A0A096MAM4_POEFO Loading...

Goosecoid homeobox 2

AlphaFold DB , UniProt , Accession A0A096MAM4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 145 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
1K46.8Very low65.3Low266 Ų266163.9 Ų163.9100%1.15776%0.755SS**  0109.50-76.2175.5173.1172.40106.9
2M45.5Very low66.4Low195 Ų195162.3 Ų162.396%0.96175%0.749SS**  trans-86.1120.6174.3-72.7-175.2177.600108.2R4M2-R4 PolarHBondContact O-N 3.26Å
3E57.2Low67.3Low179 Ų179153.3 Ų153.384%0.83671%0.71SS**  trans-74.1117177.4-168.5174.9115.200108.9Q5E3-Q5 PolarHBondContact O-N 3.47Å; E3-Q5 VanDerWaalsContact O-N 3.11Å
4R63.9Low68.2Low240 Ų240147.5 Ų147.591%0.90669%0.685SS**  trans-70.3105.7171.6-89.3-179.7157.5145.7-5107.8M2 K6M2-R4 PolarHBondContact O-N 3.26Å; R4-K6 PolarHBondContact O-N 2.88Å; R4-K6 VanDerWaalsContact O-N 3.12Å
5Q69.4Low68.9Low138 Ų138145.5 Ų145.565%0.64568%0.68SS**  trans-60.7115.9171.3-68.1-162.79.200109.2E3 F7E3-Q5 PolarHBondContact O-N 3.47Å; E3-Q5 VanDerWaalsContact O-N 3.11Å; Q5-F7 HydrophobicContact CB-CD2 4.25Å; Q5-F7 HydrophobicContact CB-CE2 3.73Å; Q5-F7 HydrophobicContact CB-CZ 4.1Å; Q5-F7 PolarHBondContact O-N 3.49Å; Q5-F7 VanDerWaalsContact O-N 3.14Å
6K67.9Low69.2Low205 Ų205144.9 Ų144.989%0.89168%0.683SS**  trans-75.596.5170.5-82.9-179.5175.2179.90107.7R4 P8R4-K6 PolarHBondContact O-N 2.88Å; R4-K6 VanDerWaalsContact O-N 3.12Å; K6-P8 VanDerWaalsContact O-CD 3.31Å; K6-P8 WeakPolarHBondContact O-CD 3.49Å
7F66.6Low69.3Low113 Ų113143.4 Ų143.450%0.49667%0.674SS.*  trans-77118.7167.4-70.4-76.5000108.6Q5 F9Q5-F7 HydrophobicContact CB-CD2 4.25Å; Q5-F7 HydrophobicContact CB-CE2 3.73Å; Q5-F7 HydrophobicContact CB-CZ 4.1Å; Q5-F7 PolarHBondContact O-N 3.49Å; Q5-F7 VanDerWaalsContact O-N 3.14Å; F7-F9 PolarHBondContact O-N 3.13Å
8P72.3Confident68.8Low77 Ų77142.9 Ų142.950%0.567%0.666SS.*  trans-65.1132.3171.725.8-32000109.1K6 T10 N13K6-P8 VanDerWaalsContact O-CD 3.31Å; K6-P8 WeakPolarHBondContact O-CD 3.49Å; P8-T10 HydrophobicContact CB-CG2 4.4Å; P8-T10 PolarHBondContact O-N 2.96Å; P8-N13 WeakPolarHBondContact CD-ND2 3.47Å; P8-N13 PolarHBondContact O-ND2 2.91Å; P8-N13 VanDerWaalsContact O-ND2 3.08Å
9F71.3Confident68.1Low196 Ų196141.6 Ų141.686%0.8667%0.671SS**  trans-81.555.5178-160.2-96000110F7 I14F7-F9 PolarHBondContact O-N 3.13Å; F9-I14 HydrophobicContact CE2-CD1 4.3Å; F9-I14 HydrophobicContact CZ-CD1 4.32Å
10T82.4Confident67.4Low61 Ų61140 Ų14037%0.37468%0.676SS.*  trans-95.8145.5171.859.50000109.3P8 E12 N13 I14P8-T10 HydrophobicContact CB-CG2 4.4Å; P8-T10 PolarHBondContact O-N 2.96Å; T10-E12 PolarHBondContact O-N 3.12Å; T10-N13 PolarHBondContact O-N 3.4Å; T10-N13 VanDerWaalsContact O-N 3.1Å; T10-N13 WeakPolarHBondContact OG1-CB 3.36Å; T10-I14 PolarHBondContact O-N 3.34Å
11I75.4Confident66.5Low133 Ų133139.2 Ų139.268%0.68268%0.684SS**Hα-helixtrans-55.4-41.5179.9-63.8170.7000110.2N13 I14 L15I11-N13 VanDerWaalsContact C-N 3.35Å; I11-N13 PolarHBondContact O-N 3.18Å; I11-I14 PolarHBondContact O-N 3.09Å; I11-L15 HydrophobicContact CG2-CD1 3.87Å; I11-L15 HydrophobicContact CG2-CG 4.3Å; I11-L15 WeakPolarHBondContact O-CG 3.44Å; I11-L15 PolarHBondContact O-N 3.1Å
12E78.6Confident66.6Low145 Ų145134.2 Ų134.268%0.67867%0.669SS**Hα-helixtrans-57.9-42.9177.9-62.6162.9175.600112.9T10 I14 L15 N16T10-E12 PolarHBondContact O-N 3.12Å; E12-I14 VanDerWaalsContact C-N 3.32Å; E12-I14 PolarHBondContact O-N 2.84Å; E12-L15 PolarHBondContact O-N 3.2Å; E12-N16 WeakPolarHBondContact O-CB 3.46Å; E12-N16 PolarHBondContact O-N 3.48Å
13N77.4Confident66.6Low45 Ų45128.5 Ų128.524%0.24166%0.66CS.*Hα-helixtrans-72.7-28.8-177.4-159.436.8000112P8 T10 I11 K17P8-N13 WeakPolarHBondContact CD-ND2 3.47Å; P8-N13 PolarHBondContact O-ND2 2.91Å; P8-N13 VanDerWaalsContact O-ND2 3.08Å; T10-N13 PolarHBondContact O-N 3.4Å; T10-N13 VanDerWaalsContact O-N 3.1Å; T10-N13 WeakPolarHBondContact OG1-CB 3.36Å; I11-N13 VanDerWaalsContact C-N 3.35Å; I11-N13 PolarHBondContact O-N 3.18Å; N13-K17 PolarHBondContact O-N 3.42Å
14I80.8Confident65.4Low72 Ų72123.6 Ų123.637%0.36966%0.657SS.*Hα-helixtrans-71.2-47.7173.2-62.6168.7000109.7F9 T10 I11 E12 N16 K17 Y18F9-I14 HydrophobicContact CE2-CD1 4.3Å; F9-I14 HydrophobicContact CZ-CD1 4.32Å; T10-I14 PolarHBondContact O-N 3.34Å; I11-I14 PolarHBondContact O-N 3.09Å; E12-I14 VanDerWaalsContact C-N 3.32Å; E12-I14 PolarHBondContact O-N 2.84Å; I14-N16 VanDerWaalsContact C-N 3.32Å; I14-N16 PolarHBondContact O-N 2.99Å; I14-K17 PolarHBondContact O-N 3.01Å; I14-Y18 WeakPolarHBondContact O-CD2 3.45Å
15L78.8Confident64.5Low117 Ų117122.1 Ų122.161%0.61366%0.658SS**Hα-helixtrans-63.4-38.1179.7-65.8175.7000111.9I11 E12 K17 Y18I11-L15 HydrophobicContact CG2-CD1 3.87Å; I11-L15 HydrophobicContact CG2-CG 4.3Å; I11-L15 WeakPolarHBondContact O-CG 3.44Å; I11-L15 PolarHBondContact O-N 3.1Å; E12-L15 PolarHBondContact O-N 3.2Å; L15-K17 VanDerWaalsContact C-N 3.28Å; L15-K17 PolarHBondContact O-N 3.35Å; L15-Y18 PolarHBondContact O-N 3.22Å
16N73.4Confident62.8Low136 Ų136124.2 Ų124.273%0.72767%0.667SS**Hα-helixtrans-68.6-19.8176.8-81.8-13.6000114.5E12 I14 Y18E12-N16 WeakPolarHBondContact O-CB 3.46Å; E12-N16 PolarHBondContact O-N 3.48Å; I14-N16 VanDerWaalsContact C-N 3.32Å; I14-N16 PolarHBondContact O-N 2.99Å; N16-Y18 PolarHBondContact O-N 3.46Å
17K70.6Confident61.6Low119 Ų119120 Ų12052%0.51766%0.66SS.*THydrogen-bonded Turntrans-75.5-14.1174-80.9-171.7-174.8-670113.2N13 I14 L15 P19N13-K17 PolarHBondContact O-N 3.42Å; I14-K17 PolarHBondContact O-N 3.01Å; L15-K17 VanDerWaalsContact C-N 3.28Å; L15-K17 PolarHBondContact O-N 3.35Å; K17-P19 WeakPolarHBondContact O-CD 3.4Å
18Y60.6Low60.1Low136 Ų136121 Ų12153%0.53368%0.68SS.*SBendtrans-102.2106.8175.3-72.7-82.9000109.2I14 L15 N16 S20I14-Y18 WeakPolarHBondContact O-CD2 3.45Å; L15-Y18 PolarHBondContact O-N 3.22Å; N16-Y18 PolarHBondContact O-N 3.46Å; Y18-S20 PolarHBondContact O-N 3.02Å; Y18-S20 VanDerWaalsContact O-N 3.12Å
19P55.5Low58.4Low117 Ų117120.5 Ų120.576%0.7669%0.689SS**  trans-61122.6167.425.5-29.7000107.2K17 S21K17-P19 WeakPolarHBondContact O-CD 3.4Å; P19-S21 PolarHBondContact O-N 3.26Å
20S54Low56.7Low110 Ų110117.6 Ų117.677%0.76969%0.687SS**  trans-57.8101.1172-62.60000108.1Y18 I22Y18-S20 PolarHBondContact O-N 3.02Å; Y18-S20 VanDerWaalsContact O-N 3.12Å; S20-I22 PolarHBondContact O-N 2.92Å
21S49Very low54.7Low123 Ų123125.7 Ų125.786%0.8671%0.711SS**  trans-71.187.2172-179.30000108.4P19P19-S21 PolarHBondContact O-N 3.26Å
22I47.3Very low52.8Low161 Ų161125.1 Ų125.183%0.82671%0.713SS**  trans-110.7115160.3-64.3179.7000106.1S20S20-I22 PolarHBondContact O-N 2.92Å
23G45.8Very low50.7Low76 Ų76126.2 Ų126.278%0.78472%0.723SS**  trans136.269.9158.300000116.4
24G32.4Very low48.8Very low75 Ų75127.6 Ų127.677%0.77375%0.748SS**  trans-144.574.8165.800000110.9H26G24-H26 PolarHBondContact O-N 3.21Å
25K44.6Very low46.8Very low210 Ų210132.8 Ų132.891%0.91378%0.776SS**  trans-66.7116.8168.1-68.3-179177.8177.90108.2
26H33.8Very low44.9Very low182 Ų182135.6 Ų135.684%0.84378%0.783SS**  trans-117.4118.5162.8-132.5-87.6000108.2G24 C28G24-H26 PolarHBondContact O-N 3.21Å; H26-C28 PolarHBondContact O-N 3.18Å
27P44Very low43.1Very low116 Ų116135.5 Ų135.575%0.75378%0.778SS**  trans-83.1112.6176.131.7-26.6000108G29P27-G29 PolarHBondContact O-N 3.35Å
28C34.3Very low41.3Very low133 Ų133137.8 Ų137.890%0.89979%0.788SS**  trans-94.284.8161.8-167.90000107.9H26H26-C28 PolarHBondContact O-N 3.18Å
29G36.9Very low40.3Very low67 Ų67139.8 Ų139.869%0.69180%0.804SS**  trans-112.6104.5165.800000108.9P27P27-G29 PolarHBondContact O-N 3.35Å
30T34.3Very low39.1Very low135 Ų135140 Ų14083%0.82880%0.803SS**  trans-133.8102157.5-55.30000108
31R40.8Very low38.5Very low232 Ų232140.7 Ų140.788%0.87581%0.806SS**  trans-80.6153155.2-45179.7-152.4-130.43.3105.2
32V36.2Very low37.8Very low120 Ų120140.8 Ų140.873%0.72780%0.804SS**  -170.7142.250.7-174.70000104.2
33L35.2Very low37.2Very low168 Ų168141.2 Ų141.288%0.8880%0.803SS**  -173.2133.992-86.6163.7000109.8
34G36.9Very low37.3Very low74 Ų74140.6 Ų140.676%0.76379%0.785SS**  trans-75.2137.8-176.800000113.1
35L38.5Very low37.9Very low182 Ų182144.2 Ų144.295%0.95379%0.791SS**  trans-127.1142.2143.2-84.5171.1000108
36K38.2Very low37.8Very low175 Ų175141.7 Ų141.776%0.76178%0.783SS**  trans-88.4147.9-160.3179.5176.7138.9-179.50110.5
37E36.1Very low38.3Very low134 Ų134141.7 Ų141.763%0.62678%0.783SS**  trans69.7136.5160.1-93.9174.995.500115.5
38K33.8Very low38.6Very low167 Ų167140.1 Ų140.173%0.72678%0.779SS**  cis-157149.524.7-66.2-163.9165.3-170.80111.7
39M38.4Very low39.3Very low178 Ų178137.3 Ų137.388%0.87776%0.761SS**  trans61142.1133.5-153.7145.9179.700121.8
40V31.3Very low40.3Very low121 Ų121142.6 Ų142.673%0.73377%0.772SS**  trans99.8106.3163.1-170.50000114.6
41C41.1Very low41.1Very low125 Ų125141.4 Ų141.485%0.84577%0.768SS**  trans-63.7142.4160.1-69.10000109.9
42P33.8Very low41.5Very low125 Ų125134.4 Ų134.481%0.81275%0.753SS**  trans-116.3127.9143.313.66.4000110.9
43E35.4Very low42.3Very low171 Ų171133.7 Ų133.780%0.79975%0.753SS**  trans-69-175.7164.1-138.3-98.314800110.7
44P46.7Very low43.1Very low62 Ų62130.5 Ų130.540%0.40373%0.732SS.*  -84.3159.6-83.532.5-16.7000112.8H46P44-H46 WeakPolarHBondContact CG-NE2 3.23Å; P44-H46 PolarHBondContact O-CD2 3.42Å; P44-H46 PolarHBondContact O-N 2.94Å
45V45.2Very low43.9Very low151 Ų151130 Ų13092%0.91572%0.716SS**  trans-70.389.8173.7-1650000108.9H47V45-H47 PolarHBondContact O-N 3.44Å
46H43.9Very low44.3Very low157 Ų157126.9 Ų126.973%0.72771%0.71SS**  trans-68.3118.2173.3-82.4-97.6000109.7P44 A48P44-H46 WeakPolarHBondContact CG-NE2 3.23Å; P44-H46 PolarHBondContact O-CD2 3.42Å; P44-H46 PolarHBondContact O-N 2.94Å; H46-A48 PolarHBondContact O-N 3.06Å; H46-A48 VanDerWaalsContact O-N 3.13Å
47H43.4Very low44.7Very low183 Ų183127.1 Ų127.185%0.84771%0.713SS**  trans-56.4112.1177.1-143.5-89.4000109.9V45 C49V45-H47 PolarHBondContact O-N 3.44Å; H47-C49 PolarHBondContact O-N 3.17Å
48A50.5Low45.2Very low82 Ų82125.3 Ų125.368%0.67871%0.714SS**  trans-64.8102.5173.800000108.8H46 L50H46-A48 PolarHBondContact O-N 3.06Å; H46-A48 VanDerWaalsContact O-N 3.13Å; A48-L50 PolarHBondContact O-N 3.45Å
49C48.1Very low45.8Very low75 Ų75121.3 Ų121.351%0.50771%0.712SS.*  trans-73.994.3178.4-172.60000109.5H47 C51 C52H47-C49 PolarHBondContact O-N 3.17Å; C49-C51 PolarHBondContact O-N 3.24Å; C49-C52 HydrophobicContact CB-CB 4.09Å; C49-C52 PolarHBondContact O-N 2.87Å; C49-C52 PolarHBondContact SG-N 3.31Å
50L58.1Low46.1Very low178 Ų178120.4 Ų120.493%0.93271%0.711SS**THydrogen-bonded Turntrans-63.2-1.1171.2-77.6146.2000113.7A48A48-L50 PolarHBondContact O-N 3.45Å
51C51.8Low47Very low109 Ų109122.2 Ų122.274%0.73671%0.713SS**THydrogen-bonded Turntrans-110.1-9-179.8-176.20000113.3C49 C53C49-C51 PolarHBondContact O-N 3.24Å; C51-C53 PolarHBondContact O-N 3.39Å
52C48.3Very low47.2Very low85 Ų85123.2 Ų123.257%0.57471%0.71SS**  trans-87.476-179.2-88.90000111.4C49 F54C49-C52 HydrophobicContact CB-CB 4.09Å; C49-C52 PolarHBondContact O-N 2.87Å; C49-C52 PolarHBondContact SG-N 3.31Å; C52-F54 PolarHBondContact O-N 3.33Å
53C53.3Low47.8Very low106 Ų106125 Ų12572%0.71671%0.707SS**  trans-66.99.2171.1-63.10000114.2C51C51-C53 PolarHBondContact O-N 3.39Å
54F52.9Low48.3Very low101 Ų101121.2 Ų121.244%0.44370%0.699SS.*  trans-157.265.2-170-75.7-62.5000115.3C52 R105 R107C52-F54 PolarHBondContact O-N 3.33Å; F54-R105 WeakPolarHBondContact CE1-O 3.35Å; F54-R107 HydrophobicContact CB-CB 3.82Å; F54-R107 HydrophobicContact CB-CG 3.94Å; F54-R107 HydrophobicContact CD1-CB 3.2Å; F54-R107 HydrophobicContact CD1-CG 3.88Å; F54-R107 HydrophobicContact CD2-CB 3.6Å; F54-R107 HydrophobicContact CD2-CG 3.21Å; F54-R107 HydrophobicContact CE1-CB 3.5Å; F54-R107 VanDerWaalsContact CE1-CB 3.5Å; F54-R107 HydrophobicContact CE1-CG 4.15Å; F54-R107 HydrophobicContact CE2-CB 3.79Å; F54-R107 HydrophobicContact CE2-CG 3.45Å; F54-R107 VanDerWaalsContact CE2-CG 3.45Å; F54-R107 HydrophobicContact CG-CB 3.24Å; F54-R107 HydrophobicContact CG-CG 3.39Å; F54-R107 HydrophobicContact CZ-CB 3.72Å; F54-R107 HydrophobicContact CZ-CG 3.89Å; F54-R107 VanDerWaalsContact CZ-N 3.34Å
55C52.1Low48.3Very low64 Ų64124.5 Ų124.543%0.43271%0.713SS.*  trans-116.3121.4157.5-169.80000108.4H57 C58C55-H57 PolarHBondContact O-N 2.97Å; C55-H57 VanDerWaalsContact O-N 3.09Å; C55-C58 PolarHBondContact O-N 3.12Å
56S48.5Very low48.5Very low116 Ų116124.5 Ų124.581%0.81171%0.707SS**THydrogen-bonded Turntrans-65.9-3.7173.3-40.80000113
57H46.1Very low48.6Very low179 Ų179124.4 Ų124.483%0.82971%0.71SS**THydrogen-bonded Turntrans-102.7-1.3179.5-91.685.1000114.7C55C55-H57 PolarHBondContact O-N 2.97Å; C55-H57 VanDerWaalsContact O-N 3.09Å
58C46.3Very low48.7Very low96 Ų96122.4 Ų122.465%0.64970%0.701SS**SBendtrans-100.67.2177.6-60.70000113.4C55C55-C58 PolarHBondContact O-N 3.12Å
59A45.8Very low48.6Very low84 Ų84125.5 Ų125.569%0.69471%0.706SS**SBendtrans-78-20.2-172.700000114.5
60D46.3Very low48.4Very low159 Ų159125.9 Ų125.985%0.8572%0.715SS**SBendtrans-100.3-4.3-171-75.5-31.7000115.8
61M50.3Low47.8Very low159 Ų159121.1 Ų121.178%0.78370%0.696SS**SBendtrans-146.189.9173.9-79.5-142.379.100111.7
62L44.5Very low47.7Very low146 Ų146124.4 Ų124.476%0.76470%0.7SS**  168.6100123.1-85.3152.4000109.5S64L62-S64 PolarHBondContact O-N 2.82Å; L62-S64 VanDerWaalsContact O-N 3.16Å
63H46Very low48.1Very low163 Ų163127.7 Ų127.776%0.75570%0.702SS**  trans-64.5104.6152.8-152.7-112.6000106.2D65H63-D65 IonicContact CE1-OD1 3.43Å; H63-D65 PolarHBondContact CE1-OD1 2.89Å; H63-D65 IonicContact CE1-OD2 2.84Å; H63-D65 PolarHBondContact CE1-OD2 3.43Å; H63-D65 VanDerWaalsContact ND1-CG 3.33Å; H63-D65 IonicContact ND1-OD1 3.18Å; H63-D65 PolarHBondContact ND1-OD1 2.86Å; H63-D65 IonicContact ND1-OD2 3.88Å; H63-D65 PolarHBondContact ND1-OD2 3.44Å
64S45.6Very low48Very low90 Ų90126 Ų12663%0.62970%0.701SS**  trans-96.792.1170.4-670000107.9L62 L66L62-S64 PolarHBondContact O-N 2.82Å; L62-S64 VanDerWaalsContact O-N 3.16Å; S64-L66 PolarHBondContact O-N 3.16Å
65D47.6Very low47.7Very low132 Ų132131.1 Ų131.171%0.70672%0.718SS**  trans-71.947.6162.9-66.6-52.1000110.5H63H63-D65 IonicContact CE1-OD1 3.43Å; H63-D65 PolarHBondContact CE1-OD1 2.89Å; H63-D65 IonicContact CE1-OD2 2.84Å; H63-D65 PolarHBondContact CE1-OD2 3.43Å; H63-D65 VanDerWaalsContact ND1-CG 3.33Å; H63-D65 IonicContact ND1-OD1 3.18Å; H63-D65 PolarHBondContact ND1-OD1 2.86Å; H63-D65 IonicContact ND1-OD2 3.88Å; H63-D65 PolarHBondContact ND1-OD2 3.44Å
66L48.3Very low47.8Very low151 Ų151132.7 Ų132.779%0.79172%0.722SS**  trans-105.4101.1170.6-139.975.9000107.3S64 H68S64-L66 PolarHBondContact O-N 3.16Å; L66-H68 PolarHBondContact O-N 3.05Å
67I46.7Very low48Very low154 Ų154131.8 Ų131.879%0.7971%0.713SS**  trans-53.4105.1166.6-59.7178.2000106.6D69I67-D69 HydrophobicContact CG2-CB 4.17Å; I67-D69 PolarHBondContact O-N 3.48Å
68H44.8Very low48.5Very low141 Ų141126.3 Ų126.365%0.65370%0.699SS**  trans-75.576.7167.6-172.4-77.5000107.4L66 A70 C71L66-H68 PolarHBondContact O-N 3.05Å; H68-A70 PolarHBondContact O-N 3.48Å; H68-C71 PolarHBondContact CE1-SG 2.93Å; H68-C71 PolarHBondContact ND1-N 2.79Å
69D48.5Very low48.8Very low148 Ų148124.7 Ų124.779%0.79169%0.693SS**THydrogen-bonded Turntrans-68.3123.7173.9-158.421000108.3I67I67-D69 HydrophobicContact CG2-CB 4.17Å; I67-D69 PolarHBondContact O-N 3.48Å
70A45.4Very low49.1Very low82 Ų82125.8 Ų125.868%0.67869%0.685SS**THydrogen-bonded Turntrans70.965.3178.200000118.5H68 Q72H68-A70 PolarHBondContact O-N 3.48Å; A70-Q72 PolarHBondContact O-N 3.16Å
71C45.1Very low49.5Very low79 Ų79122.3 Ų122.353%0.53467%0.669SS.*  trans-80.2101.2139.9-114.10000107.8H68 Y73H68-C71 PolarHBondContact CE1-SG 2.93Å; H68-C71 PolarHBondContact ND1-N 2.79Å; C71-Y73 PolarHBondContact O-N 3.38Å; C71-Y73 VanDerWaalsContact O-N 3.1Å
72Q49.9Very low49.3Very low177 Ų177119.3 Ų119.383%0.82766%0.664SS**SBendtrans-63.7-12.6-179.5-169.3168.622.400113.4A70A70-Q72 PolarHBondContact O-N 3.16Å
73Y57.3Low48.9Very low155 Ų155120.5 Ų120.561%0.60867%0.665SS**SBendtrans-113.1100.4170.4-60.7-76.4000108.5C71 W75C71-Y73 PolarHBondContact O-N 3.38Å; C71-Y73 VanDerWaalsContact O-N 3.1Å; Y73-W75 PolarHBondContact O-N 3.47Å; Y73-W75 VanDerWaalsContact O-N 3.12Å
74G50Low48.9Very low69 Ų69118.8 Ų118.871%0.71167%0.667SS**  trans-64.2106.5-162.900000114.2
75W46.6Very low48.6Very low209 Ų209120.5 Ų120.579%0.79268%0.677SS**  trans-103.380.4148.1-66.276.2000105.9Y73 P77 M80Y73-W75 PolarHBondContact O-N 3.47Å; Y73-W75 VanDerWaalsContact O-N 3.12Å; W75-P77 WeakPolarHBondContact O-CD 3.31Å; W75-M80 HydrophobicContact CB-CE 3.91Å; W75-M80 HydrophobicContact CE3-CE 3.94Å
76N55.3Low48.5Very low98 Ų98126 Ų12652%0.52469%0.688SS.*  trans-77.1109174.7-173.4-20.2000108A78 A79 M80N76-A78 PolarHBondContact O-N 3.06Å; N76-A78 VanDerWaalsContact O-N 3.07Å; N76-A78 VanDerWaalsContact OD1-CB 3.23Å; N76-A78 WeakPolarHBondContact OD1-CB 3.4Å; N76-A78 PolarHBondContact OD1-N 2.99Å; N76-A79 HydrophobicContact CB-CB 4.42Å; N76-A79 PolarHBondContact O-N 3.34Å; N76-M80 VanDerWaalsContact O-CE 3.28Å; N76-M80 WeakPolarHBondContact O-CE 3.17Å
77P52.8Low48.2Very low96 Ų96127.4 Ų127.462%0.62370%0.696SS**THydrogen-bonded Turntrans-60.5-23.7-177.5-19.834.3000112.2W75 V81W75-P77 WeakPolarHBondContact O-CD 3.31Å; P77-V81 WeakPolarHBondContact O-CG2 3.42Å
78A55.5Low47.6Very low65 Ų65123.7 Ų123.754%0.53770%0.695SS.*THydrogen-bonded Turntrans-71.3-26.2178.200000113.4N76N76-A78 PolarHBondContact O-N 3.06Å; N76-A78 VanDerWaalsContact O-N 3.07Å; N76-A78 VanDerWaalsContact OD1-CB 3.23Å; N76-A78 WeakPolarHBondContact OD1-CB 3.4Å; N76-A78 PolarHBondContact OD1-N 2.99Å
79A53.1Low47.3Very low62 Ų62126.7 Ų126.751%0.51271%0.709SS.*THydrogen-bonded Turntrans-75.9-30179.700000112.6N76 V81N76-A79 HydrophobicContact CB-CB 4.42Å; N76-A79 PolarHBondContact O-N 3.34Å; A79-V81 VanDerWaalsContact C-N 3.33Å; A79-V81 PolarHBondContact O-N 3.26Å
80M51.7Low46.5Very low107 Ų107124.4 Ų124.453%0.52771%0.711SS.*THydrogen-bonded Turntrans-78.3-14.7-178.5-4.9-82.3-16700113.9W75 N76W75-M80 HydrophobicContact CB-CE 3.91Å; W75-M80 HydrophobicContact CE3-CE 3.94Å; N76-M80 VanDerWaalsContact O-CE 3.28Å; N76-M80 WeakPolarHBondContact O-CE 3.17Å
81V54Low46.3Very low86 Ų86127.9 Ų127.952%0.52171%0.713SS.*THydrogen-bonded Turntrans-89.2-9.6-176.1-177.50000111.6P77 A79 V102P77-V81 WeakPolarHBondContact O-CG2 3.42Å; A79-V81 VanDerWaalsContact C-N 3.33Å; A79-V81 PolarHBondContact O-N 3.26Å; V81-V102 HydrophobicContact CG1-CG1 4.47Å; V81-V102 HydrophobicContact CG1-CG2 3.77Å
82S46.8Very low45.8Very low95 Ų95135.9 Ų135.966%0.66473%0.732SS**SBendtrans-98-0.9-174.8-61.20000115.7
83E36.8Very low45.4Very low171 Ų171134.7 Ų134.780%0.79973%0.726SS**  trans-106.277.5175.2-79.3167.6154.400110.1C85E83-C85 PolarHBondContact O-N 3.05Å; E83-C85 VanDerWaalsContact O-N 3.16Å
84T44.2Very low44.6Very low127 Ų127134.5 Ų134.578%0.77973%0.731SS**  trans-49.9120.8157.640.40000108.5R86T84-R86 PolarHBondContact O-N 3.13Å; T84-R86 VanDerWaalsContact O-N 3.11Å
85C41Very low43.9Very low127 Ų127139 Ų13986%0.85873%0.734SS**  trans-38.8115.8175.7-59.90000110.9E83E83-C85 PolarHBondContact O-N 3.05Å; E83-C85 VanDerWaalsContact O-N 3.16Å
86R44.7Very low43.6Very low246 Ų246136.7 Ų136.793%0.92873%0.731SS**  trans-66.9133.5164.8-72.9-165.8166.3-103-2.2109T84T84-R86 PolarHBondContact O-N 3.13Å; T84-R86 VanDerWaalsContact O-N 3.11Å
87L41.8Very low42.8Very low182 Ų182137.2 Ų137.295%0.95374%0.74SS**  trans106.1108.1154.5-153.171.2000117
88G34.2Very low42.3Very low75 Ų75142 Ų14277%0.77375%0.751SS**  trans154.170.9163.800000113.1A90G88-A90 PolarHBondContact O-N 3.32Å
89E37.7Very low41.5Very low205 Ų205141.6 Ų141.696%0.95875%0.753SS**  trans-71.8119.7167.3-75.5-173.9146.300110.2
90A33.4Very low41.1Very low100 Ų100142.6 Ų142.683%0.82677%0.769SS**  trans-146.4112.5151.100000108G88G88-A90 PolarHBondContact O-N 3.32Å
91H39.8Very low41.2Very low155 Ų155145.7 Ų145.772%0.71878%0.783SS**  trans-60.3124.6178.8167.3-148.6000112.1E93H91-E93 IonicContact CD2-OE2 3.29Å; H91-E93 IonicContact CE1-OE2 3.62Å; H91-E93 IonicContact NE2-OE2 2.8Å; H91-E93 PolarHBondContact NE2-OE2 2.88Å
92R35.7Very low41.5Very low246 Ų246145.6 Ų145.693%0.92878%0.782SS**  trans-156.2132.3135.4-121.9-173.7-178.8-135.30.5111.2
93E42Very low42.3Very low152 Ų152150.3 Ų150.371%0.7179%0.793SS**  trans-65.7156.8-170.3-92.4151.495.200116.7H91H91-E93 IonicContact CD2-OE2 3.29Å; H91-E93 IonicContact CE1-OE2 3.62Å; H91-E93 IonicContact NE2-OE2 2.8Å; H91-E93 PolarHBondContact NE2-OE2 2.88Å
94E40.5Very low44Very low152 Ų152152.5 Ų152.571%0.7180%0.795SS**  trans71.1100.3148.2-78.5-78.987.600118.8
95Q34.8Very low45.6Very low163 Ų163156 Ų15676%0.76279%0.794SS**  168116.398.6-161.9107.473.800109.2
96H40.3Very low47.5Very low160 Ų160155.5 Ų155.574%0.74179%0.786SS**  trans-85.7138.8171-167.7178.9000108.9K98H96-K98 PolarHBondContact CD2-N 2.92Å; H96-K98 PolarHBondContact NE2-N 2.92Å
97P38.9Very low49.4Very low110 Ų110150.3 Ų150.371%0.71477%0.767SS**  -138.1132.6115.435.3-22.6000113.8
98K41.5Very low51.6Low196 Ų196151.1 Ų151.185%0.85276%0.757SS**SBendtrans38107.4142.1-58.6-163.8177.3-169.60117.7H96H96-K98 PolarHBondContact CD2-N 2.92Å; H96-K98 PolarHBondContact NE2-N 2.92Å
99G38.6Very low54.3Low56 Ų56156.1 Ų156.158%0.57776%0.76SS**  trans147.383.7161.500000108.5Q101G99-Q101 PolarHBondContact O-N 3.29Å
100G45.8Very low57Low83 Ų83156 Ų15686%0.85675%0.751SS**  trans-6771.3174.300000110.2V102G100-V102 VanDerWaalsContact C-N 3.3Å; G100-V102 PolarHBondContact O-N 2.89Å
101Q53.8Low59.8Low173 Ų173155.6 Ų155.681%0.80874%0.738SS**  trans-67.6100.2164.5-55.4-173.10.500104.4G99 Q103G99-Q101 PolarHBondContact O-N 3.29Å; Q101-Q103 VanDerWaalsContact C-N 3.31Å; Q101-Q103 PolarHBondContact O-N 3.18Å
102V59.9Low62.5Low84 Ų84154.5 Ų154.551%0.50974%0.737SS.*  trans-49.8105.2166.9177.10000105.3V81 G100 R104V81-V102 HydrophobicContact CG1-CG1 4.47Å; V81-V102 HydrophobicContact CG1-CG2 3.77Å; G100-V102 VanDerWaalsContact C-N 3.3Å; G100-V102 PolarHBondContact O-N 2.89Å; V102-R104 HydrophobicContact CG1-CG 4.29Å; V102-R104 PolarHBondContact O-N 3.43Å
103Q63.6Low65.5Low193 Ų193146.8 Ų146.890%0.90271%0.71SS**  trans-64.587.3177.4-79.1-176.9-26.200106.8Q101 R105Q101-Q103 VanDerWaalsContact C-N 3.31Å; Q101-Q103 PolarHBondContact O-N 3.18Å; Q103-R105 PolarHBondContact O-N 2.84Å
104R71.5Confident68.2Low218 Ų218143.1 Ų143.182%0.82370%0.698SS**PPolyproline II helixtrans-66.4124.8179.1-76.9-176.8172.5178.6-1.2107.3V102 T106V102-R104 HydrophobicContact CG1-CG 4.29Å; V102-R104 PolarHBondContact O-N 3.43Å; R104-T106 PolarHBondContact O-N 2.91Å; R104-T106 VanDerWaalsContact O-N 3.16Å
105R77.5Confident70.9Confident201 Ų201143.2 Ų143.276%0.75870%0.698SS**PPolyproline II helixtrans-60.8116.6-179.6-170.1179.1-173.91805110F54 Q103F54-R105 WeakPolarHBondContact CE1-O 3.35Å; Q103-R105 PolarHBondContact O-N 2.84Å
106T80.7Confident73.9Confident115 Ų115143.1 Ų143.171%0.70670%0.698SS**PPolyproline II helixtrans-67.6153.9176.3-52.10000112R104R104-T106 PolarHBondContact O-N 2.91Å; R104-T106 VanDerWaalsContact O-N 3.16Å
107R84.5Confident76.7Confident138 Ų138137.1 Ų137.152%0.52167%0.67SS.*PPolyproline II helixtrans-67.8150.3-180-147.6170.4167.2-108.813.1107.2F54F54-R107 HydrophobicContact CB-CB 3.82Å; F54-R107 HydrophobicContact CB-CG 3.94Å; F54-R107 HydrophobicContact CD1-CB 3.2Å; F54-R107 HydrophobicContact CD1-CG 3.88Å; F54-R107 HydrophobicContact CD2-CB 3.6Å; F54-R107 HydrophobicContact CD2-CG 3.21Å; F54-R107 HydrophobicContact CE1-CB 3.5Å; F54-R107 VanDerWaalsContact CE1-CB 3.5Å; F54-R107 HydrophobicContact CE1-CG 4.15Å; F54-R107 HydrophobicContact CE2-CB 3.79Å; F54-R107 HydrophobicContact CE2-CG 3.45Å; F54-R107 VanDerWaalsContact CE2-CG 3.45Å; F54-R107 HydrophobicContact CG-CB 3.24Å; F54-R107 HydrophobicContact CG-CG 3.39Å; F54-R107 HydrophobicContact CZ-CB 3.72Å; F54-R107 HydrophobicContact CZ-CG 3.89Å; F54-R107 VanDerWaalsContact CZ-N 3.34Å
108R88.4Confident79.5Confident198 Ų198135.2 Ų135.275%0.74765%0.654SS**PPolyproline II helixtrans-69.6143.8157.7-60.7179.7-178.5-179.6-3.1109.3
109H91.5Very high82.2Confident180 Ų180130.1 Ų130.183%0.83364%0.636SS**PPolyproline II helixtrans-58.3149.9169.6-67.6-80.5000109.8T111H109-T111 PolarHBondContact O-N 3.32Å
110R93.9Very high85Confident202 Ų202128.9 Ų128.976%0.76262%0.62SS**PPolyproline II helixtrans-65.4125.2172.8-178.2-179.2-178.61751107.6I112R110-I112 HydrophobicContact CG-CD1 4.21Å
111T93.6Very high87.5Confident93 Ų93127.6 Ų127.657%0.57159%0.593SS**PPolyproline II helixtrans-66.8132.4170.6-49.30000109.3H109 F113H109-T111 PolarHBondContact O-N 3.32Å; T111-F113 HydrophobicContact CG2-CD1 4.33Å; T111-F113 HydrophobicContact CG2-CE1 3.97Å; T111-F113 HydrophobicContact CG2-CZ 4.24Å
112I95.9Very high89.6Confident132 Ų132124.9 Ų124.968%0.67758%0.58SS**  trans-113.3119.6172.7-51.2-60.4000106.1R110R110-I112 HydrophobicContact CG-CD1 4.21Å
113F97.8Very high91.4Very high83 Ų83126.6 Ų126.636%0.36458%0.583SS.*  trans-82.2149.9179.6-60.8-69.7000110.6T111 Q117 L118 L145T111-F113 HydrophobicContact CG2-CD1 4.33Å; T111-F113 HydrophobicContact CG2-CE1 3.97Å; T111-F113 HydrophobicContact CG2-CZ 4.24Å; F113-Q117 HydrophobicContact CB-CB 4.2Å; F113-Q117 HydrophobicContact CD1-CB 4.49Å; F113-L118 HydrophobicContact CB-CD2 3.76Å; F113-L118 HydrophobicContact CB-CG 3.84Å; F113-L118 HydrophobicContact CD2-CD2 3.95Å; F113-L118 HydrophobicContact CG-CD2 4.15Å; F113-L145 HydrophobicContact CD1-CD1 3.97Å; F113-L145 HydrophobicContact CD1-CD2 3.93Å; F113-L145 HydrophobicContact CE1-CD1 3.53Å; F113-L145 HydrophobicContact CE1-CD2 3.64Å; F113-L145 HydrophobicContact CE1-CG 4.25Å
114T98.3Very high93Very high75 Ų75119.2 Ų119.246%0.4655%0.549SS..  trans-73.6162.9166.265.80000110.1E116 Q117 L118T114-E116 PolarHBondContact O-N 3.29Å; T114-Q117 PolarHBondContact O-N 2.71Å; T114-Q117 VanDerWaalsContact OG1-CG 3.23Å; T114-Q117 WeakPolarHBondContact OG1-CG 3.47Å; T114-Q117 PolarHBondContact OG1-N 2.81Å; T114-Q117 PolarHBondContact OG1-OE1 3.21Å; T114-L118 WeakPolarHBondContact O-CG 3.49Å; T114-L118 PolarHBondContact O-N 2.71Å; T114-L118 VanDerWaalsContact O-N 3.1Å
115E98.2Very high94.2Very high155 Ų155114 Ų11472%0.72453%0.533SS*.Hα-helixtrans-58-48.2176.8-170.4168.9-166.100111.1Q117 L118 D119E115-Q117 VanDerWaalsContact C-N 3.26Å; E115-Q117 PolarHBondContact O-N 2.71Å; E115-L118 WeakPolarHBondContact O-CB 3.4Å; E115-L118 PolarHBondContact O-N 3.1Å; E115-D119 PolarHBondContact O-N 2.77Å
116E97.8Very high95.2Very high160 Ų160111.7 Ų111.775%0.74854%0.535SS*.Hα-helixtrans-56.9-36.3176.6-61.8177.6176.800113.4T114 A120T114-E116 PolarHBondContact O-N 3.29Å; E116-A120 PolarHBondContact O-N 2.92Å
117Q98.3Very high96Very high35 Ų35112.8 Ų112.816%0.16453%0.532CS..Hα-helixtrans-69.8-40.2176.6-73.8172.8-24.800111.5F113 T114 E115 L121 T143F113-Q117 HydrophobicContact CB-CB 4.2Å; F113-Q117 HydrophobicContact CD1-CB 4.49Å; T114-Q117 PolarHBondContact O-N 2.71Å; T114-Q117 VanDerWaalsContact OG1-CG 3.23Å; T114-Q117 WeakPolarHBondContact OG1-CG 3.47Å; T114-Q117 PolarHBondContact OG1-N 2.81Å; T114-Q117 PolarHBondContact OG1-OE1 3.21Å; E115-Q117 VanDerWaalsContact C-N 3.26Å; E115-Q117 PolarHBondContact O-N 2.71Å; Q117-L121 WeakPolarHBondContact O-CB 3.4Å; Q117-L121 VanDerWaalsContact O-CD1 3.31Å; Q117-L121 WeakPolarHBondContact O-CD1 3.5Å; Q117-L121 WeakPolarHBondContact O-CG 3.34Å; Q117-L121 PolarHBondContact O-N 3.31Å; Q117-L121 VanDerWaalsContact O-N 3.12Å; Q117-T143 PolarHBondContact NE2-O 3.28Å
118L98.3Very high96.6Very high70 Ų70109.7 Ų109.737%0.36653%0.526SS..Hα-helixtrans-64.8-44.7176.2-67.3173.4000110.8F113 T114 E115 A120 L121 E122F113-L118 HydrophobicContact CB-CD2 3.76Å; F113-L118 HydrophobicContact CB-CG 3.84Å; F113-L118 HydrophobicContact CD2-CD2 3.95Å; F113-L118 HydrophobicContact CG-CD2 4.15Å; T114-L118 WeakPolarHBondContact O-CG 3.49Å; T114-L118 PolarHBondContact O-N 2.71Å; T114-L118 VanDerWaalsContact O-N 3.1Å; E115-L118 WeakPolarHBondContact O-CB 3.4Å; E115-L118 PolarHBondContact O-N 3.1Å; L118-A120 PolarHBondContact O-N 3.46Å; L118-L121 WeakPolarHBondContact O-CB 3.37Å; L118-L121 PolarHBondContact O-N 3.32Å; L118-L121 VanDerWaalsContact O-N 3.12Å; L118-E122 WeakPolarHBondContact O-CB 3.44Å; L118-E122 WeakPolarHBondContact O-CG 3.35Å; L118-E122 PolarHBondContact O-N 3.06Å
119D98.1Very high97Very high89 Ų89105.5 Ų105.548%0.47651%0.514SS..Hα-helixtrans-57.8-47.4178.5-68.9-19000111.6E115 L121 E122 E123E115-D119 PolarHBondContact O-N 2.77Å; D119-L121 VanDerWaalsContact C-N 3.33Å; D119-L121 PolarHBondContact O-N 3.46Å; D119-E122 PolarHBondContact O-N 3.36Å; D119-E123 WeakPolarHBondContact O-CB 3.3Å; D119-E123 PolarHBondContact O-N 2.95Å
120A97.4Very high97.3Very high29 Ų29106.3 Ų106.324%0.2451%0.512CS..Hα-helixtrans-63.2-37.7177.300000112.7E116 L118 L124 L139 T143E116-A120 PolarHBondContact O-N 2.92Å; L118-A120 PolarHBondContact O-N 3.46Å; A120-L124 PolarHBondContact O-N 2.87Å; A120-L139 HydrophobicContact CB-CD1 4.36Å; A120-T143 HydrophobicContact CB-CG2 3.88Å
121L97.8Very high97.4Very high56 Ų5697.8 Ų97.829%0.29348%0.483SS..Hα-helixtrans-67.1-43.1176.3-73.5163.8000111.6Q117 L118 D119 F125 L139 L145Q117-L121 WeakPolarHBondContact O-CB 3.4Å; Q117-L121 VanDerWaalsContact O-CD1 3.31Å; Q117-L121 WeakPolarHBondContact O-CD1 3.5Å; Q117-L121 WeakPolarHBondContact O-CG 3.34Å; Q117-L121 PolarHBondContact O-N 3.31Å; Q117-L121 VanDerWaalsContact O-N 3.12Å; L118-L121 WeakPolarHBondContact O-CB 3.37Å; L118-L121 PolarHBondContact O-N 3.32Å; L118-L121 VanDerWaalsContact O-N 3.12Å; D119-L121 VanDerWaalsContact C-N 3.33Å; D119-L121 PolarHBondContact O-N 3.46Å; L121-F125 WeakPolarHBondContact O-CB 3.47Å; L121-F125 PolarHBondContact O-N 3.42Å; L121-L139 HydrophobicContact CD2-CD2 3.58Å; L121-L139 HydrophobicContact CD2-CG 4.5Å; L121-L145 HydrophobicContact CD1-CD1 4.41Å
122E98.2Very high97.6Very high117 Ų11798.2 Ų98.255%0.54748%0.481SS..Hα-helixtrans-68.7-42.5179.5-72.7-179.2-169.700111.8L118 D119 L124 F125 L126L118-E122 WeakPolarHBondContact O-CB 3.44Å; L118-E122 WeakPolarHBondContact O-CG 3.35Å; L118-E122 PolarHBondContact O-N 3.06Å; D119-E122 PolarHBondContact O-N 3.36Å; E122-L124 PolarHBondContact O-N 2.94Å; E122-F125 PolarHBondContact O-N 3.39Å; E122-L126 WeakPolarHBondContact O-CG 3.34Å; E122-L126 PolarHBondContact O-N 3.47Å
123E97.6Very high97.7Very high119 Ų11996 Ų9656%0.55647%0.473SS*.Hα-helixtrans-57.7-48.7175.8-173.6-174.4173.800111.1D119 F125 L126 Q127D119-E123 WeakPolarHBondContact O-CB 3.3Å; D119-E123 PolarHBondContact O-N 2.95Å; E123-F125 VanDerWaalsContact C-N 3.31Å; E123-F125 PolarHBondContact O-N 3.12Å; E123-L126 PolarHBondContact O-N 3.19Å; E123-Q127 WeakPolarHBondContact O-CG 3.32Å; E123-Q127 PolarHBondContact O-N 3.18Å; E123-Q127 PolarHBondContact OE1-NE2 3.32Å
124L97.3Very high97.7Very high38 Ų3896 Ų9620%0.19948%0.478CS..Hα-helixtrans-62-42.2177.5-173.175.7000111A120 E122 L126 Q127 N128 P131 L139A120-L124 PolarHBondContact O-N 2.87Å; E122-L124 PolarHBondContact O-N 2.94Å; L124-L126 VanDerWaalsContact C-N 3.33Å; L124-L126 PolarHBondContact O-N 3.34Å; L124-Q127 PolarHBondContact O-N 3.45Å; L124-N128 CarbonylContact O-C 3.53Å; L124-N128 PolarHBondContact O-N 3.26Å; L124-N128 VanDerWaalsContact O-O 3.13Å; L124-P131 HydrophobicContact CD2-CB 4.15Å; L124-P131 HydrophobicContact CD2-CG 4.06Å; L124-L139 HydrophobicContact CB-CD1 4.43Å; L124-L139 HydrophobicContact CD2-CB 4.31Å; L124-L139 HydrophobicContact CD2-CD1 4.27Å; L124-L139 HydrophobicContact CD2-CD2 3.49Å; L124-L139 VanDerWaalsContact CD2-CD2 3.49Å; L124-L139 HydrophobicContact CD2-CG 4.23Å
125F97.9Very high97.7Very high110 Ų11093.8 Ų93.848%0.48247%0.467SS..Hα-helixtrans-63.2-38.9-179.2-175.9-97.4000112.6L121 E122 E123 Q127 N128 Q129L121-F125 WeakPolarHBondContact O-CB 3.47Å; L121-F125 PolarHBondContact O-N 3.42Å; E122-F125 PolarHBondContact O-N 3.39Å; E123-F125 VanDerWaalsContact C-N 3.31Å; E123-F125 PolarHBondContact O-N 3.12Å; F125-Q127 VanDerWaalsContact C-N 3.3Å; F125-Q127 PolarHBondContact O-N 3Å; F125-N128 CarbonylContact O-C 3.51Å; F125-Q129 HydrophobicContact CD1-CG 4.35Å; F125-Q129 HydrophobicContact CD2-CB 4.16Å; F125-Q129 HydrophobicContact CD2-CG 4.03Å; F125-Q129 HydrophobicContact CE1-CG 3.99Å; F125-Q129 HydrophobicContact CE2-CB 3.77Å; F125-Q129 HydrophobicContact CE2-CG 3.64Å; F125-Q129 HydrophobicContact CG-CG 4.37Å; F125-Q129 HydrophobicContact CZ-CB 4.21Å; F125-Q129 HydrophobicContact CZ-CG 3.62Å; F125-Q129 WeakPolarHBondContact O-CG 3.39Å; F125-Q129 PolarHBondContact O-N 3.33Å
126L98.1Very high97.7Very high151 Ų15192.7 Ų92.779%0.79146%0.456SS*.Hα-helixtrans-63.9-36.3175.2-70.6173.5000112.1E122 E123 L124E122-L126 WeakPolarHBondContact O-CG 3.34Å; E122-L126 PolarHBondContact O-N 3.47Å; E123-L126 PolarHBondContact O-N 3.19Å; L124-L126 VanDerWaalsContact C-N 3.33Å; L124-L126 PolarHBondContact O-N 3.34Å
127Q96.7Very high97.7Very high138 Ų13890.2 Ų90.265%0.64544%0.444SS*.Hα-helixtrans-76.9-44.8177.4-65.717713.100112.2E123 L124 F125E123-Q127 WeakPolarHBondContact O-CG 3.32Å; E123-Q127 PolarHBondContact O-N 3.18Å; E123-Q127 PolarHBondContact OE1-NE2 3.32Å; L124-Q127 PolarHBondContact O-N 3.45Å; F125-Q127 VanDerWaalsContact C-N 3.3Å; F125-Q127 PolarHBondContact O-N 3Å
128N96.7Very high97.7Very high74 Ų7494.1 Ų94.140%0.39646%0.461SS..  trans-154.1112.2-178.4-1788.4000111.4L124 F125 Y130 P131L124-N128 CarbonylContact O-C 3.53Å; L124-N128 PolarHBondContact O-N 3.26Å; L124-N128 VanDerWaalsContact O-O 3.13Å; F125-N128 CarbonylContact O-C 3.51Å; N128-Y130 PolarHBondContact ND2-O 3.24Å; N128-Y130 PolarHBondContact O-N 3.47Å; N128-Y130 VanDerWaalsContact OD1-C 3.28Å; N128-Y130 PolarHBondContact OD1-N 3.12Å; N128-Y130 PolarHBondContact OD1-O 3.26Å; N128-P131 WeakPolarHBondContact ND2-CA 3.32Å
129Q97.6Very high97.6Very high109 Ų10991.8 Ų91.851%0.50945%0.449SS..SBendtrans-70.7-19.7178.5-60.9-176.5-6.100113.6F125F125-Q129 HydrophobicContact CD1-CG 4.35Å; F125-Q129 HydrophobicContact CD2-CB 4.16Å; F125-Q129 HydrophobicContact CD2-CG 4.03Å; F125-Q129 HydrophobicContact CE1-CG 3.99Å; F125-Q129 HydrophobicContact CE2-CB 3.77Å; F125-Q129 HydrophobicContact CE2-CG 3.64Å; F125-Q129 HydrophobicContact CG-CG 4.37Å; F125-Q129 HydrophobicContact CZ-CB 4.21Å; F125-Q129 HydrophobicContact CZ-CG 3.62Å; F125-Q129 WeakPolarHBondContact O-CG 3.39Å; F125-Q129 PolarHBondContact O-N 3.33Å
130Y97.6Very high97.6Very high198 Ų19889.3 Ų89.378%0.77644%0.44SS*.SBendtrans-128.473-179-58.6-67.6000110.9N128N128-Y130 PolarHBondContact ND2-O 3.24Å; N128-Y130 PolarHBondContact O-N 3.47Å; N128-Y130 VanDerWaalsContact OD1-C 3.28Å; N128-Y130 PolarHBondContact OD1-N 3.12Å; N128-Y130 PolarHBondContact OD1-O 3.26Å
131P97Very high97.6Very high23 Ų2394.7 Ų94.715%0.14946%0.461CS..  trans-66.4147.1178.327-33.7000111.7L124 N128 A135 R136L124-P131 HydrophobicContact CD2-CB 4.15Å; L124-P131 HydrophobicContact CD2-CG 4.06Å; N128-P131 WeakPolarHBondContact ND2-CA 3.32Å; P131-A135 HydrophobicContact CB-CB 3.73Å; P131-R136 HydrophobicContact CB-CG 4.04Å; P131-R136 HydrophobicContact CG-CG 3.71Å; P131-R136 PolarHBondContact O-NH1 3Å
132D98.1Very high97.5Very high101 Ų10199 Ų9954%0.5448%0.479SS..  trans-72.8-179.1173.871.515.2000112.1N134 A135 R136D132-N134 VanDerWaalsContact C-N 3.34Å; D132-N134 PolarHBondContact O-N 3.02Å; D132-N134 PolarHBondContact OD1-N 2.99Å; D132-N134 VanDerWaalsContact OD1-N 3.1Å; D132-A135 VanDerWaalsContact OD1-CB 3.32Å; D132-A135 WeakPolarHBondContact OD1-CB 3.33Å; D132-A135 PolarHBondContact OD1-N 3.49Å; D132-R136 WeakPolarHBondContact O-CG 3.38Å; D132-R136 PolarHBondContact O-N 3.38Å; D132-R136 VanDerWaalsContact O-N 3.1Å
133V97.9Very high97.4Very high85 Ų8593.9 Ų93.952%0.51546%0.456SS..Hα-helixtrans-60.4-44.4-178.8178.40000111.3R136 E137V133-R136 PolarHBondContact O-N 3.1Å; V133-E137 HydrophobicContact CG1-CG 4.34Å; V133-E137 WeakPolarHBondContact O-CG 3.34Å; V133-E137 PolarHBondContact O-N 3.1Å
134N97.9Very high97.3Very high85 Ų8595 Ų9546%0.45547%0.466SS..Hα-helixtrans-67.3-43.3-176.2-173.94.6000111.5D132 R136 E137 K138D132-N134 VanDerWaalsContact C-N 3.34Å; D132-N134 PolarHBondContact O-N 3.02Å; D132-N134 PolarHBondContact OD1-N 2.99Å; D132-N134 VanDerWaalsContact OD1-N 3.1Å; N134-R136 VanDerWaalsContact C-N 3.34Å; N134-R136 PolarHBondContact O-N 2.99Å; N134-E137 PolarHBondContact O-N 3.43Å; N134-K138 WeakPolarHBondContact O-CG 3.46Å; N134-K138 PolarHBondContact O-N 3.1Å; N134-K138 WeakPolarHBondContact OD1-CE 3.14Å
135A97.1Very high97.1Very high28 Ų2899 Ų9923%0.23149%0.486CS..Hα-helixtrans-61.1-42.2175.400000111.6P131 D132 L139P131-A135 HydrophobicContact CB-CB 3.73Å; D132-A135 VanDerWaalsContact OD1-CB 3.32Å; D132-A135 WeakPolarHBondContact OD1-CB 3.33Å; D132-A135 PolarHBondContact OD1-N 3.49Å; A135-L139 WeakPolarHBondContact O-CB 3.28Å; A135-L139 PolarHBondContact O-N 3.46Å
136R98.1Very high97.1Very high131 Ų13198.4 Ų98.449%0.49449%0.487SS..Hα-helixtrans-66.3-40.8175.4-69.2-171.5-53.8-105.55.8112.8P131 D132 V133 N134 L139 A140P131-R136 HydrophobicContact CB-CG 4.04Å; P131-R136 HydrophobicContact CG-CG 3.71Å; P131-R136 PolarHBondContact O-NH1 3Å; D132-R136 WeakPolarHBondContact O-CG 3.38Å; D132-R136 PolarHBondContact O-N 3.38Å; D132-R136 VanDerWaalsContact O-N 3.1Å; V133-R136 PolarHBondContact O-N 3.1Å; N134-R136 VanDerWaalsContact C-N 3.34Å; N134-R136 PolarHBondContact O-N 2.99Å; R136-L139 PolarHBondContact O-N 3.08Å; R136-A140 WeakPolarHBondContact O-CB 3.44Å; R136-A140 PolarHBondContact O-N 2.97Å
137E98.2Very high97Very high108 Ų10895.6 Ų95.651%0.50547%0.471SS..Hα-helixtrans-64-42.5177.7-76.5176.7169.900112.1V133 N134 A140 Q141V133-E137 HydrophobicContact CG1-CG 4.34Å; V133-E137 WeakPolarHBondContact O-CG 3.34Å; V133-E137 PolarHBondContact O-N 3.1Å; N134-E137 PolarHBondContact O-N 3.43Å; E137-A140 PolarHBondContact O-N 3.04Å; E137-Q141 WeakPolarHBondContact O-CG 3.34Å; E137-Q141 PolarHBondContact O-N 3.48Å
138K97.4Very high97Very high117 Ų11793.3 Ų93.351%0.50946%0.461SS..Hα-helixtrans-60.7-46.1174-74.7177.1178.4179.40111.7N134 A140 Q141 Q142N134-K138 WeakPolarHBondContact O-CG 3.46Å; N134-K138 PolarHBondContact O-N 3.1Å; N134-K138 WeakPolarHBondContact OD1-CE 3.14Å; K138-A140 VanDerWaalsContact C-N 3.35Å; K138-A140 PolarHBondContact O-N 3.07Å; K138-Q141 PolarHBondContact O-N 3.11Å; K138-Q142 WeakPolarHBondContact O-CG 3.37Å; K138-Q142 PolarHBondContact O-N 3.46Å
139L97.4Very high97.1Very high22 Ų2294.4 Ų94.412%0.11547%0.465CS..Hα-helixtrans-60.2-46.2177.8-17272.2000111.2A120 L121 L124 A135 R136 Q141 Q142 T143A120-L139 HydrophobicContact CB-CD1 4.36Å; L121-L139 HydrophobicContact CD2-CD2 3.58Å; L121-L139 HydrophobicContact CD2-CG 4.5Å; L124-L139 HydrophobicContact CB-CD1 4.43Å; L124-L139 HydrophobicContact CD2-CB 4.31Å; L124-L139 HydrophobicContact CD2-CD1 4.27Å; L124-L139 HydrophobicContact CD2-CD2 3.49Å; L124-L139 VanDerWaalsContact CD2-CD2 3.49Å; L124-L139 HydrophobicContact CD2-CG 4.23Å; A135-L139 WeakPolarHBondContact O-CB 3.28Å; A135-L139 PolarHBondContact O-N 3.46Å; R136-L139 PolarHBondContact O-N 3.08Å; L139-Q141 VanDerWaalsContact C-N 3.29Å; L139-Q141 PolarHBondContact O-N 3.16Å; L139-Q142 WeakPolarHBondContact O-CB 3.42Å; L139-Q142 PolarHBondContact O-N 2.8Å; L139-T143 HydrophobicContact CD1-CG2 4.29Å; L139-T143 HydrophobicContact CG-CG2 4.4Å; L139-T143 PolarHBondContact O-N 3.14Å; L139-T143 PolarHBondContact O-OG1 3.12Å
140A97.6Very high97Very high36 Ų3693.5 Ų93.530%0.29846%0.462SS..Hα-helixtrans-58.4-40.717800000112.4R136 E137 K138 N144 L145R136-A140 WeakPolarHBondContact O-CB 3.44Å; R136-A140 PolarHBondContact O-N 2.97Å; E137-A140 PolarHBondContact O-N 3.04Å; K138-A140 VanDerWaalsContact C-N 3.35Å; K138-A140 PolarHBondContact O-N 3.07Å; A140-N144 VanDerWaalsContact O-CA 3.3Å; A140-N144 WeakPolarHBondContact O-CA 3.31Å; A140-N144 PolarHBondContact O-N 3.11Å; A140-L145 PolarHBondContact O-N 3.41Å; A140-L145 VanDerWaalsContact O-N 3.13Å
141Q97.4Very high97Very high143 Ų14386.5 Ų86.567%0.66844%0.441SS*.Hα-helixtrans-65.3-39.1174.4-69.9171.534.100112.3E137 K138 L139E137-Q141 WeakPolarHBondContact O-CG 3.34Å; E137-Q141 PolarHBondContact O-N 3.48Å; K138-Q141 PolarHBondContact O-N 3.11Å; L139-Q141 VanDerWaalsContact C-N 3.29Å; L139-Q141 PolarHBondContact O-N 3.16Å
142Q96.1Very high97Very high147 Ų14791.1 Ų91.169%0.68746%0.462SS*.Hα-helixtrans-69-42.4178.1-70.5174.7-65.600112K138 L139K138-Q142 WeakPolarHBondContact O-CG 3.37Å; K138-Q142 PolarHBondContact O-N 3.46Å; L139-Q142 WeakPolarHBondContact O-CB 3.42Å; L139-Q142 PolarHBondContact O-N 2.8Å
143T96.5Very high96.9Very high8 Ų890.3 Ų90.35%0.04946%0.456CS..Hα-helixtrans-90.1-6.9-176.259.30000114Q117 A120 L139 L145Q117-T143 PolarHBondContact NE2-O 3.28Å; A120-T143 HydrophobicContact CB-CG2 3.88Å; L139-T143 HydrophobicContact CD1-CG2 4.29Å; L139-T143 HydrophobicContact CG-CG2 4.4Å; L139-T143 PolarHBondContact O-N 3.14Å; L139-T143 PolarHBondContact O-OG1 3.12Å; T143-L145 WeakPolarHBondContact OG1-CD1 3.23Å; T143-L145 WeakPolarHBondContact OG1-CG 3.43Å
144N95.8Very high96.8Very high143 Ų14390.8 Ų90.877%0.76545%0.451SS*.THydrogen-bonded Turntrans53.948.9-172.1-59.9-69.4000113.2A140A140-N144 VanDerWaalsContact O-CA 3.3Å; A140-N144 WeakPolarHBondContact O-CA 3.31Å; A140-N144 PolarHBondContact O-N 3.11Å
145L92.5Very high96.7Very high121 Ų12191.3 Ų91.363%0.63445%0.45SS*.  trans-109.60180-67.4178.7000113.3F113 L121 A140 T143F113-L145 HydrophobicContact CD1-CD1 3.97Å; F113-L145 HydrophobicContact CD1-CD2 3.93Å; F113-L145 HydrophobicContact CE1-CD1 3.53Å; F113-L145 HydrophobicContact CE1-CD2 3.64Å; F113-L145 HydrophobicContact CE1-CG 4.25Å; L121-L145 HydrophobicContact CD1-CD1 4.41Å; A140-L145 PolarHBondContact O-N 3.41Å; A140-L145 VanDerWaalsContact O-N 3.13Å; T143-L145 WeakPolarHBondContact OG1-CD1 3.23Å; T143-L145 WeakPolarHBondContact OG1-CG 3.43Å

Retrieved 145 of 145 residues in 46.9 ms (Link to these results)