A0A096MG10_POEFO Loading...

Protein MGARP N-terminal domain-containing protein

AlphaFold DB , UniProt , Accession A0A096MG10, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 540 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
1M63.5Low71.3Confident212 Ų212139.1 Ų139.1100%1.04469%0.686SS**  0-51.90-68.8-176.7177.700113.3S3 C4M1-S3 VanDerWaalsContact C-N 3.32Å; M1-S3 PolarHBondContact O-N 2.86Å; M1-C4 PolarHBondContact O-N 3.1Å
2F65.8Low71.8Confident182 Ų182129.4 Ų129.480%0.79865%0.649SS**Hα-helixtrans-57.6-32.9-175.1-68.7-75.3000116.3C4 R5 A6F2-C4 VanDerWaalsContact C-N 3.31Å; F2-C4 PolarHBondContact O-N 2.85Å; F2-R5 PolarHBondContact O-N 3.17Å; F2-R5 VanDerWaalsContact O-N 3.16Å; F2-A6 PolarHBondContact O-N 2.83Å
3S70.8Confident72Confident90 Ų90125.5 Ų125.563%0.62964%0.638SS**Hα-helixtrans-56.5-39.6176.843.40000113.5M1 R5 A6 A7M1-S3 VanDerWaalsContact C-N 3.32Å; M1-S3 PolarHBondContact O-N 2.86Å; S3-R5 PolarHBondContact O-N 3.34Å; S3-A6 PolarHBondContact O-N 3.32Å; S3-A7 PolarHBondContact O-N 3.18Å
4C71Confident71.7Confident82 Ų82124.9 Ų124.955%0.55464%0.636SS**Hα-helixtrans-66-37.6178-61.30000112.3M1 F2 A7 W8M1-C4 PolarHBondContact O-N 3.1Å; F2-C4 VanDerWaalsContact C-N 3.31Å; F2-C4 PolarHBondContact O-N 2.85Å; C4-A7 PolarHBondContact O-N 3.21Å; C4-W8 WeakPolarHBondContact O-CB 3.35Å; C4-W8 PolarHBondContact O-N 3.09Å
5R76Confident71.5Confident197 Ų197120.4 Ų120.474%0.74363%0.626SS**Hα-helixtrans-65.3-39.1174.8-74.7-167.9174.9-155.9-0.7111.6F2 S3 W8 Q9F2-R5 PolarHBondContact O-N 3.17Å; F2-R5 VanDerWaalsContact O-N 3.16Å; S3-R5 PolarHBondContact O-N 3.34Å; R5-W8 PolarHBondContact O-N 3.01Å; R5-Q9 WeakPolarHBondContact O-CG 3.16Å; R5-Q9 PolarHBondContact O-N 3.2Å
6A74.6Confident71.1Confident63 Ų63124.2 Ų124.252%0.52163%0.629SS.*Hα-helixtrans-66.2-37.4176.300000112.8F2 S3F2-A6 PolarHBondContact O-N 2.83Å; S3-A6 PolarHBondContact O-N 3.32Å
7A74.9Confident70.6Confident51 Ų51127.9 Ų127.942%0.42163%0.634SS.*Hα-helixtrans-66.1-48173.100000111.7S3 C4 Q9 R10 C11S3-A7 PolarHBondContact O-N 3.18Å; C4-A7 PolarHBondContact O-N 3.21Å; A7-Q9 VanDerWaalsContact C-N 3.32Å; A7-Q9 PolarHBondContact O-N 2.91Å; A7-R10 PolarHBondContact O-N 3Å; A7-C11 PolarHBondContact O-N 3.4Å
8W68.8Low70.1Confident206 Ų206123.8 Ų123.878%0.7862%0.624SS**Hα-helixtrans-60.2-37.3178.1-99.767000113.4C4 R5 R10 C11 G12C4-W8 WeakPolarHBondContact O-CB 3.35Å; C4-W8 PolarHBondContact O-N 3.09Å; R5-W8 PolarHBondContact O-N 3.01Å; W8-R10 PolarHBondContact O-N 3.28Å; W8-C11 PolarHBondContact O-N 2.92Å; W8-G12 PolarHBondContact O-N 3.22Å
9Q77.1Confident69.5Low157 Ų157122.2 Ų122.273%0.73462%0.621SS**Hα-helixtrans-64.8-24.2174.5-73.2-69-4.500113.5R5 A7R5-Q9 WeakPolarHBondContact O-CG 3.16Å; R5-Q9 PolarHBondContact O-N 3.2Å; A7-Q9 VanDerWaalsContact C-N 3.32Å; A7-Q9 PolarHBondContact O-N 2.91Å
10R72.1Confident68.9Low213 Ų213126 Ų12680%0.80463%0.629SS**Hα-helixtrans-87.1-33.2174-68.4-175176.5-167.9-1.5113.1A7 W8A7-R10 PolarHBondContact O-N 3Å; W8-R10 PolarHBondContact O-N 3.28Å
11C69.9Low68.3Low77 Ų77130.3 Ų130.352%0.5264%0.638SS.*Hα-helixtrans-85.4-26.5179.9-62.80000113.6A7 W8 L14 A15A7-C11 PolarHBondContact O-N 3.4Å; W8-C11 PolarHBondContact O-N 2.92Å; C11-L14 WeakPolarHBondContact O-CB 3.4Å; C11-L14 PolarHBondContact O-N 3.41Å; C11-A15 PolarHBondContact O-N 3.14Å
12G77.1Confident67.8Low23 Ų23126.1 Ų126.124%0.23762%0.619CS.*Hα-helixtrans-53.1-43.8-177.800000115.3W8 L14 A15 R16W8-G12 PolarHBondContact O-N 3.22Å; G12-L14 VanDerWaalsContact C-N 3.3Å; G12-L14 PolarHBondContact O-N 2.97Å; G12-A15 PolarHBondContact O-N 2.89Å; G12-R16 WeakPolarHBondContact O-CG 3.29Å; G12-R16 PolarHBondContact O-N 3.16Å
13P74.2Confident67.4Low78 Ų78121.7 Ų121.751%0.50661%0.608SS.*Hα-helixtrans-64.3-31.8175.3-24.335.4000113.7R17P13-R17 WeakPolarHBondContact O-CG 3.47Å; P13-R17 PolarHBondContact O-N 3.34Å; P13-R17 VanDerWaalsContact O-N 3.08Å
14L68.3Low66.7Low117 Ų117125.7 Ų125.761%0.61362%0.622SS**Hα-helixtrans-76.9-40.7177-63.4176.7000111.3C11 G12 R16 R17 A18C11-L14 WeakPolarHBondContact O-CB 3.4Å; C11-L14 PolarHBondContact O-N 3.41Å; G12-L14 VanDerWaalsContact C-N 3.3Å; G12-L14 PolarHBondContact O-N 2.97Å; L14-R16 VanDerWaalsContact C-N 3.34Å; L14-R16 PolarHBondContact O-N 3.01Å; L14-R17 PolarHBondContact O-N 3.44Å; L14-A18 PolarHBondContact O-N 3.06Å
15A67.8Low65.7Low58 Ų58127.6 Ų127.648%0.47963%0.626SS.*Hα-helixtrans-59.3-44.1172.600000111.5C11 G12 A18 T19C11-A15 PolarHBondContact O-N 3.14Å; G12-A15 PolarHBondContact O-N 2.89Å; A15-A18 WeakPolarHBondContact O-CB 3.29Å; A15-A18 PolarHBondContact O-N 3.29Å; A15-T19 PolarHBondContact O-N 3.16Å; A15-T19 PolarHBondContact O-OG1 3.33Å
16R65.7Low64.8Low181 Ų181121.3 Ų121.368%0.68362%0.623SS**Hα-helixtrans-63.6-40.6174.3-71.7179.5-178.9-141.5-2.8112.6G12 L14 A18 T19 Y20G12-R16 WeakPolarHBondContact O-CG 3.29Å; G12-R16 PolarHBondContact O-N 3.16Å; L14-R16 VanDerWaalsContact C-N 3.34Å; L14-R16 PolarHBondContact O-N 3.01Å; R16-A18 VanDerWaalsContact C-N 3.29Å; R16-A18 PolarHBondContact O-N 3.19Å; R16-T19 WeakPolarHBondContact CA-OG1 3.45Å; R16-T19 PolarHBondContact O-N 2.96Å; R16-T19 PolarHBondContact O-OG1 3Å; R16-Y20 WeakPolarHBondContact O-CD2 3.5Å; R16-Y20 PolarHBondContact O-N 3.48Å
17R62.2Low63.9Low187 Ų187123.5 Ų123.571%0.70663%0.629SS**Hα-helixtrans-65.5-31.2173.6-80.4-178.1173.9178.9-1.6112.7P13 L14 R21P13-R17 WeakPolarHBondContact O-CG 3.47Å; P13-R17 PolarHBondContact O-N 3.34Å; P13-R17 VanDerWaalsContact O-N 3.08Å; L14-R17 PolarHBondContact O-N 3.44Å; R17-R21 VanDerWaalsContact O-CB 3.24Å; R17-R21 WeakPolarHBondContact O-CB 3.44Å; R17-R21 WeakPolarHBondContact O-CG 3.36Å; R17-R21 PolarHBondContact O-N 3.38Å
18A61.3Low62.8Low55 Ų55129.8 Ų129.846%0.45565%0.65SS.*Hα-helixtrans-70.6-42.9173.100000111.9L14 A15 R16 Y20 R21 L22L14-A18 PolarHBondContact O-N 3.06Å; A15-A18 WeakPolarHBondContact O-CB 3.29Å; A15-A18 PolarHBondContact O-N 3.29Å; R16-A18 VanDerWaalsContact C-N 3.29Å; R16-A18 PolarHBondContact O-N 3.19Å; A18-Y20 VanDerWaalsContact C-N 3.29Å; A18-Y20 PolarHBondContact O-N 3.5Å; A18-R21 CarbonylContact O-C 3.58Å; A18-R21 WeakPolarHBondContact O-CA 3.33Å; A18-R21 PolarHBondContact O-N 3.49Å; A18-L22 PolarHBondContact O-N 3.09Å
19T59.3Low62.2Low92 Ų92130.9 Ų130.956%0.56465%0.654SS**Hα-helixtrans-66.8-28.3176.153.80000113.3A15 R16 R21A15-T19 PolarHBondContact O-N 3.16Å; A15-T19 PolarHBondContact O-OG1 3.33Å; R16-T19 WeakPolarHBondContact CA-OG1 3.45Å; R16-T19 PolarHBondContact O-N 2.96Å; R16-T19 PolarHBondContact O-OG1 3Å; T19-R21 VanDerWaalsContact C-N 3.3Å
20Y57.5Low61.4Low199 Ų199132.9 Ų132.978%0.7866%0.655SS**THydrogen-bonded Turntrans-86.68.9168.8-65.5-58.9000114R16 A18R16-Y20 WeakPolarHBondContact O-CD2 3.5Å; R16-Y20 PolarHBondContact O-N 3.48Å; A18-Y20 VanDerWaalsContact C-N 3.29Å; A18-Y20 PolarHBondContact O-N 3.5Å
21R56.8Low60.6Low217 Ų217126.7 Ų126.782%0.81964%0.642SS**THydrogen-bonded Turntrans-128.8-7.1176-84.7-72.1-172.3146.8-2.9114.5R17 A18 T19R17-R21 VanDerWaalsContact O-CB 3.24Å; R17-R21 WeakPolarHBondContact O-CB 3.44Å; R17-R21 WeakPolarHBondContact O-CG 3.36Å; R17-R21 PolarHBondContact O-N 3.38Å; A18-R21 CarbonylContact O-C 3.58Å; A18-R21 WeakPolarHBondContact O-CA 3.33Å; A18-R21 PolarHBondContact O-N 3.49Å; T19-R21 VanDerWaalsContact C-N 3.3Å
22L52.9Low59.5Low123 Ų123131.1 Ų131.164%0.64466%0.658SS**SBendtrans-60126.9154.2-73.2170.9000107.1A18 L24A18-L22 PolarHBondContact O-N 3.09Å; L22-L24 PolarHBondContact O-N 3.37Å
23P56.3Low58.4Low89 Ų89134.8 Ų134.858%0.57868%0.68SS**  trans-57.8127.4167-21.533.5000108.6D25P23-D25 HydrophobicContact CB-CB 4.09Å; P23-D25 WeakPolarHBondContact CB-OD2 3.28Å; P23-D25 PolarHBondContact O-N 2.92Å
24L55.9Low57.2Low175 Ų175135 Ų13592%0.91668%0.682SS**  trans-76.365.8154.7-79.3164.4000107.1L22 G26L22-L24 PolarHBondContact O-N 3.37Å; L24-G26 PolarHBondContact O-N 3.17Å
25D50.8Low56.9Low122 Ų122134.6 Ų134.665%0.65269%0.685SS**  trans-72.952170.8-78.2-27.6000110.1P23 V27P23-D25 HydrophobicContact CB-CB 4.09Å; P23-D25 WeakPolarHBondContact CB-OD2 3.28Å; P23-D25 PolarHBondContact O-N 2.92Å; D25-V27 HydrophobicContact CB-CG2 4.21Å; D25-V27 PolarHBondContact O-N 3.32Å
26G57.5Low56Low65 Ų65138.3 Ų138.367%0.6770%0.704SS**  trans-6395.8135.800000105.2L24 Q28L24-G26 PolarHBondContact O-N 3.17Å; G26-Q28 VanDerWaalsContact C-N 3.27Å; G26-Q28 PolarHBondContact O-N 3Å
27V54.8Low55.6Low108 Ų108131.7 Ų131.766%0.65569%0.692SS**  trans-66.488-171-177.70000109.4D25 R29D25-V27 HydrophobicContact CB-CG2 4.21Å; D25-V27 PolarHBondContact O-N 3.32Å; V27-R29 VanDerWaalsContact C-N 3.3Å; V27-R29 PolarHBondContact O-N 3.31Å
28Q53.3Low55.7Low183 Ų183126.5 Ų126.586%0.85570%0.697SS**  trans-54.5106.4146.8-74.2-168.6-8.100105.4G26 R30G26-Q28 VanDerWaalsContact C-N 3.27Å; G26-Q28 PolarHBondContact O-N 3Å; Q28-R30 PolarHBondContact O-N 2.82Å
29R54.9Low55.8Low229 Ų229128.1 Ų128.186%0.86471%0.705SS**  trans-58.794169.4-78.6-176.1171.3-168.5-0.7106.6V27 P31V27-R29 VanDerWaalsContact C-N 3.3Å; V27-R29 PolarHBondContact O-N 3.31Å; R29-P31 VanDerWaalsContact O-CD 3.22Å; R29-P31 WeakPolarHBondContact O-CD 3.47Å
30R59.7Low56Low199 Ų199125.9 Ų125.975%0.75170%0.7SS**  trans-53.3113177.7-174.7178.9-166.9-112.3-0.8106.9Q28 M32Q28-R30 PolarHBondContact O-N 2.82Å; R30-M32 PolarHBondContact O-N 3.47Å
31P55.9Low56.6Low83 Ų83123.3 Ų123.354%0.53970%0.695SS.*  trans-68.697.8-173.925.7-32.5000108.2R29 S33 S34R29-P31 VanDerWaalsContact O-CD 3.22Å; R29-P31 WeakPolarHBondContact O-CD 3.47Å; P31-S33 PolarHBondContact O-N 2.99Å; P31-S34 PolarHBondContact O-N 3.01Å; P31-S34 VanDerWaalsContact O-N 3.11Å; P31-S34 PolarHBondContact O-OG 2.92Å
32M47.5Very low57.5Low171 Ų171117.9 Ų117.984%0.84268%0.682SS**SBendtrans-68.4-16.9177.9-68.2-170175.100111.3R30 S34R30-M32 PolarHBondContact O-N 3.47Å; M32-S34 PolarHBondContact O-N 3.41Å
33S53.3Low59Low100 Ų100117.4 Ų117.470%0.69968%0.679SS**  trans-70.238.1158.5520000113.5P31 V35P31-S33 PolarHBondContact O-N 2.99Å; S33-V35 PolarHBondContact O-N 3.41Å
34S48.5Very low60.5Low81 Ų81119.4 Ų119.457%0.56668%0.684SS**  trans-74.178.2166.3-660000108.5P31 M32 P36P31-S34 PolarHBondContact O-N 3.01Å; P31-S34 VanDerWaalsContact O-N 3.11Å; P31-S34 PolarHBondContact O-OG 2.92Å; M32-S34 PolarHBondContact O-N 3.41Å; S34-P36 WeakPolarHBondContact O-CD 3.44Å
35V62.4Low61.9Low110 Ų110118.7 Ų118.767%0.66767%0.671SS**  trans-55.8121.5-179.1-179.20000109.2S33 G37 G38S33-V35 PolarHBondContact O-N 3.41Å; V35-G37 PolarHBondContact O-N 3.02Å; V35-G38 PolarHBondContact O-N 3.11Å
36P50.1Low63.9Low136 Ų136117.2 Ų117.288%0.88367%0.666SS**THydrogen-bonded Turntrans-64.7104.1179.4-21.834.1000110.6S34S34-P36 WeakPolarHBondContact O-CD 3.44Å
37G57.3Low65.7Low41 Ų41119 Ų11942%0.42366%0.663SS.*THydrogen-bonded Turntrans145.4-6.7-175.800000115.7V35 S39V35-G37 PolarHBondContact O-N 3.02Å; G37-S39 VanDerWaalsContact C-N 3.26Å; G37-S39 PolarHBondContact O-N 2.89Å
38G63.2Low67.7Low78 Ų78120 Ų12080%0.80467%0.665SS**  trans-68.961.1-178.700000116.4V35V35-G38 PolarHBondContact O-N 3.11Å
39S63.2Low69.6Low89 Ų89113.6 Ų113.662%0.62264%0.64SS**SBendtrans-137.975.2174.661.30000112.4G37 Q41G37-S39 VanDerWaalsContact C-N 3.26Å; G37-S39 PolarHBondContact O-N 2.89Å; S39-Q41 PolarHBondContact O-N 3.4Å
40G65.1Low71.6Confident45 Ų45104.2 Ų104.246%0.46461%0.614SS.*SBendtrans72.4-35.3168.100000117.2N42 I43 L44G40-N42 VanDerWaalsContact C-N 3.31Å; G40-N42 PolarHBondContact O-N 3.43Å; G40-I43 WeakPolarHBondContact O-CB 3.42Å; G40-I43 PolarHBondContact O-N 3.42Å; G40-L44 PolarHBondContact O-N 3.06Å
41Q68.9Low73.4Confident145 Ų14596.9 Ų96.968%0.67860%0.601SS**Hα-helixtrans-62.9-34.1-173.2-69.8175.9-28.900113.2S39 I43 L44 Y45S39-Q41 PolarHBondContact O-N 3.4Å; Q41-I43 VanDerWaalsContact C-N 3.26Å; Q41-I43 PolarHBondContact O-N 2.96Å; Q41-L44 PolarHBondContact O-N 2.96Å; Q41-Y45 PolarHBondContact O-N 2.99Å; Q41-Y45 VanDerWaalsContact O-N 3.16Å
42N75.3Confident75.4Confident103 Ų10395.9 Ų95.955%0.55160%0.599SS**Hα-helixtrans-64.3-28.5173.9-70.85.7000113.1G40 Y45 T46G40-N42 VanDerWaalsContact C-N 3.31Å; G40-N42 PolarHBondContact O-N 3.43Å; N42-Y45 PolarHBondContact O-N 3.42Å; N42-T46 PolarHBondContact O-N 3.37Å; N42-T46 PolarHBondContact O-OG1 3.45Å
43I84.4Confident77.8Confident114 Ų11492.7 Ų92.759%0.58559%0.585SS**Hα-helixtrans-71.3-38.6178.5-54.3175.2000110G40 Q41 Y45 T46 V47G40-I43 WeakPolarHBondContact O-CB 3.42Å; G40-I43 PolarHBondContact O-N 3.42Å; Q41-I43 VanDerWaalsContact C-N 3.26Å; Q41-I43 PolarHBondContact O-N 2.96Å; I43-Y45 VanDerWaalsContact C-N 3.28Å; I43-Y45 PolarHBondContact O-N 3.5Å; I43-T46 PolarHBondContact O-N 3.19Å; I43-T46 PolarHBondContact O-OG1 2.91Å; I43-T46 VanDerWaalsContact O-OG1 3.13Å; I43-V47 HydrophobicContact CG2-CG2 4.43Å; I43-V47 WeakPolarHBondContact O-CB 3.47Å; I43-V47 VanDerWaalsContact O-CG2 3.28Å; I43-V47 WeakPolarHBondContact O-CG2 3.49Å; I43-V47 PolarHBondContact O-N 3.38Å
44L87.9Confident80Confident130 Ų13092.4 Ų92.468%0.68158%0.579SS**Hα-helixtrans-63.7-37.2172.2-63.3175.9000111.2G40 Q41 L48G40-L44 PolarHBondContact O-N 3.06Å; Q41-L44 PolarHBondContact O-N 2.96Å; L44-L48 WeakPolarHBondContact O-CB 3.45Å; L44-L48 PolarHBondContact O-N 3.18Å
45Y87Confident82.3Confident161 Ų16190.4 Ų90.463%0.63157%0.571SS**Hα-helixtrans-68.1-43.7175.7-172-97.4000112.8Q41 N42 I43 L48 C49Q41-Y45 PolarHBondContact O-N 2.99Å; Q41-Y45 VanDerWaalsContact O-N 3.16Å; N42-Y45 PolarHBondContact O-N 3.42Å; I43-Y45 VanDerWaalsContact C-N 3.28Å; I43-Y45 PolarHBondContact O-N 3.5Å; Y45-L48 PolarHBondContact O-N 2.86Å; Y45-C49 HydrophobicContact CE1-CB 4.42Å; Y45-C49 WeakPolarHBondContact O-CB 3.11Å; Y45-C49 PolarHBondContact O-N 3.08Å
46T91.8Very high84Confident91 Ų9188.2 Ų88.256%0.55856%0.564SS**Hα-helixtrans-68.2-37.9177.454.10000112.4N42 I43 G50N42-T46 PolarHBondContact O-N 3.37Å; N42-T46 PolarHBondContact O-OG1 3.45Å; I43-T46 PolarHBondContact O-N 3.19Å; I43-T46 PolarHBondContact O-OG1 2.91Å; I43-T46 VanDerWaalsContact O-OG1 3.13Å; T46-G50 WeakPolarHBondContact O-CA 3.41Å; T46-G50 PolarHBondContact O-N 2.95Å
47V95.5Very high86.3Confident101 Ų10186.9 Ų86.961%0.61255%0.549SS*.Hα-helixtrans-66.2-42.7174.1171.40000111.4I43 G51I43-V47 HydrophobicContact CG2-CG2 4.43Å; I43-V47 WeakPolarHBondContact O-CB 3.47Å; I43-V47 VanDerWaalsContact O-CG2 3.28Å; I43-V47 WeakPolarHBondContact O-CG2 3.49Å; I43-V47 PolarHBondContact O-N 3.38Å; V47-G51 PolarHBondContact O-N 3.22Å
48L95.7Very high88.2Confident130 Ų13088.4 Ų88.468%0.68155%0.553SS**Hα-helixtrans-66.6-47.9177.8-177.366.8000111.9L44 Y45 A52L44-L48 WeakPolarHBondContact O-CB 3.45Å; L44-L48 PolarHBondContact O-N 3.18Å; Y45-L48 PolarHBondContact O-N 2.86Å; L48-A52 WeakPolarHBondContact O-CB 3.3Å; L48-A52 PolarHBondContact O-N 3.23Å
49C94.1Very high89.9Confident49 Ų4992.7 Ų92.733%0.33155%0.546SS..Hα-helixtrans-70.3-44.1-178-164.60000111.5Y45 A52 L53Y45-C49 HydrophobicContact CE1-CB 4.42Å; Y45-C49 WeakPolarHBondContact O-CB 3.11Å; Y45-C49 PolarHBondContact O-N 3.08Å; C49-A52 PolarHBondContact O-N 3.28Å; C49-L53 WeakPolarHBondContact O-CG 3.48Å; C49-L53 PolarHBondContact O-N 2.73Å
50G97.3Very high91.6Very high31 Ų3189.8 Ų89.832%0.3253%0.531SS..Hα-helixtrans-62-42.7173.500000112.4T46 A52 L53 V54T46-G50 WeakPolarHBondContact O-CA 3.41Å; T46-G50 PolarHBondContact O-N 2.95Å; G50-A52 VanDerWaalsContact C-N 3.34Å; G50-A52 PolarHBondContact O-N 2.84Å; G50-L53 PolarHBondContact O-N 3Å; G50-V54 WeakPolarHBondContact O-CB 3.47Å; G50-V54 WeakPolarHBondContact O-CG2 3.31Å; G50-V54 PolarHBondContact O-N 3.44Å
51G98Very high93.1Very high46 Ų4696 Ų9647%0.47454%0.541SS..Hα-helixtrans-61.8-39.4173.700000113.1V47 G55V47-G51 PolarHBondContact O-N 3.22Å; G51-G55 PolarHBondContact O-N 3.17Å
52A97.8Very high94.5Very high62 Ų6296.5 Ų96.551%0.51254%0.541SS..Hα-helixtrans-66.3-43.4174.500000112.3L48 C49 G50 G55 A56L48-A52 WeakPolarHBondContact O-CB 3.3Å; L48-A52 PolarHBondContact O-N 3.23Å; C49-A52 PolarHBondContact O-N 3.28Å; G50-A52 VanDerWaalsContact C-N 3.34Å; G50-A52 PolarHBondContact O-N 2.84Å; A52-G55 PolarHBondContact O-N 3.45Å; A52-A56 WeakPolarHBondContact O-CB 3.46Å; A52-A56 PolarHBondContact O-N 3.03Å
53L97.8Very high95.6Very high104 Ų10494.1 Ų94.155%0.54553%0.531SS..Hα-helixtrans-64.2-48.1176.8-71.9169.8000111.9C49 G50 G55 A56 L57C49-L53 WeakPolarHBondContact O-CG 3.48Å; C49-L53 PolarHBondContact O-N 2.73Å; G50-L53 PolarHBondContact O-N 3Å; L53-G55 VanDerWaalsContact C-N 3.31Å; L53-G55 PolarHBondContact O-N 3.49Å; L53-A56 PolarHBondContact O-N 3.26Å; L53-L57 WeakPolarHBondContact O-CB 3.45Å; L53-L57 WeakPolarHBondContact O-CG 3.4Å; L53-L57 PolarHBondContact O-N 2.83Å
54V98.1Very high96.2Very high93 Ų9393.5 Ų93.556%0.56453%0.532SS*.Hα-helixtrans-62.2-39.41761720000111G50 S58G50-V54 WeakPolarHBondContact O-CB 3.47Å; G50-V54 WeakPolarHBondContact O-CG2 3.31Å; G50-V54 PolarHBondContact O-N 3.44Å; V54-S58 WeakPolarHBondContact O-CB 3.24Å; V54-S58 PolarHBondContact O-N 3.14Å; V54-S58 PolarHBondContact O-OG 2.95Å
55G98.1Very high96.6Very high40 Ų4089.6 Ų89.641%0.41251%0.514SS..Hα-helixtrans-62.7-45.6174.100000113G51 A52 L53 S58 Y59G51-G55 PolarHBondContact O-N 3.17Å; A52-G55 PolarHBondContact O-N 3.45Å; L53-G55 VanDerWaalsContact C-N 3.31Å; L53-G55 PolarHBondContact O-N 3.49Å; G55-S58 PolarHBondContact O-N 3.42Å; G55-Y59 WeakPolarHBondContact O-CB 3.5Å; G55-Y59 PolarHBondContact O-N 3.37Å
56A97.8Very high97.1Very high63 Ų6385.3 Ų85.352%0.52151%0.507SS..Hα-helixtrans-65.3-45.9178.300000112.2A52 L53 Y59 G60A52-A56 WeakPolarHBondContact O-CB 3.46Å; A52-A56 PolarHBondContact O-N 3.03Å; L53-A56 PolarHBondContact O-N 3.26Å; A56-Y59 PolarHBondContact O-N 3.44Å; A56-G60 PolarHBondContact O-N 2.9Å
57L98.1Very high97.3Very high109 Ų10984.7 Ų84.757%0.57150%0.501SS*.Hα-helixtrans-63.2-43.4175.8-71.5169.9000111.6L53 Y59 G60 Y61L53-L57 WeakPolarHBondContact O-CB 3.45Å; L53-L57 WeakPolarHBondContact O-CG 3.4Å; L53-L57 PolarHBondContact O-N 2.83Å; L57-Y59 VanDerWaalsContact C-N 3.34Å; L57-Y59 PolarHBondContact O-N 2.94Å; L57-G60 PolarHBondContact O-N 2.98Å; L57-Y61 WeakPolarHBondContact O-CB 3.47Å; L57-Y61 PolarHBondContact O-N 2.93Å
58S98Very high97.4Very high72 Ų7285 Ų8550%0.50350%0.495SS..Hα-helixtrans-64.1-38.2177-600000112.3V54 G55 K62V54-S58 WeakPolarHBondContact O-CB 3.24Å; V54-S58 PolarHBondContact O-N 3.14Å; V54-S58 PolarHBondContact O-OG 2.95Å; G55-S58 PolarHBondContact O-N 3.42Å; S58-K62 VanDerWaalsContact O-CB 3.31Å; S58-K62 WeakPolarHBondContact O-CB 3.49Å; S58-K62 PolarHBondContact O-N 2.97Å; S58-K62 VanDerWaalsContact O-N 3.1Å
59Y98Very high97.5Very high168 Ų16883 Ų8366%0.65949%0.485SS*.Hα-helixtrans-68-48.1174.9179.9-100.2000111.4G55 A56 L57 K62 T63G55-Y59 WeakPolarHBondContact O-CB 3.5Å; G55-Y59 PolarHBondContact O-N 3.37Å; A56-Y59 PolarHBondContact O-N 3.44Å; L57-Y59 VanDerWaalsContact C-N 3.34Å; L57-Y59 PolarHBondContact O-N 2.94Å; Y59-K62 PolarHBondContact O-N 3.43Å; Y59-T63 HydrophobicContact CD1-CG2 4.27Å; Y59-T63 HydrophobicContact CD2-CG2 4.39Å; Y59-T63 HydrophobicContact CE1-CG2 3.81Å; Y59-T63 HydrophobicContact CE2-CG2 3.95Å; Y59-T63 WeakPolarHBondContact O-CG2 3.38Å; Y59-T63 PolarHBondContact O-N 3.5Å; Y59-T63 PolarHBondContact O-OG1 2.98Å
60G98.3Very high97.6Very high29 Ų2987.1 Ų87.130%0.29949%0.494SS..Hα-helixtrans-59.9-45.7177.800000112.8A56 L57 K62 T63 V64A56-G60 PolarHBondContact O-N 2.9Å; L57-G60 PolarHBondContact O-N 2.98Å; G60-K62 PolarHBondContact O-N 3.46Å; G60-T63 PolarHBondContact O-N 3.34Å; G60-T63 PolarHBondContact O-OG1 3.28Å; G60-V64 WeakPolarHBondContact O-CB 3.33Å; G60-V64 VanDerWaalsContact O-CG2 3.24Å; G60-V64 WeakPolarHBondContact O-CG2 3.46Å; G60-V64 PolarHBondContact O-N 3.16Å
61Y98.1Very high97.6Very high174 Ų17490.8 Ų90.868%0.68250%0.501SS*.Hα-helixtrans-57.1-51.2172.7179.5-99000111L57 T63 V64 T65L57-Y61 WeakPolarHBondContact O-CB 3.47Å; L57-Y61 PolarHBondContact O-N 2.93Å; Y61-T63 PolarHBondContact O-N 2.75Å; Y61-V64 PolarHBondContact O-N 2.83Å; Y61-T65 WeakPolarHBondContact O-CB 3.26Å; Y61-T65 PolarHBondContact O-N 2.97Å; Y61-T65 PolarHBondContact O-OG1 2.83Å; Y61-T65 VanDerWaalsContact O-OG1 3.04Å
62K97.7Very high97.5Very high156 Ų15691.7 Ų91.768%0.67850%0.495SS*.Hα-helixtrans-63-39.4-177.9-173172.1-177.41750113.1S58 Y59 G60 S66S58-K62 VanDerWaalsContact O-CB 3.31Å; S58-K62 WeakPolarHBondContact O-CB 3.49Å; S58-K62 PolarHBondContact O-N 2.97Å; S58-K62 VanDerWaalsContact O-N 3.1Å; Y59-K62 PolarHBondContact O-N 3.43Å; G60-K62 PolarHBondContact O-N 3.46Å; K62-S66 VanDerWaalsContact O-CB 3.31Å; K62-S66 WeakPolarHBondContact O-CB 3.26Å; K62-S66 PolarHBondContact O-N 3.13Å; K62-S66 VanDerWaalsContact O-N 3.12Å; K62-S66 PolarHBondContact O-OG 3.29Å
63T97.8Very high97.4Very high53 Ų5394 Ų9433%0.32550%0.499SS..Hα-helixtrans-68.6-47.6176.653.30000111.1Y59 G60 Y61 S66 D67Y59-T63 HydrophobicContact CD1-CG2 4.27Å; Y59-T63 HydrophobicContact CD2-CG2 4.39Å; Y59-T63 HydrophobicContact CE1-CG2 3.81Å; Y59-T63 HydrophobicContact CE2-CG2 3.95Å; Y59-T63 WeakPolarHBondContact O-CG2 3.38Å; Y59-T63 PolarHBondContact O-N 3.5Å; Y59-T63 PolarHBondContact O-OG1 2.98Å; G60-T63 PolarHBondContact O-N 3.34Å; G60-T63 PolarHBondContact O-OG1 3.28Å; Y61-T63 PolarHBondContact O-N 2.75Å; T63-S66 PolarHBondContact O-N 2.79Å; T63-S66 PolarHBondContact O-OG 3.49Å; T63-D67 PolarHBondContact O-N 3.39Å
64V97.9Very high97.4Very high102 Ų10295.2 Ų95.262%0.61850%0.496SS*.Hα-helixtrans-60.4-47.4179171.20000111.5G60 Y61 S66 D67 H68G60-V64 WeakPolarHBondContact O-CB 3.33Å; G60-V64 VanDerWaalsContact O-CG2 3.24Å; G60-V64 WeakPolarHBondContact O-CG2 3.46Å; G60-V64 PolarHBondContact O-N 3.16Å; Y61-V64 PolarHBondContact O-N 2.83Å; V64-S66 VanDerWaalsContact C-N 3.34Å; V64-S66 PolarHBondContact O-N 3.21Å; V64-D67 PolarHBondContact O-N 3.27Å; V64-H68 WeakPolarHBondContact O-CB 3.48Å; V64-H68 PolarHBondContact O-N 3.44Å
65T96.9Very high97.3Very high47 Ų4792.8 Ų92.829%0.28848%0.48SS..Hα-helixtrans-59.2-45.3174.8-54.90000111.1Y61 D67 H68 D69Y61-T65 WeakPolarHBondContact O-CB 3.26Å; Y61-T65 PolarHBondContact O-N 2.97Å; Y61-T65 PolarHBondContact O-OG1 2.83Å; Y61-T65 VanDerWaalsContact O-OG1 3.04Å; T65-D67 PolarHBondContact O-N 3.04Å; T65-H68 WeakPolarHBondContact O-CB 3.43Å; T65-H68 PolarHBondContact O-N 3.03Å; T65-D69 PolarHBondContact O-N 3.19Å
66S96Very high97.1Very high71 Ų7193.9 Ų93.950%0.49748%0.481SS..Hα-helixtrans-66.6-33-177.171.50000114.7K62 T63 V64 R70K62-S66 VanDerWaalsContact O-CB 3.31Å; K62-S66 WeakPolarHBondContact O-CB 3.26Å; K62-S66 PolarHBondContact O-N 3.13Å; K62-S66 VanDerWaalsContact O-N 3.12Å; K62-S66 PolarHBondContact O-OG 3.29Å; T63-S66 PolarHBondContact O-N 2.79Å; T63-S66 PolarHBondContact O-OG 3.49Å; V64-S66 VanDerWaalsContact C-N 3.34Å; V64-S66 PolarHBondContact O-N 3.21Å; S66-R70 WeakPolarHBondContact O-CB 3.28Å; S66-R70 PolarHBondContact O-N 2.91Å
67D97.6Very high97Very high79 Ų7995.5 Ų95.542%0.42248%0.478SS..Hα-helixtrans-85-25173.7-154.568.6000111.9T63 V64 T65 R70 F71T63-D67 PolarHBondContact O-N 3.39Å; V64-D67 PolarHBondContact O-N 3.27Å; T65-D67 PolarHBondContact O-N 3.04Å; D67-R70 PolarHBondContact O-N 2.96Å; D67-R70 WeakPolarHBondContact OD1-CD 3.4Å; D67-R70 IonicContact OD1-CZ 2.73Å; D67-R70 IonicContact OD1-NH1 3.91Å; D67-R70 PolarHBondContact OD1-NH1 3.07Å; D67-F71 VanDerWaalsContact O-CB 3.26Å; D67-F71 WeakPolarHBondContact O-CB 3.38Å; D67-F71 PolarHBondContact O-N 2.76Å
68H96.9Very high96.8Very high106 Ų10695 Ų9549%0.49148%0.475SS..Hα-helixtrans-64.5-43.2168.9-175.278.6000111.9V64 T65 F71 N72V64-H68 WeakPolarHBondContact O-CB 3.48Å; V64-H68 PolarHBondContact O-N 3.44Å; T65-H68 WeakPolarHBondContact O-CB 3.43Å; T65-H68 PolarHBondContact O-N 3.03Å; H68-F71 WeakPolarHBondContact O-CB 3.49Å; H68-F71 PolarHBondContact O-N 2.91Å; H68-N72 PolarHBondContact CD2-ND2 3.29Å; H68-N72 PolarHBondContact NE2-ND2 2.82Å; H68-N72 WeakPolarHBondContact O-CB 3.32Å; H68-N72 PolarHBondContact O-N 3.32Å; H68-N72 PolarHBondContact O-ND2 3.11Å
69D97Very high96.5Very high90 Ų90100.2 Ų100.248%0.48148%0.484SS..Hα-helixtrans-59-48.8172.5-69.4-27.1000110.7T65 F71 N72 D73T65-D69 PolarHBondContact O-N 3.19Å; D69-F71 VanDerWaalsContact C-N 3.29Å; D69-F71 PolarHBondContact O-N 3.12Å; D69-N72 WeakPolarHBondContact O-CB 3.15Å; D69-N72 PolarHBondContact O-N 3.36Å; D69-N72 VanDerWaalsContact O-N 3.14Å; D69-D73 PolarHBondContact O-N 3.34Å
70R96.4Very high96.3Very high134 Ų13496.1 Ų96.151%0.50649%0.485SS..Hα-helixtrans-63.1-31.9176.9-169-164.8-172.6-163.87.3113.4S66 D67 R74S66-R70 WeakPolarHBondContact O-CB 3.28Å; S66-R70 PolarHBondContact O-N 2.91Å; D67-R70 PolarHBondContact O-N 2.96Å; D67-R70 WeakPolarHBondContact OD1-CD 3.4Å; D67-R70 IonicContact OD1-CZ 2.73Å; D67-R70 IonicContact OD1-NH1 3.91Å; D67-R70 PolarHBondContact OD1-NH1 3.07Å; R70-R74 WeakPolarHBondContact O-CG 3.22Å; R70-R74 PolarHBondContact O-N 3.29Å
71F96.6Very high95.9Very high108 Ų108101.4 Ų101.447%0.47450%0.496SS..Hα-helixtrans-70.6-45.5172.6176.8-96.2000110.6D67 H68 D69 D73 R74 I75D67-F71 VanDerWaalsContact O-CB 3.26Å; D67-F71 WeakPolarHBondContact O-CB 3.38Å; D67-F71 PolarHBondContact O-N 2.76Å; H68-F71 WeakPolarHBondContact O-CB 3.49Å; H68-F71 PolarHBondContact O-N 2.91Å; D69-F71 VanDerWaalsContact C-N 3.29Å; D69-F71 PolarHBondContact O-N 3.12Å; F71-D73 VanDerWaalsContact C-N 3.32Å; F71-D73 PolarHBondContact O-N 2.86Å; F71-R74 PolarHBondContact O-N 3.49Å; F71-I75 HydrophobicContact CD1-CG1 4.01Å; F71-I75 HydrophobicContact CD2-CG1 4.45Å; F71-I75 HydrophobicContact CE1-CD1 4.3Å; F71-I75 HydrophobicContact CE1-CG1 3.64Å; F71-I75 HydrophobicContact CE2-CD1 4.25Å; F71-I75 HydrophobicContact CE2-CG1 4.11Å; F71-I75 HydrophobicContact CG-CG1 4.41Å; F71-I75 HydrophobicContact CZ-CD1 3.88Å; F71-I75 HydrophobicContact CZ-CG1 3.7Å; F71-I75 WeakPolarHBondContact O-CB 3.43Å; F71-I75 VanDerWaalsContact O-CG1 3.29Å; F71-I75 WeakPolarHBondContact O-CG1 3.43Å; F71-I75 PolarHBondContact O-N 2.83Å
72N96.6Very high95.2Very high66 Ų6698.4 Ų98.435%0.35350%0.497SS..Hα-helixtrans-59.9-40.9174.7-74.4-36.4000111.9H68 D69 I75 S76H68-N72 PolarHBondContact CD2-ND2 3.29Å; H68-N72 PolarHBondContact NE2-ND2 2.82Å; H68-N72 WeakPolarHBondContact O-CB 3.32Å; H68-N72 PolarHBondContact O-N 3.32Å; H68-N72 PolarHBondContact O-ND2 3.11Å; D69-N72 WeakPolarHBondContact O-CB 3.15Å; D69-N72 PolarHBondContact O-N 3.36Å; D69-N72 VanDerWaalsContact O-N 3.14Å; N72-I75 PolarHBondContact O-N 2.74Å; N72-S76 WeakPolarHBondContact O-CB 3.38Å; N72-S76 PolarHBondContact O-N 2.99Å
73D96.8Very high94.2Very high110 Ų11099.6 Ų99.659%0.58850%0.503SS*.Hα-helixtrans-57-52172.3-82.6-18.1000111.5D69 F71 I75 S76 E77D69-D73 PolarHBondContact O-N 3.34Å; F71-D73 VanDerWaalsContact C-N 3.32Å; F71-D73 PolarHBondContact O-N 2.86Å; D73-I75 VanDerWaalsContact C-N 3.35Å; D73-I75 PolarHBondContact O-N 3.44Å; D73-S76 WeakPolarHBondContact O-CB 3.19Å; D73-S76 PolarHBondContact O-N 2.96Å; D73-S76 VanDerWaalsContact O-N 3.12Å; D73-S76 PolarHBondContact O-OG 2.97Å; D73-E77 PolarHBondContact O-N 2.9Å
74R96.4Very high93.1Very high129 Ų129103 Ų10349%0.48752%0.523SS..Hα-helixtrans-59.4-43177.2-74.8167.4166.3176.9-5.1112.4R70 F71 S76 E77 L78R70-R74 WeakPolarHBondContact O-CG 3.22Å; R70-R74 PolarHBondContact O-N 3.29Å; F71-R74 PolarHBondContact O-N 3.49Å; R74-S76 VanDerWaalsContact C-N 3.32Å; R74-E77 PolarHBondContact O-N 3.42Å; R74-L78 VanDerWaalsContact O-CG 3.3Å; R74-L78 WeakPolarHBondContact O-CG 3.38Å; R74-L78 PolarHBondContact O-N 3.05Å
75I96.4Very high91.7Very high42 Ų42106.2 Ų106.222%0.21553%0.532CS..Hα-helixtrans-67.3-34.5176.8-68.7-66.4000110.9F71 N72 D73 L78 R79F71-I75 HydrophobicContact CD1-CG1 4.01Å; F71-I75 HydrophobicContact CD2-CG1 4.45Å; F71-I75 HydrophobicContact CE1-CD1 4.3Å; F71-I75 HydrophobicContact CE1-CG1 3.64Å; F71-I75 HydrophobicContact CE2-CD1 4.25Å; F71-I75 HydrophobicContact CE2-CG1 4.11Å; F71-I75 HydrophobicContact CG-CG1 4.41Å; F71-I75 HydrophobicContact CZ-CD1 3.88Å; F71-I75 HydrophobicContact CZ-CG1 3.7Å; F71-I75 WeakPolarHBondContact O-CB 3.43Å; F71-I75 VanDerWaalsContact O-CG1 3.29Å; F71-I75 WeakPolarHBondContact O-CG1 3.43Å; F71-I75 PolarHBondContact O-N 2.83Å; N72-I75 PolarHBondContact O-N 2.74Å; D73-I75 VanDerWaalsContact C-N 3.35Å; D73-I75 PolarHBondContact O-N 3.44Å; I75-L78 HydrophobicContact CD1-CD1 4.49Å; I75-R79 WeakPolarHBondContact O-CB 3.46Å; I75-R79 WeakPolarHBondContact O-CD 3.2Å; I75-R79 WeakPolarHBondContact O-CG 3.39Å; I75-R79 PolarHBondContact O-N 3.44Å
76S95Very high90.4Very high63 Ų63114 Ų11444%0.44156%0.556SS.*Hα-helixtrans-65.8-42.3172.888.30000111.2N72 D73 R74 R79 A80N72-S76 WeakPolarHBondContact O-CB 3.38Å; N72-S76 PolarHBondContact O-N 2.99Å; D73-S76 WeakPolarHBondContact O-CB 3.19Å; D73-S76 PolarHBondContact O-N 2.96Å; D73-S76 VanDerWaalsContact O-N 3.12Å; D73-S76 PolarHBondContact O-OG 2.97Å; R74-S76 VanDerWaalsContact C-N 3.32Å; S76-R79 CarbonylContact O-C 3.59Å; S76-R79 PolarHBondContact O-N 2.93Å; S76-A80 VanDerWaalsContact O-CB 3.27Å; S76-A80 WeakPolarHBondContact O-CB 3.46Å; S76-A80 PolarHBondContact O-N 3.3Å
77E95.6Very high89.1Confident97 Ų97115.3 Ų115.345%0.45356%0.561SS.*Hα-helixtrans-63.4-46.4176.6-158.3-139.5122.200110.9D73 R74 R79 A80 R81D73-E77 PolarHBondContact O-N 2.9Å; R74-E77 PolarHBondContact O-N 3.42Å; E77-R79 VanDerWaalsContact C-N 3.26Å; E77-R79 PolarHBondContact O-N 3.26Å; E77-A80 PolarHBondContact O-N 3.47Å; E77-A80 VanDerWaalsContact O-N 3.13Å; E77-R81 WeakPolarHBondContact O-CG 3.17Å; E77-R81 PolarHBondContact O-N 2.9Å; E77-R81 IonicContact OE1-CZ 2.96Å; E77-R81 IonicContact OE1-NE 3.12Å; E77-R81 PolarHBondContact OE1-NE 3.2Å; E77-R81 IonicContact OE1-NH2 3.86Å; E77-R81 PolarHBondContact OE1-NH2 3.43Å; E77-R81 IonicContact OE2-NH2 2.75Å
78L93.9Very high88Confident98 Ų98115.9 Ų115.951%0.51357%0.569SS.*Hα-helixtrans-63.7-27.9175.9-69170.8000113.3R74 I75R74-L78 VanDerWaalsContact O-CG 3.3Å; R74-L78 WeakPolarHBondContact O-CG 3.38Å; R74-L78 PolarHBondContact O-N 3.05Å; I75-L78 HydrophobicContact CD1-CD1 4.49Å
79R91Very high86.9Confident183 Ų183119.8 Ų119.869%0.69159%0.585SS**Hα-helixtrans-79.1-33.6171.9-72.9166.9-179.5164.62.1112.6I75 S76 E77I75-R79 WeakPolarHBondContact O-CB 3.46Å; I75-R79 WeakPolarHBondContact O-CD 3.2Å; I75-R79 WeakPolarHBondContact O-CG 3.39Å; I75-R79 PolarHBondContact O-N 3.44Å; S76-R79 CarbonylContact O-C 3.59Å; S76-R79 PolarHBondContact O-N 2.93Å; E77-R79 VanDerWaalsContact C-N 3.26Å; E77-R79 PolarHBondContact O-N 3.26Å
80A93.6Very high85.9Confident82 Ų82121.2 Ų121.268%0.67860%0.599SS**Hα-helixtrans-81-25.2-179.400000113.4S76 E77S76-A80 VanDerWaalsContact O-CB 3.27Å; S76-A80 WeakPolarHBondContact O-CB 3.46Å; S76-A80 PolarHBondContact O-N 3.3Å; E77-A80 PolarHBondContact O-N 3.47Å; E77-A80 VanDerWaalsContact O-N 3.13Å
81R89.2Confident84Confident139 Ų139125.3 Ų125.353%0.52561%0.614SS.*SBendtrans-53.5126.4168.6-78.6175.5-171.8-162.13109.2E77 K83E77-R81 WeakPolarHBondContact O-CG 3.17Å; E77-R81 PolarHBondContact O-N 2.9Å; E77-R81 IonicContact OE1-CZ 2.96Å; E77-R81 IonicContact OE1-NE 3.12Å; E77-R81 PolarHBondContact OE1-NE 3.2Å; E77-R81 IonicContact OE1-NH2 3.86Å; E77-R81 PolarHBondContact OE1-NH2 3.43Å; E77-R81 IonicContact OE2-NH2 2.75Å; R81-K83 PolarHBondContact O-N 3.44Å
82P84.3Confident82.8Confident111 Ų111124.7 Ų124.772%0.72162%0.621SS**  trans-62.9118-179.225.4-33.4000109T84P82-T84 PolarHBondContact O-N 3.09Å
83K77.2Confident81.1Confident182 Ų182125.5 Ų125.579%0.79163%0.63SS**  trans-69.481.4176.4-64-179.8-177.3-179.80109R81 E85R81-K83 PolarHBondContact O-N 3.44Å; K83-E85 PolarHBondContact O-N 2.69Å; K83-E85 VanDerWaalsContact O-N 3.08Å
84T74.5Confident79.1Confident123 Ų123130.9 Ų130.976%0.75565%0.648SS**  trans-59.8112.5175.151.40000108.3P82 W86P82-T84 PolarHBondContact O-N 3.09Å; T84-W86 PolarHBondContact O-N 2.95Å
85E68.2Low77.1Confident171 Ų171127.9 Ų127.980%0.79966%0.657SS**  trans-53.8105.7-177.9-173.3179.5170.300110.1K83 T87K83-E85 PolarHBondContact O-N 2.69Å; K83-E85 VanDerWaalsContact O-N 3.08Å; E85-T87 VanDerWaalsContact C-N 3.31Å; E85-T87 PolarHBondContact O-N 2.94Å
86W69.3Low74.5Confident210 Ų210134.1 Ų134.180%0.79568%0.683SS**  trans-7489.9178.1-178.384.3000108.3T84 P88T84-W86 PolarHBondContact O-N 2.95Å; W86-P88 HydrophobicContact CE3-CB 4.28Å; W86-P88 HydrophobicContact CH2-CB 3.77Å; W86-P88 HydrophobicContact CZ3-CB 3.63Å; W86-P88 HydrophobicContact CZ3-CG 4.35Å; W86-P88 VanDerWaalsContact O-CD 3.27Å; W86-P88 WeakPolarHBondContact O-CD 3.34Å
87T68.7Low72.1Confident99 Ų99137 Ų13761%0.60769%0.693SS**PPolyproline II helixtrans-69.5116.1169.554.90000108.2E85 K89E85-T87 VanDerWaalsContact C-N 3.31Å; E85-T87 PolarHBondContact O-N 2.94Å; T87-K89 PolarHBondContact O-N 2.86Å
88P75.6Confident69.6Low90 Ų90141.6 Ų141.658%0.58472%0.715SS**PPolyproline II helixtrans-58.9117.3178.221.3-31.8000109.6W86 P90W86-P88 HydrophobicContact CE3-CB 4.28Å; W86-P88 HydrophobicContact CH2-CB 3.77Å; W86-P88 HydrophobicContact CZ3-CB 3.63Å; W86-P88 HydrophobicContact CZ3-CG 4.35Å; W86-P88 VanDerWaalsContact O-CD 3.27Å; W86-P88 WeakPolarHBondContact O-CD 3.34Å; P88-P90 WeakPolarHBondContact O-CD 3.31Å
89K72.3Confident67.2Low189 Ų189144.7 Ų144.782%0.82273%0.732SS**PPolyproline II helixtrans-67.7117.2175.9-167.1174.3-1741770107.3T87 W91T87-K89 PolarHBondContact O-N 2.86Å; K89-W91 PolarHBondContact O-N 3.26Å; K89-W91 VanDerWaalsContact O-N 3.1Å
90P75.6Confident64.7Low120 Ų120139.7 Ų139.778%0.77974%0.738SS**PPolyproline II helixtrans-62.6118.2-165.721.8-33.1000111.5P88P88-P90 WeakPolarHBondContact O-CD 3.31Å
91W57Low62.4Low219 Ų219145.1 Ų145.183%0.8375%0.749SS**SBendtrans-102.8150.2176.9-164.2-98.9000109.2K89 P93K89-W91 PolarHBondContact O-N 3.26Å; K89-W91 VanDerWaalsContact O-N 3.1Å; W91-P93 HydrophobicContact CH2-CG 4.01Å; W91-P93 HydrophobicContact CZ2-CG 4.33Å; W91-P93 HydrophobicContact CZ3-CG 4.18Å
92P71.4Confident60.2Low96 Ų96142.7 Ų142.762%0.62376%0.758SS**SBendcis-79.5160.9-2.833.7-36.2000113.7
93P61.5Low58.2Low82 Ų82144.7 Ų144.753%0.53276%0.763SS.*PPolyproline II helixtrans-58.7139.8163.128.5-34.9000108.9W91 G95W91-P93 HydrophobicContact CH2-CG 4.01Å; W91-P93 HydrophobicContact CZ2-CG 4.33Å; W91-P93 HydrophobicContact CZ3-CG 4.18Å; P93-G95 PolarHBondContact O-N 3.4Å
94K53.9Low56.6Low224 Ų224141.2 Ų141.297%0.97477%0.768SS**SBendtrans-7277.6174.3-80.3-165.5171.2-173.50110.8
95G54.7Low55.2Low65 Ų65138.2 Ų138.267%0.6776%0.761SS**  trans-128.458.2-176.100000112.1P93P93-G95 PolarHBondContact O-N 3.4Å
96K41.9Very low54.2Low174 Ų174137.8 Ų137.876%0.75776%0.759SS**  trans39.2112.6151.9-163.8-168.8177.1-156.50118.7
97D45.5Very low52.9Low123 Ų123136 Ų13666%0.65876%0.76SS**  trans35.4102.7142.4-25.7-32000118.2
98E41.9Very low51.8Low193 Ų193139.3 Ų139.390%0.90277%0.769SS**  -172.2168.9114.2-98.5160.6-157.400110.9
99D44.3Very low50.5Low163 Ų163137.8 Ų137.887%0.87276%0.764SS**  trans-75.9149-160.634.7-70.5000116.8
100G38Very low49.4Very low79 Ų79131.6 Ų131.681%0.81475%0.747SS**  trans-178.445.8-176.400000114.9A102G100-A102 PolarHBondContact O-N 2.93Å
101E45.3Very low48.1Very low196 Ų196128.9 Ų128.992%0.91674%0.735SS**  trans-88.497.5179.3-178.277-17300111.3
102A43.7Very low47.9Very low87 Ų87121.4 Ų121.472%0.71972%0.72SS**  trans-169159.2158.800000110.9G100G100-A102 PolarHBondContact O-N 2.93Å
103D42.4Very low47.1Very low154 Ų154120.9 Ų120.982%0.82472%0.715SS**  trans58.480.6164.9-10155.5000118.6
104A42.1Very low46.7Very low109 Ų109119.6 Ų119.690%0.90171%0.712SS**  trans-15144.7160.300000110.7
105G46.5Very low46.7Very low59 Ų59111.5 Ų111.561%0.60869%0.687SS**SBendtrans-135.1-23.4-167.600000117.8
106E45.6Very low46.8Very low162 Ų162111 Ų11176%0.75768%0.675SS**SBendtrans-95.8-27.6-178.3-66.5-168.7132.300113.6A109 A110E106-A109 PolarHBondContact O-N 3.42Å; E106-A110 PolarHBondContact O-N 3.32Å; E106-A110 VanDerWaalsContact O-N 3.16Å
107E43.9Very low47.5Very low173 Ų173108.7 Ų108.781%0.80867%0.668SS**Hα-helixtrans-71.5-38.9-174.9-164.3172.9-156.500113.2A109 A110 A111E107-A109 VanDerWaalsContact C-N 3.33Å; E107-A109 PolarHBondContact O-N 2.89Å; E107-A110 PolarHBondContact O-N 2.9Å; E107-A111 PolarHBondContact O-N 3.46Å; E107-A111 VanDerWaalsContact O-N 3.09Å
108E43.8Very low47.8Very low169 Ų169105.2 Ų105.279%0.7966%0.656SS**Hα-helixtrans-69.1-31.6177-167.8172.4-133.500111.9A112E108-A112 WeakPolarHBondContact O-CB 3.34Å; E108-A112 PolarHBondContact O-N 2.9Å; E108-A112 VanDerWaalsContact O-N 3.1Å
109A48.8Very low48.6Very low58 Ų58103 Ų10348%0.47965%0.646SS.*Hα-helixtrans-68.3-44.5174.800000111.9E106 E107 A111 A112 T113E106-A109 PolarHBondContact O-N 3.42Å; E107-A109 VanDerWaalsContact C-N 3.33Å; E107-A109 PolarHBondContact O-N 2.89Å; A109-A111 PolarHBondContact O-N 3.25Å; A109-A112 PolarHBondContact O-N 2.99Å; A109-T113 PolarHBondContact O-N 2.92Å; A109-T113 PolarHBondContact O-OG1 2.98Å
110A49Very low49.1Very low58 Ų5899.6 Ų99.648%0.47963%0.631SS.*Hα-helixtrans-64.8-37.6177.600000112.6E106 E107 T113 A114E106-A110 PolarHBondContact O-N 3.32Å; E106-A110 VanDerWaalsContact O-N 3.16Å; E107-A110 PolarHBondContact O-N 2.9Å; A110-T113 PolarHBondContact O-OG1 3.14Å; A110-A114 WeakPolarHBondContact O-CB 3.33Å; A110-A114 PolarHBondContact O-N 3.25Å; A110-A114 VanDerWaalsContact O-N 3.08Å
111A49.7Very low50.3Low63 Ų63101 Ų10152%0.52162%0.618SS.*Hα-helixtrans-65.1-40.5174.100000112.2E107 A109 A115E107-A111 PolarHBondContact O-N 3.46Å; E107-A111 VanDerWaalsContact O-N 3.09Å; A109-A111 PolarHBondContact O-N 3.25Å; A111-A115 WeakPolarHBondContact O-CB 3.35Å; A111-A115 PolarHBondContact O-N 2.95Å
112A52.5Low51Low62 Ų6296.4 Ų96.451%0.51260%0.604SS.*Hα-helixtrans-66.4-40.1177.600000112.7E108 A109 A116E108-A112 WeakPolarHBondContact O-CB 3.34Å; E108-A112 PolarHBondContact O-N 2.9Å; E108-A112 VanDerWaalsContact O-N 3.1Å; A109-A112 PolarHBondContact O-N 2.99Å; A112-A116 PolarHBondContact O-N 3.35Å; A112-A116 VanDerWaalsContact O-N 3.13Å
113T53.9Low51.7Low85 Ų8599.3 Ų99.352%0.52160%0.602SS.*Hα-helixtrans-67.5-42.7175.548.80000112.2A109 A110 A115 A116 E117A109-T113 PolarHBondContact O-N 2.92Å; A109-T113 PolarHBondContact O-OG1 2.98Å; A110-T113 PolarHBondContact O-OG1 3.14Å; T113-A115 VanDerWaalsContact C-N 3.31Å; T113-A115 PolarHBondContact O-N 3.34Å; T113-A116 PolarHBondContact O-N 2.96Å; T113-E117 PolarHBondContact O-N 3.29Å
114A53.5Low52.1Low56 Ų5698.3 Ų98.346%0.46359%0.593SS.*Hα-helixtrans-65.5-33.8178.500000112.7A110 A118A110-A114 WeakPolarHBondContact O-CB 3.33Å; A110-A114 PolarHBondContact O-N 3.25Å; A110-A114 VanDerWaalsContact O-N 3.08Å; A114-A118 WeakPolarHBondContact O-CB 3.3Å; A114-A118 PolarHBondContact O-N 3.12Å; A114-A118 VanDerWaalsContact O-N 3.1Å
115A54.1Low52.6Low54 Ų5495.6 Ų95.645%0.44657%0.571SS.*Hα-helixtrans-67.5-42.8173.100000112.1A111 T113 A118 E119A111-A115 WeakPolarHBondContact O-CB 3.35Å; A111-A115 PolarHBondContact O-N 2.95Å; T113-A115 VanDerWaalsContact C-N 3.31Å; T113-A115 PolarHBondContact O-N 3.34Å; A115-A118 PolarHBondContact O-N 2.93Å; A115-E119 PolarHBondContact O-N 3.18Å
116A56Low53.4Low53 Ų5395.4 Ų95.444%0.43856%0.563SS.*Hα-helixtrans-64.8-43.1178.100000112.4A112 T113 A118 E119 T120A112-A116 PolarHBondContact O-N 3.35Å; A112-A116 VanDerWaalsContact O-N 3.13Å; T113-A116 PolarHBondContact O-N 2.96Å; A116-A118 VanDerWaalsContact C-N 3.34Å; A116-A118 PolarHBondContact O-N 3.46Å; A116-E119 PolarHBondContact O-N 3.22Å; A116-T120 PolarHBondContact O-N 3.1Å; A116-T120 PolarHBondContact O-OG1 3.35Å
117E57.3Low54.3Low127 Ų12794.8 Ų94.859%0.59356%0.56SS**Hα-helixtrans-61.8-42.4174.2-71.4-179.516300111.1T113 E119 T120 I121T113-E117 PolarHBondContact O-N 3.29Å; E117-E119 PolarHBondContact O-N 3.49Å; E117-T120 WeakPolarHBondContact CA-OG1 3.39Å; E117-T120 PolarHBondContact O-N 2.88Å; E117-T120 PolarHBondContact O-OG1 3.4Å; E117-I121 WeakPolarHBondContact O-CD1 3.5Å; E117-I121 VanDerWaalsContact O-CG1 3.31Å; E117-I121 WeakPolarHBondContact O-CG1 3.3Å; E117-I121 PolarHBondContact O-N 2.85Å
118A51.9Low55Low50 Ų5090.5 Ų90.541%0.41355%0.546SS..Hα-helixtrans-62.9-39.8176.300000113.4A114 A115 A116 I121 V122A114-A118 WeakPolarHBondContact O-CB 3.3Å; A114-A118 PolarHBondContact O-N 3.12Å; A114-A118 VanDerWaalsContact O-N 3.1Å; A115-A118 PolarHBondContact O-N 2.93Å; A116-A118 VanDerWaalsContact C-N 3.34Å; A116-A118 PolarHBondContact O-N 3.46Å; A118-I121 PolarHBondContact O-N 3.49Å; A118-V122 WeakPolarHBondContact O-CG2 3.31Å; A118-V122 PolarHBondContact O-N 3.38Å; A118-V122 VanDerWaalsContact O-N 3.15Å
119E58.8Low56.1Low147 Ų14787.2 Ų87.269%0.68754%0.537SS*.Hα-helixtrans-64.9-41.4174.3-74.3-174.1154.200111.5A115 A116 E117 I121 V122 E123A115-E119 PolarHBondContact O-N 3.18Å; A116-E119 PolarHBondContact O-N 3.22Å; E117-E119 PolarHBondContact O-N 3.49Å; E119-I121 PolarHBondContact O-N 2.91Å; E119-V122 PolarHBondContact O-N 3.46Å; E119-E123 PolarHBondContact O-N 2.81Å
120T54.1Low57.3Low91 Ų9187 Ų8756%0.55854%0.536SS*.Hα-helixtrans-63.8-37.1176.753.10000113.5A116 E117 V122 E123 E124A116-T120 PolarHBondContact O-N 3.1Å; A116-T120 PolarHBondContact O-OG1 3.35Å; E117-T120 WeakPolarHBondContact CA-OG1 3.39Å; E117-T120 PolarHBondContact O-N 2.88Å; E117-T120 PolarHBondContact O-OG1 3.4Å; T120-V122 VanDerWaalsContact C-N 3.31Å; T120-V122 PolarHBondContact O-N 3.04Å; T120-E123 PolarHBondContact O-N 3.19Å; T120-E124 PolarHBondContact O-N 3.03Å
121I62.4Low58Low107 Ų10791.1 Ų91.155%0.54955%0.545SS..Hα-helixtrans-69.3-30.5176.6-65.7162000111.2E117 A118 E119 A125E117-I121 WeakPolarHBondContact O-CD1 3.5Å; E117-I121 VanDerWaalsContact O-CG1 3.31Å; E117-I121 WeakPolarHBondContact O-CG1 3.3Å; E117-I121 PolarHBondContact O-N 2.85Å; A118-I121 PolarHBondContact O-N 3.49Å; E119-I121 PolarHBondContact O-N 2.91Å; I121-A125 VanDerWaalsContact O-CB 3.23Å; I121-A125 WeakPolarHBondContact O-CB 3.49Å; I121-A125 PolarHBondContact O-N 2.89Å
122V60.5Low58.5Low100 Ų10090.6 Ų90.661%0.60654%0.54SS*.Hα-helixtrans-74.7-37.3175.9169.70000111.8A118 E119 T120 A126A118-V122 WeakPolarHBondContact O-CG2 3.31Å; A118-V122 PolarHBondContact O-N 3.38Å; A118-V122 VanDerWaalsContact O-N 3.15Å; E119-V122 PolarHBondContact O-N 3.46Å; T120-V122 VanDerWaalsContact C-N 3.31Å; T120-V122 PolarHBondContact O-N 3.04Å; V122-A126 VanDerWaalsContact O-CB 3.32Å; V122-A126 WeakPolarHBondContact O-CB 3.33Å; V122-A126 PolarHBondContact O-N 2.93Å
123E58.5Low59.3Low149 Ų14990.4 Ų90.470%0.69654%0.539SS*.Hα-helixtrans-64.1-47.7172.2-68.7-93.4116.100111E119 T120 A125 A126 E127E119-E123 PolarHBondContact O-N 2.81Å; T120-E123 PolarHBondContact O-N 3.19Å; E123-A125 PolarHBondContact O-N 3.45Å; E123-A126 WeakPolarHBondContact O-CB 3.42Å; E123-A126 PolarHBondContact O-N 2.85Å; E123-A126 VanDerWaalsContact O-N 3.1Å; E123-E127 PolarHBondContact O-N 3.37Å
124E50.4Low59.9Low132 Ų13293.6 Ų93.662%0.61755%0.548SS*.Hα-helixtrans-58.6-45.7175.8-173-171.6142.400111.6T120 A126 E127 V128T120-E124 PolarHBondContact O-N 3.03Å; E124-A126 VanDerWaalsContact C-N 3.29Å; E124-A126 PolarHBondContact O-N 3.36Å; E124-E127 PolarHBondContact O-N 3.42Å; E124-V128 WeakPolarHBondContact O-CG2 3.31Å; E124-V128 PolarHBondContact O-N 3.39Å
125A53.6Low60.4Low53 Ų5393.6 Ų93.644%0.43855%0.548SS..Hα-helixtrans-65.2-30.9176.700000112.9I121 E123 V129I121-A125 VanDerWaalsContact O-CB 3.23Å; I121-A125 WeakPolarHBondContact O-CB 3.49Å; I121-A125 PolarHBondContact O-N 2.89Å; E123-A125 PolarHBondContact O-N 3.45Å; A125-V129 WeakPolarHBondContact O-CB 3.35Å; A125-V129 WeakPolarHBondContact O-CG2 3.34Å; A125-V129 PolarHBondContact O-N 3.1Å; A125-V129 VanDerWaalsContact O-N 3.11Å
126A63.7Low61.1Low55 Ų5594.8 Ų94.846%0.45555%0.549SS..Hα-helixtrans-72.6-38.217500000112V122 E123 E124 V129 A130V122-A126 VanDerWaalsContact O-CB 3.32Å; V122-A126 WeakPolarHBondContact O-CB 3.33Å; V122-A126 PolarHBondContact O-N 2.93Å; E123-A126 WeakPolarHBondContact O-CB 3.42Å; E123-A126 PolarHBondContact O-N 2.85Å; E123-A126 VanDerWaalsContact O-N 3.1Å; E124-A126 VanDerWaalsContact C-N 3.29Å; E124-A126 PolarHBondContact O-N 3.36Å; A126-V129 PolarHBondContact O-N 2.88Å; A126-A130 WeakPolarHBondContact O-CB 3.49Å; A126-A130 PolarHBondContact O-N 3.14Å
127E63.9Low61.6Low148 Ų14895.1 Ų95.169%0.69255%0.549SS*.Hα-helixtrans-63.5-47.6174.7-171.9170.8-17200111.2E123 E124 V129 A130 E131E123-E127 PolarHBondContact O-N 3.37Å; E124-E127 PolarHBondContact O-N 3.42Å; E127-V129 VanDerWaalsContact C-N 3.31Å; E127-V129 PolarHBondContact O-N 3.1Å; E127-A130 WeakPolarHBondContact O-CB 3.44Å; E127-A130 PolarHBondContact O-N 3.34Å; E127-E131 PolarHBondContact O-N 3.04Å
128V58.6Low62.2Low83 Ų8396.3 Ų96.350%0.50355%0.554SS.*Hα-helixtrans-62.9-35.5176.2174.40000112.2E124 A132E124-V128 WeakPolarHBondContact O-CG2 3.31Å; E124-V128 PolarHBondContact O-N 3.39Å; V128-A132 VanDerWaalsContact O-CB 3.31Å; V128-A132 WeakPolarHBondContact O-CB 3.48Å; V128-A132 PolarHBondContact O-N 3.43Å
129V67.8Low62.9Low101 Ų10196.5 Ų96.561%0.61256%0.556SS**Hα-helixtrans-71-31.81741670000111.9A125 A126 E127 A133A125-V129 WeakPolarHBondContact O-CB 3.35Å; A125-V129 WeakPolarHBondContact O-CG2 3.34Å; A125-V129 PolarHBondContact O-N 3.1Å; A125-V129 VanDerWaalsContact O-N 3.11Å; A126-V129 PolarHBondContact O-N 2.88Å; E127-V129 VanDerWaalsContact C-N 3.31Å; E127-V129 PolarHBondContact O-N 3.1Å; V129-A133 WeakPolarHBondContact O-CB 3.46Å; V129-A133 PolarHBondContact O-N 2.85Å
130A72.5Confident63.7Low54 Ų5492.2 Ų92.245%0.44655%0.546SS..Hα-helixtrans-70.4-45174.100000111.9A126 E127 A132 A133 E134A126-A130 WeakPolarHBondContact O-CB 3.49Å; A126-A130 PolarHBondContact O-N 3.14Å; E127-A130 WeakPolarHBondContact O-CB 3.44Å; E127-A130 PolarHBondContact O-N 3.34Å; A130-A132 VanDerWaalsContact C-N 3.33Å; A130-A132 PolarHBondContact O-N 2.93Å; A130-A133 WeakPolarHBondContact O-CB 3.48Å; A130-A133 PolarHBondContact O-N 3.41Å; A130-A133 VanDerWaalsContact O-N 3.1Å; A130-E134 PolarHBondContact O-N 3.4Å
131E63.8Low64.8Low143 Ų14393.7 Ų93.767%0.66855%0.546SS*.Hα-helixtrans-58.4-45.3173.5-171.5-171.7170.400111.1E127 A133 E134 A135E127-E131 PolarHBondContact O-N 3.04Å; E131-A133 VanDerWaalsContact C-N 3.29Å; E131-A133 PolarHBondContact O-N 3.11Å; E131-E134 PolarHBondContact O-N 3.34Å; E131-A135 WeakPolarHBondContact O-CB 3.49Å; E131-A135 PolarHBondContact O-N 2.89Å
132A60.9Low65.1Low52 Ų5290.9 Ų90.943%0.4354%0.539SS..Hα-helixtrans-63.6-32.4175.600000113V128 A130 V136V128-A132 VanDerWaalsContact O-CB 3.31Å; V128-A132 WeakPolarHBondContact O-CB 3.48Å; V128-A132 PolarHBondContact O-N 3.43Å; A130-A132 VanDerWaalsContact C-N 3.33Å; A130-A132 PolarHBondContact O-N 2.93Å; A132-V136 WeakPolarHBondContact O-CB 3.21Å; A132-V136 VanDerWaalsContact O-CG2 3.25Å; A132-V136 WeakPolarHBondContact O-CG2 3.34Å; A132-V136 PolarHBondContact O-N 3.21Å; A132-V136 VanDerWaalsContact O-N 3.09Å
133A69.9Low65.7Low58 Ų5891 Ų9148%0.47954%0.54SS..Hα-helixtrans-73-41.5176.500000112.4V129 A130 E131 V136 S137V129-A133 WeakPolarHBondContact O-CB 3.46Å; V129-A133 PolarHBondContact O-N 2.85Å; A130-A133 WeakPolarHBondContact O-CB 3.48Å; A130-A133 PolarHBondContact O-N 3.41Å; A130-A133 VanDerWaalsContact O-N 3.1Å; E131-A133 VanDerWaalsContact C-N 3.29Å; E131-A133 PolarHBondContact O-N 3.11Å; A133-V136 PolarHBondContact O-N 2.89Å; A133-S137 PolarHBondContact O-N 3.02Å
134E66.3Low66.6Low152 Ų15286.2 Ų86.271%0.7153%0.526SS*.Hα-helixtrans-59.6-48.4173-70.2-103.2122.900110.6A130 E131 V136 S137 E138A130-E134 PolarHBondContact O-N 3.4Å; E131-E134 PolarHBondContact O-N 3.34Å; E134-V136 VanDerWaalsContact C-N 3.31Å; E134-V136 PolarHBondContact O-N 3.4Å; E134-S137 WeakPolarHBondContact O-CA 3.25Å; E134-S137 WeakPolarHBondContact O-CB 3.45Å; E134-S137 PolarHBondContact O-N 3.45Å; E134-E138 PolarHBondContact O-N 2.93Å
135A63.2Low67.5Low56 Ų5685.8 Ų85.846%0.46352%0.524SS..Hα-helixtrans-62.2-34.917800000113.1E131 A139E131-A135 WeakPolarHBondContact O-CB 3.49Å; E131-A135 PolarHBondContact O-N 2.89Å; A135-A139 VanDerWaalsContact O-CB 3.32Å; A135-A139 WeakPolarHBondContact O-CB 3.21Å; A135-A139 PolarHBondContact O-N 3.11Å; A135-A139 VanDerWaalsContact O-N 3.11Å
136V69.1Low68.2Low79 Ų7987.3 Ų87.348%0.47953%0.527SS..Hα-helixtrans-70.7-32.2172.2166.70000111.7A132 A133 E134 A140A132-V136 WeakPolarHBondContact O-CB 3.21Å; A132-V136 VanDerWaalsContact O-CG2 3.25Å; A132-V136 WeakPolarHBondContact O-CG2 3.34Å; A132-V136 PolarHBondContact O-N 3.21Å; A132-V136 VanDerWaalsContact O-N 3.09Å; A133-V136 PolarHBondContact O-N 2.89Å; E134-V136 VanDerWaalsContact C-N 3.31Å; E134-V136 PolarHBondContact O-N 3.4Å; V136-A140 VanDerWaalsContact O-CB 3.3Å; V136-A140 WeakPolarHBondContact O-CB 3.24Å; V136-A140 PolarHBondContact O-N 3.34Å
137S65.7Low68.9Low61 Ų6187.3 Ų87.343%0.42753%0.528SS..Hα-helixtrans-68.9-47.7175.2-160.70000111.8A133 E134 A139 A140 E141A133-S137 PolarHBondContact O-N 3.02Å; E134-S137 WeakPolarHBondContact O-CA 3.25Å; E134-S137 WeakPolarHBondContact O-CB 3.45Å; E134-S137 PolarHBondContact O-N 3.45Å; S137-A139 VanDerWaalsContact C-N 3.31Å; S137-A139 PolarHBondContact O-N 3.19Å; S137-A140 WeakPolarHBondContact O-CB 3.43Å; S137-A140 PolarHBondContact O-N 3.43Å; S137-A140 VanDerWaalsContact O-N 3.11Å; S137-E141 PolarHBondContact O-N 3.09Å
138E69.9Low69.1Low151 Ų15186.6 Ų86.671%0.70652%0.524SS*.Hα-helixtrans-59.2-43.5175-171.1-174.9176.500111E134 A140 E141 A142E134-E138 PolarHBondContact O-N 2.93Å; E138-A140 VanDerWaalsContact C-N 3.33Å; E138-A140 PolarHBondContact O-N 2.98Å; E138-E141 PolarHBondContact O-N 2.96Å; E138-A142 WeakPolarHBondContact O-CB 3.32Å; E138-A142 PolarHBondContact O-N 3.11Å
139A68.3Low69.5Low55 Ų5589.6 Ų89.646%0.45553%0.533SS..Hα-helixtrans-62.8-37.3175.100000112.8A135 S137 V143A135-A139 VanDerWaalsContact O-CB 3.32Å; A135-A139 WeakPolarHBondContact O-CB 3.21Å; A135-A139 PolarHBondContact O-N 3.11Å; A135-A139 VanDerWaalsContact O-N 3.11Å; S137-A139 VanDerWaalsContact C-N 3.31Å; S137-A139 PolarHBondContact O-N 3.19Å; A139-V143 VanDerWaalsContact O-CG2 3.31Å; A139-V143 WeakPolarHBondContact O-CG2 3.46Å; A139-V143 PolarHBondContact O-N 3.26Å
140A75.1Confident69.7Low57 Ų5789.3 Ų89.347%0.47153%0.531SS..Hα-helixtrans-68.7-40.3176.500000112.2V136 S137 E138 V143 A144V136-A140 VanDerWaalsContact O-CB 3.3Å; V136-A140 WeakPolarHBondContact O-CB 3.24Å; V136-A140 PolarHBondContact O-N 3.34Å; S137-A140 WeakPolarHBondContact O-CB 3.43Å; S137-A140 PolarHBondContact O-N 3.43Å; S137-A140 VanDerWaalsContact O-N 3.11Å; E138-A140 VanDerWaalsContact C-N 3.33Å; E138-A140 PolarHBondContact O-N 2.98Å; A140-V143 PolarHBondContact O-N 3.33Å; A140-A144 WeakPolarHBondContact O-CB 3.34Å; A140-A144 PolarHBondContact O-N 2.72Å
141E76.4Confident69.5Low121 Ų12193.3 Ų93.357%0.56554%0.54SS*.Hα-helixtrans-65.2-41.5174.5-71.7-169.8-173.900112S137 E138 V143 A144 Q145S137-E141 PolarHBondContact O-N 3.09Å; E138-E141 PolarHBondContact O-N 2.96Å; E141-V143 VanDerWaalsContact C-N 3.34Å; E141-V143 PolarHBondContact O-N 2.97Å; E141-A144 PolarHBondContact O-N 2.89Å; E141-Q145 WeakPolarHBondContact O-CG 3.29Å; E141-Q145 PolarHBondContact O-N 3.12Å
142A68.7Low70.1Confident48 Ų4889.2 Ų89.240%0.39753%0.531SS..Hα-helixtrans-61.3-41.417400000112E138 Q145 V146E138-A142 WeakPolarHBondContact O-CB 3.32Å; E138-A142 PolarHBondContact O-N 3.11Å; A142-Q145 PolarHBondContact O-N 3.42Å; A142-V146 WeakPolarHBondContact O-CG2 3.36Å; A142-V146 PolarHBondContact O-N 3.43Å; A142-V146 VanDerWaalsContact O-N 3.09Å
143V72.8Confident70.4Confident103 Ų10389.4 Ų89.462%0.62453%0.532SS*.Hα-helixtrans-65.9-37.2174.3168.90000111.7A139 A140 E141 V146 A147A139-V143 VanDerWaalsContact O-CG2 3.31Å; A139-V143 WeakPolarHBondContact O-CG2 3.46Å; A139-V143 PolarHBondContact O-N 3.26Å; A140-V143 PolarHBondContact O-N 3.33Å; E141-V143 VanDerWaalsContact C-N 3.34Å; E141-V143 PolarHBondContact O-N 2.97Å; V143-V146 PolarHBondContact O-N 2.98Å; V143-A147 WeakPolarHBondContact O-CB 3.26Å; V143-A147 PolarHBondContact O-N 3.34Å
144A77.1Confident70.8Confident49 Ų4989.4 Ų89.441%0.40553%0.533SS..Hα-helixtrans-66.2-39.6176.200000112.6A140 E141 A147 Q148A140-A144 WeakPolarHBondContact O-CB 3.34Å; A140-A144 PolarHBondContact O-N 2.72Å; E141-A144 PolarHBondContact O-N 2.89Å; A144-A147 PolarHBondContact O-N 2.77Å; A144-Q148 WeakPolarHBondContact O-CG 3.33Å; A144-Q148 PolarHBondContact O-N 2.97Å; A144-Q148 VanDerWaalsContact O-N 3.12Å
145Q70.8Confident71.5Confident123 Ų12387.7 Ų87.758%0.57553%0.525SS*.Hα-helixtrans-62.8-47.2173.6-69.3172.344.500111.2E141 A142 A147 Q148 E149E141-Q145 WeakPolarHBondContact O-CG 3.29Å; E141-Q145 PolarHBondContact O-N 3.12Å; A142-Q145 PolarHBondContact O-N 3.42Å; Q145-A147 VanDerWaalsContact C-N 3.29Å; Q145-A147 PolarHBondContact O-N 2.85Å; Q145-Q148 PolarHBondContact O-N 3.13Å; Q145-E149 PolarHBondContact O-N 3.2Å
146V68.6Low71.9Confident84 Ų8490.2 Ų90.251%0.50953%0.527SS..Hα-helixtrans-61.8-35.8176171.60000111.9A142 V143 E149 V150A142-V146 WeakPolarHBondContact O-CG2 3.36Å; A142-V146 PolarHBondContact O-N 3.43Å; A142-V146 VanDerWaalsContact O-N 3.09Å; V143-V146 PolarHBondContact O-N 2.98Å; V146-E149 PolarHBondContact O-N 2.86Å; V146-V150 WeakPolarHBondContact O-CG2 3.5Å; V146-V150 PolarHBondContact O-N 3.26Å
147A78.3Confident71.8Confident56 Ų5691.4 Ų91.446%0.46353%0.534SS..Hα-helixtrans-63.7-42.9175.100000112.2V143 A144 Q145 V150 E151V143-A147 WeakPolarHBondContact O-CB 3.26Å; V143-A147 PolarHBondContact O-N 3.34Å; A144-A147 PolarHBondContact O-N 2.77Å; Q145-A147 VanDerWaalsContact C-N 3.29Å; Q145-A147 PolarHBondContact O-N 2.85Å; A147-V150 PolarHBondContact O-N 2.78Å; A147-E151 PolarHBondContact O-N 2.99Å
148Q67.9Low72.3Confident133 Ų13391.2 Ų91.262%0.62154%0.536SS*.Hα-helixtrans-66-38.4176.4-69.3177.512.700112.4A144 Q145 V150 E151 A152A144-Q148 WeakPolarHBondContact O-CG 3.33Å; A144-Q148 PolarHBondContact O-N 2.97Å; A144-Q148 VanDerWaalsContact O-N 3.12Å; Q145-Q148 PolarHBondContact O-N 3.13Å; Q148-V150 VanDerWaalsContact C-N 3.33Å; Q148-V150 PolarHBondContact O-N 3.2Å; Q148-E151 PolarHBondContact O-N 3.21Å; Q148-A152 WeakPolarHBondContact O-CB 3.48Å; Q148-A152 PolarHBondContact O-N 3.1Å
149E67.3Low72.5Confident146 Ų14688.3 Ų88.368%0.68252%0.521SS*.Hα-helixtrans-62.9-39.2173-70.9-164.115100112.1Q145 V146 A153Q145-E149 PolarHBondContact O-N 3.2Å; V146-E149 PolarHBondContact O-N 2.86Å; E149-A153 VanDerWaalsContact O-CB 3.26Å; E149-A153 WeakPolarHBondContact O-CB 3.31Å; E149-A153 PolarHBondContact O-N 3.37Å
150V70.3Confident72.7Confident95 Ų9590 Ų9058%0.57653%0.526SS*.Hα-helixtrans-69.5-37.9176.9170.10000111.8V146 A147 Q148 A153 A154V146-V150 WeakPolarHBondContact O-CG2 3.5Å; V146-V150 PolarHBondContact O-N 3.26Å; A147-V150 PolarHBondContact O-N 2.78Å; Q148-V150 VanDerWaalsContact C-N 3.33Å; Q148-V150 PolarHBondContact O-N 3.2Å; V150-A153 PolarHBondContact O-N 3.44Å; V150-A154 WeakPolarHBondContact O-CB 3.42Å; V150-A154 PolarHBondContact O-N 3.04Å
151E69.1Low72.6Confident138 Ų13890 Ų9065%0.64553%0.526SS*.Hα-helixtrans-65.9-46.7175.7-172.5166.5-150.200111.5A147 Q148 A153 A154 E155A147-E151 PolarHBondContact O-N 2.99Å; Q148-E151 PolarHBondContact O-N 3.21Å; E151-A153 VanDerWaalsContact C-N 3.33Å; E151-A153 PolarHBondContact O-N 2.94Å; E151-A154 WeakPolarHBondContact O-CB 3.49Å; E151-A154 PolarHBondContact O-N 3.37Å; E151-A154 VanDerWaalsContact O-N 3.14Å; E151-E155 PolarHBondContact O-N 3.32Å
152A76.4Confident72.5Confident57 Ų5791 Ų9147%0.47153%0.53SS..Hα-helixtrans-62-38.9174.100000112.5Q148 A154 E155 E156Q148-A152 WeakPolarHBondContact O-CB 3.48Å; Q148-A152 PolarHBondContact O-N 3.1Å; A152-A154 VanDerWaalsContact C-N 3.35Å; A152-E155 PolarHBondContact O-N 3.23Å; A152-E156 PolarHBondContact O-N 2.84Å
153A67.4Low72.8Confident55 Ų5591.7 Ų91.746%0.45554%0.536SS..Hα-helixtrans-66.5-35.5174.200000112.5E149 V150 E151 E156 V157E149-A153 VanDerWaalsContact O-CB 3.26Å; E149-A153 WeakPolarHBondContact O-CB 3.31Å; E149-A153 PolarHBondContact O-N 3.37Å; V150-A153 PolarHBondContact O-N 3.44Å; E151-A153 VanDerWaalsContact C-N 3.33Å; E151-A153 PolarHBondContact O-N 2.94Å; A153-E156 PolarHBondContact O-N 3.13Å; A153-V157 WeakPolarHBondContact O-CG2 3.27Å; A153-V157 PolarHBondContact O-N 2.82Å
154A77.5Confident72.7Confident59 Ų5991.3 Ų91.349%0.48853%0.534SS..Hα-helixtrans-67.2-40.3175.700000111.9V150 E151 A152 V157 A158V150-A154 WeakPolarHBondContact O-CB 3.42Å; V150-A154 PolarHBondContact O-N 3.04Å; E151-A154 WeakPolarHBondContact O-CB 3.49Å; E151-A154 PolarHBondContact O-N 3.37Å; E151-A154 VanDerWaalsContact O-N 3.14Å; A152-A154 VanDerWaalsContact C-N 3.35Å; A154-V157 PolarHBondContact O-N 3.02Å; A154-A158 WeakPolarHBondContact O-CB 3.35Å; A154-A158 PolarHBondContact O-N 3.31Å
155E81.9Confident72.4Confident116 Ų11694.7 Ų94.754%0.54254%0.541SS..Hα-helixtrans-59.6-45.8172.1-79.6-154.8171.800112.7E151 A152 V157 A158 K159E151-E155 PolarHBondContact O-N 3.32Å; A152-E155 PolarHBondContact O-N 3.23Å; E155-V157 VanDerWaalsContact C-N 3.33Å; E155-V157 PolarHBondContact O-N 3.24Å; E155-A158 WeakPolarHBondContact O-CB 3.18Å; E155-A158 PolarHBondContact O-N 3.2Å; E155-K159 WeakPolarHBondContact O-CD 3.3Å; E155-K159 WeakPolarHBondContact O-CE 3.44Å; E155-K159 VanDerWaalsContact O-CG 3.3Å; E155-K159 WeakPolarHBondContact O-CG 3.44Å; E155-K159 PolarHBondContact O-N 2.93Å; E155-K159 IonicContact OE2-NZ 2.67Å; E155-K159 PolarHBondContact OE2-NZ 3.32Å
156E70.9Confident72.2Confident109 Ų10995.4 Ų95.451%0.50954%0.544SS..Hα-helixtrans-65.1-38.1178.9-70.2-60.9107.500111.6A152 A153 A158 K159 V160A152-E156 PolarHBondContact O-N 2.84Å; A153-E156 PolarHBondContact O-N 3.13Å; E156-A158 VanDerWaalsContact C-N 3.33Å; E156-A158 PolarHBondContact O-N 3Å; E156-K159 PolarHBondContact O-N 3.31Å; E156-K159 VanDerWaalsContact OE1-CD 3.26Å; E156-K159 WeakPolarHBondContact OE1-CD 3.45Å; E156-K159 IonicContact OE1-NZ 2.84Å; E156-K159 PolarHBondContact OE1-NZ 2.67Å; E156-V160 WeakPolarHBondContact O-CB 3.21Å; E156-V160 VanDerWaalsContact O-CG2 3.31Å; E156-V160 WeakPolarHBondContact O-CG2 3.32Å; E156-V160 PolarHBondContact O-N 2.75Å
157V66.8Low71.9Confident103 Ų10393.8 Ų93.862%0.62454%0.54SS*.Hα-helixtrans-65-36.6172.7170.80000111.6A153 A154 E155 V160 A161A153-V157 WeakPolarHBondContact O-CG2 3.27Å; A153-V157 PolarHBondContact O-N 2.82Å; A154-V157 PolarHBondContact O-N 3.02Å; E155-V157 VanDerWaalsContact C-N 3.33Å; E155-V157 PolarHBondContact O-N 3.24Å; V157-V160 PolarHBondContact O-N 2.92Å; V157-A161 WeakPolarHBondContact O-CB 3.35Å; V157-A161 PolarHBondContact O-N 2.91Å
158A77.6Confident71.2Confident57 Ų5793.6 Ų93.647%0.47154%0.538SS..Hα-helixtrans-65-45.7174.900000112.1A154 E155 E156 V160 A161 E162A154-A158 WeakPolarHBondContact O-CB 3.35Å; A154-A158 PolarHBondContact O-N 3.31Å; E155-A158 WeakPolarHBondContact O-CB 3.18Å; E155-A158 PolarHBondContact O-N 3.2Å; E156-A158 VanDerWaalsContact C-N 3.33Å; E156-A158 PolarHBondContact O-N 3Å; A158-V160 VanDerWaalsContact C-N 3.3Å; A158-V160 PolarHBondContact O-N 3.06Å; A158-A161 WeakPolarHBondContact O-CB 3.4Å; A158-A161 PolarHBondContact O-N 3.36Å; A158-A161 VanDerWaalsContact O-N 3.11Å; A158-E162 PolarHBondContact O-N 3.05Å
159K73.7Confident70.9Confident90 Ų9093 Ų9339%0.39154%0.535SS..Hα-helixtrans-61.3-38175.6-64.6159-154.8166.20111.7E155 E156 A163E155-K159 WeakPolarHBondContact O-CD 3.3Å; E155-K159 WeakPolarHBondContact O-CE 3.44Å; E155-K159 VanDerWaalsContact O-CG 3.3Å; E155-K159 WeakPolarHBondContact O-CG 3.44Å; E155-K159 PolarHBondContact O-N 2.93Å; E155-K159 IonicContact OE2-NZ 2.67Å; E155-K159 PolarHBondContact OE2-NZ 3.32Å; E156-K159 PolarHBondContact O-N 3.31Å; E156-K159 VanDerWaalsContact OE1-CD 3.26Å; E156-K159 WeakPolarHBondContact OE1-CD 3.45Å; E156-K159 IonicContact OE1-NZ 2.84Å; E156-K159 PolarHBondContact OE1-NZ 2.67Å; K159-A163 WeakPolarHBondContact O-CB 3.23Å; K159-A163 PolarHBondContact O-N 2.88Å; K159-A163 VanDerWaalsContact O-N 3.09Å
160V71.9Confident70.3Confident92 Ų9289.7 Ų89.756%0.55853%0.533SS*.Hα-helixtrans-68.3-38173.6169.60000111.8E156 V157 A158 V164E156-V160 WeakPolarHBondContact O-CB 3.21Å; E156-V160 VanDerWaalsContact O-CG2 3.31Å; E156-V160 WeakPolarHBondContact O-CG2 3.32Å; E156-V160 PolarHBondContact O-N 2.75Å; V157-V160 PolarHBondContact O-N 2.92Å; A158-V160 VanDerWaalsContact C-N 3.3Å; A158-V160 PolarHBondContact O-N 3.06Å; V160-V164 WeakPolarHBondContact O-CB 3.39Å; V160-V164 VanDerWaalsContact O-CG2 3.28Å; V160-V164 WeakPolarHBondContact O-CG2 3.47Å; V160-V164 PolarHBondContact O-N 3.39Å
161A73.1Confident69.5Low57 Ų5790.5 Ų90.547%0.47154%0.538SS..Hα-helixtrans-65.9-44.3176.100000112V157 A158 A163 V164 E165V157-A161 WeakPolarHBondContact O-CB 3.35Å; V157-A161 PolarHBondContact O-N 2.91Å; A158-A161 WeakPolarHBondContact O-CB 3.4Å; A158-A161 PolarHBondContact O-N 3.36Å; A158-A161 VanDerWaalsContact O-N 3.11Å; A161-A163 PolarHBondContact O-N 2.79Å; A161-V164 PolarHBondContact O-N 3.11Å; A161-E165 PolarHBondContact O-N 3.07Å
162E75Confident68Low142 Ų14289.2 Ų89.266%0.66454%0.54SS*.Hα-helixtrans-59.2-46.3174.9-173.8179.4-175.700111.4A158 V164 E165 E166A158-E162 PolarHBondContact O-N 3.05Å; E162-V164 VanDerWaalsContact C-N 3.3Å; E162-V164 PolarHBondContact O-N 2.89Å; E162-E165 PolarHBondContact O-N 3.29Å; E162-E165 VanDerWaalsContact O-N 3.14Å; E162-E166 PolarHBondContact O-N 3.38Å
163A73.4Confident66.4Low61 Ų6195.3 Ų95.350%0.50456%0.559SS.*Hα-helixtrans-64.7-30.617600000113.5K159 A161 A167K159-A163 WeakPolarHBondContact O-CB 3.23Å; K159-A163 PolarHBondContact O-N 2.88Å; K159-A163 VanDerWaalsContact O-N 3.09Å; A161-A163 PolarHBondContact O-N 2.79Å; A163-A167 VanDerWaalsContact O-CB 3.29Å; A163-A167 WeakPolarHBondContact O-CB 3.37Å; A163-A167 PolarHBondContact O-N 3.1Å; A163-A167 VanDerWaalsContact O-N 3.16Å
164V71.9Confident65.2Low96 Ų9697.7 Ų97.758%0.58257%0.569SS**Hα-helixtrans-73.9-34.4172.9166.50000111.4V160 A161 E162 A168V160-V164 WeakPolarHBondContact O-CB 3.39Å; V160-V164 VanDerWaalsContact O-CG2 3.28Å; V160-V164 WeakPolarHBondContact O-CG2 3.47Å; V160-V164 PolarHBondContact O-N 3.39Å; A161-V164 PolarHBondContact O-N 3.11Å; E162-V164 VanDerWaalsContact C-N 3.3Å; E162-V164 PolarHBondContact O-N 2.89Å; V164-A168 WeakPolarHBondContact O-CB 3.47Å; V164-A168 PolarHBondContact O-N 3.43Å
165E69.9Low63.2Low120 Ų12099 Ų9956%0.56158%0.58SS**Hα-helixtrans-70.2-44.7174.8-163-178.2143.100111.7A161 E162 A167 A168 Q169A161-E165 PolarHBondContact O-N 3.07Å; E162-E165 PolarHBondContact O-N 3.29Å; E162-E165 VanDerWaalsContact O-N 3.14Å; E165-A167 VanDerWaalsContact C-N 3.31Å; E165-A167 PolarHBondContact O-N 2.95Å; E165-A168 CarbonylContact O-C 3.44Å; E165-A168 WeakPolarHBondContact O-CA 3.44Å; E165-A168 WeakPolarHBondContact O-CB 3.22Å; E165-A168 PolarHBondContact O-N 2.95Å; E165-Q169 WeakPolarHBondContact O-CG 3.31Å; E165-Q169 PolarHBondContact O-N 3.08Å; E165-Q169 PolarHBondContact OE1-NE2 3.02Å
166E67.9Low60.9Low137 Ų13798.9 Ų98.964%0.6460%0.599SS**Hα-helixtrans-59.9-42.6175.9-155.5-90.9157.800110.9E162 A168 Q169 A170E162-E166 PolarHBondContact O-N 3.38Å; E166-A168 VanDerWaalsContact C-N 3.34Å; E166-A168 PolarHBondContact O-N 3.01Å; E166-Q169 PolarHBondContact O-N 2.93Å; E166-A170 WeakPolarHBondContact O-CB 3.27Å; E166-A170 PolarHBondContact O-N 3.42Å
167A61.8Low59.1Low51 Ų51100.2 Ų100.242%0.42161%0.614SS.*Hα-helixtrans-64.1-32.517200000113.7A163 E165 V171A163-A167 VanDerWaalsContact O-CB 3.29Å; A163-A167 WeakPolarHBondContact O-CB 3.37Å; A163-A167 PolarHBondContact O-N 3.1Å; A163-A167 VanDerWaalsContact O-N 3.16Å; E165-A167 VanDerWaalsContact C-N 3.31Å; E165-A167 PolarHBondContact O-N 2.95Å; A167-V171 VanDerWaalsContact O-CG2 3.29Å; A167-V171 WeakPolarHBondContact O-CG2 3.34Å; A167-V171 PolarHBondContact O-N 3.18Å
168A62.6Low57.4Low52 Ų5299 Ų9943%0.4362%0.623SS.*Hα-helixtrans-74.6-36.9175.500000112.3V164 E165 E166 V171 T172V164-A168 WeakPolarHBondContact O-CB 3.47Å; V164-A168 PolarHBondContact O-N 3.43Å; E165-A168 CarbonylContact O-C 3.44Å; E165-A168 WeakPolarHBondContact O-CA 3.44Å; E165-A168 WeakPolarHBondContact O-CB 3.22Å; E165-A168 PolarHBondContact O-N 2.95Å; E166-A168 VanDerWaalsContact C-N 3.34Å; E166-A168 PolarHBondContact O-N 3.01Å; A168-V171 PolarHBondContact O-N 3.15Å; A168-T172 PolarHBondContact O-N 3.42Å; A168-T172 PolarHBondContact O-OG1 3.05Å
169Q61.5Low55.4Low119 Ų119101.4 Ų101.456%0.55664%0.642SS**Hα-helixtrans-64-43172.1-67.6-174.33100110.4E165 E166 V171 T172E165-Q169 WeakPolarHBondContact O-CG 3.31Å; E165-Q169 PolarHBondContact O-N 3.08Å; E165-Q169 PolarHBondContact OE1-NE2 3.02Å; E166-Q169 PolarHBondContact O-N 2.93Å; Q169-V171 PolarHBondContact O-N 3.48Å; Q169-T172 WeakPolarHBondContact CA-OG1 3.46Å; Q169-T172 PolarHBondContact O-N 3.47Å; Q169-T172 VanDerWaalsContact O-N 3.09Å; Q169-T172 PolarHBondContact O-OG1 3.07Å; Q169-T172 VanDerWaalsContact O-OG1 3.1Å
170A56.1Low53.3Low77 Ų77106.5 Ų106.564%0.63667%0.668SS**Hα-helixtrans-63.4-19.4173.800000114.6E166E166-A170 WeakPolarHBondContact O-CB 3.27Å; E166-A170 PolarHBondContact O-N 3.42Å
171V53.2Low51.7Low113 Ų113110.3 Ų110.369%0.68568%0.68SS**Hα-helixtrans-93.4-14.8176.2168.50000112.6A167 A168 Q169A167-V171 VanDerWaalsContact O-CG2 3.29Å; A167-V171 WeakPolarHBondContact O-CG2 3.34Å; A167-V171 PolarHBondContact O-N 3.18Å; A168-V171 PolarHBondContact O-N 3.15Å; Q169-V171 PolarHBondContact O-N 3.48Å
172T36.8Very low49.7Very low110 Ų110114.3 Ų114.368%0.67570%0.698SS**SBendtrans-94.511.7-174.935.80000115.6A168 Q169 P174A168-T172 PolarHBondContact O-N 3.42Å; A168-T172 PolarHBondContact O-OG1 3.05Å; Q169-T172 WeakPolarHBondContact CA-OG1 3.46Å; Q169-T172 PolarHBondContact O-N 3.47Å; Q169-T172 VanDerWaalsContact O-N 3.09Å; Q169-T172 PolarHBondContact O-OG1 3.07Å; Q169-T172 VanDerWaalsContact O-OG1 3.1Å; T172-P174 WeakPolarHBondContact O-CD 3.43Å
173E43.5Very low47.9Very low186 Ų186116.3 Ų116.387%0.86971%0.708SS**  trans-102.255.7166.3-153.7-167.5169.400115.9
174P42.1Very low46.4Very low105 Ų105118.4 Ų118.468%0.68272%0.719SS**  trans-90.7101166.134.6-30.3000112.2T172T172-P174 WeakPolarHBondContact O-CD 3.43Å
175A34.3Very low44.5Very low86 Ų86120.8 Ų120.871%0.71173%0.728SS**  trans47.485149.300000118.5V177A175-V177 VanDerWaalsContact C-N 3.28Å; A175-V177 PolarHBondContact O-N 3.28Å
176A34.6Very low42.9Very low114 Ų114121.2 Ų121.294%0.94274%0.738SS**  trans-71.371.7166.500000113.2
177V33.1Very low41.8Very low136 Ų136120 Ų12082%0.82474%0.742SS**  trans-144123.1170.7-161.60000112.5A175A175-V177 VanDerWaalsContact C-N 3.28Å; A175-V177 PolarHBondContact O-N 3.28Å
178G30.8Very low40.2Very low79 Ų79125.5 Ų125.581%0.81476%0.764SS**  trans94.398.1159.400000115.8
179A35.6Very low38.6Very low106 Ų106127.7 Ų127.788%0.87678%0.782SS**  trans-94.5139.5162.100000110.3
180E29.9Very low37.1Very low197 Ų197126.5 Ų126.592%0.92179%0.793SS**  trans-153.1148145.5-145.1175.9173.300109.9
181E38.3Very low35.9Very low173 Ų173127.6 Ų127.681%0.80880%0.801SS**  trans-91.5141.3179.5-61.4178.283.600111.7
182T32.1Very low34.8Very low141 Ų141127.6 Ų127.687%0.86581%0.806SS**  trans-148.6129144.949.70000111.2
183Q36.8Very low34.6Very low184 Ų184127.3 Ų127.386%0.8681%0.809SS**  trans-89.2133.5169.9-60.8170.3-23.300110.6
184S40.7Very low34.2Very low105 Ų105127 Ų12773%0.73481%0.812SS**  trans-170.7131.4151.859.40000113.8
185D33.2Very low33.8Very low146 Ų146130.1 Ų130.178%0.78182%0.818SS**  trans45110.1150.8-72.6-118.4000124.5
186V35.7Very low33.7Very low128 Ų128134.5 Ų134.578%0.77683%0.828SS**  21.6149.7122.2-1090000121.2
187P44.5Very low33.3Very low111 Ų111136.6 Ų136.672%0.72182%0.823SS**  -136.7-176.9-60.641.7-24.7000114
188L29.5Very low33.3Very low168 Ų168139.9 Ų139.988%0.8883%0.826SS**  trans56.697.6145.7-170.1119.6000120
189A28.4Very low33.2Very low97 Ų97146.4 Ų146.480%0.80283%0.832SS**  trans-168.8138.5137.900000114.8
190A29.6Very low32.9Very low95 Ų95146 Ų14679%0.78583%0.829SS**  trans29.1106.9147.500000122.3
191A30.7Very low32.8Very low99 Ų99146.6 Ų146.682%0.81883%0.828SS**  54133.7118.300000123.6
192S30.7Very low32.1Very low113 Ų113141.4 Ų141.479%0.7982%0.822SS**  trans88.6154.8140.5-159.80000120.3
193S32.9Very low32Very low105 Ų105144 Ų14473%0.73482%0.821SS**  trans90.581.7159.9-37.10000117.6E195S193-E195 PolarHBondContact O-N 3.35Å
194L35.3Very low31.8Very low178 Ų178142.1 Ų142.193%0.93282%0.817SS**  trans-65.4110.6159.5-176.5170.4000109.7
195E33.2Very low31.4Very low171 Ų171144.8 Ų144.880%0.79982%0.823SS**  trans-148.1100.7168.9-161-175.2162.500112.6S193S193-E195 PolarHBondContact O-N 3.35Å
196L31.6Very low31.3Very low178 Ų178143.8 Ų143.893%0.93283%0.827SS**  trans-133.995.7169.8-80.4-179.7000111.8
197L27.7Very low31Very low159 Ų159142.8 Ų142.883%0.83283%0.832SS**  trans-135.783.7170.8-168.8151000110
198K31.1Very low30.3Very low204 Ų204142.3 Ų142.389%0.88783%0.832SS**  trans-164.175172.8-125.8165.1-169165.20118
199K30.6Very low30.3Very low217 Ų217142 Ų14294%0.94383%0.831SS**  trans-167.8156.2142.2-105.7153.3-176175.20109.1
200A28.4Very low30.5Very low98 Ų98143.8 Ų143.881%0.8183%0.827SS**  cis-124.5170.11.400000112
201K26.8Very low30.8Very low208 Ų208148.1 Ų148.190%0.90483%0.831SS**  trans-116.8127173.3169.7171.4175.1170.20110.7
202G25.5Very low30.8Very low65 Ų65150.9 Ų150.967%0.6783%0.827SS**  trans101.5112.5140.500000117.3
203K29.4Very low30.9Very low194 Ų194152.1 Ų152.184%0.84382%0.824SS**  -149.9125.6125.5-163.473.4178.4-173.70108.6
204D32.6Very low30.9Very low145 Ų145154.5 Ų154.578%0.77583%0.828SS**  trans-80.2140.5167.1-50.9-98.1000109.2
205D31.7Very low31.4Very low162 Ų162151.3 Ų151.387%0.86682%0.818SS**  trans-162153.2140.3-105.4-43.8000110.1
206S31.8Very low32.4Very low124 Ų124148.3 Ų148.387%0.86781%0.813SS**  trans-113.9133.9-170.8-62.70000112.8
207A29.9Very low32.4Very low107 Ų107149 Ų14988%0.88481%0.812SS**  trans-145.3135.2159.900000110.3
208S29.3Very low32.6Very low101 Ų101147.7 Ų147.771%0.70681%0.809SS**  trans-99.2146.7170.2141.30000109
209N29.3Very low32.8Very low161 Ų161146.1 Ų146.186%0.86181%0.805SS**  trans-151.4148.6133.2-153.412.4000110.1
210D32.3Very low33Very low135 Ų135141.7 Ų141.772%0.72280%0.797SS**  trans-110127-175.8-71.6-101.6000110.6
211Q35.9Very low33.5Very low186 Ų186142.9 Ų142.987%0.86980%0.796SS**  trans-166.8149.2160.3-153.1161.15300110.6
212E31.7Very low33.7Very low157 Ų157139.7 Ų139.773%0.73479%0.794SS**  cis-162.5148-45179.1165.6110.500106.9
213L31.1Very low34.1Very low139 Ų139144.4 Ų144.473%0.72880%0.798SS**  trans48.4105167.1-9669.4000122
214L34.5Very low34.3Very low156 Ų156145.1 Ų145.182%0.81780%0.802SS**  62.6157.4112.4-66.7-177.2000122.8
215P45Very low34.4Very low111 Ų111143.7 Ų143.772%0.72180%0.798SS**  trans-126.8-120.1-140.628.8-1.5000116.9
216P53.3Low34.3Very low107 Ų107140.4 Ų140.470%0.69579%0.788SS**  -130.5151.1-104.839.3-22.4000117.7
217E32Very low34.3Very low194 Ų194140.6 Ų140.691%0.90779%0.786SS**  trans-138.3134.8160-63.7-173.714700107.2
218V32Very low34.2Very low130 Ų130141.3 Ų141.379%0.78878%0.779SS**  cis107.5148.431.1168.60000110.9
219E34.9Very low34.4Very low171 Ų171143.8 Ų143.880%0.79978%0.783SS**  trans88.688.7178.5-49.8-138.6141.900119.8
220T35.4Very low34.5Very low125 Ų125141.5 Ų141.577%0.76778%0.775SS**  47.9153.7118.938.50000124.3
221P39.3Very low34.8Very low122 Ų122143.3 Ų143.379%0.79278%0.779SS**  trans-94.1160.4-168.538.5-36.6000114.9
222V32Very low34.5Very low142 Ų142140.1 Ų140.186%0.86177%0.772SS**  trans-106.4110.5172.3179.60000111.4
223E33.4Very low34.5Very low164 Ų164140.8 Ų140.877%0.76678%0.78SS**  trans32.9119.2136.7-143.4162.613300120.9V225E223-V225 HydrophobicContact CG-CG2 4.22Å
224K32.7Very low34.6Very low209 Ų209139.8 Ų139.891%0.90978%0.78SS**  trans-93.597.8167.8-178.7-177.9-179.7-179.30109.3
225V34.9Very low34.9Very low114 Ų114137.1 Ų137.169%0.69177%0.774SS**PPolyproline II helixtrans-82125.6179.9-179.60000110.8E223E223-V225 HydrophobicContact CG-CG2 4.22Å
226S29Very low34.4Very low94 Ų94139 Ų13966%0.65778%0.778SS**PPolyproline II helixtrans-78.8143.3170.5-56.90000110.8T228S226-T228 PolarHBondContact O-N 2.96Å
227P33.3Very low33.8Very low128 Ų128137.5 Ų137.583%0.83178%0.782SS**PPolyproline II helixtrans-69.2120.4174.628.3-33.3000111I229P227-I229 PolarHBondContact O-N 3.48Å
228T26.2Very low34Very low121 Ų121135 Ų13574%0.74278%0.775SS**PPolyproline II helixtrans-76117.5172.4-59.70000110.2S226 T230S226-T228 PolarHBondContact O-N 2.96Å; T228-T230 PolarHBondContact O-N 3.04Å
229I35.4Very low34.1Very low154 Ų154135 Ų13579%0.7978%0.775SS**PPolyproline II helixtrans-62.4123.9165.6-60.7173.2000107.6P227 E231P227-I229 PolarHBondContact O-N 3.48Å; I229-E231 HydrophobicContact CG2-CG 4.36Å
230T30.7Very low34.1Very low112 Ų112131.7 Ų131.769%0.68777%0.771SS**  trans-120.5105.5173.7-560000107.3T228T228-T230 PolarHBondContact O-N 3.04Å
231E37.3Very low33.9Very low173 Ų173134.1 Ų134.181%0.80878%0.779SS**  trans-71.3130.4177.9-61.5-174.3133.300110.2I229I229-E231 HydrophobicContact CG2-CG 4.36Å
232V31.2Very low33.5Very low120 Ų120137.2 Ų137.273%0.72778%0.779SS**  trans-11696.8171.5179.80000107.3T234V232-T234 PolarHBondContact O-N 3.1Å; V232-T234 VanDerWaalsContact O-N 3.1Å
233L30.7Very low33.4Very low170 Ų170135.4 Ų135.489%0.8978%0.779SS**  trans-67.8103.7172.2-70.9169.5000109.7
234T33.8Very low33.3Very low119 Ų119133.3 Ų133.373%0.7378%0.778SS**  trans-93132.9154.749.30000108.7V232V232-T234 PolarHBondContact O-N 3.1Å; V232-T234 VanDerWaalsContact O-N 3.1Å
235S41Very low33.2Very low99 Ų99128 Ų12869%0.69277%0.772SS**SBendtrans-60.4162.8168.2-1700000110.7
236D33.3Very low33Very low151 Ų151130.3 Ų130.381%0.80778%0.779SS**SBendtrans79.1121.7171.6-41.9-22.9000112.5
237G41.8Very low33.2Very low76 Ų76131 Ų13178%0.78479%0.785SS**  trans-92.5-168.9-164.100000116.1
238D36.4Very low33.4Very low141 Ų141133.4 Ų133.475%0.75479%0.785SS**  trans73.4102.2-170.6-153.1-44.9000114.9S240D238-S240 PolarHBondContact OD1-N 2.91Å; D238-S240 PolarHBondContact OD1-OG 3.13Å; D238-S240 VanDerWaalsContact OD1-OG 3.14Å
239T34.1Very low33.6Very low130 Ų130137 Ų13780%0.79879%0.793SS**  trans-127.761.8171.6470000111L241T239-L241 PolarHBondContact O-N 3.24Å
240S33.5Very low33.1Very low102 Ų102134.7 Ų134.771%0.71379%0.786SS**  trans-50.1108.5163.6-68.70000111.5D238 K242D238-S240 PolarHBondContact OD1-N 2.91Å; D238-S240 PolarHBondContact OD1-OG 3.13Å; D238-S240 VanDerWaalsContact OD1-OG 3.14Å; S240-K242 PolarHBondContact O-N 3.32Å
241L32.1Very low33.1Very low176 Ų176135 Ų13592%0.92179%0.787SS**  trans-69.791.8-174.7-71.2176.9000112.4T239T239-L241 PolarHBondContact O-N 3.24Å
242K30.7Very low32.6Very low186 Ų186133.4 Ų133.481%0.80979%0.79SS**  trans-96.798.7168-168.1165-171.7167.30110.7S240 V244S240-K242 PolarHBondContact O-N 3.32Å; K242-V244 PolarHBondContact O-N 3.37Å
243A29.7Very low33.1Very low104 Ų104133 Ų13386%0.8679%0.79SS**  trans-58.6120176.100000111.2
244V30.8Very low33Very low120 Ų120134 Ų13473%0.72779%0.79SS**  trans-113.1113.3169.41760000107.1K242K242-V244 PolarHBondContact O-N 3.37Å
245A31.4Very low33.2Very low97 Ų97136.6 Ų136.680%0.80279%0.794SS**  trans-66.5136.5176.500000110.6
246I31.7Very low33Very low163 Ų163139.4 Ų139.484%0.83680%0.801SS**  trans-119.3116.3168.9-57.7178.9000106.7
247S32.8Very low33.3Very low110 Ų110135.8 Ų135.877%0.76980%0.8SS**  trans-81.5157.4176.8-600000111.8
248E36.3Very low33Very low178 Ų178141.8 Ų141.883%0.83280%0.804SS**  trans-45.8131.8173.5-176.5-172138.300114.3
249E30.6Very low32.7Very low196 Ų196141.9 Ų141.992%0.91681%0.809SS**  trans-137.3138.1155.2-168.8170.4105.200110.2
250T25.4Very low32.5Very low105 Ų105140.2 Ų140.264%0.64480%0.803SS**  trans-102.5112-168-72.40000113
251V30.8Very low32.3Very low118 Ų118141.8 Ų141.872%0.71581%0.808SS**  trans31.5119.4137.6-176.20000118.5
252T26.4Very low32.2Very low140 Ų140139.4 Ų139.486%0.85980%0.801SS**  -158.9145.4119.28.10000111.6
253P40.8Very low32.1Very low113 Ų113136.7 Ų136.773%0.73480%0.8SS**  trans-100.8145.7-174.437.2-32.3000113.7
254E29.9Very low32.1Very low189 Ų189141.7 Ų141.788%0.88380%0.802SS**  trans-147.1177.7154.1-138.1175.3144.800110.2
255E38.2Very low32.3Very low174 Ų174142.1 Ų142.181%0.81381%0.805SS**SBendtrans-74.1166.4-158.6-68.7179.383.100116.8
256D35.5Very low32Very low158 Ų158142 Ų14285%0.84580%0.804SS**  trans57.984.1164.8-80-46.6000119.1
257G40.8Very low32.2Very low76 Ų76139.9 Ų139.978%0.78480%0.801SS**  51.5114.3116.400000120.1
258K34Very low31.9Very low201 Ų201139 Ų13987%0.87480%0.8SS**  trans88.683.6160.8-163.7-177.3-177.5175.60116.7
259V30.5Very low31.7Very low143 Ų143138 Ų13887%0.86780%0.797SS**  trans-89.5135.5158.5-178.70000109.7
260S31.2Very low31.9Very low96 Ų96136.4 Ų136.467%0.67179%0.79SS**  trans-117.8123176.157.70000111.3
261V29.1Very low32.1Very low134 Ų134137.4 Ų137.481%0.81280%0.801SS**  trans-100.3126.5172.2-178.80000109.2
262T29.4Very low32.2Very low126 Ų126140.1 Ų140.177%0.77381%0.811SS**  trans-103.6109.1-175.350.60000112.1
263V28.9Very low32.5Very low130 Ų130139.7 Ų139.779%0.78881%0.808SS**  trans-81.4144.1167.3-177.60000109.5V265V263-V265 HydrophobicContact CG1-CG2 4.24Å
264K29.1Very low32.4Very low208 Ų208139.5 Ų139.590%0.90481%0.807SS**  trans-126.9114.1-175.6-153.5176.2-171.4179.50110.3
265V34.6Very low32.3Very low130 Ų130136.9 Ų136.979%0.78880%0.803SS**  trans-118.2136.6-177-179.90000109.9V263V263-V265 HydrophobicContact CG1-CG2 4.24Å
266A25.8Very low32Very low95 Ų95136.3 Ų136.379%0.78580%0.801SS**  trans-155.7147.6163.600000110
267P37Very low31.6Very low118 Ų118135.9 Ų135.977%0.76680%0.804SS**  trans-136.2175.1-152.342.6-24.9000118
268A25.6Very low30.9Very low90 Ų90137.8 Ų137.874%0.74480%0.8SS**  trans88.6151.413900000123.4
269M31.6Very low30.4Very low157 Ų157133 Ų13377%0.77379%0.791SS**  trans94.2104.6153.3-50.1-148.7115.900121.5
270E34.8Very low30Very low163 Ų163132.9 Ų132.976%0.76278%0.783SS**  42130.5124.7-59.417997.900122.4
271S30.1Very low30Very low127 Ų127136.1 Ų136.189%0.88879%0.788SS**  -170.1163.6120.533.70000113.5
272L32.6Very low29.9Very low175 Ų175136.4 Ų136.492%0.91679%0.785SS**  trans-84.8167.9-164.3-62.5160000114.9
273T33.7Very low29.9Very low131 Ų131135.5 Ų135.580%0.80478%0.784SS**  trans-76.2168.5168.562.20000112
274P39Very low30Very low109 Ų109133.8 Ų133.871%0.70878%0.783SS**  -156.7152.591.639.8-20.5000118.8
275V26.9Very low30.1Very low133 Ų133129 Ų12981%0.80678%0.782SS**  trans62.8149136-179.70000122.3
276E30.9Very low29.8Very low163 Ų163132.3 Ų132.376%0.76279%0.786SS**  trans-58.6156.2-176.6-50.4154.68500117.7
277V27.4Very low30.2Very low149 Ų149132.2 Ų132.290%0.90379%0.786SS**  -147.1148.7121-164.60000109.8
278V27.4Very low29.8Very low115 Ų115134.7 Ų134.770%0.69779%0.787SS**  trans-92146.8-179.3174.70000112.6
279S22.8Very low30.1Very low100 Ų100136 Ų13670%0.69979%0.786SS**  166.2143.1128.7-76.70000117.3
280M22.8Very low30.2Very low142 Ų142133.1 Ų133.170%0.779%0.787SS**  trans58.7115141.8-84.663.7-169.800124
281E30.5Very low30.3Very low163 Ų163130.9 Ų130.976%0.76279%0.786SS**  59.4141.3113.8-66.4-178.376.500123.7
282D27.3Very low30.3Very low140 Ų140131.3 Ų131.375%0.74978%0.783SS**  trans56.2117.6147.2-154.9-106.2000120.5
283S29.8Very low30.2Very low108 Ų108128.6 Ų128.676%0.75577%0.774SS**  -171165.485.3-1440000114.5
284A30.6Very low30.2Very low93 Ų93131.9 Ų131.977%0.76978%0.78SS**  trans-88.6155.1-170.600000114.5
285A31.9Very low29.8Very low107 Ų107133.7 Ų133.788%0.88478%0.784SS**  trans-138.3127.9158.400000109.5
286F27.6Very low29.9Very low200 Ų200133.8 Ų133.888%0.87778%0.784SS**  trans-129.4113.9-173-169.4-77.4000110.4
287A34.1Very low29.7Very low94 Ų94130.2 Ų130.278%0.77778%0.777SS**  trans-161.889.317100000108.2
288E29.4Very low29.9Very low169 Ų169129.6 Ų129.679%0.7977%0.773SS**  87.4136.181.3-151.2-162.914900113.8
289V31.8Very low30.4Very low119 Ų119129 Ų12972%0.72177%0.772SS**  trans78.779.7169-159.50000119.6
290A33.4Very low30.6Very low96 Ų96131.1 Ų131.179%0.79377%0.774SS**  67.1155.2121.400000122.6
291P37.2Very low31Very low115 Ų115133 Ų13375%0.74778%0.781SS**  trans-131.7165.9-145.243-28000118.3
292V28.8Very low30.8Very low136 Ų136131.6 Ų131.682%0.82478%0.783SS**  trans-152.3108.9148.4150.70000103.8
293V30.8Very low30.9Very low119 Ų119130.6 Ų130.672%0.72179%0.787SS**  66.195.371-176.80000113.3
294E33.8Very low30.9Very low199 Ų199130.1 Ų130.193%0.9379%0.79SS**  -161159.7116.9-102.9177.1163.300109.2
295D31.2Very low30.7Very low148 Ų148132.2 Ų132.279%0.79179%0.793SS**  trans-124.4137.2-155.7-167.8-62.1000113.1S297D295-S297 PolarHBondContact OD1-N 2.77Å
296V29.2Very low30.6Very low135 Ų135132 Ų13282%0.81879%0.791SS**  trans-144.792.3171.3-174.90000112.1
297S27.1Very low30.7Very low87 Ų87128.7 Ų128.761%0.60879%0.787SS**  trans71.9100.1133.1-60.90000122.6D295D295-S297 PolarHBondContact OD1-N 2.77Å
298V30.2Very low30.6Very low136 Ų136133.4 Ų133.482%0.82479%0.793SS**  51.2162.1129.5-77.40000123.1
299P39.3Very low31Very low103 Ų103129.4 Ų129.467%0.66979%0.788SS**  cis-130.7-157.2-15.525.7-0.4000113.2
300I26.5Very low32Very low145 Ų145129.4 Ų129.474%0.74479%0.791SS**  trans83127.9162-54.5165.9000115.3
301E29.8Very low32.6Very low180 Ų180130.1 Ų130.184%0.84179%0.787SS**  cis-152.6-176.3-15-122.7-174.2179.600112.8
302V27.8Very low32.2Very low135 Ų135130.2 Ų130.282%0.81879%0.786SS**  trans-65.3138.7-166.9-162.80000115.9
303S27.9Very low32.4Very low118 Ų118130.9 Ų130.983%0.82578%0.784SS**  171.9115.5127.2-174.50000114.8
304A30.4Very low32.5Very low98 Ų98133.6 Ų133.681%0.8179%0.788SS**  trans-179.1140.5139.400000111
305V26.7Very low32.3Very low138 Ų138130 Ų13084%0.83678%0.78SS**  trans-102.5136.4175.5169.50000110.9V307V305-V307 HydrophobicContact CG1-CG2 4.28Å
306A30.6Very low32.2Very low102 Ų102129.1 Ų129.184%0.84378%0.779SS**  trans-147.7146.9162.600000110.1
307V29.4Very low32.2Very low131 Ų131126.7 Ų126.779%0.79477%0.774SS**  trans-138121.8-170.4175.40000112V305V305-V307 HydrophobicContact CG1-CG2 4.28Å
308E32Very low32.3Very low193 Ų193129.5 Ų129.590%0.90279%0.787SS**  trans-160.3154.7153-88.5-164.3107.200106.9
309A37.1Very low32.4Very low84 Ų84128.8 Ų128.869%0.69478%0.783SS**  cis173.7148.7-2700000105.4
310P53.7Low32.3Very low119 Ų119133.1 Ų133.177%0.77379%0.794SS**  trans-100.8174.5-166.342.3-38.7000113.5
311P44.8Very low32.6Very low111 Ų111134.3 Ų134.372%0.72180%0.796SS**  -158.7138.288.341.1-19.8000119.9
312T29.7Very low32.5Very low118 Ų118132 Ų13272%0.72479%0.794SS**  trans51.3133.2131.467.40000126.9
313I32.6Very low32.6Very low150 Ų150132.5 Ų132.577%0.76979%0.792SS**  97.4146.4125.8-79.9167.4000123
314E32.4Very low32.7Very low176 Ų176132.6 Ų132.682%0.82279%0.788SS**  trans98.7138.6169.3-56.6-147.9167.100120.7
315V29.7Very low32.8Very low124 Ų124134.3 Ų134.375%0.75279%0.791SS**  cis-168148.2-34102.80000114.5
316V28.8Very low33Very low128 Ų128132.1 Ų132.178%0.77679%0.787SS**  trans73.6106.4155.2172.10000124.3
317A30.3Very low33.2Very low85 Ų85136.3 Ų136.370%0.70279%0.789SS**  45.6143.6125.600000126.9
318V28.5Very low33.4Very low146 Ų146136.3 Ų136.389%0.88579%0.789SS**  -150.3157.7123.7142.70000108.6
319V31.9Very low33.5Very low121 Ų121130.4 Ų130.473%0.73377%0.773SS**  trans-128.9137.4-178.81710000110.8
320E37.7Very low33.3Very low194 Ų194132.4 Ų132.491%0.90778%0.779SS**  trans-143.5153.6145.2-77.5-153.9105.300109.5
321E33.6Very low32.1Very low170 Ų170132.9 Ų132.979%0.79478%0.78SS**  trans-98.8162.4-175.6-61.6179.57600112.7
322T27.3Very low31.6Very low130 Ų130134 Ų13480%0.79878%0.784SS**  -170.8120.8117.218.60000114.5
323L29.6Very low31.8Very low146 Ų146136.9 Ų136.976%0.76479%0.789SS**  trans70.6112.7145.7-54.5178.1000122.2
324T29.7Very low32Very low121 Ų121137.1 Ų137.174%0.74279%0.787SS**  trans63.5109.7140.858.90000121
325P33.6Very low32Very low134 Ų134134.6 Ų134.687%0.8778%0.783SS**PPolyproline II helixtrans-80.7134.2139.233.5-28.8000110
326A30.7Very low32.1Very low92 Ų92134 Ų13476%0.7678%0.782SS**PPolyproline II helixtrans-100121.3172.500000110.1
327E33.2Very low32.1Very low189 Ų189134 Ų13488%0.88378%0.782SS**PPolyproline II helixtrans-74.8129.9173.7-172.4-177.2129.100110.1
328V34.3Very low32.1Very low132 Ų132135.5 Ų135.580%0.879%0.788SS**  trans-122.7114.6169.8179.30000107.5
329A33.6Very low32.1Very low69 Ų69134.8 Ų134.857%0.5778%0.783SS**  trans-69.1140.5-17900000111.6V331A329-V331 PolarHBondContact O-N 3.49Å
330P33.3Very low32Very low126 Ų126137.4 Ų137.482%0.81879%0.788SS**  trans-72.1114.3170.329.5-32.4000110
331V30Very low31.5Very low129 Ų129134.7 Ų134.778%0.78278%0.784SS**  trans-84.8122.2168.9174.60000108.9A329A329-V331 PolarHBondContact O-N 3.49Å
332V33.9Very low31.1Very low134 Ų134131.4 Ų131.481%0.81278%0.78SS**  trans-132.6103.7164-178.80000107.2
333E34.1Very low31.1Very low179 Ų179129.5 Ų129.584%0.83678%0.777SS**  trans-123.6116.7168.9-174.9173-157.100106.8
334E36.8Very low31Very low154 Ų154128.8 Ų128.872%0.7278%0.778SS**  trans-141.693.6-173.7-155.1-74.3104.800107.8
335V31.1Very low30.9Very low123 Ų123129.3 Ų129.375%0.74578%0.781SS**  trans-145.3126.3172.4-176.10000107.6
336P32.6Very low30.9Very low112 Ų112131.9 Ų131.973%0.72778%0.782SS**  trans-80.9150.2-173.231.3-36.3000113.5
337V28.3Very low31Very low128 Ų128135.7 Ų135.778%0.77678%0.784SS**  trans-130.7119169.5-179.60000110.1V339V337-V339 HydrophobicContact CG1-CG2 4.26Å
338S29.4Very low31Very low117 Ų117130 Ų13082%0.81877%0.769SS**  trans-81.2135.7170.653.20000111.3
339V30.1Very low30.9Very low130 Ų130129.9 Ų129.979%0.78877%0.771SS**  trans-129.3120.5177178.30000109.9V337V337-V339 HydrophobicContact CG1-CG2 4.26Å
340E30.2Very low30.7Very low177 Ų177136.7 Ų136.783%0.82779%0.788SS**  trans-93.2-173.7166.3-59.5-169.9121.800110.5
341V27.3Very low30.8Very low137 Ų137135 Ų13583%0.8378%0.784SS**  trans82.5129.1175.3-176.30000114.8
342S23.8Very low30.8Very low101 Ų101135.6 Ų135.671%0.70679%0.788SS**  cis-171.2164.9-18.557.10000113.2
343A28.1Very low31Very low90 Ų90137.8 Ų137.874%0.74479%0.789SS**  trans87156.7138.200000122.7
344V27.4Very low30.7Very low130 Ų130136 Ų13679%0.78879%0.79SS**  trans79.4113.6169.3-174.80000118.2
345V27.3Very low30.4Very low132 Ų132132.8 Ų132.880%0.879%0.79SS**  trans-103.6137.7157168.50000107.5
346E34.2Very low30.1Very low189 Ų189132.4 Ų132.488%0.88379%0.793SS**  trans-103.2151.3157.6-82.2-148.6126.700110.2
347E32.3Very low29.8Very low171 Ų171133.4 Ų133.480%0.79980%0.797SS**  trans-146.4155.1-175.9-154.3-78.7111.200110.1
348A33.1Very low29.7Very low70 Ų70133.6 Ų133.658%0.57980%0.798SS**  trans67.2158.417300000117.8
349P31.5Very low29.7Very low130 Ų130134.1 Ų134.184%0.84479%0.792SS**  cis-119.6163.74.640.1-27.5000116.3
350K30.6Very low29.7Very low211 Ų211136.4 Ų136.492%0.91779%0.794SS**  trans-108.2142.1-176.9-174.5177.3-175.1174.90110.9
351A34.8Very low29.7Very low90 Ų90132 Ų13274%0.74479%0.787SS**  trans-149.2119.9-179.300000115.7
352V28.9Very low30.2Very low142 Ų142131.5 Ų131.586%0.86179%0.787SS**  trans54.4113.4144.2-171.20000120.2
353E38.3Very low30.6Very low181 Ų181130.3 Ų130.385%0.84678%0.783SS**  trans-99.7157.9141-62.4-167.9140.200110.2
354V29.5Very low30.6Very low140 Ų140135.1 Ų135.185%0.84879%0.788SS**  trans-178.7120141.7140.50000113.3
355A28.9Very low30.6Very low87 Ų87135.3 Ų135.372%0.71979%0.789SS**  trans60.1149.2144.900000125.8
356S25.3Very low30.7Very low116 Ų116137.4 Ų137.481%0.81179%0.79SS**  trans106.7141.6147.375.60000118.3
357V25.4Very low30.4Very low132 Ų132135 Ų13580%0.879%0.788SS**  cis-177.1163.6-30.6121.60000107.8
358V26.4Very low30.6Very low132 Ų132131.3 Ų131.380%0.879%0.787SS**  trans75.1148.7170.8135.60000114.2
359D31.3Very low30.6Very low129 Ų129133.5 Ų133.569%0.6980%0.795SS**  cis-144.9148.922.1-150.3-156.5000115.5
360E29.3Very low30.2Very low177 Ų177133.6 Ų133.683%0.82779%0.793SS**  trans38.3155.3139.6-155.8151112.600126.1
361A30.5Very low30.2Very low84 Ų84129.6 Ų129.669%0.69479%0.786SS**  trans-142.9161.5175.900000111.9
362P37.9Very low30Very low128 Ų128134.5 Ų134.583%0.83179%0.793SS**  trans-144.7150.2135.234-17000117.5
363A31.3Very low30.3Very low76 Ų76136.3 Ų136.363%0.62879%0.792SS**  trans-58.9173-177.800000118.6
364F27.4Very low30.6Very low191 Ų191132.7 Ų132.784%0.83879%0.785SS**  173.4147.7103.2-94.4-60.7000118.1
365V28.5Very low30.5Very low134 Ų134131.9 Ų131.981%0.81279%0.786SS**  trans81.1143.9147.6168.70000121
366Q29.7Very low30.5Very low175 Ų175134.4 Ų134.482%0.81879%0.792SS**  trans-115171.7180-52.2167.55.200110.9
367V27.5Very low31.3Very low139 Ų139134.2 Ų134.284%0.84279%0.788SS**  171.3145.3127.7148.70000111
368A35.5Very low31.3Very low94 Ų94132.5 Ų132.578%0.77779%0.788SS**  trans-137.4145.8173.100000112.5
369P33Very low31.6Very low116 Ų116135.5 Ų135.575%0.75379%0.793SS**  trans-127.7127.3157.132.5-17.2000112
370V25.1Very low31.5Very low131 Ų131136.4 Ų136.479%0.79480%0.803SS**  93.198.166.7168.70000114.4
371V30.5Very low31.6Very low127 Ų127132.7 Ų132.777%0.7780%0.802SS**  trans34.7124.6132-173.70000121.1
372E30.6Very low31.4Very low193 Ų193133.4 Ų133.490%0.90281%0.808SS**  -167.2157.7115.2-103.9-169.1137.400112.8
373E33.8Very low31.2Very low180 Ų180135.5 Ų135.584%0.84181%0.811SS**  trans-104.4-158.7-179.3-43.9177.89400110.8
374P45.3Very low31.1Very low105 Ų105138 Ų13868%0.68282%0.818SS**  cis-133.8167.3-22.138.5-23.3000114.8
375S27.1Very low31.4Very low124 Ų124138 Ų13887%0.86782%0.821SS**  trans-172.5147.8141.5-84.30000113.3
376T29.5Very low31.5Very low139 Ų139138.7 Ų138.785%0.85382%0.82SS**  trans-127.2179.2172.960.50000108.5
377P42.1Very low31.4Very low112 Ų112135.8 Ų135.873%0.72781%0.814SS**  cis-136.81722.142.8-26.6000116.8
378A25.9Very low31.4Very low96 Ų96138.4 Ų138.479%0.79382%0.817SS**  trans66158.715900000117.3
379E31.9Very low31.1Very low196 Ų196140.2 Ų140.292%0.91682%0.818SS**  cis-118.9-168.95.3-86.6-168.4112.200113.4
380V29.3Very low31.6Very low148 Ų148140.2 Ų140.290%0.89782%0.818SS**  trans-103.6126.6-164.61780000113.2
381A31.1Very low31.7Very low98 Ų98140.8 Ų140.881%0.8182%0.822SS**  trans173.4114.9134.200000109.6
382A27.4Very low31.8Very low100 Ų100143.7 Ų143.783%0.82683%0.827SS**  trans-118.1119.7176.600000110.5
383I32Very low31.8Very low171 Ų171141.4 Ų141.488%0.87783%0.826SS**  trans-137103.9161.6-58.2177.3000105.8
384V29.3Very low31.8Very low130 Ų130137 Ų13779%0.78882%0.82SS**  trans-146.6122.1171.6170.50000106.2
385E35.4Very low31.7Very low190 Ų190137.7 Ų137.789%0.88882%0.824SS**  trans-66.6139.6160.6-75.1167.178.900109.1
386D30.1Very low31.8Very low149 Ų149138.7 Ų138.780%0.79783%0.825SS**  trans-143.4135.6157-146.7-23.4000111.2
387T27.1Very low32.1Very low114 Ų114138.2 Ų138.270%0.69982%0.822SS**  trans-87.6141.9-17848.70000110.9
388H27.6Very low31.7Very low193 Ų193141.6 Ų141.689%0.89483%0.828SS**  trans-162.9159.6142.1-105.7-65.8000112.1
389V29.6Very low32Very low133 Ų133145.4 Ų145.481%0.80683%0.829SS**  trans-112.6-170.3-166-1400000111.2
390P43.7Very low32.2Very low116 Ų116140.3 Ų140.375%0.75382%0.821SS**  -106.5164.5-122.541-27.3000115.8
391V26Very low32.6Very low143 Ų143139 Ų13987%0.86782%0.815SS**  trans-146.5133.3165.71790000111.2
392E33.4Very low33.1Very low187 Ų187138.8 Ų138.887%0.87481%0.813SS**  trans-97.6147.9164.5-64.4-167.713200112.1
393V30.3Very low34Very low146 Ų146139.1 Ų139.189%0.88581%0.807SS**  trans-148.5137.4141.8-172.60000108.8
394A33.1Very low34Very low87 Ų87137.7 Ų137.772%0.71980%0.799SS**  trans-104.6-142178.600000113
395P44.9Very low34.4Very low119 Ų119138.8 Ų138.877%0.77380%0.796SS**  -115.7168.2-102.937.6-24.9000115
396V28.5Very low34.2Very low146 Ų146136.4 Ų136.489%0.88579%0.788SS**  trans-136141.7168.7177.90000110.3
397V34.6Very low34.2Very low129 Ų129136.3 Ų136.378%0.78279%0.793SS**  trans-112.7141.3178.4168.90000109.3
398E34.8Very low34.8Very low182 Ų182135.1 Ų135.185%0.8580%0.795SS**  trans-174.2158.6141.4-98.5-102.377.200113.6
399E32.5Very low34.9Very low176 Ų176132.9 Ų132.982%0.82279%0.794SS**  trans66120.2163.6-147.1173.2-173.300122.4
400A35.1Very low35.3Very low90 Ų90132.5 Ų132.574%0.74479%0.792SS**  trans-135.7153.4154.500000107.9
401P38.4Very low35Very low121 Ų121135.9 Ų135.979%0.78680%0.798SS**  -149.1167.1106.435.4-17.4000117.4
402A40.7Very low35.5Very low92 Ų92137.3 Ų137.376%0.7679%0.792SS**  trans-79-153.5-176.300000113.3
403P46.8Very low35.3Very low107 Ų107136.5 Ų136.570%0.69579%0.792SS**  cis-144.8-1609.933-5000116.8
404I32.6Very low35.2Very low141 Ų141136.6 Ų136.672%0.72379%0.787SS**  trans90.9134.3156.8-60.4161.3000117.9
405E36.3Very low35.3Very low153 Ų153140 Ų14072%0.71579%0.792SS**  cis-162.4141.9-22.2-111.7171.4-150.300112
406I31.2Very low34.9Very low140 Ų140140.6 Ų140.672%0.71880%0.795SS**  trans37122138.4-54.8165.2000121
407T31.4Very low35Very low147 Ų147137.8 Ų137.890%0.90279%0.788SS**  -153.2149.6122.312.10000110.2
408A39.1Very low34.9Very low89 Ų89140.6 Ų140.674%0.73679%0.792SS**  trans-140.6139.9-177.700000111.8
409V29.8Very low34.7Very low146 Ų146138.7 Ų138.789%0.88579%0.792SS**  trans-137.2135163.5177.80000107.1
410V37.1Very low34.7Very low125 Ų125136 Ų13676%0.75879%0.788SS**  trans-123.4118.4-179.2172.30000108.6
411E38.1Very low34.6Very low187 Ų187139.6 Ų139.687%0.87479%0.794SS**  trans-152.257.4163.3-128.7161.7-139.800114.9
412K36.2Very low34Very low174 Ų174140.2 Ų140.276%0.75780%0.795SS**  trans32.7104.1133.4-172.3179.5-177.5172.20119.1
413I29.8Very low33.6Very low170 Ų170142.5 Ų142.587%0.87280%0.799SS**  trans-125156.9142-73.3-178.7000108.2
414L28.3Very low33Very low147 Ų147146.5 Ų146.577%0.7781%0.809SS**  trans-94.9136.9-167.5-67.2160000112.9
415I35.2Very low32.9Very low160 Ų160148.3 Ų148.382%0.82181%0.814SS**  trans-137.6128.8164.5-50174.9000107.5
416P36.5Very low32.9Very low130 Ų130145 Ų14584%0.84481%0.813SS**  trans-118.492.9172.335.7-22.5000111.9
417A29.8Very low33Very low88 Ų88144.6 Ų144.673%0.72782%0.819SS**  trans-155.4110.6165.600000110.6
418E33.5Very low33Very low187 Ų187144.6 Ų144.687%0.87482%0.819SS**  trans-171.8147.9143.8-113.2172.8-165.300109.7
419V30.8Very low32.8Very low142 Ų142144.4 Ų144.486%0.86182%0.817SS**  trans-127.8109.9178.5176.80000107.9
420V31.7Very low32.8Very low121 Ų121143.3 Ų143.373%0.73381%0.811SS**  trans-132.8134.6173.6-177.90000109.5
421L32.9Very low32.7Very low165 Ų165146.2 Ų146.286%0.86482%0.816SS**  trans-85.7122.6-178.2-66.2160.4000110.9
422V26.6Very low32.4Very low133 Ų133141 Ų14181%0.80681%0.805SS**  trans-138.8137.5158.8178.70000109.2
423V31.1Very low32.2Very low141 Ų141139.4 Ų139.486%0.85581%0.81SS**  trans-87.9130.2171.1171.10000108.7
424E35Very low32.9Very low190 Ų190136.9 Ų136.989%0.88880%0.804SS**  trans-132.9157.9161.7-139.4-170.9155.600112.5
425E30.6Very low32.9Very low180 Ų180136.2 Ų136.284%0.84181%0.806SS**  trans-80.4158.5-161.5-165.6-174.216000113.9
426A36.7Very low32.6Very low83 Ų83134.4 Ų134.469%0.68680%0.802SS**  trans-107.4123.9175.400000112.2
427P33.6Very low32.4Very low131 Ų131135.3 Ų135.385%0.85180%0.8SS**  trans-79.1144.1177.230.8-34.2000113.5
428V29.8Very low32.3Very low147 Ų147139.1 Ų139.189%0.89180%0.803SS**  trans-85.2140.4-176172.10000113.1
429A35.8Very low32Very low85 Ų85133.9 Ų133.970%0.70280%0.799SS**  trans-163.2131.6150.800000116.6
430T30.4Very low32.5Very low123 Ų123132.6 Ų132.676%0.75579%0.794SS**  trans44.7111.814650.40000124.3
431E33.8Very low32.3Very low187 Ų187132.5 Ų132.587%0.87479%0.793SS**  60.2139.5107-142.7-169.8156.900123.5
432A31.5Very low32.5Very low78 Ų78132.8 Ų132.865%0.64579%0.794SS**  trans111.9103.7136.900000121.3
433V31.9Very low32.9Very low139 Ų139132.3 Ų132.384%0.84279%0.791SS**  trans71.3128.9139.5-175.50000120.6
434P46.2Very low33Very low117 Ų117134 Ų13476%0.7679%0.79SS**  trans-101.6155.3172.339.2-34.2000114.8
435V26.6Very low32.8Very low134 Ų134131 Ų13181%0.81278%0.784SS**  trans169.8122.9160.5139.90000106.2
436V30.8Very low33.2Very low122 Ų122128.1 Ų128.174%0.73978%0.779SS**  67.1115.972.21790000114.7
437D30.6Very low33.3Very low149 Ų149129.7 Ų129.780%0.79778%0.782SS**  trans149.2156155.7-96.7-148.7000109.3
438E28.9Very low33.3Very low167 Ų167129.2 Ų129.278%0.7878%0.776SS**  cis177.177.1-27-112.2-74.6113.300107.1
439G27.1Very low33.4Very low77 Ų77128.9 Ų128.979%0.79478%0.775SS**  trans54.7-152.2162.500000119.7
440P40.5Very low33.6Very low116 Ų116133.5 Ų133.575%0.75378%0.782SS**  cis-141.7173.3-24.337.2-18.4000116
441V29Very low33.7Very low118 Ų118135.6 Ų135.672%0.71578%0.783SS**  trans69.6116.6159.5-153.60000120.4
442L36.9Very low33.4Very low171 Ų171132.1 Ų132.190%0.89577%0.774SS**  -152.8159.6116.1-83.7-159.1000109.7
443V33.3Very low33.4Very low123 Ų123134 Ų13475%0.74578%0.783SS**  trans-138.8141.4-168.81710000109.1
444E34.4Very low33.3Very low176 Ų176133.8 Ų133.882%0.82278%0.782SS**  179.9125.3128.3-98.2-172145.700115.9
445V31.3Very low33.1Very low127 Ų127133.5 Ų133.577%0.7778%0.78SS**  trans74.7145143.9-1760000121.3
446V37.1Very low33.2Very low120 Ų120131.4 Ų131.473%0.72778%0.777SS**  trans-142134.7-172.4165.50000108.8V448V446-V448 HydrophobicContact CG1-CG2 3.92Å
447P39.2Very low33.3Very low116 Ų116133.9 Ų133.975%0.75378%0.781SS**  -146.1153.2110.937.3-20.6000113.3
448V33.9Very low33.4Very low121 Ų121132.9 Ų132.973%0.73378%0.78SS**  cis72.6106.643.3179.90000114.9V446V446-V448 HydrophobicContact CG1-CG2 3.92Å
449V32.8Very low33.8Very low141 Ų141128.8 Ų128.886%0.85577%0.774SS**  trans-155.2122.2141.71730000108.4
450E38.5Very low34.2Very low181 Ų181131.3 Ų131.385%0.84678%0.776SS**  trans-94.6158.9151.2-71.4-174.697.900108.6
451E34.2Very low33.6Very low168 Ų168132.6 Ų132.679%0.78578%0.782SS**  trans-176.1175.3134.4-103.9-56.8162.900112.3
452T27.6Very low33.8Very low113 Ų113133.2 Ų133.269%0.69379%0.786SS**  trans-118.4161.8-159.458.40000114
453S29.9Very low33.5Very low117 Ų117133.6 Ų133.682%0.81878%0.783SS**  trans167.3146.5136.1-78.60000115.9
454T30.6Very low33.4Very low135 Ų135135.8 Ų135.883%0.82879%0.785SS**  trans-98-162.3159.353.80000108.5
455P42.3Very low33.4Very low111 Ų111131.3 Ų131.372%0.72178%0.778SS**  cis-146.9-161.9844.5-22000117
456A29.1Very low33.7Very low90 Ų90129.8 Ų129.874%0.74477%0.771SS**  trans70.5157.3146.800000120.2
457E31.7Very low33.5Very low175 Ų175130.8 Ų130.882%0.81878%0.777SS**  cis-172.1174-23.9-167.6-161.9129.400108.5
458V32.6Very low34.4Very low128 Ų128130.7 Ų130.778%0.77678%0.776SS**  trans91.4144.5160.6-167.60000117.9
459A38.1Very low34.2Very low81 Ų81131 Ų13167%0.66978%0.779SS**  trans-118.2165.4-167.200000114.3
460P34.3Very low34.2Very low129 Ų129132.3 Ų132.384%0.83878%0.776SS**  trans-90.6169.8173.636.4-34.9000114.3
461V27.8Very low33.7Very low144 Ų144128.9 Ų128.987%0.87377%0.767SS**  trans-128.1157.2-173.8166.20000112.2
462V33.4Very low33.4Very low131 Ų131127.2 Ų127.279%0.79477%0.768SS**  trans-53139.8-179.8-179.40000116.2
463E31.6Very low33.3Very low178 Ų178125.9 Ų125.983%0.83277%0.768SS**  trans165.9155.4136.3-97.2-174.5163.100109.8
464E30.2Very low33.2Very low170 Ų170126.5 Ų126.579%0.79477%0.767SS**  cis-149.3-169.6-10.1-149.7-153.1143.100109
465A35.8Very low32.9Very low81 Ų81126 Ų12667%0.66976%0.763SS**  trans-122-150.7175.200000110
466P36.1Very low32.3Very low96 Ų96129.5 Ų129.562%0.62377%0.77SS**  cis-143.8148.6-16.841.8-22.7000118.1
467V33.6Very low32.4Very low141 Ų141129.1 Ų129.186%0.85577%0.767SS**  trans62.8-173140.3-47.50000121.9
468P58.9Low33.2Very low114 Ų114126.9 Ų126.974%0.7477%0.767SS**  -138.7-172.4-116.642.1-17.8000119.2
469T29.2Very low32.9Very low128 Ų128125.8 Ų125.879%0.78577%0.772SS**  trans-157.8162.2165.427.50000109.2
470E31.9Very low32.7Very low168 Ų168127.6 Ų127.679%0.78578%0.779SS**  cis87.5142.519.1-69.2-157.1117.200117
471V29.5Very low32.5Very low109 Ų109127.5 Ų127.566%0.66178%0.777SS**  cis-158.7139.55.5-1070000114.6
472V27.8Very low32.8Very low133 Ų133129.5 Ų129.581%0.80678%0.777SS**  trans67.4146.5133.8173.40000123.8
473A25.5Very low32.8Very low85 Ų85129.6 Ų129.670%0.70278%0.777SS**  trans77.7153.7154.800000120
474V26.2Very low32.8Very low130 Ų130125 Ų12579%0.78877%0.769SS**  cis-165155-6.91240000111.2
475V26Very low33Very low124 Ų124122.9 Ų122.975%0.75277%0.771SS**  trans22.5131.6149.8-172.10000118.7
476E28.5Very low32.7Very low184 Ų184125.8 Ų125.886%0.8678%0.78SS**  -165.8173.967.9-154.9164.8173.100114
477A31Very low32.6Very low83 Ų83129.9 Ų129.969%0.68679%0.793SS**  trans-148.6-179.6177.800000110.2
478P48.3Very low32.5Very low127 Ų127131.1 Ų131.183%0.82579%0.789SS**  cis-123.7166.6-48.936.4-24000112
479A27.7Very low31.2Very low106 Ų106133.9 Ų133.988%0.87679%0.792SS**  trans-150138.3163.900000112.2
480S33.5Very low31.4Very low118 Ų118134 Ų13483%0.82579%0.793SS**  trans-104.4147172.4-1790000110.2
481T29.4Very low31.7Very low128 Ų128131.9 Ų131.979%0.78579%0.794SS**  trans-152131.4167.3-66.60000110.8
482E35.2Very low31.9Very low185 Ų185133.1 Ų133.186%0.86480%0.801SS**  trans-93.5131.9-179.7172.4-159.7131.400110.8
483V33.8Very low32.6Very low134 Ų134134.5 Ų134.581%0.81280%0.803SS**  trans-144.2143.6163.2-173.60000110
484A30.6Very low33.2Very low80 Ų80136.2 Ų136.266%0.66181%0.805SS**  trans-68.3158.1-171.400000115.8
485P33.6Very low33.6Very low127 Ų127136.9 Ų136.983%0.82580%0.804SS**  trans-73.7148.4178.330.8-36.6000113.5
486V29.8Very low34.9Very low142 Ų142136.6 Ų136.686%0.86181%0.808SS**  trans-104.3138.4171175.70000109.1
487M34.2Very low35.6Very low182 Ų182133.1 Ų133.190%0.89780%0.804SS**  trans-81.2143.1179.5-48.3-164.786.100111.4
488Q32Very low36.6Very low167 Ų167136.7 Ų136.778%0.7880%0.803SS**  trans-145.2104.4164.1-151.2160.814.200113.6
489E31.6Very low36.5Very low171 Ų171139.9 Ų139.980%0.79981%0.808SS**  trans46.2123.9142-58.6179.7118.800121.6
490T32.9Very low37.2Very low130 Ų130142.5 Ų142.580%0.79880%0.796SS**PPolyproline II helixtrans-75.5134.7169.948.60000113.1
491P38.6Very low38.1Very low125 Ų125144.1 Ų144.181%0.81279%0.794SS**PPolyproline II helixtrans-80.2162.8157.733.9-32.5000111.7
492V33.2Very low39Very low135 Ų135143.9 Ų143.982%0.81879%0.792SS**PPolyproline II helixtrans-100150.7-174.4177.60000111.8
493L42.3Very low39.9Very low161 Ų161140.4 Ų140.484%0.84378%0.783SS**  trans-44126.9173.9178.6157.6000114
494V38.4Very low40.6Very low121 Ų121139.7 Ų139.773%0.73378%0.779SS**  trans-147.3129.4162.3-177.10000109.1
495D35.8Very low41.2Very low145 Ų145143.3 Ų143.378%0.77579%0.786SS**  trans21.9113.5169.2-62.1-56.6000121.2
496S52.6Low41.9Very low118 Ų118146.8 Ų146.883%0.82579%0.791SS**SBendtrans-81.5108169.349.90000112.9
497S43.8Very low42.5Very low111 Ų111142.8 Ų142.878%0.77678%0.779SS**  trans173.744.1156.540.90000113.1
498K52Low42.8Very low157 Ų157140.6 Ų140.668%0.68378%0.776SS**  trans-139115.2175.3-68.7176.2-174.1155.50110.5Y500K498-Y500 HydrophobicContact CB-CD2 4.43Å; K498-Y500 HydrophobicContact CB-CE2 3.71Å; K498-Y500 WeakPolarHBondContact O-CD2 3.41Å; K498-Y500 WeakPolarHBondContact O-CE2 3.41Å
499E46.3Very low43.4Very low195 Ų195138.8 Ų138.891%0.91178%0.778SS**  trans-76.8134.4170.9-62.3-179.5143.600109.6
500Y41.8Very low44.2Very low161 Ų161139.8 Ų139.863%0.63178%0.78SS**  trans-121.2113.3178.2-66.4-87.8000108.9K498 V502K498-Y500 HydrophobicContact CB-CD2 4.43Å; K498-Y500 HydrophobicContact CB-CE2 3.71Å; K498-Y500 WeakPolarHBondContact O-CD2 3.41Å; K498-Y500 WeakPolarHBondContact O-CE2 3.41Å; Y500-V502 PolarHBondContact O-N 3.04Å
501I52Low44.9Very low152 Ų152141.7 Ų141.778%0.77978%0.78SS**  trans-77.2108.5178-49.3178.7000109.1V503I501-V503 HydrophobicContact CG2-CG2 3.62Å; I501-V503 PolarHBondContact O-N 3.41Å
502V48Very low45.5Very low123 Ų123145.3 Ų145.375%0.74579%0.786SS**  trans-89.985.8173.2-174.30000109.1Y500 V504Y500-V502 PolarHBondContact O-N 3.04Å; V502-V504 HydrophobicContact CG1-CG2 4.08Å; V502-V504 PolarHBondContact O-N 3.08Å; V502-V504 VanDerWaalsContact O-N 3.11Å
503V53.5Low46.2Very low112 Ų112148.4 Ų148.468%0.67979%0.788SS**  trans-76.296.9175.7-173.10000109.8I501 L505I501-V503 HydrophobicContact CG2-CG2 3.62Å; I501-V503 PolarHBondContact O-N 3.41Å; V503-L505 HydrophobicContact CG1-CG 4.3Å; V503-L505 PolarHBondContact O-N 2.99Å
504V50.2Low46.5Very low119 Ų119151.9 Ų151.972%0.72179%0.79SS**  trans-84.2102.8169.2-175.50000108.7V502 E506V502-V504 HydrophobicContact CG1-CG2 4.08Å; V502-V504 PolarHBondContact O-N 3.08Å; V502-V504 VanDerWaalsContact O-N 3.11Å; V504-E506 PolarHBondContact O-N 3.07Å
505L43.2Very low47Very low155 Ų155152 Ų15281%0.81279%0.793SS**  trans-79.4106169-79.2164.5000109.5V503 G507V503-L505 HydrophobicContact CG1-CG 4.3Å; V503-L505 PolarHBondContact O-N 2.99Å; L505-G507 PolarHBondContact O-N 3.1Å
506E47.8Very low47.6Very low201 Ų201154.5 Ų154.594%0.93980%0.797SS**  trans-68.595.1164.3-79.1-158.1119.300110V504V504-E506 PolarHBondContact O-N 3.07Å
507G41.4Very low47.2Very low58 Ų58155.3 Ų155.360%0.59880%0.797SS**  trans-147.6120.7170.100000109.6L505 P509L505-G507 PolarHBondContact O-N 3.1Å; G507-P509 VanDerWaalsContact O-CD 3.3Å; G507-P509 WeakPolarHBondContact O-CD 3.46Å
508T40.9Very low47.2Very low135 Ų135157.6 Ų157.683%0.82880%0.8SS**  trans-64.7116.1-178.150.70000110.5K510T508-K510 PolarHBondContact O-N 3.09Å
509P45.6Very low46.8Very low129 Ų129153.6 Ų153.684%0.83880%0.803SS**  trans-75.6115.9-174.229.2-33.6000110.9G507 E511G507-P509 VanDerWaalsContact O-CD 3.3Å; G507-P509 WeakPolarHBondContact O-CD 3.46Å; P509-E511 PolarHBondContact O-N 3.27Å
510K46.8Very low46.7Very low192 Ų192150.6 Ų150.684%0.83580%0.798SS**  trans-79.1113.2164.5-73.3-174.2176.8-179.90109.8T508T508-K510 PolarHBondContact O-N 3.09Å
511E49.2Very low47Very low170 Ų170145.7 Ų145.779%0.79480%0.796SS**SBendtrans66.1105.3156.8-64173.3-170.500119P509 K513P509-E511 PolarHBondContact O-N 3.27Å; E511-K513 PolarHBondContact O-N 3.5Å
512E49.9Very low46.5Very low202 Ų202143.8 Ų143.894%0.94479%0.794SS**  trans46.142.1142.1-57-150.4143.100120.2
513K48.8Very low46.8Very low199 Ų199147.3 Ų147.387%0.86581%0.805SS**  trans-120.1121.4158.5-74.2173.5-175.4160.50111.2E511E511-K513 PolarHBondContact O-N 3.5Å
514R48.6Very low46.4Very low234 Ų234147.8 Ų147.888%0.88381%0.808SS**  trans-57139.2178.5-59.7-178.9-176.6-164.7-0.4109.7K516R514-K516 PolarHBondContact O-N 3.3Å; R514-K516 VanDerWaalsContact O-N 3.1Å
515P49.2Very low46.5Very low123 Ų123146.4 Ų146.480%0.79982%0.818SS**  trans-60.2117.9177.324.7-33.3000109.9V517P515-V517 PolarHBondContact O-N 3.06Å
516K48.8Very low46.3Very low198 Ų198149.7 Ų149.786%0.86182%0.819SS**  trans-75.2107.8171.2-75.8-176.1176.5-179.30108R514 L518R514-K516 PolarHBondContact O-N 3.3Å; R514-K516 VanDerWaalsContact O-N 3.1Å; K516-L518 PolarHBondContact O-N 2.99Å
517V44.4Very low46.2Very low135 Ų135148.1 Ų148.182%0.81882%0.816SS**  trans-68.697.7170.1-177.70000108.3P515P515-V517 PolarHBondContact O-N 3.06Å
518L43.5Very low46.4Very low160 Ų160152.5 Ų152.584%0.83882%0.824SS**  trans-68.7138163.3-85.8154.2000108.5K516K516-L518 PolarHBondContact O-N 2.99Å
519G42.9Very low47Very low73 Ų73151.2 Ų151.275%0.75382%0.818SS**  trans-70.2137.8-163.300000114G521G519-G521 PolarHBondContact O-N 3.42Å
520V43.6Very low47.3Very low131 Ų131149.1 Ų149.179%0.79481%0.812SS**  trans-75.4105.6171.6-177.40000109.2
521G47.8Very low47.5Very low58 Ų58146 Ų14660%0.59881%0.81SS**  trans-99.9140.7170.900000111.5G519G519-G521 PolarHBondContact O-N 3.42Å
522P43.1Very low47.3Very low113 Ų113146.5 Ų146.573%0.73481%0.813SS**  trans-68.3147.4170.729.8-33.9000110.8T524P522-T524 PolarHBondContact O-N 3.16Å
523M53.4Low47Very low196 Ų196145.4 Ų145.497%0.96681%0.814SS**  trans-57.199.5178.7-78.8-74.2-166.600111.7
524T44.7Very low46.8Very low122 Ų122143.5 Ų143.575%0.74881%0.813SS**  trans-125.8115.7160.351.50000107.7P522 R526P522-T524 PolarHBondContact O-N 3.16Å; T524-R526 PolarHBondContact O-N 3.1Å
525G52Low46.5Very low90 Ų90135 Ų13593%0.92880%0.798SS**  trans-68.790.8-171.100000113
526R40.4Very low46.2Very low225 Ų225135.6 Ų135.685%0.84980%0.8SS**  trans-139.3120.5158.8-76.9-170.4172.5158.4-0.5109.5T524 I528T524-R526 PolarHBondContact O-N 3.1Å; R526-I528 PolarHBondContact O-N 3.44Å
527I45.8Very low46.3Very low167 Ų167131.5 Ų131.586%0.85679%0.793SS**  trans-66121.8168.1-60.3164.2000106.9
528I44.2Very low46.3Very low150 Ų150129.8 Ų129.877%0.76979%0.794SS**  trans-95.8114.3170-60.1175.4000106R526R526-I528 PolarHBondContact O-N 3.44Å
529P53.4Low46.4Very low108 Ų108128.1 Ų128.170%0.70180%0.795SS**PPolyproline II helixtrans-57.8141.1170.2-2233.9000110
530A52Low46.2Very low86 Ų86137.5 Ų137.571%0.71182%0.819SS**PPolyproline II helixtrans-61.4141.7177.200000110.3E532A530-E532 PolarHBondContact O-N 3.48Å
531P51.3Low46.4Very low125 Ų125137.8 Ų137.881%0.81282%0.82SS**PPolyproline II helixtrans-67.612717129.2-32.9000109.2
532E45.5Very low46.3Very low181 Ų181142 Ų14285%0.84683%0.832SS**PPolyproline II helixtrans-73.9139.5173.7-63.8-178.4-14100109.9A530 D534A530-E532 PolarHBondContact O-N 3.48Å; E532-D534 PolarHBondContact O-N 3.47Å
533D43.5Very low46.5Very low179 Ų179143.6 Ų143.696%0.95784%0.838SS**  trans-8360.5-169.3-125-39.5000111.5G535D533-G535 PolarHBondContact O-N 2.75Å
534D43.8Very low46.1Very low159 Ų159140.5 Ų140.585%0.8583%0.83SS**  trans-96.888.2-174.2-142.3-7.5000111.7E532E532-D534 PolarHBondContact O-N 3.47Å
535G42.4Very low46.1Very low55 Ų55141.7 Ų141.757%0.56784%0.835SS**  trans-117.1132.6164.300000109.2D533D533-G535 PolarHBondContact O-N 2.75Å
536T43.9Very low45.7Very low136 Ų136145.1 Ų145.183%0.83483%0.829SS**  cis-175.5-166.336.348.40000108.2
537P49.7Very low46.1Very low112 Ų112139.4 Ų139.473%0.72783%0.828SS**  -111.7-176.9-61.537.2-24.6000111.1
538A45Very low46.2Very low100 Ų100137.3 Ų137.383%0.82683%0.825SS**  trans-64.6153.2174.400000113.7
539S45.9Very low46.3Very low124 Ų124136.3 Ų136.387%0.86783%0.83SS**  trans-149.2114166.3-71.60000111
540E39.3Very low45.7Very low270 Ų270138.8 Ų138.8100%1.26284%0.842SS**  trans-123.40156.6-175.7-178.5116.500107

Retrieved 540 of 540 residues in 237.2 ms (Link to these results)