-CD1 4.25Å
2D81.5Confident79.2Confident130 Ų13099.8 Ų99.870%0.69558%0.583SS**  trans-67.4118.8-178.6-62.7-29.8000109.4A4 A5 V6D2-A4 PolarHBondContact O-N 3.41Å; D2-A4 VanDerWaalsContact O-N 3.08Å; D2-A5 HydrophobicContact CB-CB 4.47Å; D2-A5 WeakPolarHBondContact O-CB 3.48Å; D2-A5 PolarHBondContact O-N 3.21Å; D2-V6 PolarHBondContact O-N 2.89Å
3T77Confident79.5Confident109 Ų10998.5 Ų98.567%0.66957%0.571SS**Hα-helixtrans-54.3-32.1-178.5-45.20000111.5M1 A5 V6 M7M1-T3 PolarHBondContact O-N 3Å; T3-A5 PolarHBondContact O-N 3.17Å; T3-V6 PolarHBondContact O-N 3.49Å; T3-M7 VanDerWaalsContact O-CG 3.28Å; T3-M7 WeakPolarHBondContact O-CG 3.41Å; T3-M7 PolarHBondContact O-N 3.43Å
4A73Confident79.5Confident72 Ų7299.6 Ų99.660%0.59557%0.573SS**Hα-helixtrans-58.4-43.7173.500000112.6D2 V6 M7 T8D2-A4 PolarHBondContact O-N 3.41Å; D2-A4 VanDerWaalsContact O-N 3.08Å; A4-V6 VanDerWaalsContact C-N 3.34Å; A4-V6 PolarHBondContact O-N 3.07Å; A4-M7 PolarHBondContact O-N 3.05Å; A4-T8 WeakPolarHBondContact O-CG2 3.35Å; A4-T8 PolarHBondContact O-N 2.97Å; A4-T8 PolarHBondContact O-OG1 3.42Å
5A75.8Confident79.2Confident56 Ų5697.3 Ų97.346%0.46357%0.571SS.*Hα-helixtrans-64.8-40.3179.400000111.5D2 T3 T8 L9D2-A5 HydrophobicContact CB-CB 4.47Å; D2-A5 WeakPolarHBondContact O-CB 3.48Å; D2-A5 PolarHBondContact O-N 3.21Å; T3-A5 PolarHBondContact O-N 3.17Å; A5-T8 WeakPolarHBondContact CA-OG1 3.15Å; A5-T8 PolarHBondContact O-N 3.26Å; A5-T8 PolarHBondContact O-OG1 2.89Å; A5-L9 PolarHBondContact O-N 3.15Å
6V80.4Confident78.7Confident69 Ų6999.5 Ų99.542%0.41858%0.576SS.*Hα-helixtrans-65.2-43.5177.2-178.30000110.9M1 D2 T3 A4 T8 L9 L10M1-V6 HydrophobicContact CE-CG2 4.05Å; D2-V6 PolarHBondContact O-N 2.89Å; T3-V6 PolarHBondContact O-N 3.49Å; A4-V6 VanDerWaalsContact C-N 3.34Å; A4-V6 PolarHBondContact O-N 3.07Å; V6-T8 PolarHBondContact O-N 3.14Å; V6-L9 PolarHBondContact O-N 3.14Å; V6-L10 WeakPolarHBondContact O-CB 3.49Å; V6-L10 PolarHBondContact O-N 2.83Å
7M82.1Confident77.9Confident113 Ų11396.7 Ų96.756%0.55757%0.567SS**Hα-helixtrans-65.8-37.4177.6-67.2-56.4-7000112.2T3 A4 L10 A11T3-M7 VanDerWaalsContact O-CG 3.28Å; T3-M7 WeakPolarHBondContact O-CG 3.41Å; T3-M7 PolarHBondContact O-N 3.43Å; A4-M7 PolarHBondContact O-N 3.05Å; M7-L10 PolarHBondContact O-N 2.85Å; M7-A11 WeakPolarHBondContact O-CB 3.35Å; M7-A11 PolarHBondContact O-N 3.21Å
8T82.2Confident76.7Confident96 Ų9693.9 Ų93.959%0.58956%0.563SS**Hα-helixtrans-67-38.7175.253.40000112.4A4 A5 V6 A11 L12A4-T8 WeakPolarHBondContact O-CG2 3.35Å; A4-T8 PolarHBondContact O-N 2.97Å; A4-T8 PolarHBondContact O-OG1 3.42Å; A5-T8 WeakPolarHBondContact CA-OG1 3.15Å; A5-T8 PolarHBondContact O-N 3.26Å; A5-T8 PolarHBondContact O-OG1 2.89Å; V6-T8 PolarHBondContact O-N 3.14Å; T8-A11 PolarHBondContact O-N 2.9Å; T8-L12 WeakPolarHBondContact O-CB 3.48Å; T8-L12 PolarHBondContact O-N 3.07Å
9L86Confident75.5Confident110 Ų11094.8 Ų94.858%0.57657%0.568SS**Hα-helixtrans-65.4-44.3176.3-167.999000110.8A5 V6 L12 I13A5-L9 PolarHBondContact O-N 3.15Å; V6-L9 PolarHBondContact O-N 3.14Å; L9-L12 WeakPolarHBondContact O-CB 3.44Å; L9-L12 PolarHBondContact O-N 3.02Å; L9-I13 HydrophobicContact CD2-CD1 4.05Å; L9-I13 HydrophobicContact CG-CD1 4.16Å; L9-I13 VanDerWaalsContact O-CG1 3.29Å; L9-I13 WeakPolarHBondContact O-CG1 3.28Å; L9-I13 PolarHBondContact O-N 3.13Å
10L83.9Confident74.3Confident89 Ų8994.8 Ų94.847%0.46657%0.573SS.*Hα-helixtrans-60.2-47.4176.4-175.173.1000111.1V6 M7 L12 I13 L14V6-L10 WeakPolarHBondContact O-CB 3.49Å; V6-L10 PolarHBondContact O-N 2.83Å; M7-L10 PolarHBondContact O-N 2.85Å; L10-L12 VanDerWaalsContact C-N 3.31Å; L10-L12 PolarHBondContact O-N 2.92Å; L10-I13 PolarHBondContact O-N 3.21Å; L10-L14 HydrophobicContact CD1-CD1 3.9Å; L10-L14 HydrophobicContact CD2-CD1 4.4Å; L10-L14 HydrophobicContact CG-CD1 3.66Å; L10-L14 VanDerWaalsContact O-CD1 3.3Å; L10-L14 WeakPolarHBondContact O-CD1 3.36Å; L10-L14 PolarHBondContact O-N 3.32Å
11A82.7Confident72.9Confident59 Ų5998.1 Ų98.149%0.48858%0.582SS.*Hα-helixtrans-60.6-39.6177.500000112.3M7 T8 A15M7-A11 WeakPolarHBondContact O-CB 3.35Å; M7-A11 PolarHBondContact O-N 3.21Å; T8-A11 PolarHBondContact O-N 2.9Å; A11-A15 VanDerWaalsContact O-CB 3.31Å; A11-A15 WeakPolarHBondContact O-CB 3.37Å; A11-A15 PolarHBondContact O-N 3.16Å
12L83.1Confident71.9Confident112 Ų11293.4 Ų93.459%0.58657%0.572SS**Hα-helixtrans-63.5-43.3176-163.991.4000111.6T8 L9 L10 A15 M16T8-L12 WeakPolarHBondContact O-CB 3.48Å; T8-L12 PolarHBondContact O-N 3.07Å; L9-L12 WeakPolarHBondContact O-CB 3.44Å; L9-L12 PolarHBondContact O-N 3.02Å; L10-L12 VanDerWaalsContact C-N 3.31Å; L10-L12 PolarHBondContact O-N 2.92Å; L12-A15 PolarHBondContact O-N 3.03Å; L12-M16 VanDerWaalsContact O-CG 3.28Å; L12-M16 WeakPolarHBondContact O-CG 3.31Å; L12-M16 PolarHBondContact O-N 3.41Å
13I83.6Confident70.2Confident84 Ų8494.9 Ų94.943%0.43158%0.579SS.*Hα-helixtrans-65.2-46.2178.7-67.4164.9000110.6L9 L10 A15 M16 A17L9-I13 HydrophobicContact CD2-CD1 4.05Å; L9-I13 HydrophobicContact CG-CD1 4.16Å; L9-I13 VanDerWaalsContact O-CG1 3.29Å; L9-I13 WeakPolarHBondContact O-CG1 3.28Å; L9-I13 PolarHBondContact O-N 3.13Å; L10-I13 PolarHBondContact O-N 3.21Å; I13-A15 VanDerWaalsContact C-N 3.34Å; I13-A15 PolarHBondContact O-N 3.29Å; I13-M16 PolarHBondContact O-N 3.47Å; I13-A17 WeakPolarHBondContact O-CB 3.48Å; I13-A17 PolarHBondContact O-N 2.91Å
14L79.6Confident68.7Low113 Ų11398 Ų9859%0.59259%0.586SS**Hα-helixtrans-62.7-39.4176.4-90117.1000112.3L10 A17 G18L10-L14 HydrophobicContact CD1-CD1 3.9Å; L10-L14 HydrophobicContact CD2-CD1 4.4Å; L10-L14 HydrophobicContact CG-CD1 3.66Å; L10-L14 VanDerWaalsContact O-CD1 3.3Å; L10-L14 WeakPolarHBondContact O-CD1 3.36Å; L10-L14 PolarHBondContact O-N 3.32Å; L14-A17 PolarHBondContact O-N 2.94Å; L14-G18 PolarHBondContact O-N 3.36Å
15A74.5Confident67.5Low65 Ų65101 Ų10154%0.53759%0.59SS.*Hα-helixtrans-63.3-40.7175.800000112.1A11 L12 I13 V19A11-A15 VanDerWaalsContact O-CB 3.31Å; A11-A15 WeakPolarHBondContact O-CB 3.37Å; A11-A15 PolarHBondContact O-N 3.16Å; L12-A15 PolarHBondContact O-N 3.03Å; I13-A15 VanDerWaalsContact C-N 3.34Å; I13-A15 PolarHBondContact O-N 3.29Å; A15-V19 WeakPolarHBondContact O-CG2 3.36Å
16M71.1Confident66.2Low133 Ų133107.6 Ų107.666%0.65561%0.612SS**Hα-helixtrans-71.5-34176.2-66-120.4-67.900112.6L12 I13L12-M16 VanDerWaalsContact O-CG 3.28Å; L12-M16 WeakPolarHBondContact O-CG 3.31Å; L12-M16 PolarHBondContact O-N 3.41Å; I13-M16 PolarHBondContact O-N 3.47Å
17A65.9Low64.1Low52 Ų52108.1 Ų108.143%0.4363%0.631SS.*Hα-helixtrans-72.4-36.1177.700000113I13 L14 V19 S20I13-A17 WeakPolarHBondContact O-CB 3.48Å; I13-A17 PolarHBondContact O-N 2.91Å; L14-A17 PolarHBondContact O-N 2.94Å; A17-V19 VanDerWaalsContact C-N 3.28Å; A17-V19 PolarHBondContact O-N 2.94Å; A17-S20 PolarHBondContact O-N 3.34Å
18G56.4Low61.7Low47 Ų47106.5 Ų106.549%0.48564%0.643SS.*Hα-helixtrans-67.9-21.9179.300000114.6L14 S20L14-G18 PolarHBondContact O-N 3.36Å; G18-S20 VanDerWaalsContact C-N 3.31Å
19V53.8Low59.9Low111 Ų111106 Ų10667%0.67366%0.657SS**THydrogen-bonded Turntrans-73.7-23.6176176.70000111.9A15 A17A15-V19 WeakPolarHBondContact O-CG2 3.36Å; A17-V19 VanDerWaalsContact C-N 3.28Å; A17-V19 PolarHBondContact O-N 2.94Å
20S51.3Low57.4Low94 Ų94107.8 Ų107.866%0.65767%0.667SS**THydrogen-bonded Turntrans-78.3-23-179.1-70.50000114.5A17 G18A17-S20 PolarHBondContact O-N 3.34Å; G18-S20 VanDerWaalsContact C-N 3.31Å
21Q44.7Very low55.9Low164 Ų164111.9 Ų111.977%0.76668%0.684SS**G310 helixtrans-80.8-16.5-178.6-83.5-179.2-8.100114.1L23Q21-L23 PolarHBondContact O-N 3.25Å
22A40.6Very low54Low83 Ų83115.7 Ų115.769%0.68670%0.696SS**G310 helixtrans-76.6-5.518000000114.3
23L46.8Very low52.3Low162 Ų162117.4 Ų117.485%0.84871%0.706SS**G310 helixtrans-98.5-1.3177.5-95.8160.1000114Q21 I25Q21-L23 PolarHBondContact O-N 3.25Å; L23-I25 VanDerWaalsContact C-N 3.33Å; L23-I25 PolarHBondContact O-N 3.31Å
24H46.3Very low50.2Low173 Ų173122.3 Ų122.380%0.80173%0.729SS**  trans-96.246.6179.4-151.895.3000112.1
25I47.8Very low48.4Very low136 Ų136124.5 Ų124.570%0.69774%0.741SS**  trans-129.782.1170-53.1179.1000108.2L23L23-I25 VanDerWaalsContact C-N 3.33Å; L23-I25 PolarHBondContact O-N 3.31Å
26Q47Very low47.1Very low195 Ų195127.9 Ų127.991%0.91176%0.757SS**  trans153.3111.1143.1-89.3169.188.900110.4
27G35.9Very low45.7Very low80 Ų80124.4 Ų124.483%0.82576%0.755SS**  trans160.685.4162.400000114.1
28G32.9Very low44.9Very low78 Ų78126.4 Ų126.480%0.80477%0.766SS**  trans81.6106.2150.600000115.7
29G45.2Very low44.6Very low86 Ų86128.5 Ų128.589%0.88777%0.773SS**  trans-63.1133.2159.800000110.1
30D32.6Very low44.5Very low148 Ų148130.8 Ų130.879%0.79178%0.777SS**  trans-145.6116.3139-154.216.6000106.8N32D30-N32 PolarHBondContact O-N 2.66Å
31E52.1Low44.4Very low174 Ų174133.9 Ų133.981%0.81378%0.781SS**  trans-59.3129.8163.8-62.3173.3114.300106.4
32N42.5Very low44.9Very low139 Ų139130.2 Ų130.274%0.74377%0.766SS**  trans174.4121.9140.1-85.6-52.5000109.9D30D30-N32 PolarHBondContact O-N 2.66Å
33D48.5Very low45.6Very low148 Ų148130.3 Ų130.379%0.79175%0.754SS**  trans52.292.9152.6-65.9-19000119.5
34M39.1Very low46.2Very low187 Ų187125.2 Ų125.292%0.92174%0.735SS**  trans-151106.1131.3-136.6131.497.400112.3
35L41.8Very low46.7Very low160 Ų160122.5 Ų122.584%0.83873%0.726SS**  trans-55.3122.5167.9-134.4110.4000109.6G37L35-G37 PolarHBondContact O-N 2.76Å
36P47.6Very low47.4Very low136 Ų136123.9 Ų123.988%0.88372%0.723SS**  trans-88.385.1173.333.7-27.6000107.9
37G41.8Very low47.8Very low59 Ų59119.8 Ų119.861%0.60871%0.706SS**  trans-159.470.1-17500000113.3L35L35-G37 PolarHBondContact O-N 2.76Å
38S48.3Very low48.8Very low95 Ų95120.8 Ų120.866%0.66469%0.693SS**SBendtrans-177.4-6160.760.10000114.4E40S38-E40 PolarHBondContact O-N 2.97Å
39S49.6Very low50Low90 Ų90119 Ų11963%0.62967%0.673SS**THydrogen-bonded Turntrans-74.7-21.7-171.1-173.50000114.9
40E51.5Low50.5Low160 Ų160116 Ų11675%0.74864%0.637SS**THydrogen-bonded Turntrans-80.8-36.6-173.7-69.4-173.8152.100113.1S38 N42 M43S38-E40 PolarHBondContact O-N 2.97Å; E40-N42 VanDerWaalsContact C-N 3.28Å; E40-N42 PolarHBondContact O-N 2.97Å; E40-M43 HydrophobicContact CB-CE 4.47Å; E40-M43 HydrophobicContact CG-CE 4.14Å; E40-M43 PolarHBondContact O-N 3.35Å
41E49.3Very low51.4Low158 Ų158115.7 Ų115.774%0.73863%0.631SS**Hα-helixtrans-66.2-28.5-177.5-72.4170.5139.100112.6
42N55.8Low51.6Low87 Ų87114.2 Ų114.247%0.46563%0.627SS.*Hα-helixtrans-79.2-18.9179.5-146-72000113.6E40 R46E40-N42 VanDerWaalsContact C-N 3.28Å; E40-N42 PolarHBondContact O-N 2.97Å; N42-R46 VanDerWaalsContact O-CG 3.3Å; N42-R46 WeakPolarHBondContact O-CG 3.29Å; N42-R46 PolarHBondContact O-N 2.98Å; N42-R46 PolarHBondContact OD1-NE 2.87Å
43M56Low52.2Low86 Ų86115.4 Ų115.442%0.42463%0.628SS.*Hα-helixtrans-76.2-38.6-178.6-67.6-165.5-7400111.8E40 L47E40-M43 HydrophobicContact CB-CE 4.47Å; E40-M43 HydrophobicContact CG-CE 4.14Å; E40-M43 PolarHBondContact O-N 3.35Å; M43-L47 WeakPolarHBondContact O-CG 3.37Å; M43-L47 PolarHBondContact O-N 3.46Å; M43-L47 VanDerWaalsContact O-N 3.12Å
44A58Low52.6Low54 Ų54108.9 Ų108.945%0.44660%0.595SS.*Hα-helixtrans-67.3-45.117900000111.7R46 L47 L48A44-R46 VanDerWaalsContact C-N 3.29Å; A44-R46 PolarHBondContact O-N 3.17Å; A44-L47 WeakPolarHBondContact O-CB 3.3Å; A44-L47 PolarHBondContact O-N 2.78Å; A44-L47 VanDerWaalsContact O-N 3.14Å; A44-L48 WeakPolarHBondContact O-CG 3.28Å; A44-L48 PolarHBondContact O-N 3.5Å
45D57.9Low53.4Low117 Ų117110.4 Ų110.463%0.62659%0.59SS**Hα-helixtrans-64.4-32.9178.9-79.8-11.5000112.8G49D45-G49 PolarHBondContact O-N 3.33Å
46R61.3Low54.2Low164 Ų164110.6 Ų110.662%0.61959%0.592SS**Hα-helixtrans-75.4-28.9174.9-71.5179.9-176.9-119.6-0.6113.3N42 A44 L50N42-R46 VanDerWaalsContact O-CG 3.3Å; N42-R46 WeakPolarHBondContact O-CG 3.29Å; N42-R46 PolarHBondContact O-N 2.98Å; N42-R46 PolarHBondContact OD1-NE 2.87Å; A44-R46 VanDerWaalsContact C-N 3.29Å; A44-R46 PolarHBondContact O-N 3.17Å; R46-L50 PolarHBondContact O-N 2.98Å
47L56.6Low55Low109 Ų109107.3 Ų107.357%0.57157%0.569SS**Hα-helixtrans-69.8-42.3171.8-81.7165.3000110.9M43 A44 G49 L50M43-L47 WeakPolarHBondContact O-CG 3.37Å; M43-L47 PolarHBondContact O-N 3.46Å; M43-L47 VanDerWaalsContact O-N 3.12Å; A44-L47 WeakPolarHBondContact O-CB 3.3Å; A44-L47 PolarHBondContact O-N 2.78Å; A44-L47 VanDerWaalsContact O-N 3.14Å; L47-G49 VanDerWaalsContact C-N 3.35Å; L47-L50 WeakPolarHBondContact O-CB 3.46Å; L47-L50 PolarHBondContact O-N 3.46Å
48L57.2Low56.6Low102 Ų102106.9 Ų106.953%0.53456%0.557SS.*Hα-helixtrans-66.6-35.4175.8-67.1173.2000112.2A44 L50 E51A44-L48 WeakPolarHBondContact O-CG 3.28Å; A44-L48 PolarHBondContact O-N 3.5Å; L48-L50 PolarHBondContact O-N 3.21Å; L48-E51 PolarHBondContact O-N 3.31Å
49G57.9Low57.7Low39 Ų39106.8 Ų106.840%0.40255%0.554SS.*Hα-helixtrans-62.1-26.4172.700000114.2D45 L47D45-G49 PolarHBondContact O-N 3.33Å; L47-G49 VanDerWaalsContact C-N 3.35Å
50L54.9Low58.8Low24 Ų24107.9 Ų107.913%0.12655%0.553CS.*Hα-helixtrans-79.1-27.8179.5-155.392.9000112.9R46 L47 L48 I52 E53 S54 L65 L66R46-L50 PolarHBondContact O-N 2.98Å; L47-L50 WeakPolarHBondContact O-CB 3.46Å; L47-L50 PolarHBondContact O-N 3.46Å; L48-L50 PolarHBondContact O-N 3.21Å; L50-I52 PolarHBondContact O-N 2.93Å; L50-E53 PolarHBondContact O-N 3Å; L50-S54 VanDerWaalsContact O-CB 3.27Å; L50-S54 WeakPolarHBondContact O-CB 3.46Å; L50-S54 PolarHBondContact O-N 2.75Å; L50-S54 VanDerWaalsContact O-N 3.09Å; L50-S54 PolarHBondContact O-OG 3.48Å; L50-L65 HydrophobicContact CD1-CD2 4.2Å; L50-L66 HydrophobicContact CD2-CD2 3.81Å; L50-L66 HydrophobicContact CD2-CG 4.37Å
51E52.8Low60Low141 Ų141104.5 Ų104.566%0.65954%0.54SS*.Hα-helixtrans-65.8-29.4178.9-139.4179-176.400111.2L48L48-E51 PolarHBondContact O-N 3.31Å
52I55.7Low61.3Low144 Ų144101.2 Ų101.274%0.73852%0.521SS*.Hα-helixtrans-76.9-37.9-179.8-58.4172.5000111.7L50L50-I52 PolarHBondContact O-N 2.93Å
53E55.7Low62.4Low163 Ų163101.1 Ų101.176%0.76252%0.52SS*.Hα-helixtrans-87.2-22.7-177.4-166.3171.9-169.600113.2L50 R55L50-E53 PolarHBondContact O-N 3Å; E53-R55 VanDerWaalsContact C-N 3.34Å; E53-R55 PolarHBondContact O-N 3Å
54S55.8Low63.7Low12 Ų12101.9 Ų101.98%0.08453%0.525CS..G310 helixtrans-82.2-4.9-171.178.90000115.3L50 D56 T57 R62L50-S54 VanDerWaalsContact O-CB 3.27Å; L50-S54 WeakPolarHBondContact O-CB 3.46Å; L50-S54 PolarHBondContact O-N 2.75Å; L50-S54 VanDerWaalsContact O-N 3.09Å; L50-S54 PolarHBondContact O-OG 3.48Å; S54-D56 PolarHBondContact O-N 3.39Å; S54-T57 PolarHBondContact O-N 3.29Å; S54-T57 PolarHBondContact O-OG1 3.38Å; S54-T57 VanDerWaalsContact O-OG1 3.07Å; S54-R62 PolarHBondContact O-NE 3.08Å; S54-R62 VanDerWaalsContact O-NE 3.13Å; S54-R62 PolarHBondContact O-NH2 3.31Å; S54-R62 PolarHBondContact OG-NE 3.39Å; S54-R62 PolarHBondContact OG-NH1 3.31Å; S54-R62 VanDerWaalsContact OG-NH1 3.12Å; S54-R62 PolarHBondContact OG-NH2 3.26Å
55R56.4Low64.7Low219 Ų219103.1 Ų103.183%0.82652%0.524SS*.G310 helixtrans-58-17.3-168.3-152.6169.8159.8134.1-3.3115.2E53E53-R55 VanDerWaalsContact C-N 3.34Å; E53-R55 PolarHBondContact O-N 3Å
56D59.1Low65.8Low163 Ų163101.2 Ų101.287%0.87251%0.513SS*.G310 helixtrans-1154.5179.8-64.4-32.4000115.3S54S54-D56 PolarHBondContact O-N 3.39Å
57T62.9Low66.7Low68 Ų6897.3 Ų97.342%0.41751%0.508SS..SBendtrans-102.8143-178.952.40000112.8S54 R62S54-T57 PolarHBondContact O-N 3.29Å; S54-T57 PolarHBondContact O-OG1 3.38Å; S54-T57 VanDerWaalsContact O-OG1 3.07Å; T57-R62 PolarHBondContact O-NE 3.46Å
58S75.8Confident67.8Low49 Ų4996.4 Ų96.434%0.34350%0.503SS..  trans-59.3149.3179.884.60000110.7D60 D61 R62S58-D60 PolarHBondContact O-N 3.01Å; S58-D60 VanDerWaalsContact O-N 3.17Å; S58-D61 WeakPolarHBondContact CB-OD2 3.29Å; S58-D61 PolarHBondContact O-N 2.72Å; S58-D61 VanDerWaalsContact O-N 3.16Å; S58-D61 PolarHBondContact OG-N 2.7Å; S58-D61 PolarHBondContact OG-OD2 2.86Å; S58-R62 PolarHBondContact O-N 2.95Å
59P71.8Confident68.5Low94 Ų9497.2 Ų97.261%0.6150%0.499SS*.Hα-helixtrans-60.2-29.4-176.725.3-34.5000112.6R62 L63P59-R62 PolarHBondContact O-N 3.47Å; P59-L63 WeakPolarHBondContact O-CG 3.35Å; P59-L63 PolarHBondContact O-N 2.96Å
60D72.9Confident69.2Low112 Ų11298.1 Ų98.160%0.59950%0.503SS*.Hα-helixtrans-72.2-39.1178.9-62.6-41.1000112S58 R62 L63 L64S58-D60 PolarHBondContact O-N 3.01Å; S58-D60 VanDerWaalsContact O-N 3.17Å; D60-R62 VanDerWaalsContact C-N 3.28Å; D60-R62 PolarHBondContact O-N 3.21Å; D60-L63 PolarHBondContact O-N 2.94Å; D60-L64 PolarHBondContact O-N 2.91Å
61D76.4Confident70.2Confident90 Ų90100.5 Ų100.548%0.48152%0.515SS..Hα-helixtrans-65.7-35.1176.1-62.7-41.1000111.5S58 L64 L65S58-D61 WeakPolarHBondContact CB-OD2 3.29Å; S58-D61 PolarHBondContact O-N 2.72Å; S58-D61 VanDerWaalsContact O-N 3.16Å; S58-D61 PolarHBondContact OG-N 2.7Å; S58-D61 PolarHBondContact OG-OD2 2.86Å; D61-L64 PolarHBondContact O-N 3Å; D61-L65 VanDerWaalsContact O-CB 3.3Å; D61-L65 WeakPolarHBondContact O-CB 3.41Å; D61-L65 PolarHBondContact O-N 2.69Å
62R76.4Confident71Confident88 Ų88101.2 Ų101.233%0.33252%0.516SS..Hα-helixtrans-64.7-43.5174.3-64.8-179.8-177.9-161.65.6111.5S54 T57 S58 P59 D60 L65 L66S54-R62 PolarHBondContact O-NE 3.08Å; S54-R62 VanDerWaalsContact O-NE 3.13Å; S54-R62 PolarHBondContact O-NH2 3.31Å; S54-R62 PolarHBondContact OG-NE 3.39Å; S54-R62 PolarHBondContact OG-NH1 3.31Å; S54-R62 VanDerWaalsContact OG-NH1 3.12Å; S54-R62 PolarHBondContact OG-NH2 3.26Å; T57-R62 PolarHBondContact O-NE 3.46Å; S58-R62 PolarHBondContact O-N 2.95Å; P59-R62 PolarHBondContact O-N 3.47Å; D60-R62 VanDerWaalsContact C-N 3.28Å; D60-R62 PolarHBondContact O-N 3.21Å; R62-L65 PolarHBondContact O-N 2.71Å; R62-L66 WeakPolarHBondContact O-CB 2.8Å; R62-L66 VanDerWaalsContact O-CG 3.26Å; R62-L66 WeakPolarHBondContact O-CG 3.37Å; R62-L66 PolarHBondContact O-N 3.24Å
63L79.6Confident71.4Confident86 Ų86100 Ų10045%0.4551%0.507SS..Hα-helixtrans-63.9-44.3176.8-70.5174.4000111.4M1 P59 D60 L65 L66 V67M1-L63 HydrophobicContact SD-CD1 4.25Å; P59-L63 WeakPolarHBondContact O-CG 3.35Å; P59-L63 PolarHBondContact O-N 2.96Å; D60-L63 PolarHBondContact O-N 2.94Å; L63-L65 VanDerWaalsContact C-N 3.34Å; L63-L65 PolarHBondContact O-N 2.75Å; L63-L66 PolarHBondContact O-N 3.45Å; L63-V67 VanDerWaalsContact O-CG2 3.29Å; L63-V67 WeakPolarHBondContact O-CG2 3.35Å; L63-V67 PolarHBondContact O-N 3.04Å
64L82.1Confident71.9Confident102 Ų10295.9 Ų95.953%0.53450%0.5SS..Hα-helixtrans-60.4-44176.3-179.663.8000111.7D60 D61 V67 L68D60-L64 PolarHBondContact O-N 2.91Å; D61-L64 PolarHBondContact O-N 3Å; L64-V67 PolarHBondContact O-N 2.73Å; L64-L68 HydrophobicContact CD1-CD1 4.21Å; L64-L68 HydrophobicContact CD1-CG 4.34Å; L64-L68 HydrophobicContact CG-CD1 4.02Å; L64-L68 WeakPolarHBondContact O-CB 3.42Å; L64-L68 WeakPolarHBondContact O-CG 3.09Å; L64-L68 PolarHBondContact O-N 3.29Å
65L80.3Confident71.9Confident80 Ų8098 Ų9842%0.41953%0.525SS..Hα-helixtrans-63.6-42.2178.4-17763.4000112L50 D61 R62 L63 R69L50-L65 HydrophobicContact CD1-CD2 4.2Å; D61-L65 VanDerWaalsContact O-CB 3.3Å; D61-L65 WeakPolarHBondContact O-CB 3.41Å; D61-L65 PolarHBondContact O-N 2.69Å; R62-L65 PolarHBondContact O-N 2.71Å; L63-L65 VanDerWaalsContact C-N 3.34Å; L63-L65 PolarHBondContact O-N 2.75Å; L65-R69 VanDerWaalsContact O-CB 3.31Å; L65-R69 WeakPolarHBondContact O-CB 3.29Å; L65-R69 PolarHBondContact O-N 3.35Å
66L80.1Confident71.8Confident76 Ų7693.1 Ų93.140%0.39851%0.51SS..Hα-helixtrans-63.6-43.4175.8-73.3171.4000111.5L50 R62 L63 R69 A70L50-L66 HydrophobicContact CD2-CD2 3.81Å; L50-L66 HydrophobicContact CD2-CG 4.37Å; R62-L66 WeakPolarHBondContact O-CB 2.8Å; R62-L66 VanDerWaalsContact O-CG 3.26Å; R62-L66 WeakPolarHBondContact O-CG 3.37Å; R62-L66 PolarHBondContact O-N 3.24Å; L63-L66 PolarHBondContact O-N 3.45Å; L66-R69 PolarHBondContact O-N 3.5Å; L66-A70 WeakPolarHBondContact O-CB 3.26Å; L66-A70 PolarHBondContact O-N 3.09Å
67V81.4Confident71.7Confident83 Ų8389.6 Ų89.650%0.50350%0.496SS..Hα-helixtrans-64.4-46.5177.2170.70000111.2L63 L64 R69 A70 L71L63-V67 VanDerWaalsContact O-CG2 3.29Å; L63-V67 WeakPolarHBondContact O-CG2 3.35Å; L63-V67 PolarHBondContact O-N 3.04Å; L64-V67 PolarHBondContact O-N 2.73Å; V67-R69 VanDerWaalsContact C-N 3.33Å; V67-R69 PolarHBondContact O-N 3.42Å; V67-A70 PolarHBondContact O-N 3.39Å; V67-L71 HydrophobicContact CG1-CD1 3.93Å; V67-L71 WeakPolarHBondContact O-CB 3.48Å; V67-L71 VanDerWaalsContact O-CG 3.29Å; V67-L71 WeakPolarHBondContact O-CG 3.17Å; V67-L71 PolarHBondContact O-N 2.89Å
68L78.3Confident71.3Confident90 Ų9094.7 Ų94.747%0.47152%0.52SS..Hα-helixtrans-62.8-38.8178.3-75.2171.1000112.3L64 K72L64-L68 HydrophobicContact CD1-CD1 4.21Å; L64-L68 HydrophobicContact CD1-CG 4.34Å; L64-L68 HydrophobicContact CG-CD1 4.02Å; L64-L68 WeakPolarHBondContact O-CB 3.42Å; L64-L68 WeakPolarHBondContact O-CG 3.09Å; L64-L68 PolarHBondContact O-N 3.29Å; L68-K72 WeakPolarHBondContact O-CG 3.3Å; L68-K72 PolarHBondContact O-N 3.24Å; L68-K72 VanDerWaalsContact O-N 3.09Å
69R71.6Confident70.2Confident119 Ų11994.5 Ų94.545%0.44953%0.525SS..Hα-helixtrans-74.9-39.6178.3-171.6174.2-82.1165.1-3.4111.7L65 L66 V67 L71 K72 Q73L65-R69 VanDerWaalsContact O-CB 3.31Å; L65-R69 WeakPolarHBondContact O-CB 3.29Å; L65-R69 PolarHBondContact O-N 3.35Å; L66-R69 PolarHBondContact O-N 3.5Å; V67-R69 VanDerWaalsContact C-N 3.33Å; V67-R69 PolarHBondContact O-N 3.42Å; R69-L71 VanDerWaalsContact C-N 3.31Å; R69-L71 PolarHBondContact O-N 3.3Å; R69-K72 PolarHBondContact O-N 2.97Å; R69-Q73 VanDerWaalsContact O-CB 3.3Å; R69-Q73 WeakPolarHBondContact O-CB 3.42Å; R69-Q73 PolarHBondContact O-N 3.25Å
70A73.5Confident69.2Low58 Ų5895.5 Ų95.548%0.47953%0.53SS..Hα-helixtrans-60.6-41.317300000111.2L66 V67 Q73 A74L66-A70 WeakPolarHBondContact O-CB 3.26Å; L66-A70 PolarHBondContact O-N 3.09Å; V67-A70 PolarHBondContact O-N 3.39Å; A70-Q73 PolarHBondContact O-N 3.47Å; A70-A74 WeakPolarHBondContact O-CB 3.33Å; A70-A74 PolarHBondContact O-N 2.77Å
71L74.6Confident68.1Low74 Ų7499 Ų9939%0.38754%0.542SS..Hα-helixtrans-62.6-46.5173.8-75166.7000111.7V67 R69 Q73 F76V67-L71 HydrophobicContact CG1-CD1 3.93Å; V67-L71 WeakPolarHBondContact O-CB 3.48Å; V67-L71 VanDerWaalsContact O-CG 3.29Å; V67-L71 WeakPolarHBondContact O-CG 3.17Å; V67-L71 PolarHBondContact O-N 2.89Å; R69-L71 VanDerWaalsContact C-N 3.31Å; R69-L71 PolarHBondContact O-N 3.3Å; L71-Q73 VanDerWaalsContact C-N 3.28Å; L71-Q73 PolarHBondContact O-N 2.93Å; L71-F76 HydrophobicContact CD2-CD2 4.26Å; L71-F76 WeakPolarHBondContact O-CB 3.31Å; L71-F76 PolarHBondContact O-N 3.42Å
72K69.9Low67Low155 Ų155104.5 Ų104.567%0.67456%0.556SS**Hα-helixtrans-60.7-36.6175.5-74.7-180179-172.90112.9L68 R69L68-K72 WeakPolarHBondContact O-CG 3.3Å; L68-K72 PolarHBondContact O-N 3.24Å; L68-K72 VanDerWaalsContact O-N 3.09Å; R69-K72 PolarHBondContact O-N 2.97Å
73Q65.6Low66Low120 Ų120108.9 Ų108.956%0.56158%0.581SS**Hα-helixtrans-85.8-30.9-175.8-168.7141.43.700113.2R69 A70 L71 G75R69-Q73 VanDerWaalsContact O-CB 3.3Å; R69-Q73 WeakPolarHBondContact O-CB 3.42Å; R69-Q73 PolarHBondContact O-N 3.25Å; A70-Q73 PolarHBondContact O-N 3.47Å; L71-Q73 VanDerWaalsContact C-N 3.28Å; L71-Q73 PolarHBondContact O-N 2.93Å; Q73-G75 PolarHBondContact O-N 3.17Å
74A65.7Low64.8Low75 Ų75110.7 Ų110.762%0.6260%0.596SS**THydrogen-bonded Turntrans-71.318.817400000113.2A70 F76A70-A74 WeakPolarHBondContact O-CB 3.33Å; A70-A74 PolarHBondContact O-N 2.77Å; A74-F76 PolarHBondContact O-N 3.24Å
75G55.8Low63.8Low58 Ų58116.4 Ų116.460%0.59861%0.61SS**THydrogen-bonded Turntrans65.128.2177.400000113.2Q73 P77Q73-G75 PolarHBondContact O-N 3.17Å; G75-P77 WeakPolarHBondContact O-CD 3.3Å
76F54.8Low62.8Low116 Ų116122 Ų12251%0.50963%0.634SS.*  trans-87.684.2154.6-79.6-93.6000107.6L71 A74 L78L71-F76 HydrophobicContact CD2-CD2 4.26Å; L71-F76 WeakPolarHBondContact O-CB 3.31Å; L71-F76 PolarHBondContact O-N 3.42Å; A74-F76 PolarHBondContact O-N 3.24Å; F76-L78 PolarHBondContact O-N 3.5Å
77P56.3Low62.2Low88 Ų88122.8 Ų122.857%0.57165%0.646SS**  trans-61.9114164.230.4-33.8000105.7G75 G79G75-P77 WeakPolarHBondContact O-CD 3.3Å; P77-G79 WeakPolarHBondContact CB-O 3.47Å; P77-G79 CarbonylContact O-C 3.25Å; P77-G79 VanDerWaalsContact O-C 3.25Å; P77-G79 PolarHBondContact O-N 3.19Å
78L54.6Low61.7Low176 Ų176124.1 Ų124.192%0.92165%0.654SS**SBendtrans-71.170.6171.9-154.982.5000108.1F76F76-L78 PolarHBondContact O-N 3.5Å
79G51.7Low61.2Low45 Ų45126.7 Ų126.746%0.46467%0.668SS.*SBendtrans151.568-149.600000105P77 Q81P77-G79 WeakPolarHBondContact CB-O 3.47Å; P77-G79 CarbonylContact O-C 3.25Å; P77-G79 VanDerWaalsContact O-C 3.25Å; P77-G79 PolarHBondContact O-N 3.19Å; G79-Q81 PolarHBondContact O-N 3.39Å
80T51.8Low61.1Low114 Ų114128.9 Ų128.970%0.69968%0.682SS**  trans-45.797.4153.545.60000105.6R82T80-R82 PolarHBondContact O-N 3.47Å
81Q50.6Low61Low186 Ų186133.9 Ų133.987%0.86970%0.696SS**  trans-63.184.5158.4-179.2165.3-25.900102.2G79 E83G79-Q81 PolarHBondContact O-N 3.39Å; Q81-E83 VanDerWaalsContact C-N 3.26Å; Q81-E83 PolarHBondContact O-N 3.16Å
82R52.6Low60.9Low205 Ų205135.6 Ų135.677%0.77471%0.712SS**  trans-52.7109.1166-75.3178.9175.2160.2-1.2101.8T80 T84T80-R82 PolarHBondContact O-N 3.47Å; R82-T84 PolarHBondContact O-N 2.95Å
83E56Low61Low180 Ų180135.6 Ų135.684%0.84171%0.714SS**  trans-52.2100171.6-164.4164.3-160.200104.7Q81 R85Q81-E83 VanDerWaalsContact C-N 3.26Å; Q81-E83 PolarHBondContact O-N 3.16Å; E83-R85 PolarHBondContact O-N 3.33Å
84T53.5Low61Low125 Ų125138.4 Ų138.477%0.76772%0.719SS**  trans-69.590.6-176.434.50000103.7R82 E86R82-T84 PolarHBondContact O-N 2.95Å; T84-E86 PolarHBondContact O-N 2.99Å
85R61.1Low61.1Low222 Ų222143.1 Ų143.184%0.83873%0.726SS**  trans-46.9128.2160.8-66.1-177.2174.6-174.8-2.7105.3E83 S87E83-R85 PolarHBondContact O-N 3.33Å; R85-S87 PolarHBondContact O-N 3.46Å
86E59.3Low61.5Low197 Ų197144 Ų14492%0.92174%0.735SS**  trans-6070172.2-71.3-84.3164.300108.8T84T84-E86 PolarHBondContact O-N 2.99Å
87S68Low61.9Low93 Ų93146.6 Ų146.665%0.6574%0.742SS**  trans-91107.2173.764.90000106.6R85 L89R85-S87 PolarHBondContact O-N 3.46Å; S87-L89 PolarHBondContact O-N 3.4Å
88V69.6Low61.8Low110 Ų110148.1 Ų148.167%0.66776%0.755SS**  trans-56.4109.8171176.50000107.9H90V88-H90 PolarHBondContact O-N 2.9Å
89L68.6Low62Low145 Ų145144.5 Ų144.576%0.75974%0.744SS**  trans-73.492.7176.7-157.795000107.7S87 Q91S87-L89 PolarHBondContact O-N 3.4Å; L89-Q91 PolarHBondContact O-N 2.94Å
90H68.8Low62.4Low164 Ų164150.8 Ų150.876%0.75977%0.767SS**  trans-66.3104.6171.2-68.5-68.5000108.5V88 P92V88-H90 PolarHBondContact O-N 2.9Å; H90-P92 WeakPolarHBondContact O-CD 3.45Å
91Q72.9Confident62.4Low164 Ų164148.4 Ų148.477%0.76677%0.765SS**  trans-64.1126.5168.7-71.1-170.2-8.800108.1L89 Q93L89-Q91 PolarHBondContact O-N 2.94Å; Q91-Q93 PolarHBondContact O-N 3.35Å
92P71Confident62.5Low110 Ų110147.6 Ų147.671%0.71476%0.761SS**  trans-59.9126.9173.323.1-30.8000108.6H90 R94H90-P92 WeakPolarHBondContact O-CD 3.45Å; P92-R94 PolarHBondContact O-N 3.44Å
93Q72.6Confident62.6Low155 Ų155142.7 Ų142.772%0.72476%0.764SS**  trans-60.2105.4-178.6-174158.78.600109.6Q91 F95Q91-Q93 PolarHBondContact O-N 3.35Å; Q93-F95 HydrophobicContact CB-CE2 4.39Å; Q93-F95 HydrophobicContact CG-CE1 4.22Å; Q93-F95 HydrophobicContact CG-CE2 4.14Å; Q93-F95 HydrophobicContact CG-CZ 3.94Å; Q93-F95 PolarHBondContact O-N 2.82Å; Q93-F95 VanDerWaalsContact O-N 3.13Å
94R65.8Low62.5Low179 Ų179139.3 Ų139.368%0.67576%0.756SS**  trans-80.894.2177.3-78.3-176.2168.8-116.47.2109.2P92 R97P92-R94 PolarHBondContact O-N 3.44Å; R94-R97 HydrophobicContact CB-CG 4.42Å; R94-R97 VanDerWaalsContact CD-NH1 3.34Å
95F67.3Low62.5Low173 Ų173140.4 Ų140.476%0.75976%0.756SS**THydrogen-bonded Turntrans-61.6138.6166-64.2-75.4000110.1Q93Q93-F95 HydrophobicContact CB-CE2 4.39Å; Q93-F95 HydrophobicContact CG-CE1 4.22Å; Q93-F95 HydrophobicContact CG-CE2 4.14Å; Q93-F95 HydrophobicContact CG-CZ 3.94Å; Q93-F95 PolarHBondContact O-N 2.82Å; Q93-F95 VanDerWaalsContact O-N 3.13Å
96G65.4Low62.2Low77 Ų77138.1 Ų138.179%0.79476%0.755SS**THydrogen-bonded Turntrans92.816.2173.500000117.1
97R63.1Low62Low170 Ų170136.1 Ų136.164%0.64275%0.751SS**  trans-112.366.1175.8-63.1-176.582.4169.512.2112.4R94R94-R97 HydrophobicContact CB-CG 4.42Å; R94-R97 VanDerWaalsContact CD-NH1 3.34Å
98S53.4Low61.3Low121 Ų121138.6 Ų138.685%0.84675%0.752SS**  trans-117.655.9160.463.30000109.4
99S58.2Low60.7Low100 Ų100140.5 Ų140.570%0.69976%0.757SS**SBendtrans-143.7134.9158.762.40000107.3G101S99-G101 PolarHBondContact O-N 2.96Å
100N60.6Low60.5Low176 Ų176140.5 Ų140.594%0.94175%0.753SS**  trans-61.779.9-172.5-59.7-37.2000111.1Q102N100-Q102 PolarHBondContact O-N 2.86Å
101G52.8Low60.3Low64 Ų64138 Ų13866%0.6675%0.751SS**  trans-77.191.817900000109.5S99 A103S99-G101 PolarHBondContact O-N 2.96Å; G101-A103 PolarHBondContact O-N 3.19Å
102Q51.5Low59.9Low170 Ų170139.4 Ų139.479%0.79475%0.75SS**  trans-31.4132.2160.3-168155.1-59.400110.2N100 V104N100-Q102 PolarHBondContact O-N 2.86Å; Q102-V104 VanDerWaalsContact C-N 3.28Å; Q102-V104 WeakPolarHBondContact O-CG2 3.46Å; Q102-V104 PolarHBondContact O-N 3.23Å
103A56.2Low59.5Low101 Ų101140.1 Ų140.184%0.83575%0.747SS**  trans-57.893.7174.300000108.8G101 L105G101-A103 PolarHBondContact O-N 3.19Å; A103-L105 PolarHBondContact O-N 3.34Å
104V53.3Low58.9Low110 Ų110142 Ų14267%0.66775%0.748SS**  trans-73.8113174.4177.80000105.4Q102 E106Q102-V104 VanDerWaalsContact C-N 3.28Å; Q102-V104 WeakPolarHBondContact O-CG2 3.46Å; Q102-V104 PolarHBondContact O-N 3.23Å; V104-E106 PolarHBondContact O-N 2.62Å
105L53.2Low58.6Low148 Ų148142.8 Ų142.878%0.77576%0.759SS**  trans-39.8126.6168.5-96.4137000109.9A103 D107A103-L105 PolarHBondContact O-N 3.34Å; L105-D107 PolarHBondContact O-N 3.31Å
106E54.2Low58.2Low174 Ų174138.1 Ų138.181%0.81375%0.753SS**THydrogen-bonded Turntrans-51.8-3.8179.6-125.179.5-174.400115.4V104 Q108V104-E106 PolarHBondContact O-N 2.62Å; E106-Q108 PolarHBondContact O-N 3.13Å
107D54.9Low57.9Low154 Ų154136.3 Ų136.382%0.82473%0.73SS**THydrogen-bonded Turntrans-90.55.4-171.1-149.728.6000114L105L105-D107 PolarHBondContact O-N 3.31Å
108Q54.6Low57.8Low145 Ų145131.7 Ų131.768%0.67872%0.722SS**  trans-125.453.7-180-138.3-179.9110.500111.6E106 Q110E106-Q108 PolarHBondContact O-N 3.13Å; Q108-Q110 PolarHBondContact O-N 3.14Å
109I57.2Low58.2Low151 Ų151128.3 Ų128.377%0.77471%0.707SS**  trans-71.388.3165.8-56.3174.9000107
110Q64.5Low58.3Low144 Ų144130.3 Ų130.367%0.67371%0.705SS**  trans-58129.6168.7-73.9-179.810.400108.4Q108 R112Q108-Q110 PolarHBondContact O-N 3.14Å; Q110-R112 PolarHBondContact O-N 3.22Å
111P63.5Low58.5Low112 Ų112126.4 Ų126.473%0.72768%0.683SS**  trans-58.3118.7169.524.7-31.2000107.3D113P111-D113 PolarHBondContact O-N 3.12Å
112R64.4Low58.9Low193 Ų193133.2 Ų133.273%0.72869%0.689SS**  trans-63.1109.4172.9-90.2-170.9-178-140.60.9107.8Q110 W114Q110-R112 PolarHBondContact O-N 3.22Å; R112-W114 VanDerWaalsContact C-N 3.28Å; R112-W114 VanDerWaalsContact O-CD1 3.24Å; R112-W114 PolarHBondContact O-N 3.42Å
113D62.9Low59.4Low125 Ų125129.4 Ų129.467%0.66868%0.681SS**  trans-66.190.5164.6-79.6-23.4000108.7P111 E115 A116P111-D113 PolarHBondContact O-N 3.12Å; D113-E115 PolarHBondContact O-N 3.29Å; D113-A116 HydrophobicContact CB-CB 4.45Å; D113-A116 PolarHBondContact O-N 2.81Å; D113-A116 VanDerWaalsContact O-N 3.16Å
114W59.8Low59.7Low195 Ų195131.1 Ų131.174%0.73967%0.674SS**G310 helixtrans-64.3-14.8174.7-72.3102.3000112.7R112 A116R112-W114 VanDerWaalsContact C-N 3.28Å; R112-W114 VanDerWaalsContact O-CD1 3.24Å; R112-W114 PolarHBondContact O-N 3.42Å; W114-A116 VanDerWaalsContact C-N 3.3Å
115E59.1Low60.5Low195 Ų195129.4 Ų129.491%0.91167%0.671SS**G310 helixtrans-71.8-21.1173.4-100.9171.4163.400113.7D113D113-E115 PolarHBondContact O-N 3.29Å
116A58.7Low61.2Low75 Ų75127.3 Ų127.362%0.6266%0.664SS**G310 helixtrans-97.814.1178.900000113.1D113 W114 P118D113-A116 HydrophobicContact CB-CB 4.45Å; D113-A116 PolarHBondContact O-N 2.81Å; D113-A116 VanDerWaalsContact O-N 3.16Å; W114-A116 VanDerWaalsContact C-N 3.3Å; A116-P118 WeakPolarHBondContact O-CD 3.3Å
117A59.4Low61.9Low39 Ų39124.1 Ų124.132%0.32266%0.658SS.*  trans-58.6112.8173.800000108.4G119A117-G119 PolarHBondContact O-N 3.43Å; A117-G119 VanDerWaalsContact O-N 3.15Å
118P60.9Low62.8Low73 Ų73124 Ų12447%0.47465%0.653SS.*  trans-60.8127.6-172.717.1-24.7000108.1A116 Q120 I121A116-P118 WeakPolarHBondContact O-CD 3.3Å; P118-Q120 HydrophobicContact CB-CB 4.37Å; P118-Q120 PolarHBondContact O-N 2.88Å; P118-I121 HydrophobicContact CG-CD1 3.92Å; P118-I121 HydrophobicContact CG-CG1 4.05Å; P118-I121 PolarHBondContact O-N 3.01Å
119G62.2Low63.6Low50 Ų50127.6 Ų127.652%0.51566%0.66SS.*Hα-helixtrans-52.1-20.2178.700000112.9A117 I121 W122 S123A117-G119 PolarHBondContact O-N 3.43Å; A117-G119 VanDerWaalsContact O-N 3.15Å; G119-I121 VanDerWaalsContact C-N 3.29Å; G119-I121 PolarHBondContact O-N 3.32Å; G119-W122 PolarHBondContact O-N 2.61Å; G119-W122 VanDerWaalsContact O-N 3.14Å; G119-S123 PolarHBondContact O-N 3.36Å; G119-S123 PolarHBondContact O-OG 3.07Å; G119-S123 VanDerWaalsContact O-OG 3.07Å
120Q60.8Low64.3Low143 Ų143128.3 Ų128.367%0.66866%0.658SS**Hα-helixtrans-56.1-32170.1-159.8167.2-2.400114.5P118 S123 M124P118-Q120 HydrophobicContact CB-CB 4.37Å; P118-Q120 PolarHBondContact O-N 2.88Å; Q120-S123 PolarHBondContact O-N 3.28Å; Q120-M124 WeakPolarHBondContact O-CG 3.27Å; Q120-M124 PolarHBondContact O-N 3.09Å
121I64.3Low64.4Low94 Ų94124.8 Ų124.848%0.48266%0.66SS.*Hα-helixtrans-66.1-42.6175.1-62.7173.7000110.3P118 G119 S123 M124 A125P118-I121 HydrophobicContact CG-CD1 3.92Å; P118-I121 HydrophobicContact CG-CG1 4.05Å; P118-I121 PolarHBondContact O-N 3.01Å; G119-I121 VanDerWaalsContact C-N 3.29Å; G119-I121 PolarHBondContact O-N 3.32Å; I121-S123 VanDerWaalsContact C-N 3.34Å; I121-M124 PolarHBondContact O-N 3.3Å; I121-A125 PolarHBondContact O-N 3.36Å; I121-A125 VanDerWaalsContact O-N 3.17Å
122W60.5Low64.4Low206 Ų206128.8 Ų128.878%0.7867%0.666SS**Hα-helixtrans-71.7-33.6179-63.769000110.9G119 M124 A125G119-W122 PolarHBondContact O-N 2.61Å; G119-W122 VanDerWaalsContact O-N 3.14Å; W122-M124 VanDerWaalsContact C-N 3.29Å; W122-M124 PolarHBondContact O-N 3.12Å; W122-A125 WeakPolarHBondContact O-CB 3.37Å; W122-A125 PolarHBondContact O-N 3.43Å
123S62.7Low64.2Low90 Ų90132.8 Ų132.863%0.62969%0.689SS**Hα-helixtrans-68.4-23.5172.4-55.40000113.9G119 Q120 I121G119-S123 PolarHBondContact O-N 3.36Å; G119-S123 PolarHBondContact O-OG 3.07Å; G119-S123 VanDerWaalsContact O-OG 3.07Å; Q120-S123 PolarHBondContact O-N 3.28Å; I121-S123 VanDerWaalsContact C-N 3.34Å
124M63.3Low64.3Low138 Ų138133.2 Ų133.268%0.6869%0.69SS**Hα-helixtrans-87.3-15.3172.4-70.7-170.4-5300112.9Q120 I121 W122 V126Q120-M124 WeakPolarHBondContact O-CG 3.27Å; Q120-M124 PolarHBondContact O-N 3.09Å; I121-M124 PolarHBondContact O-N 3.3Å; W122-M124 VanDerWaalsContact C-N 3.29Å; W122-M124 PolarHBondContact O-N 3.12Å; M124-V126 PolarHBondContact O-N 3.29Å
125A69.1Low64.5Low73 Ų73129.9 Ų129.960%0.60369%0.687SS**  trans-77.447.5174.100000111.5I121 W122 P127I121-A125 PolarHBondContact O-N 3.36Å; I121-A125 VanDerWaalsContact O-N 3.17Å; W122-A125 WeakPolarHBondContact O-CB 3.37Å; W122-A125 PolarHBondContact O-N 3.43Å; A125-P127 WeakPolarHBondContact O-CD 3.4Å
126V68.5Low64.8Low105 Ų105126.3 Ų126.364%0.63668%0.675SS**  trans-76.5122.1170.5-1790000107.4M124 Q128M124-V126 PolarHBondContact O-N 3.29Å; V126-Q128 PolarHBondContact O-N 3.18Å; V126-Q128 VanDerWaalsContact O-N 3.14Å
127P68.1Low65.2Low106 Ų106129.3 Ų129.369%0.68868%0.678SS**  trans-54.9124.2173.8-2332.6000109.3A125 R129A125-P127 WeakPolarHBondContact O-CD 3.4Å; P127-R129 PolarHBondContact O-N 3.46Å
128Q74.3Confident65.6Low153 Ų153134.9 Ų134.972%0.71570%0.7SS**  trans-58.1106.2175.8-175.8174.32.500108.3V126 F130V126-Q128 PolarHBondContact O-N 3.18Å; V126-Q128 VanDerWaalsContact O-N 3.14Å; Q128-F130 HydrophobicContact CG-CE2 4.27Å; Q128-F130 HydrophobicContact CG-CZ 4.49Å; Q128-F130 PolarHBondContact O-N 2.98Å
129R72Confident65.9Low219 Ų219139.1 Ų139.183%0.82672%0.715SS**  trans-73.795.9176.9-70.6-177.9173-109.11.9107.8P127 G131P127-R129 PolarHBondContact O-N 3.46Å; R129-G131 PolarHBondContact O-N 3Å
130F72.1Confident66.1Low167 Ų167145.4 Ų145.473%0.73273%0.729SS**  trans-59.1136.4162.5-73.1-84000108.4Q128Q128-F130 HydrophobicContact CG-CE2 4.27Å; Q128-F130 HydrophobicContact CG-CZ 4.49Å; Q128-F130 PolarHBondContact O-N 2.98Å
131G67Low66.5Low69 Ų69145.6 Ų145.671%0.71173%0.734SS**  trans-42.7141.7-163.200000115.1R129 K133R129-G131 PolarHBondContact O-N 3Å; G131-K133 PolarHBondContact O-N 3.34Å
132K62.1Low66.7Low196 Ų196149.9 Ų149.985%0.85276%0.755SS**  trans-59.4133163.6-70.2-166.3175.8-173.60108.1
133K61.4Low67.3Low277 Ų277144.8 Ų144.8100%1.20475%0.753SS**  trans-62.60164.2-66.8-176.3179.3-177.10110.1G131G131-K133 PolarHBondContact O-N 3.34Å

Retrieved 133 of 133 residues in 184.1 ms (Link to these results)