A0A087Y5F6_POEFO Loading...

Intermediate filament family orphan 2

AlphaFold DB , UniProt , Accession A0A087Y5F6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 479 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
1M37Very low41.4Very low243 Ų243141.8 Ų141.8100%1.19781%0.809SS**  0115.40-66.9171.4175.900106.7
2S37Very low41.4Very low121 Ų121134.8 Ų134.885%0.84679%0.791SS**  cis-143.6160.3-3.2-67.30000109.8
3S36.6Very low41.7Very low101 Ų101134.2 Ų134.271%0.70679%0.794SS**  trans-123.8166.7-168.148.70000112.2
4L43.2Very low42.5Very low137 Ų137134.2 Ų134.272%0.71780%0.795SS**  trans75.7153.2174.2-41.7170.9000113
5F40.3Very low42.5Very low155 Ų155132.3 Ų132.368%0.6879%0.79SS**  cis-156.5151.316.3-121.4-43.7000112.2
6F38Very low43.1Very low178 Ų178130.4 Ų130.478%0.78179%0.785SS**  trans60.8158.3163.5-72-76.7000118.2
7C34.7Very low43.5Very low112 Ų112125.5 Ų125.576%0.75777%0.767SS**  cis-136.8152.12.2-157.90000112.3
8E43.3Very low43.9Very low173 Ų173123.1 Ų123.181%0.80876%0.756SS**PPolyproline II helixtrans-97.6132.8175-177.8178.3167.200110.1
9P47.4Very low44.3Very low106 Ų106119.1 Ų119.169%0.68874%0.742SS**PPolyproline II helixtrans-83.6145.9171.833.8-32.5000111
10P46.6Very low44.8Very low124 Ų124116.1 Ų116.181%0.80573%0.729SS**PPolyproline II helixtrans-72151-173.730.1-36.1000113.1G12P10-G12 PolarHBondContact O-N 2.76Å
11A50.7Low45.3Very low110 Ų110114.9 Ų114.991%0.90972%0.721SS**  trans-64.9104.2169.600000110.8
12G41.8Very low46.5Very low58 Ų58107.3 Ų107.360%0.59869%0.689SS**  trans-70158.1168.800000112P10P10-G12 PolarHBondContact O-N 2.76Å
13P45.5Very low47.8Very low127 Ų127104.2 Ų104.283%0.82567%0.667SS**  trans-64.3139.8-17927.4-34.8000111.7C15P13-C15 PolarHBondContact O-N 2.91Å
14V52.3Low49.1Very low134 Ų134101.4 Ų101.481%0.81265%0.65SS**  trans-66.7101.6178.31770000109.8S16V14-S16 WeakPolarHBondContact CG1-OG 3.47Å
15C43Very low50.1Low106 Ų106100.2 Ų100.272%0.71664%0.643SS**  trans-105.871.8-179.9-160.80000110.9P13 G17P13-C15 PolarHBondContact O-N 2.91Å; C15-G17 PolarHBondContact O-N 3.31Å
16S51.5Low51.5Low101 Ų101102.1 Ų102.171%0.70665%0.646SS**THydrogen-bonded Turntrans-64.2-2.3-171.1-56.50000116.3V14V14-S16 WeakPolarHBondContact CG1-OG 3.47Å
17G50.9Low53.1Low47 Ų4799 Ų9949%0.48564%0.638SS.*THydrogen-bonded Turntrans-82.3-37-178.300000115.4C15 A20 V21C15-G17 PolarHBondContact O-N 3.31Å; G17-A20 PolarHBondContact O-N 2.94Å; G17-V21 PolarHBondContact O-N 3.12Å
18S50.5Low55Low82 Ų8297.8 Ų97.857%0.57362%0.624SS**Hα-helixtrans-73.9-34.4-166-1700000114A20 T22S18-A20 VanDerWaalsContact C-N 3.34Å; S18-A20 PolarHBondContact O-N 3.11Å; S18-T22 PolarHBondContact O-N 2.79Å; S18-T22 VanDerWaalsContact O-N 3.14Å; S18-T22 PolarHBondContact O-OG1 3.09Å
19G51.8Low56.4Low48 Ų4895.1 Ų95.150%0.49561%0.614SS.*Hα-helixtrans-67.4-31.6177.100000113.7T22 S23G19-T22 PolarHBondContact O-OG1 3.46Å; G19-S23 WeakPolarHBondContact O-CB 3.44Å; G19-S23 PolarHBondContact O-N 3.43Å; G19-S23 VanDerWaalsContact O-N 3.1Å; G19-S23 PolarHBondContact O-OG 3.27Å
20A54.6Low57.7Low58 Ų5891.9 Ų91.948%0.47960%0.6SS.*Hα-helixtrans-69-48.6176.300000111.4G17 S18 T22 S23 A24G17-A20 PolarHBondContact O-N 2.94Å; S18-A20 VanDerWaalsContact C-N 3.34Å; S18-A20 PolarHBondContact O-N 3.11Å; A20-T22 PolarHBondContact O-N 3.31Å; A20-S23 PolarHBondContact O-N 2.98Å; A20-S23 PolarHBondContact O-OG 3.39Å; A20-S23 VanDerWaalsContact O-OG 3.04Å; A20-A24 VanDerWaalsContact O-CB 3.31Å; A20-A24 WeakPolarHBondContact O-CB 3.42Å; A20-A24 PolarHBondContact O-N 3.25Å
21V53.9Low59.2Low91 Ų9189.1 Ų89.155%0.55258%0.584SS**Hα-helixtrans-63.8-41.6179.4-1800000111.6G17 S23 A24 L25G17-V21 PolarHBondContact O-N 3.12Å; V21-S23 PolarHBondContact O-N 3.35Å; V21-A24 PolarHBondContact O-N 2.97Å; V21-L25 HydrophobicContact CG1-CD1 4.03Å; V21-L25 HydrophobicContact CG1-CG 4.5Å; V21-L25 WeakPolarHBondContact O-CB 3.42Å; V21-L25 WeakPolarHBondContact O-CG 3.48Å; V21-L25 PolarHBondContact O-N 3.16Å
22T64Low60.7Low85 Ų8588.4 Ų88.452%0.52157%0.565SS.*Hα-helixtrans-74.8-21.6179.9510000114.1S18 G19 A20 R26S18-T22 PolarHBondContact O-N 2.79Å; S18-T22 VanDerWaalsContact O-N 3.14Å; S18-T22 PolarHBondContact O-OG1 3.09Å; G19-T22 PolarHBondContact O-OG1 3.46Å; A20-T22 PolarHBondContact O-N 3.31Å; T22-R26 WeakPolarHBondContact O-CB 3.29Å
23S64Low62.8Low55 Ų5589.4 Ų89.439%0.38556%0.555SS.*Hα-helixtrans-84.6-37.6169.753.80000112.5G19 A20 V21 R26 N27G19-S23 WeakPolarHBondContact O-CB 3.44Å; G19-S23 PolarHBondContact O-N 3.43Å; G19-S23 VanDerWaalsContact O-N 3.1Å; G19-S23 PolarHBondContact O-OG 3.27Å; A20-S23 PolarHBondContact O-N 2.98Å; A20-S23 PolarHBondContact O-OG 3.39Å; A20-S23 VanDerWaalsContact O-OG 3.04Å; V21-S23 PolarHBondContact O-N 3.35Å; S23-R26 WeakPolarHBondContact O-CB 3.3Å; S23-R26 PolarHBondContact O-N 3.49Å; S23-N27 VanDerWaalsContact O-CG 3.22Å; S23-N27 PolarHBondContact O-N 3.39Å; S23-N27 PolarHBondContact O-ND2 3.01Å
24A63.1Low64.7Low43 Ų4389.2 Ų89.236%0.35554%0.543SS..Hα-helixtrans-56.8-55.2171.100000111.2A20 V21 R26 N27 D28A20-A24 VanDerWaalsContact O-CB 3.31Å; A20-A24 WeakPolarHBondContact O-CB 3.42Å; A20-A24 PolarHBondContact O-N 3.25Å; V21-A24 PolarHBondContact O-N 2.97Å; A24-R26 PolarHBondContact O-N 2.98Å; A24-R26 VanDerWaalsContact O-N 3.12Å; A24-N27 CarbonylContact O-C 3.55Å; A24-N27 WeakPolarHBondContact O-CA 3.3Å; A24-N27 WeakPolarHBondContact O-CB 3.48Å; A24-N27 PolarHBondContact O-N 3.4Å; A24-D28 PolarHBondContact O-N 3.35Å
25L63.9Low66.4Low111 Ų11186.6 Ų86.658%0.58153%0.528SS*.Hα-helixtrans-58.3-30.5177-70.4171.7000113.3V21 L29V21-L25 HydrophobicContact CG1-CD1 4.03Å; V21-L25 HydrophobicContact CG1-CG 4.5Å; V21-L25 WeakPolarHBondContact O-CB 3.42Å; V21-L25 WeakPolarHBondContact O-CG 3.48Å; V21-L25 PolarHBondContact O-N 3.16Å; L25-L29 VanDerWaalsContact O-CB 3.27Å; L25-L29 WeakPolarHBondContact O-CB 3.48Å; L25-L29 PolarHBondContact O-N 3.05Å
26R70.7Confident68.8Low196 Ų19686.3 Ų86.374%0.7452%0.519SS*.Hα-helixtrans-71.6-40.1173.7-179.9179.7-66.3-133.9-1.6111.8T22 S23 A24 G30T22-R26 WeakPolarHBondContact O-CB 3.29Å; S23-R26 WeakPolarHBondContact O-CB 3.3Å; S23-R26 PolarHBondContact O-N 3.49Å; A24-R26 PolarHBondContact O-N 2.98Å; A24-R26 VanDerWaalsContact O-N 3.12Å; R26-G30 PolarHBondContact O-N 2.91Å
27N70Confident70.5Confident112 Ų11288.1 Ų88.160%0.59951%0.514SS*.Hα-helixtrans-68.7-42.4176.6-67.2-16.4000110.9S23 A24 G30 S31S23-N27 VanDerWaalsContact O-CG 3.22Å; S23-N27 PolarHBondContact O-N 3.39Å; S23-N27 PolarHBondContact O-ND2 3.01Å; A24-N27 CarbonylContact O-C 3.55Å; A24-N27 WeakPolarHBondContact O-CA 3.3Å; A24-N27 WeakPolarHBondContact O-CB 3.48Å; A24-N27 PolarHBondContact O-N 3.4Å; N27-G30 CarbonylContact O-C 3.56Å; N27-G30 WeakPolarHBondContact O-CA 3.16Å; N27-G30 PolarHBondContact O-N 2.97Å; N27-S31 WeakPolarHBondContact O-CB 3.35Å; N27-S31 PolarHBondContact O-N 2.7Å
28D75.6Confident72.2Confident87 Ų8788.3 Ų88.347%0.46551%0.506SS..Hα-helixtrans-64-43176.2-64.4-29.9000111.6A24 G30 S31 N32A24-D28 PolarHBondContact O-N 3.35Å; D28-G30 VanDerWaalsContact C-N 3.32Å; D28-G30 PolarHBondContact O-N 3.4Å; D28-S31 PolarHBondContact O-N 3.49Å; D28-N32 WeakPolarHBondContact O-CB 3.47Å; D28-N32 PolarHBondContact O-N 3.23Å; D28-N32 PolarHBondContact O-ND2 3.05Å
29L73.1Confident74.1Confident116 Ų11688.3 Ų88.361%0.60750%0.498SS*.Hα-helixtrans-64.5-38.7174.1-163.273.3000111.2L25 I33L25-L29 VanDerWaalsContact O-CB 3.27Å; L25-L29 WeakPolarHBondContact O-CB 3.48Å; L25-L29 PolarHBondContact O-N 3.05Å; L29-I33 HydrophobicContact CG-CD1 4.22Å; L29-I33 WeakPolarHBondContact O-CB 3.47Å; L29-I33 WeakPolarHBondContact O-CD1 3.32Å; L29-I33 WeakPolarHBondContact O-CG1 3.47Å; L29-I33 PolarHBondContact O-N 2.85Å
30G75.2Confident75.9Confident38 Ų3891 Ų9139%0.39250%0.501SS..Hα-helixtrans-62.7-41.6172.700000113.3R26 N27 D28 I33 H34R26-G30 PolarHBondContact O-N 2.91Å; N27-G30 CarbonylContact O-C 3.56Å; N27-G30 WeakPolarHBondContact O-CA 3.16Å; N27-G30 PolarHBondContact O-N 2.97Å; D28-G30 VanDerWaalsContact C-N 3.32Å; D28-G30 PolarHBondContact O-N 3.4Å; G30-I33 PolarHBondContact O-N 3.08Å; G30-H34 PolarHBondContact O-N 3.46Å
31S78Confident77.6Confident67 Ų6792.8 Ų92.847%0.46950%0.503SS..Hα-helixtrans-64.1-50.9176-174.30000110.9N27 D28 I33 H34 V35N27-S31 WeakPolarHBondContact O-CB 3.35Å; N27-S31 PolarHBondContact O-N 2.7Å; D28-S31 PolarHBondContact O-N 3.49Å; S31-I33 VanDerWaalsContact C-N 3.31Å; S31-I33 PolarHBondContact O-N 2.95Å; S31-H34 CarbonylContact O-C 3.56Å; S31-H34 WeakPolarHBondContact O-CA 3.4Å; S31-H34 WeakPolarHBondContact O-CB 3.22Å; S31-H34 PolarHBondContact O-N 3.02Å; S31-V35 WeakPolarHBondContact O-CG2 3.3Å; S31-V35 PolarHBondContact O-N 2.91Å
32N82.3Confident79.1Confident94 Ų9496.1 Ų96.150%0.50351%0.505SS..Hα-helixtrans-57-42.2174.5-81.7-76.8000112.1D28 H34 V35 L36D28-N32 WeakPolarHBondContact O-CB 3.47Å; D28-N32 PolarHBondContact O-N 3.23Å; D28-N32 PolarHBondContact O-ND2 3.05Å; N32-H34 VanDerWaalsContact C-N 3.32Å; N32-H34 PolarHBondContact O-N 3.4Å; N32-V35 PolarHBondContact O-N 2.98Å; N32-L36 WeakPolarHBondContact O-CB 3.33Å; N32-L36 WeakPolarHBondContact O-CD1 3.02Å; N32-L36 PolarHBondContact O-N 2.94Å
33I85.4Confident80.6Confident79 Ų7997.6 Ų97.641%0.40551%0.505SS..Hα-helixtrans-63.6-36.5173.8-72.8165.5000111.7L29 G30 S31 K37L29-I33 HydrophobicContact CG-CD1 4.22Å; L29-I33 WeakPolarHBondContact O-CB 3.47Å; L29-I33 WeakPolarHBondContact O-CD1 3.32Å; L29-I33 WeakPolarHBondContact O-CG1 3.47Å; L29-I33 PolarHBondContact O-N 2.85Å; G30-I33 PolarHBondContact O-N 3.08Å; S31-I33 VanDerWaalsContact C-N 3.31Å; S31-I33 PolarHBondContact O-N 2.95Å; I33-K37 HydrophobicContact CG2-CD 4.05Å; I33-K37 WeakPolarHBondContact O-CB 3.36Å; I33-K37 WeakPolarHBondContact O-CD 3.45Å; I33-K37 WeakPolarHBondContact O-CG 3.39Å; I33-K37 PolarHBondContact O-N 3.12Å; I33-K37 VanDerWaalsContact O-N 3.07Å
34H86Confident81.8Confident123 Ų123103.3 Ų103.357%0.56952%0.518SS*.Hα-helixtrans-69.6-44.2175.3-173.585.4000111.9G30 S31 N32 K37 T38G30-H34 PolarHBondContact O-N 3.46Å; S31-H34 CarbonylContact O-C 3.56Å; S31-H34 WeakPolarHBondContact O-CA 3.4Å; S31-H34 WeakPolarHBondContact O-CB 3.22Å; S31-H34 PolarHBondContact O-N 3.02Å; N32-H34 VanDerWaalsContact C-N 3.32Å; N32-H34 PolarHBondContact O-N 3.4Å; H34-K37 PolarHBondContact O-N 3.3Å; H34-T38 WeakPolarHBondContact O-CB 3.35Å; H34-T38 PolarHBondContact O-N 3.21Å; H34-T38 PolarHBondContact O-OG1 3.12Å
35V88Confident82.8Confident80 Ų80104.6 Ų104.649%0.48552%0.523SS..Hα-helixtrans-58.3-49.3174.11730000110.5S31 N32 K37 T38 L39S31-V35 WeakPolarHBondContact O-CG2 3.3Å; S31-V35 PolarHBondContact O-N 2.91Å; N32-V35 PolarHBondContact O-N 2.98Å; V35-K37 VanDerWaalsContact C-N 3.32Å; V35-K37 PolarHBondContact O-N 3.49Å; V35-T38 PolarHBondContact O-N 2.9Å; V35-L39 VanDerWaalsContact O-CB 3.3Å; V35-L39 WeakPolarHBondContact O-CB 3.32Å; V35-L39 PolarHBondContact O-N 3.06Å
36L91.8Very high84.3Confident100 Ų100105.9 Ų105.952%0.52453%0.525SS..Hα-helixtrans-60.6-37.7176.5-99.771.6000112.8N32 N40N32-L36 WeakPolarHBondContact O-CB 3.33Å; N32-L36 WeakPolarHBondContact O-CD1 3.02Å; N32-L36 PolarHBondContact O-N 2.94Å; L36-N40 WeakPolarHBondContact O-CB 3.31Å; L36-N40 PolarHBondContact O-N 3.4Å; L36-N40 PolarHBondContact O-ND2 3.28Å
37K87.4Confident85.4Confident139 Ų139101.5 Ų101.560%0.60452%0.515SS*.Hα-helixtrans-66.9-44.6175.7-77.8167.8-179.11730111.8I33 H34 V35 N40 L41I33-K37 HydrophobicContact CG2-CD 4.05Å; I33-K37 WeakPolarHBondContact O-CB 3.36Å; I33-K37 WeakPolarHBondContact O-CD 3.45Å; I33-K37 WeakPolarHBondContact O-CG 3.39Å; I33-K37 PolarHBondContact O-N 3.12Å; I33-K37 VanDerWaalsContact O-N 3.07Å; H34-K37 PolarHBondContact O-N 3.3Å; V35-K37 VanDerWaalsContact C-N 3.32Å; V35-K37 PolarHBondContact O-N 3.49Å; K37-N40 PolarHBondContact O-N 2.85Å; K37-L41 WeakPolarHBondContact O-CB 3.24Å; K37-L41 PolarHBondContact O-N 2.8Å
38T87.3Confident86.3Confident51 Ų5199.1 Ų99.131%0.31351%0.511SS..Hα-helixtrans-64.8-40.6176.4-68.50000111.4H34 V35 L41 R42H34-T38 WeakPolarHBondContact O-CB 3.35Å; H34-T38 PolarHBondContact O-N 3.21Å; H34-T38 PolarHBondContact O-OG1 3.12Å; V35-T38 PolarHBondContact O-N 2.9Å; T38-L41 PolarHBondContact O-N 2.75Å; T38-R42 WeakPolarHBondContact O-CG 3.28Å; T38-R42 PolarHBondContact O-N 3Å
39L90.4Very high86.9Confident81 Ų81100.8 Ų100.842%0.42451%0.514SS..Hα-helixtrans-64.5-45174.9-164.774.1000111.7V35 L41 R42 F43V35-L39 VanDerWaalsContact O-CB 3.3Å; V35-L39 WeakPolarHBondContact O-CB 3.32Å; V35-L39 PolarHBondContact O-N 3.06Å; L39-L41 PolarHBondContact O-N 2.71Å; L39-R42 WeakPolarHBondContact O-CB 3.33Å; L39-R42 PolarHBondContact O-N 3.44Å; L39-F43 HydrophobicContact CD1-CE2 4.29Å; L39-F43 HydrophobicContact CD2-CE2 3.79Å; L39-F43 HydrophobicContact CG-CD2 4.01Å; L39-F43 HydrophobicContact CG-CE2 3.61Å; L39-F43 HydrophobicContact CG-CZ 4.41Å; L39-F43 VanDerWaalsContact O-CD2 3.29Å; L39-F43 WeakPolarHBondContact O-CD2 3.48Å; L39-F43 PolarHBondContact O-N 2.9Å
40N89.5Confident88Confident104 Ų10498.4 Ų98.456%0.55650%0.504SS*.Hα-helixtrans-61.9-40174-90.4-91.9000112.4L36 K37 F43 R44L36-N40 WeakPolarHBondContact O-CB 3.31Å; L36-N40 PolarHBondContact O-N 3.4Å; L36-N40 PolarHBondContact O-ND2 3.28Å; K37-N40 PolarHBondContact O-N 2.85Å; N40-F43 PolarHBondContact O-N 3.26Å; N40-R44 WeakPolarHBondContact O-CB 3.37Å; N40-R44 PolarHBondContact O-N 3.1Å
41L90.2Very high89Confident97 Ų97101.5 Ų101.551%0.50851%0.508SS..Hα-helixtrans-64.4-42.8175.6-177.959000111.3K37 T38 L39 R44 C45K37-L41 WeakPolarHBondContact O-CB 3.24Å; K37-L41 PolarHBondContact O-N 2.8Å; T38-L41 PolarHBondContact O-N 2.75Å; L39-L41 PolarHBondContact O-N 2.71Å; L41-R44 PolarHBondContact O-N 2.92Å; L41-C45 PolarHBondContact O-N 3.24Å; L41-C45 PolarHBondContact O-SG 3.28Å; L41-C45 VanDerWaalsContact O-SG 3.34Å
42R86.4Confident89.8Confident160 Ų160101 Ų10160%0.60450%0.499SS*.Hα-helixtrans-58.8-51.6172.5-72.6175-178.7-1660.7111T38 L39 R44 C45 F46T38-R42 WeakPolarHBondContact O-CG 3.28Å; T38-R42 PolarHBondContact O-N 3Å; L39-R42 WeakPolarHBondContact O-CB 3.33Å; L39-R42 PolarHBondContact O-N 3.44Å; R42-R44 VanDerWaalsContact C-N 3.33Å; R42-R44 PolarHBondContact O-N 3.15Å; R42-C45 WeakPolarHBondContact O-CB 3.3Å; R42-C45 PolarHBondContact O-N 3.25Å; R42-C45 VanDerWaalsContact O-N 3.1Å; R42-F46 VanDerWaalsContact O-CD2 3.25Å; R42-F46 WeakPolarHBondContact O-CD2 3.21Å; R42-F46 PolarHBondContact O-N 3.32Å
43F94.5Very high90.3Very high117 Ų117100.8 Ų100.851%0.51350%0.497SS..Hα-helixtrans-57.2-42.1176.6-77.6-52.6000112.8L39 N40 C45 F46 L47L39-F43 HydrophobicContact CD1-CE2 4.29Å; L39-F43 HydrophobicContact CD2-CE2 3.79Å; L39-F43 HydrophobicContact CG-CD2 4.01Å; L39-F43 HydrophobicContact CG-CE2 3.61Å; L39-F43 HydrophobicContact CG-CZ 4.41Å; L39-F43 VanDerWaalsContact O-CD2 3.29Å; L39-F43 WeakPolarHBondContact O-CD2 3.48Å; L39-F43 PolarHBondContact O-N 2.9Å; N40-F43 PolarHBondContact O-N 3.26Å; F43-C45 VanDerWaalsContact C-N 3.31Å; F43-C45 PolarHBondContact O-N 2.9Å; F43-F46 PolarHBondContact O-N 2.81Å; F43-L47 WeakPolarHBondContact O-CB 3.47Å; F43-L47 WeakPolarHBondContact O-CG 3.31Å; F43-L47 PolarHBondContact O-N 3.44Å
44R88.3Confident90.8Very high174 Ų174102.4 Ų102.466%0.65750%0.503SS*.Hα-helixtrans-63-37.2176.8-161.8-17573.696.63.7112.2N40 L41 R42 A48N40-R44 WeakPolarHBondContact O-CB 3.37Å; N40-R44 PolarHBondContact O-N 3.1Å; L41-R44 PolarHBondContact O-N 2.92Å; R42-R44 VanDerWaalsContact C-N 3.33Å; R42-R44 PolarHBondContact O-N 3.15Å; R44-A48 WeakPolarHBondContact O-CB 3.44Å; R44-A48 PolarHBondContact O-N 2.85Å
45C84.7Confident91.2Very high70 Ų70103.4 Ų103.447%0.47350%0.502SS..Hα-helixtrans-70.8-40.1173.9-68.90000112.4L41 R42 F43 A48 K49L41-C45 PolarHBondContact O-N 3.24Å; L41-C45 PolarHBondContact O-SG 3.28Å; L41-C45 VanDerWaalsContact O-SG 3.34Å; R42-C45 WeakPolarHBondContact O-CB 3.3Å; R42-C45 PolarHBondContact O-N 3.25Å; R42-C45 VanDerWaalsContact O-N 3.1Å; F43-C45 VanDerWaalsContact C-N 3.31Å; F43-C45 PolarHBondContact O-N 2.9Å; C45-A48 PolarHBondContact O-N 3Å; C45-K49 WeakPolarHBondContact O-CB 3.43Å; C45-K49 PolarHBondContact O-N 3.29Å
46F95.7Very high91.4Very high139 Ų139105.6 Ų105.661%0.6150%0.501SS*.Hα-helixtrans-62.4-48.6173.6-83.3-68.3000111.8R42 F43 A48 K49 V50R42-F46 VanDerWaalsContact O-CD2 3.25Å; R42-F46 WeakPolarHBondContact O-CD2 3.21Å; R42-F46 PolarHBondContact O-N 3.32Å; F43-F46 PolarHBondContact O-N 2.81Å; F46-A48 VanDerWaalsContact C-N 3.34Å; F46-A48 PolarHBondContact O-N 2.99Å; F46-K49 CarbonylContact O-C 3.58Å; F46-K49 WeakPolarHBondContact O-CA 3.08Å; F46-K49 WeakPolarHBondContact O-CB 3.3Å; F46-K49 PolarHBondContact O-N 3.26Å; F46-V50 WeakPolarHBondContact O-CG2 3.37Å; F46-V50 PolarHBondContact O-N 2.68Å
47L93.3Very high91.5Very high103 Ų103105 Ų10554%0.53950%0.499SS..Hα-helixtrans-58.8-44.6175.6-72168.1000111.6F43 K49 V50 H51F43-L47 WeakPolarHBondContact O-CB 3.47Å; F43-L47 WeakPolarHBondContact O-CG 3.31Å; F43-L47 PolarHBondContact O-N 3.44Å; L47-K49 VanDerWaalsContact C-N 3.28Å; L47-K49 PolarHBondContact O-N 3Å; L47-V50 PolarHBondContact O-N 2.93Å; L47-H51 PolarHBondContact O-CD2 2.91Å; L47-H51 PolarHBondContact O-N 3.37Å
48A89.5Confident91.9Very high62 Ų62105.4 Ų105.451%0.51250%0.5SS..Hα-helixtrans-60-38174.500000112.5R44 C45 F46 E52R44-A48 WeakPolarHBondContact O-CB 3.44Å; R44-A48 PolarHBondContact O-N 2.85Å; C45-A48 PolarHBondContact O-N 3Å; F46-A48 VanDerWaalsContact C-N 3.34Å; F46-A48 PolarHBondContact O-N 2.99Å; A48-E52 WeakPolarHBondContact O-CB 3.44Å; A48-E52 PolarHBondContact O-N 2.59Å; A48-E52 VanDerWaalsContact O-N 3.14Å
49K88.8Confident92.2Very high122 Ų122107.8 Ų107.853%0.5351%0.511SS..Hα-helixtrans-69.6-39.3175.3-17667.1173.6-167.60112.3C45 F46 L47 E52 L53C45-K49 WeakPolarHBondContact O-CB 3.43Å; C45-K49 PolarHBondContact O-N 3.29Å; F46-K49 CarbonylContact O-C 3.58Å; F46-K49 WeakPolarHBondContact O-CA 3.08Å; F46-K49 WeakPolarHBondContact O-CB 3.3Å; F46-K49 PolarHBondContact O-N 3.26Å; L47-K49 VanDerWaalsContact C-N 3.28Å; L47-K49 PolarHBondContact O-N 3Å; K49-E52 PolarHBondContact O-N 3.11Å; K49-L53 HydrophobicContact CG-CD1 4.2Å; K49-L53 VanDerWaalsContact O-CG 3.31Å; K49-L53 WeakPolarHBondContact O-CG 3.42Å; K49-L53 PolarHBondContact O-N 2.92Å
50V96.1Very high92.3Very high66 Ų66108.6 Ų108.640%0.452%0.515SS..Hα-helixtrans-62.7-53.6175170.30000110.3F46 L47 E52 L53 E54F46-V50 WeakPolarHBondContact O-CG2 3.37Å; F46-V50 PolarHBondContact O-N 2.68Å; L47-V50 PolarHBondContact O-N 2.93Å; V50-E52 PolarHBondContact O-N 3.02Å; V50-E52 VanDerWaalsContact O-N 3.1Å; V50-L53 CarbonylContact O-C 3.55Å; V50-L53 WeakPolarHBondContact O-CA 3.42Å; V50-L53 PolarHBondContact O-N 3.44Å; V50-E54 HydrophobicContact CG1-CG 4.27Å; V50-E54 WeakPolarHBondContact O-CG 3.5Å; V50-E54 PolarHBondContact O-N 3.36Å
51H95.9Very high92.6Very high103 Ų103108.2 Ų108.248%0.47751%0.51SS..Hα-helixtrans-60.1-25.7177.4-72.9-133.9000113.1L47 R55L47-H51 PolarHBondContact O-CD2 2.91Å; L47-H51 PolarHBondContact O-N 3.37Å; H51-R55 WeakPolarHBondContact O-CB 3.45Å; H51-R55 WeakPolarHBondContact O-CG 3.3Å; H51-R55 PolarHBondContact O-N 3.41Å; H51-R55 PolarHBondContact O-NE 3.48Å; H51-R55 VanDerWaalsContact O-NE 3.08Å
52E93.8Very high92.6Very high57 Ų57106.6 Ų106.627%0.26651%0.507SS..Hα-helixtrans-81.6-31175.5173.864.1-158.500112.9A48 K49 V50 R55 R56A48-E52 WeakPolarHBondContact O-CB 3.44Å; A48-E52 PolarHBondContact O-N 2.59Å; A48-E52 VanDerWaalsContact O-N 3.14Å; K49-E52 PolarHBondContact O-N 3.11Å; V50-E52 PolarHBondContact O-N 3.02Å; V50-E52 VanDerWaalsContact O-N 3.1Å; E52-R55 VanDerWaalsContact CA-NH2 3.33Å; E52-R55 IonicContact OE2-CZ 2.61Å; E52-R55 IonicContact OE2-NH1 3.13Å; E52-R55 PolarHBondContact OE2-NH1 3.14Å; E52-R55 IonicContact OE2-NH2 2.64Å; E52-R55 PolarHBondContact OE2-NH2 3.48Å; E52-R56 VanDerWaalsContact CG-NH1 3.34Å; E52-R56 PolarHBondContact O-N 3.38Å; E52-R56 PolarHBondContact O-NH1 3.21Å; E52-R56 IonicContact OE1-CZ 2.71Å; E52-R56 IonicContact OE1-NH1 3.06Å; E52-R56 PolarHBondContact OE1-NH1 2.91Å; E52-R56 IonicContact OE1-NH2 2.71Å; E52-R56 PolarHBondContact OE1-NH2 2.87Å
53L93.4Very high92.8Very high90 Ų90103.6 Ų103.647%0.47150%0.499SS..Hα-helixtrans-75.2-44.4170.7-72.8169.8000111.3K49 V50 R55 R56 N57K49-L53 HydrophobicContact CG-CD1 4.2Å; K49-L53 VanDerWaalsContact O-CG 3.31Å; K49-L53 WeakPolarHBondContact O-CG 3.42Å; K49-L53 PolarHBondContact O-N 2.92Å; V50-L53 CarbonylContact O-C 3.55Å; V50-L53 WeakPolarHBondContact O-CA 3.42Å; V50-L53 PolarHBondContact O-N 3.44Å; L53-R55 VanDerWaalsContact C-N 3.32Å; L53-R55 PolarHBondContact O-N 2.81Å; L53-R56 CarbonylContact O-C 3.57Å; L53-R56 WeakPolarHBondContact O-CA 3.33Å; L53-R56 WeakPolarHBondContact O-CB 3.46Å; L53-R56 PolarHBondContact O-N 3.05Å; L53-N57 PolarHBondContact O-N 3.44Å
54E95.9Very high92.5Very high112 Ų112103.1 Ų103.152%0.52350%0.502SS..Hα-helixtrans-55.2-45.4173.6-71.4172.1167.500111.8V50 R56 N57 K58V50-E54 HydrophobicContact CG1-CG 4.27Å; V50-E54 WeakPolarHBondContact O-CG 3.5Å; V50-E54 PolarHBondContact O-N 3.36Å; E54-R56 PolarHBondContact O-N 3.38Å; E54-N57 PolarHBondContact O-N 2.96Å; E54-K58 VanDerWaalsContact O-CB 3.32Å; E54-K58 WeakPolarHBondContact O-CB 3.45Å; E54-K58 PolarHBondContact O-N 2.73Å
55R94.9Very high92.4Very high145 Ų145100.3 Ų100.355%0.54750%0.496SS..Hα-helixtrans-64.7-35.3175.5-80.1-176.7-71.2101.2-1.4113.1H51 E52 L53 L59H51-R55 WeakPolarHBondContact O-CB 3.45Å; H51-R55 WeakPolarHBondContact O-CG 3.3Å; H51-R55 PolarHBondContact O-N 3.41Å; H51-R55 PolarHBondContact O-NE 3.48Å; H51-R55 VanDerWaalsContact O-NE 3.08Å; E52-R55 VanDerWaalsContact CA-NH2 3.33Å; E52-R55 IonicContact OE2-CZ 2.61Å; E52-R55 IonicContact OE2-NH1 3.13Å; E52-R55 PolarHBondContact OE2-NH1 3.14Å; E52-R55 IonicContact OE2-NH2 2.64Å; E52-R55 PolarHBondContact OE2-NH2 3.48Å; L53-R55 VanDerWaalsContact C-N 3.32Å; L53-R55 PolarHBondContact O-N 2.81Å; R55-L59 WeakPolarHBondContact O-CB 3.49Å; R55-L59 PolarHBondContact O-N 2.97Å
56R91.6Very high92.5Very high125 Ų125103.6 Ų103.647%0.47250%0.504SS..Hα-helixtrans-68.2-44.5170.7-81.4-165.8-173.668.814.7111.7E52 L53 E54 L59 L60E52-R56 VanDerWaalsContact CG-NH1 3.34Å; E52-R56 PolarHBondContact O-N 3.38Å; E52-R56 PolarHBondContact O-NH1 3.21Å; E52-R56 IonicContact OE1-CZ 2.71Å; E52-R56 IonicContact OE1-NH1 3.06Å; E52-R56 PolarHBondContact OE1-NH1 2.91Å; E52-R56 IonicContact OE1-NH2 2.71Å; E52-R56 PolarHBondContact OE1-NH2 2.87Å; L53-R56 CarbonylContact O-C 3.57Å; L53-R56 WeakPolarHBondContact O-CA 3.33Å; L53-R56 WeakPolarHBondContact O-CB 3.46Å; L53-R56 PolarHBondContact O-N 3.05Å; E54-R56 PolarHBondContact O-N 3.38Å; R56-L59 WeakPolarHBondContact O-CB 3.31Å; R56-L59 PolarHBondContact O-N 2.7Å; R56-L59 VanDerWaalsContact O-N 3.14Å; R56-L60 WeakPolarHBondContact O-CG 3.4Å; R56-L60 PolarHBondContact O-N 3.48Å
57N94.3Very high91.6Very high89 Ų89100 Ų10048%0.47650%0.5SS..Hα-helixtrans-64-45.8-177.2-150.845.1000110.5L53 E54 L59 L60 E61L53-N57 PolarHBondContact O-N 3.44Å; E54-N57 PolarHBondContact O-N 2.96Å; N57-L59 VanDerWaalsContact C-N 3.25Å; N57-L59 PolarHBondContact O-N 2.93Å; N57-L60 CarbonylContact O-C 3.54Å; N57-L60 WeakPolarHBondContact O-CA 3.23Å; N57-L60 WeakPolarHBondContact O-CB 3.49Å; N57-L60 PolarHBondContact O-N 3.36Å; N57-E61 PolarHBondContact ND2-OE1 3.5Å; N57-E61 VanDerWaalsContact ND2-OE1 3.09Å; N57-E61 WeakPolarHBondContact O-CB 3.34Å; N57-E61 VanDerWaalsContact O-CG 3.3Å; N57-E61 WeakPolarHBondContact O-CG 3.34Å; N57-E61 PolarHBondContact O-N 3.49Å
58K96.3Very high90.8Very high146 Ų146101.3 Ų101.364%0.63551%0.507SS*.Hα-helixtrans-59.6-32.5173.6-169.7167.6-173.6167.40113.6E54 S62E54-K58 VanDerWaalsContact O-CB 3.32Å; E54-K58 WeakPolarHBondContact O-CB 3.45Å; E54-K58 PolarHBondContact O-N 2.73Å; K58-S62 WeakPolarHBondContact O-CB 3.47Å; K58-S62 PolarHBondContact O-N 3.41Å; K58-S62 PolarHBondContact O-OG 2.85Å
59L93.2Very high89.9Confident101 Ų101105.4 Ų105.453%0.52952%0.516SS..Hα-helixtrans-71.7-41.3172.6-179.962.9000111.8R55 R56 N57 S62 Q63R55-L59 WeakPolarHBondContact O-CB 3.49Å; R55-L59 PolarHBondContact O-N 2.97Å; R56-L59 WeakPolarHBondContact O-CB 3.31Å; R56-L59 PolarHBondContact O-N 2.7Å; R56-L59 VanDerWaalsContact O-N 3.14Å; N57-L59 VanDerWaalsContact C-N 3.25Å; N57-L59 PolarHBondContact O-N 2.93Å; L59-S62 WeakPolarHBondContact O-CB 3.2Å; L59-S62 PolarHBondContact O-N 3.41Å; L59-Q63 VanDerWaalsContact O-CG 3.31Å; L59-Q63 WeakPolarHBondContact O-CG 3.37Å; L59-Q63 PolarHBondContact O-N 3.29Å
60L93.1Very high88.2Confident98 Ų98108.7 Ų108.751%0.51353%0.525SS..Hα-helixtrans-66.5-42.3175.6-69.1169.7000111.8R56 N57 S62 Q63 L64R56-L60 WeakPolarHBondContact O-CG 3.4Å; R56-L60 PolarHBondContact O-N 3.48Å; N57-L60 CarbonylContact O-C 3.54Å; N57-L60 WeakPolarHBondContact O-CA 3.23Å; N57-L60 WeakPolarHBondContact O-CB 3.49Å; N57-L60 PolarHBondContact O-N 3.36Å; L60-S62 VanDerWaalsContact C-N 3.32Å; L60-S62 PolarHBondContact O-N 3.3Å; L60-Q63 PolarHBondContact O-N 2.9Å; L60-L64 VanDerWaalsContact O-CB 3.32Å; L60-L64 WeakPolarHBondContact O-CB 3.38Å; L60-L64 PolarHBondContact O-N 3.22Å
61E93.9Very high86Confident96 Ų96110.1 Ų110.145%0.44954%0.536SS..Hα-helixtrans-57.3-44.6170.3-72.3163.4-168.400111.1N57 L64 Q65N57-E61 PolarHBondContact ND2-OE1 3.5Å; N57-E61 VanDerWaalsContact ND2-OE1 3.09Å; N57-E61 WeakPolarHBondContact O-CB 3.34Å; N57-E61 VanDerWaalsContact O-CG 3.3Å; N57-E61 WeakPolarHBondContact O-CG 3.34Å; N57-E61 PolarHBondContact O-N 3.49Å; E61-L64 PolarHBondContact O-N 2.88Å; E61-Q65 WeakPolarHBondContact O-CB 3.46Å; E61-Q65 WeakPolarHBondContact O-CG 3.29Å; E61-Q65 PolarHBondContact O-N 2.9Å
62S91.3Very high83.9Confident63 Ų63114.1 Ų114.144%0.44156%0.555SS.*Hα-helixtrans-64.8-39.6176.3-59.80000112K58 L59 L60 Q66K58-S62 WeakPolarHBondContact O-CB 3.47Å; K58-S62 PolarHBondContact O-N 3.41Å; K58-S62 PolarHBondContact O-OG 2.85Å; L59-S62 WeakPolarHBondContact O-CB 3.2Å; L59-S62 PolarHBondContact O-N 3.41Å; L60-S62 VanDerWaalsContact C-N 3.32Å; L60-S62 PolarHBondContact O-N 3.3Å; S62-Q66 VanDerWaalsContact O-CB 3.32Å; S62-Q66 WeakPolarHBondContact O-CB 3.43Å; S62-Q66 PolarHBondContact O-N 3.46Å
63Q91.3Very high81.4Confident97 Ų97115.4 Ų115.445%0.45357%0.569SS.*Hα-helixtrans-68.7-37.9175-73.1173.812.200112L59 L60 Q66 A67L59-Q63 VanDerWaalsContact O-CG 3.31Å; L59-Q63 WeakPolarHBondContact O-CG 3.37Å; L59-Q63 PolarHBondContact O-N 3.29Å; L60-Q63 PolarHBondContact O-N 2.9Å; Q63-Q66 CarbonylContact O-C 3.6Å; Q63-Q66 PolarHBondContact O-N 3.1Å; Q63-A67 WeakPolarHBondContact O-CB 3.11Å; Q63-A67 PolarHBondContact O-N 3.31Å
64L87.3Confident78.9Confident107 Ų107121.7 Ų121.756%0.5659%0.586SS**Hα-helixtrans-67.1-45.6175.4-179.661.2000110.9L60 E61 Q66 A67 L68L60-L64 VanDerWaalsContact O-CB 3.32Å; L60-L64 WeakPolarHBondContact O-CB 3.38Å; L60-L64 PolarHBondContact O-N 3.22Å; E61-L64 PolarHBondContact O-N 2.88Å; L64-Q66 VanDerWaalsContact C-N 3.31Å; L64-Q66 PolarHBondContact O-N 3.5Å; L64-A67 PolarHBondContact O-N 3.44Å; L64-A67 VanDerWaalsContact O-N 3.13Å; L64-L68 HydrophobicContact CD1-CD1 4.23Å; L64-L68 HydrophobicContact CD1-CG 4.42Å; L64-L68 HydrophobicContact CG-CD1 4.08Å; L64-L68 WeakPolarHBondContact O-CB 3.35Å; L64-L68 VanDerWaalsContact O-CG 3.3Å; L64-L68 WeakPolarHBondContact O-CG 3.47Å; L64-L68 PolarHBondContact O-N 3.49Å
65Q87.2Confident76Confident116 Ų116122.1 Ų122.154%0.54259%0.588SS.*Hα-helixtrans-60.6-39.5171.2-74.7-174.2-1.500111.5E61 A67 L68 Q69E61-Q65 WeakPolarHBondContact O-CB 3.46Å; E61-Q65 WeakPolarHBondContact O-CG 3.29Å; E61-Q65 PolarHBondContact O-N 2.9Å; Q65-A67 VanDerWaalsContact C-N 3.33Å; Q65-A67 PolarHBondContact O-N 2.99Å; Q65-L68 PolarHBondContact O-N 3.47Å; Q65-Q69 WeakPolarHBondContact O-CB 3.38Å; Q65-Q69 VanDerWaalsContact O-CG 3.3Å; Q65-Q69 WeakPolarHBondContact O-CG 3.36Å; Q65-Q69 PolarHBondContact O-N 2.85Å
66Q85.1Confident73.4Confident138 Ų138120.9 Ų120.965%0.64560%0.599SS**Hα-helixtrans-67.2-32.1174.2-168.9-179.840.100112.7S62 Q63 L64 R70S62-Q66 VanDerWaalsContact O-CB 3.32Å; S62-Q66 WeakPolarHBondContact O-CB 3.43Å; S62-Q66 PolarHBondContact O-N 3.46Å; Q63-Q66 CarbonylContact O-C 3.6Å; Q63-Q66 PolarHBondContact O-N 3.1Å; L64-Q66 VanDerWaalsContact C-N 3.31Å; L64-Q66 PolarHBondContact O-N 3.5Å; Q66-R70 WeakPolarHBondContact O-CB 3.35Å; Q66-R70 PolarHBondContact O-N 3.04Å
67A77.3Confident70.7Confident63 Ų63123.2 Ų123.252%0.52161%0.612SS.*Hα-helixtrans-73.6-31.717500000112.8Q63 L64 Q65Q63-A67 WeakPolarHBondContact O-CB 3.11Å; Q63-A67 PolarHBondContact O-N 3.31Å; L64-A67 PolarHBondContact O-N 3.44Å; L64-A67 VanDerWaalsContact O-N 3.13Å; Q65-A67 VanDerWaalsContact C-N 3.33Å; Q65-A67 PolarHBondContact O-N 2.99Å
68L77.6Confident68Low132 Ų132122 Ų12269%0.69162%0.621SS**Hα-helixtrans-83.3-35.6176.1-68.2168.7000113L64 Q65L64-L68 HydrophobicContact CD1-CD1 4.23Å; L64-L68 HydrophobicContact CD1-CG 4.42Å; L64-L68 HydrophobicContact CG-CD1 4.08Å; L64-L68 WeakPolarHBondContact O-CB 3.35Å; L64-L68 VanDerWaalsContact O-CG 3.3Å; L64-L68 WeakPolarHBondContact O-CG 3.47Å; L64-L68 PolarHBondContact O-N 3.49Å; Q65-L68 PolarHBondContact O-N 3.47Å
69Q70.8Confident65.2Low148 Ų148125.1 Ų125.169%0.69263%0.629SS**Hα-helixtrans-82.8-17.5175.1-70-175.924.400113Q65 P71Q65-Q69 WeakPolarHBondContact O-CB 3.38Å; Q65-Q69 VanDerWaalsContact O-CG 3.3Å; Q65-Q69 WeakPolarHBondContact O-CG 3.36Å; Q65-Q69 PolarHBondContact O-N 2.85Å; Q69-P71 WeakPolarHBondContact O-CD 3.17Å; Q69-P71 VanDerWaalsContact O-N 3.09Å
70R52.7Low62.4Low190 Ų190127.5 Ų127.572%0.71764%0.638SS**SBendtrans-53.4117155.5-104.8-178.5170.5161.1-0.6106Q66Q66-R70 WeakPolarHBondContact O-CB 3.35Å; Q66-R70 PolarHBondContact O-N 3.04Å
71P49.6Very low59.8Low97 Ų97126.4 Ų126.463%0.6364%0.635SS**  trans-55.8160.5170-20.332.8000108.3Q69 C73Q69-P71 WeakPolarHBondContact O-CD 3.17Å; Q69-P71 VanDerWaalsContact O-N 3.09Å; P71-C73 PolarHBondContact O-N 3.44Å
72Q52.1Low57.2Low187 Ų187125 Ų12587%0.87464%0.639SS**  trans-70.363.8158.9-69.4-170.39.100110.1R74Q72-R74 PolarHBondContact O-N 2.72Å
73C39.7Very low54.7Low83 Ų83126.6 Ų126.656%0.56165%0.646SS**  trans-61.868.9146.2-74.10000108.9P71 H75P71-C73 PolarHBondContact O-N 3.44Å; C73-H75 PolarHBondContact O-N 3.23Å
74R41.3Very low52.2Low223 Ų223127 Ų12784%0.84265%0.648SS**  -46.576104.2-70.3-174.3176.9-169.61.1108.4Q72 P76Q72-R74 PolarHBondContact O-N 2.72Å; R74-P76 VanDerWaalsContact O-CD 3.25Å; R74-P76 WeakPolarHBondContact O-CD 3.27Å
75H34.9Very low50Low120 Ų120127.2 Ų127.256%0.55665%0.654SS**  trans-48.2126.2136.4-88.42.7000104.2C73 F77C73-H75 PolarHBondContact O-N 3.23Å; H75-F77 HydrophobicContact CB-CD2 4.04Å; H75-F77 HydrophobicContact CB-CE2 4.37Å; H75-F77 PolarHBondContact O-N 3.24Å
76P40.6Very low47.6Very low120 Ų120126.6 Ų126.678%0.77965%0.654SS**  trans-59.584.5136.331.3-30.4000105.4R74 G78R74-P76 VanDerWaalsContact O-CD 3.25Å; R74-P76 WeakPolarHBondContact O-CD 3.27Å; P76-G78 PolarHBondContact O-N 2.88Å
77F35.3Very low45.8Very low173 Ų173121.8 Ų121.876%0.75964%0.642SS**  -44.8112.5128.9-79.8-78.8000102.5H75 R79H75-F77 HydrophobicContact CB-CD2 4.04Å; H75-F77 HydrophobicContact CB-CE2 4.37Å; H75-F77 PolarHBondContact O-N 3.24Å; F77-R79 PolarHBondContact O-N 3.36Å
78G36.4Very low44.2Very low64 Ų64125.4 Ų125.466%0.6666%0.66SS**  trans-54.399.3173.900000104.4P76 E80P76-G78 PolarHBondContact O-N 2.88Å; G78-E80 PolarHBondContact O-N 2.87Å
79R38.4Very low42.6Very low212 Ų212128.2 Ų128.280%0.867%0.67SS**  trans-69.9100.3178.5-166.4-176.2-169.2-124.46.3100.7F77 V81F77-R79 PolarHBondContact O-N 3.36Å; R79-V81 HydrophobicContact CB-CG2 4.02Å; R79-V81 HydrophobicContact CG-CG2 3.58Å; R79-V81 PolarHBondContact O-N 3.2Å
80E35.3Very low41.5Very low151 Ų151126.1 Ų126.171%0.70667%0.671SS**  trans-67.365.8166-67.2-172.2169.600106.6G78 A82 F99G78-E80 PolarHBondContact O-N 2.87Å; E80-A82 PolarHBondContact O-N 2.89Å; E80-F99 WeakPolarHBondContact OE1-CE2 3.35Å; E80-F99 WeakPolarHBondContact OE1-CZ 3.47Å
81V38.5Very low41.2Very low75 Ų75123.7 Ų123.746%0.45566%0.662SS.*  trans-64.184146.4-159.70000103R79 V83R79-V81 HydrophobicContact CB-CG2 4.02Å; R79-V81 HydrophobicContact CG-CG2 3.58Å; R79-V81 PolarHBondContact O-N 3.2Å; V81-V83 HydrophobicContact CB-CG2 4.11Å; V81-V83 HydrophobicContact CG1-CB 4.43Å; V81-V83 HydrophobicContact CG1-CG2 3.48Å; V81-V83 VanDerWaalsContact CG1-CG2 3.48Å; V81-V83 PolarHBondContact O-N 3.49Å
82A37.9Very low41Very low66 Ų66125.7 Ų125.755%0.54567%0.667SS.*  trans-5581.1142.200000105.6E80 Q84E80-A82 PolarHBondContact O-N 2.89Å; A82-Q84 VanDerWaalsContact C-N 3.35Å; A82-Q84 PolarHBondContact O-N 3.47Å
83V38.8Very low40.4Very low96 Ų96123 Ų12358%0.58267%0.666SS**  trans-60.1110.2164.4178.60000102.6V81 T85V81-V83 HydrophobicContact CB-CG2 4.11Å; V81-V83 HydrophobicContact CG1-CB 4.43Å; V81-V83 HydrophobicContact CG1-CG2 3.48Å; V81-V83 VanDerWaalsContact CG1-CG2 3.48Å; V81-V83 PolarHBondContact O-N 3.49Å; V83-T85 HydrophobicContact CB-CG2 4.17Å; V83-T85 HydrophobicContact CG1-CG2 3.71Å; V83-T85 PolarHBondContact O-N 3.44Å
84Q39.5Very low40.9Very low105 Ų105121.2 Ų121.249%0.49166%0.662SS.*  trans-70.384.8172.4-166.3161.138.200106A82 D86A82-Q84 VanDerWaalsContact C-N 3.35Å; A82-Q84 PolarHBondContact O-N 3.47Å; Q84-D86 PolarHBondContact O-N 2.82Å
85T40.3Very low41.2Very low113 Ų113112.9 Ų112.969%0.69364%0.636SS**  trans-72.884178.151.70000107.3V83 G87V83-T85 HydrophobicContact CB-CG2 4.17Å; V83-T85 HydrophobicContact CG1-CG2 3.71Å; V83-T85 PolarHBondContact O-N 3.44Å; T85-G87 PolarHBondContact O-N 3.09Å
86D37.5Very low41.9Very low102 Ų102111.7 Ų111.755%0.54563%0.633SS.*  trans-68.971.5169.8-85.8-53.2000110.1Q84 R91Q84-D86 PolarHBondContact O-N 2.82Å; D86-R91 IonicContact OD1-CZ 3.14Å; D86-R91 IonicContact OD1-NE 2.72Å; D86-R91 PolarHBondContact OD1-NE 2.99Å; D86-R91 IonicContact OD1-NH2 2.75Å; D86-R91 PolarHBondContact OD1-NH2 3.37Å; D86-R91 IonicContact OD2-CZ 4Å; D86-R91 IonicContact OD2-NH2 2.92Å; D86-R91 PolarHBondContact OD2-NH2 2.85Å
87G47.3Very low42.2Very low38 Ų38115.8 Ų115.839%0.39263%0.633SS.*  trans-76.7149.5161.700000109.9T85 E89T85-G87 PolarHBondContact O-N 3.09Å; G87-E89 VanDerWaalsContact C-N 3.26Å; G87-E89 PolarHBondContact O-N 2.97Å
88P42.7Very low42.7Very low138 Ų138111.5 Ų111.590%0.89662%0.624SS**THydrogen-bonded Turntrans-70.7-10.4-160.8-21.935000116.7
89E44.3Very low43Very low191 Ų191114 Ų11489%0.89362%0.617SS**THydrogen-bonded Turntrans-122.44-158.1-57-167.6140.200115.7G87G87-E89 VanDerWaalsContact C-N 3.26Å; G87-E89 PolarHBondContact O-N 2.97Å
90S47.4Very low43.4Very low104 Ų104106.6 Ų106.673%0.72760%0.595SS**  trans-138.546.8-170.663.50000117.1
91R47.2Very low43.8Very low139 Ų139105 Ų10553%0.52559%0.587SS.*  trans-106.688.3159.7-74.4-173.8-179.4-113.612.3111.3D86D86-R91 IonicContact OD1-CZ 3.14Å; D86-R91 IonicContact OD1-NE 2.72Å; D86-R91 PolarHBondContact OD1-NE 2.99Å; D86-R91 IonicContact OD1-NH2 2.75Å; D86-R91 PolarHBondContact OD1-NH2 3.37Å; D86-R91 IonicContact OD2-CZ 4Å; D86-R91 IonicContact OD2-NH2 2.92Å; D86-R91 PolarHBondContact OD2-NH2 2.85Å
92L45.7Very low44.3Very low139 Ų139106.5 Ų106.573%0.72859%0.592SS**  trans-65.9131.8162-72173.5000109G94 T95L92-G94 PolarHBondContact O-N 3.4Å; L92-T95 PolarHBondContact O-N 2.93Å
93P39.8Very low44.8Very low130 Ų130111 Ų11184%0.84460%0.595SS**THydrogen-bonded Turntrans-53.3130.9-178.8-28.535.7000112.6
94G49.1Very low45.2Very low47 Ų47114.7 Ų114.749%0.48560%0.598SS.*THydrogen-bonded Turntrans92.30.817900000116.4L92L92-G94 PolarHBondContact O-N 3.4Å
95T49.2Very low45.2Very low47 Ų47116.8 Ų116.829%0.28861%0.608SS.*  trans-108.1112173.7-50.50000110.9L92L92-T95 PolarHBondContact O-N 2.93Å
96I49.2Very low46.2Very low96 Ų96113.9 Ų113.949%0.49260%0.601SS.*  trans-95.2-37.2-177.7-60-174.1000112.4
97W45.8Very low46.6Very low206 Ų206117.9 Ų117.978%0.7862%0.616SS**  trans-125.8138.8175.5-72.7-12.1000111.2
98S46.6Very low46.3Very low83 Ų83124.6 Ų124.658%0.5863%0.63SS**  trans-120.4106.3169.846.50000109.6T100S98-T100 PolarHBondContact O-N 3.43Å
99F42.8Very low46.4Very low116 Ų116124.6 Ų124.651%0.50962%0.616SS.*  trans-77.2114.4179.4-158.2-73.8000110.4E80 H101E80-F99 WeakPolarHBondContact OE1-CE2 3.35Å; E80-F99 WeakPolarHBondContact OE1-CZ 3.47Å; F99-H101 AromaticContact CD1-CD2 3.81Å; F99-H101 AromaticContact CD1-CE1 3.75Å; F99-H101 AromaticContact CD1-NE2 3.62Å; F99-H101 AromaticContact CE1-CE1 3.37Å; F99-H101 WeakPolarHBondContact CE1-CE1 3.43Å; F99-H101 AromaticContact CE1-CG 3.98Å; F99-H101 AromaticContact CE1-ND1 3.53Å; F99-H101 AromaticContact CE1-NE2 3.75Å
100T46.8Very low46.4Very low56 Ų56120.4 Ų120.434%0.34460%0.596SS.*EExtended strand (participates in β ladder)trans-109.3105.8-176.5-53.60000110.2S98 I102 T111S98-T100 PolarHBondContact O-N 3.43Å; T100-I102 PolarHBondContact O-N 3.36Å; T100-T111 HydrophobicContact CG2-CG2 3.33Å
101H43.3Very low46.3Very low117 Ų117119.8 Ų119.854%0.54259%0.588SS.*EExtended strand (participates in β ladder)trans-77.6103.2178.1-73.8-77.5000110.7F99 R103 L112F99-H101 AromaticContact CD1-CD2 3.81Å; F99-H101 AromaticContact CD1-CE1 3.75Å; F99-H101 AromaticContact CD1-NE2 3.62Å; F99-H101 AromaticContact CE1-CE1 3.37Å; F99-H101 WeakPolarHBondContact CE1-CE1 3.43Å; F99-H101 AromaticContact CE1-CG 3.98Å; F99-H101 AromaticContact CE1-ND1 3.53Å; F99-H101 AromaticContact CE1-NE2 3.75Å; H101-R103 PolarHBondContact O-N 2.98Å; H101-L112 PolarHBondContact N-O 3.47Å; H101-L112 PolarHBondContact O-N 3Å
102I49Very low46.3Very low108 Ų108118 Ų11855%0.55459%0.589SS**EExtended strand (participates in β ladder)trans-84.7107.6167.2-56.2176.6000108.1T100 F109 T111T100-I102 PolarHBondContact O-N 3.36Å; I102-F109 HydrophobicContact CG2-CB 4.5Å; I102-F109 HydrophobicContact CG2-CD1 4.11Å; I102-T111 HydrophobicContact CG1-CG2 4.47Å
103R47.8Very low46.4Very low159 Ų159118.1 Ų118.160%0.659%0.585SS**EExtended strand (participates in β ladder)trans-93.8115.5175.7-158.3177.5-158.2-113.15.2108.9H101 E110H101-R103 PolarHBondContact O-N 2.98Å; R103-E110 PolarHBondContact N-O 3.01Å; R103-E110 PolarHBondContact O-N 3.39Å
104R47.5Very low47Very low175 Ų175113.4 Ų113.466%0.6656%0.56SS**EExtended strand (participates in β ladder)trans-88.6119.1173.1-171.2-178178.3-163.42.5109.9G106 F109R104-G106 WeakPolarHBondContact CG-O 3.44Å; R104-G106 PolarHBondContact NE-O 3.28Å; R104-F109 HydrophobicContact CG-CE1 4.43Å
105Q40.6Very low47Very low148 Ų148117.4 Ų117.469%0.69258%0.578SS**EExtended strand (participates in β ladder)trans-130.290.6172.2-168.8162.9-11.600108.7
106G61.6Low47Very low53 Ų53118.2 Ų118.255%0.54660%0.595SS.*THydrogen-bonded Turntrans78.8-136.3-172.300000113.1R104R104-G106 WeakPolarHBondContact CG-O 3.44Å; R104-G106 PolarHBondContact NE-O 3.28Å
107E44.4Very low46.8Very low186 Ų186119.4 Ų119.487%0.86961%0.607SS**THydrogen-bonded Turntrans-85.9-10.4-179-62.7-169.5125.200113.9
108R42Very low46.7Very low178 Ų178114.2 Ų114.267%0.67260%0.598SS**EExtended strand (participates in β ladder)trans-94134.5177-156.3176.2-170.3-139.26.3111E110R108-E110 IonicContact CZ-OE1 2.67Å; R108-E110 IonicContact NH1-OE1 2.66Å; R108-E110 PolarHBondContact NH1-OE1 3.17Å
109F44.1Very low46.9Very low138 Ų138118.5 Ų118.561%0.60560%0.602SS**EExtended strand (participates in β ladder)trans-96.8132.1169-61-92.2000108.6I102 R104I102-F109 HydrophobicContact CG2-CB 4.5Å; I102-F109 HydrophobicContact CG2-CD1 4.11Å; R104-F109 HydrophobicContact CG-CE1 4.43Å
110E43.5Very low47.4Very low103 Ų103118.1 Ų118.148%0.48161%0.609SS.*EExtended strand (participates in β ladder)trans-128.5121.7176.1-154.5156.9-10600109.3R103 R108R103-E110 PolarHBondContact N-O 3.01Å; R103-E110 PolarHBondContact O-N 3.39Å; R108-E110 IonicContact CZ-OE1 2.67Å; R108-E110 IonicContact NH1-OE1 2.66Å; R108-E110 PolarHBondContact NH1-OE1 3.17Å
111T47.1Very low47.8Very low91 Ų91118.3 Ų118.356%0.55861%0.606SS**EExtended strand (participates in β ladder)trans-101.496.9-169.1-550000109T100 I102 H113T100-T111 HydrophobicContact CG2-CG2 3.33Å; I102-T111 HydrophobicContact CG1-CG2 4.47Å; T111-H113 PolarHBondContact O-N 3.49Å
112L45.9Very low49.1Very low101 Ų101116.5 Ų116.553%0.52961%0.605SS.*EExtended strand (participates in β ladder)trans-88.2108-179.9-73.5168000109.8H101 G114H101-L112 PolarHBondContact N-O 3.47Å; H101-L112 PolarHBondContact O-N 3Å; L112-G114 PolarHBondContact O-N 3.19Å
113H49.2Very low50Low142 Ų142119.8 Ų119.866%0.65762%0.623SS**EExtended strand (participates in β ladder)trans-76.7110.4172.2-148.887.5000108.6T111T111-H113 PolarHBondContact O-N 3.49Å
114G50.9Low51.3Low31 Ų31114 Ų11432%0.3261%0.613SS.*  trans-69.2159.717500000111.5L112 G116L112-G114 PolarHBondContact O-N 3.19Å; G114-G116 PolarHBondContact O-N 2.97Å
115P49.7Very low52.9Low131 Ų131107.5 Ų107.585%0.85159%0.593SS**  trans-58.5113.5169.8-2133.2000109.6V117P115-V117 PolarHBondContact O-N 2.95Å
116G48.4Very low54.6Low64 Ų64102 Ų10266%0.6658%0.576SS**  trans-64.1107.9-178.900000110.8G114 T118G114-G116 PolarHBondContact O-N 2.97Å; G116-T118 PolarHBondContact O-N 3.03Å; G116-T118 VanDerWaalsContact O-N 3.09Å
117V45.9Very low55.6Low122 Ų122104.2 Ų104.274%0.73958%0.579SS**  trans-69.9105.5169.6-179.30000107.2P115 W119P115-V117 PolarHBondContact O-N 2.95Å; V117-W119 PolarHBondContact O-N 3.39Å
118T43.7Very low57.5Low97 Ų97101 Ų10160%0.59556%0.564SS**  trans-66.983.7170.748.10000109G116 T120G116-T118 PolarHBondContact O-N 3.03Å; G116-T118 VanDerWaalsContact O-N 3.09Å; T118-T120 PolarHBondContact O-N 3.18Å
119W50.2Low59.5Low173 Ų17396.5 Ų96.566%0.65555%0.552SS**  trans-76.980.6176.2-157.251.6000108.8V117 H121V117-W119 PolarHBondContact O-N 3.39Å; W119-H121 AromaticContact CE3-CE1 3.76Å; W119-H121 AromaticContact CE3-NE2 3.9Å; W119-H121 AromaticContact CZ3-CE1 3.49Å; W119-H121 VanDerWaalsContact CZ3-CE1 3.49Å; W119-H121 WeakPolarHBondContact CZ3-CE1 3.43Å; W119-H121 AromaticContact CZ3-ND1 3.89Å; W119-H121 PolarHBondContact O-N 2.86Å
120T54.6Low61.5Low108 Ų10895.6 Ų95.666%0.66355%0.554SS**  trans-57.4103163.650.50000107.3T118T118-T120 PolarHBondContact O-N 3.18Å
121H54.3Low63.7Low60 Ų6094 Ų9428%0.27855%0.551SS.*PPolyproline II helixtrans-50.7130.2172.7-80.1-92.4000108.7W119 D123 V125W119-H121 AromaticContact CE3-CE1 3.76Å; W119-H121 AromaticContact CE3-NE2 3.9Å; W119-H121 AromaticContact CZ3-CE1 3.49Å; W119-H121 VanDerWaalsContact CZ3-CE1 3.49Å; W119-H121 WeakPolarHBondContact CZ3-CE1 3.43Å; W119-H121 AromaticContact CZ3-ND1 3.89Å; W119-H121 PolarHBondContact O-N 2.86Å; H121-D123 PolarHBondContact O-N 3.04Å; H121-V125 HydrophobicContact CB-CB 4.36Å
122P69.8Low65.9Low79 Ų7993.9 Ų93.951%0.51355%0.546SS..PPolyproline II helixtrans-52.9140.9174-25.733.6000110.7G124 V125P122-G124 PolarHBondContact O-N 2.87Å; P122-V125 HydrophobicContact CB-CG2 3.97Å; P122-V125 HydrophobicContact CG-CG2 4.27Å; P122-V125 WeakPolarHBondContact O-CB 3.37Å; P122-V125 WeakPolarHBondContact O-CG2 3.39Å; P122-V125 PolarHBondContact O-N 3Å
123D68.8Low68Low176 Ų17692 Ų9294%0.94154%0.539SS*.THydrogen-bonded Turntrans-52.2128-174-72.7-45000111.4H121H121-D123 PolarHBondContact O-N 3.04Å
124G74.7Confident70.1Confident38 Ų3888.4 Ų88.439%0.39253%0.528SS..THydrogen-bonded Turntrans91.2-14.8-176.200000116.1P122 G126 V127 Q128P122-G124 PolarHBondContact O-N 2.87Å; G124-G126 VanDerWaalsContact C-N 3.32Å; G124-G126 PolarHBondContact O-N 3.12Å; G124-V127 WeakPolarHBondContact O-CB 3.44Å; G124-V127 PolarHBondContact O-N 2.96Å; G124-V127 VanDerWaalsContact O-N 3.14Å; G124-Q128 WeakPolarHBondContact O-CG 3.32Å; G124-Q128 PolarHBondContact O-N 2.92Å
125V81.4Confident72.1Confident39 Ų3992.3 Ų92.324%0.23654%0.538CS..Hα-helixtrans-63.9-35.6179.1171.10000112.3H121 P122 Q128 I129H121-V125 HydrophobicContact CB-CB 4.36Å; P122-V125 HydrophobicContact CB-CG2 3.97Å; P122-V125 HydrophobicContact CG-CG2 4.27Å; P122-V125 WeakPolarHBondContact O-CB 3.37Å; P122-V125 WeakPolarHBondContact O-CG2 3.39Å; P122-V125 PolarHBondContact O-N 3Å; V125-Q128 PolarHBondContact O-N 2.92Å; V125-I129 HydrophobicContact CG1-CD1 4.08Å; V125-I129 WeakPolarHBondContact O-CG1 3.41Å; V125-I129 PolarHBondContact O-N 2.81Å
126G76.9Confident74.2Confident33 Ų3389.2 Ų89.234%0.3452%0.516SS..Hα-helixtrans-59.7-48.2171.500000112.1G124 Q128 I129 D130G124-G126 VanDerWaalsContact C-N 3.32Å; G124-G126 PolarHBondContact O-N 3.12Å; G126-Q128 VanDerWaalsContact C-N 3.29Å; G126-Q128 PolarHBondContact O-N 3.22Å; G126-I129 WeakPolarHBondContact O-CB 3.18Å; G126-I129 PolarHBondContact O-N 3.45Å; G126-D130 PolarHBondContact O-N 3.44Å
127V82.2Confident76.3Confident98 Ų9893.1 Ų93.159%0.59451%0.511SS*.Hα-helixtrans-61-36.9177.8-174.40000111.8G124 D130 T131G124-V127 WeakPolarHBondContact O-CB 3.44Å; G124-V127 PolarHBondContact O-N 2.96Å; G124-V127 VanDerWaalsContact O-N 3.14Å; V127-D130 PolarHBondContact O-N 2.89Å; V127-T131 WeakPolarHBondContact O-CB 3.26Å; V127-T131 PolarHBondContact O-N 2.74Å; V127-T131 PolarHBondContact O-OG1 2.89Å
128Q83.9Confident78.7Confident119 Ų11989.7 Ų89.756%0.55650%0.496SS*.Hα-helixtrans-64-43.6172.7-70.2175.3-3.200111.9G124 V125 G126 T131 I132G124-Q128 WeakPolarHBondContact O-CG 3.32Å; G124-Q128 PolarHBondContact O-N 2.92Å; V125-Q128 PolarHBondContact O-N 2.92Å; G126-Q128 VanDerWaalsContact C-N 3.29Å; G126-Q128 PolarHBondContact O-N 3.22Å; Q128-T131 PolarHBondContact O-N 3.36Å; Q128-I132 HydrophobicContact CB-CD1 4.47Å; Q128-I132 WeakPolarHBondContact O-CB 3.4Å; Q128-I132 WeakPolarHBondContact O-CD1 3.28Å; Q128-I132 VanDerWaalsContact O-CG1 3.22Å; Q128-I132 WeakPolarHBondContact O-CG1 3.29Å; Q128-I132 PolarHBondContact O-N 3.22Å
129I85.4Confident81.2Confident83 Ų8390.9 Ų90.943%0.42650%0.498SS..Hα-helixtrans-63.3-43.5176-67.3163.7000110.7V125 G126 T131 I132 T133V125-I129 HydrophobicContact CG1-CD1 4.08Å; V125-I129 WeakPolarHBondContact O-CG1 3.41Å; V125-I129 PolarHBondContact O-N 2.81Å; G126-I129 WeakPolarHBondContact O-CB 3.18Å; G126-I129 PolarHBondContact O-N 3.45Å; I129-T131 VanDerWaalsContact C-N 3.26Å; I129-T131 PolarHBondContact O-N 3.3Å; I129-I132 PolarHBondContact O-N 3.14Å; I129-T133 VanDerWaalsContact O-CB 3.23Å; I129-T133 WeakPolarHBondContact O-CB 3.42Å; I129-T133 PolarHBondContact O-N 2.89Å; I129-T133 PolarHBondContact O-OG1 3.09Å
130D85.6Confident83.3Confident120 Ų12090.2 Ų90.264%0.64250%0.496SS*.Hα-helixtrans-66.6-25.6178.2-67.8-31.8000113G126 V127 P134G126-D130 PolarHBondContact O-N 3.44Å; V127-D130 PolarHBondContact O-N 2.89Å; D130-P134 WeakPolarHBondContact O-CD 3.42Å; D130-P134 VanDerWaalsContact O-CG 3.31Å; D130-P134 WeakPolarHBondContact O-CG 3.47Å
131T90.1Very high85.3Confident68 Ų6890.2 Ų90.242%0.41749%0.492SS..Hα-helixtrans-82.9-46.9174.6-53.90000111.7V127 Q128 I129 T133 P134 E135V127-T131 WeakPolarHBondContact O-CB 3.26Å; V127-T131 PolarHBondContact O-N 2.74Å; V127-T131 PolarHBondContact O-OG1 2.89Å; Q128-T131 PolarHBondContact O-N 3.36Å; I129-T131 VanDerWaalsContact C-N 3.26Å; I129-T131 PolarHBondContact O-N 3.3Å; T131-T133 PolarHBondContact O-N 2.8Å; T131-P134 VanDerWaalsContact O-CD 3.24Å; T131-P134 WeakPolarHBondContact O-CD 3.41Å; T131-P134 VanDerWaalsContact O-CG 3.28Å; T131-P134 WeakPolarHBondContact O-CG 3.43Å; T131-E135 WeakPolarHBondContact O-CG 3.46Å
132I92.2Very high87.4Confident89 Ų8991.4 Ų91.446%0.45650%0.504SS..Hα-helixtrans-71.2-33.8-176.3-67164.7000111.6Q128 I129 E135 V136Q128-I132 HydrophobicContact CB-CD1 4.47Å; Q128-I132 WeakPolarHBondContact O-CB 3.4Å; Q128-I132 WeakPolarHBondContact O-CD1 3.28Å; Q128-I132 VanDerWaalsContact O-CG1 3.22Å; Q128-I132 WeakPolarHBondContact O-CG1 3.29Å; Q128-I132 PolarHBondContact O-N 3.22Å; I129-I132 PolarHBondContact O-N 3.14Å; I132-E135 PolarHBondContact O-N 3.29Å; I132-V136 HydrophobicContact CG2-CG2 3.86Å; I132-V136 WeakPolarHBondContact O-CB 3.41Å; I132-V136 WeakPolarHBondContact O-CG2 3.4Å; I132-V136 PolarHBondContact O-N 3.17Å
133T90.1Very high88.5Confident63 Ų6391.6 Ų91.639%0.38750%0.5SS..Hα-helixtrans-59.8-48.8-178.6-62.40000114.1I129 T131 R137I129-T133 VanDerWaalsContact O-CB 3.23Å; I129-T133 WeakPolarHBondContact O-CB 3.42Å; I129-T133 PolarHBondContact O-N 2.89Å; I129-T133 PolarHBondContact O-OG1 3.09Å; T131-T133 PolarHBondContact O-N 2.8Å; T133-R137 WeakPolarHBondContact O-CB 3.39Å; T133-R137 PolarHBondContact O-N 3.07Å; T133-R137 VanDerWaalsContact O-N 3.14Å
134P92.4Very high89.7Confident65 Ų6585.5 Ų85.542%0.42247%0.474SS..Hα-helixtrans-68.3-34.8173.425.8-33.7000113.1D130 T131 R137 A138D130-P134 WeakPolarHBondContact O-CD 3.42Å; D130-P134 VanDerWaalsContact O-CG 3.31Å; D130-P134 WeakPolarHBondContact O-CG 3.47Å; T131-P134 VanDerWaalsContact O-CD 3.24Å; T131-P134 WeakPolarHBondContact O-CD 3.41Å; T131-P134 VanDerWaalsContact O-CG 3.28Å; T131-P134 WeakPolarHBondContact O-CG 3.43Å; P134-R137 PolarHBondContact O-N 3.03Å; P134-A138 WeakPolarHBondContact O-CB 3.21Å; P134-A138 PolarHBondContact O-N 2.88Å
135E93.6Very high90.6Very high113 Ų11388.7 Ų88.753%0.52848%0.477SS..Hα-helixtrans-60.8-49.6174.7-72.1177.4-175.700111.7T131 I132 R137 A138 L139T131-E135 WeakPolarHBondContact O-CG 3.46Å; I132-E135 PolarHBondContact O-N 3.29Å; E135-R137 VanDerWaalsContact C-N 3.28Å; E135-R137 PolarHBondContact O-N 3.32Å; E135-A138 WeakPolarHBondContact O-CB 3.43Å; E135-A138 PolarHBondContact O-N 3.24Å; E135-A138 VanDerWaalsContact O-N 3.1Å; E135-L139 WeakPolarHBondContact O-CG 3.49Å; E135-L139 PolarHBondContact O-N 3.39Å
136V93.9Very high91.3Very high66 Ų6690.6 Ų90.640%0.449%0.489SS..Hα-helixtrans-58.9-40.8175.5169.20000111I132 L139 Y140I132-V136 HydrophobicContact CG2-CG2 3.86Å; I132-V136 WeakPolarHBondContact O-CB 3.41Å; I132-V136 WeakPolarHBondContact O-CG2 3.4Å; I132-V136 PolarHBondContact O-N 3.17Å; V136-L139 PolarHBondContact O-N 2.88Å; V136-Y140 HydrophobicContact CG1-CD2 3.8Å; V136-Y140 HydrophobicContact CG1-CE2 3.66Å; V136-Y140 VanDerWaalsContact O-CD2 3.24Å; V136-Y140 WeakPolarHBondContact O-CD2 3.33Å; V136-Y140 PolarHBondContact O-N 3.01Å
137R93.5Very high92.1Very high146 Ų14694.2 Ų94.255%0.55150%0.495SS*.Hα-helixtrans-64.5-39.5175.4-170.4179.1-66.8107.2-1.3112.2T133 P134 E135 Y140 N141T133-R137 WeakPolarHBondContact O-CB 3.39Å; T133-R137 PolarHBondContact O-N 3.07Å; T133-R137 VanDerWaalsContact O-N 3.14Å; P134-R137 PolarHBondContact O-N 3.03Å; E135-R137 VanDerWaalsContact C-N 3.28Å; E135-R137 PolarHBondContact O-N 3.32Å; R137-Y140 PolarHBondContact O-N 3.25Å; R137-N141 PolarHBondContact O-N 2.78Å
138A95.4Very high92.6Very high51 Ų5196.9 Ų96.942%0.42149%0.494SS..Hα-helixtrans-64.6-43.817500000111.5P134 E135 Y140 N141 V142P134-A138 WeakPolarHBondContact O-CB 3.21Å; P134-A138 PolarHBondContact O-N 2.88Å; E135-A138 WeakPolarHBondContact O-CB 3.43Å; E135-A138 PolarHBondContact O-N 3.24Å; E135-A138 VanDerWaalsContact O-N 3.1Å; A138-Y140 PolarHBondContact O-N 3.05Å; A138-N141 WeakPolarHBondContact O-CB 3.3Å; A138-N141 PolarHBondContact O-N 3.27Å; A138-N141 VanDerWaalsContact O-N 3.14Å; A138-V142 WeakPolarHBondContact O-CG2 3.35Å; A138-V142 PolarHBondContact O-N 3.37Å
139L96.1Very high92.9Very high121 Ų12194.4 Ų94.463%0.63448%0.483SS*.Hα-helixtrans-61-41.2175.3-69.1172.6000112.3E135 V136 V142 L143E135-L139 WeakPolarHBondContact O-CG 3.49Å; E135-L139 PolarHBondContact O-N 3.39Å; V136-L139 PolarHBondContact O-N 2.88Å; L139-V142 PolarHBondContact O-N 3.45Å; L139-L143 WeakPolarHBondContact O-CB 3.45Å; L139-L143 PolarHBondContact O-N 2.93Å
140Y95.3Very high93.2Very high159 Ų15997.3 Ų97.362%0.62449%0.488SS*.Hα-helixtrans-62.8-39.6172.8-85.5-65.3000112.7V136 R137 A138 L143 A144V136-Y140 HydrophobicContact CG1-CD2 3.8Å; V136-Y140 HydrophobicContact CG1-CE2 3.66Å; V136-Y140 VanDerWaalsContact O-CD2 3.24Å; V136-Y140 WeakPolarHBondContact O-CD2 3.33Å; V136-Y140 PolarHBondContact O-N 3.01Å; R137-Y140 PolarHBondContact O-N 3.25Å; A138-Y140 PolarHBondContact O-N 3.05Å; Y140-L143 PolarHBondContact O-N 2.96Å; Y140-A144 WeakPolarHBondContact O-CB 3.49Å; Y140-A144 PolarHBondContact O-N 3.07Å
141N96.2Very high93.5Very high108 Ų10895.1 Ų95.158%0.57848%0.477SS*.Hα-helixtrans-66.5-41.1176.4-72.3-14.4000112.3R137 A138 A144 K145R137-N141 PolarHBondContact O-N 2.78Å; A138-N141 WeakPolarHBondContact O-CB 3.3Å; A138-N141 PolarHBondContact O-N 3.27Å; A138-N141 VanDerWaalsContact O-N 3.14Å; N141-A144 PolarHBondContact O-N 3.42Å; N141-K145 PolarHBondContact O-N 2.85Å
142V97.1Very high93.5Very high86 Ų8695.7 Ų95.752%0.52148%0.475SS..Hα-helixtrans-64.3-45.1174.2172.70000110.7A138 L139 A144 K145 V146A138-V142 WeakPolarHBondContact O-CG2 3.35Å; A138-V142 PolarHBondContact O-N 3.37Å; L139-V142 PolarHBondContact O-N 3.45Å; V142-A144 VanDerWaalsContact C-N 3.3Å; V142-A144 PolarHBondContact O-N 3.33Å; V142-K145 WeakPolarHBondContact O-CB 3.26Å; V142-K145 PolarHBondContact O-N 2.81Å; V142-K145 VanDerWaalsContact O-N 3.11Å; V142-V146 HydrophobicContact CG1-CG2 4.39Å; V142-V146 WeakPolarHBondContact O-CG2 3.27Å; V142-V146 PolarHBondContact O-N 3.28Å
143L93Very high93.1Very high82 Ų8299.4 Ų99.443%0.42948%0.484SS..Hα-helixtrans-61-37.7175.5-179.661.3000112.2L139 Y140 K147L139-L143 WeakPolarHBondContact O-CB 3.45Å; L139-L143 PolarHBondContact O-N 2.93Å; Y140-L143 PolarHBondContact O-N 2.96Å; L143-K147 HydrophobicContact CG-CD 4.43Å; L143-K147 WeakPolarHBondContact O-CB 3.42Å; L143-K147 VanDerWaalsContact O-CG 3.27Å; L143-K147 WeakPolarHBondContact O-CG 3.36Å; L143-K147 PolarHBondContact O-N 3.18Å
144A94.4Very high93Very high48 Ų48101.3 Ų101.340%0.39749%0.487SS..Hα-helixtrans-69.4-33.6174.600000112.6Y140 N141 V142 R148Y140-A144 WeakPolarHBondContact O-CB 3.49Å; Y140-A144 PolarHBondContact O-N 3.07Å; N141-A144 PolarHBondContact O-N 3.42Å; V142-A144 VanDerWaalsContact C-N 3.3Å; V142-A144 PolarHBondContact O-N 3.33Å; A144-R148 WeakPolarHBondContact O-CG 3.37Å; A144-R148 PolarHBondContact O-N 3.38Å; A144-R148 PolarHBondContact O-NE 2.82Å
145K94.4Very high92.8Very high105 Ų105104 Ų10446%0.45749%0.489SS..Hα-helixtrans-65-56172.1-178.6-176163.7179.70111N141 V142 K147 R148 E149N141-K145 PolarHBondContact O-N 2.85Å; V142-K145 WeakPolarHBondContact O-CB 3.26Å; V142-K145 PolarHBondContact O-N 2.81Å; V142-K145 VanDerWaalsContact O-N 3.11Å; K145-K147 VanDerWaalsContact C-N 3.27Å; K145-K147 PolarHBondContact O-N 2.76Å; K145-R148 PolarHBondContact O-N 2.93Å; K145-E149 VanDerWaalsContact CE-CD 3.4Å; K145-E149 WeakPolarHBondContact CE-OE1 3.49Å; K145-E149 WeakPolarHBondContact CE-OE2 3.45Å; K145-E149 HydrophobicContact CG-CG 4.5Å; K145-E149 IonicContact NZ-OE1 3.8Å; K145-E149 PolarHBondContact O-N 2.72Å
146V95.8Very high92.6Very high80 Ų80102.9 Ų102.949%0.48548%0.482SS..Hα-helixtrans-59.1-36.8-178.7173.90000112V142 E149 R150V142-V146 HydrophobicContact CG1-CG2 4.39Å; V142-V146 WeakPolarHBondContact O-CG2 3.27Å; V142-V146 PolarHBondContact O-N 3.28Å; V146-E149 PolarHBondContact O-N 3.12Å; V146-R150 VanDerWaalsContact O-CB 3.27Å; V146-R150 WeakPolarHBondContact O-CB 3.22Å; V146-R150 PolarHBondContact O-N 2.94Å
147K93.1Very high92.5Very high109 Ų109107.4 Ų107.447%0.47449%0.492SS..Hα-helixtrans-61-49.7173.4-79.5175.5178.9-178.10112.3L143 K145 E149 R150 D151L143-K147 HydrophobicContact CG-CD 4.43Å; L143-K147 WeakPolarHBondContact O-CB 3.42Å; L143-K147 VanDerWaalsContact O-CG 3.27Å; L143-K147 WeakPolarHBondContact O-CG 3.36Å; L143-K147 PolarHBondContact O-N 3.18Å; K145-K147 VanDerWaalsContact C-N 3.27Å; K145-K147 PolarHBondContact O-N 2.76Å; K147-E149 VanDerWaalsContact C-N 3.34Å; K147-E149 PolarHBondContact O-N 3.21Å; K147-R150 PolarHBondContact O-N 2.87Å; K147-D151 WeakPolarHBondContact O-CB 3.23Å; K147-D151 PolarHBondContact O-N 2.74Å
148R92.9Very high92.2Very high154 Ų154104.5 Ų104.558%0.58149%0.485SS*.Hα-helixtrans-60.5-42.6177.7-73.6-176.5-66.598.5-7.3112.2A144 K145 D151 E152A144-R148 WeakPolarHBondContact O-CG 3.37Å; A144-R148 PolarHBondContact O-N 3.38Å; A144-R148 PolarHBondContact O-NE 2.82Å; K145-R148 PolarHBondContact O-N 2.93Å; R148-D151 PolarHBondContact O-N 2.9Å; R148-E152 WeakPolarHBondContact O-CB 3.45Å; R148-E152 PolarHBondContact O-N 2.82Å
149E90.6Very high91.9Very high66 Ų66106 Ų10631%0.30848%0.483SS..Hα-helixtrans-62.8-46.8177.4-69.3168.6148.400110.7K145 V146 K147 D151 E152 Y153K145-E149 VanDerWaalsContact CE-CD 3.4Å; K145-E149 WeakPolarHBondContact CE-OE1 3.49Å; K145-E149 WeakPolarHBondContact CE-OE2 3.45Å; K145-E149 HydrophobicContact CG-CG 4.5Å; K145-E149 IonicContact NZ-OE1 3.8Å; K145-E149 PolarHBondContact O-N 2.72Å; V146-E149 PolarHBondContact O-N 3.12Å; K147-E149 VanDerWaalsContact C-N 3.34Å; K147-E149 PolarHBondContact O-N 3.21Å; E149-D151 VanDerWaalsContact C-N 3.32Å; E149-D151 PolarHBondContact O-N 2.88Å; E149-E152 PolarHBondContact O-N 3.25Å; E149-E152 VanDerWaalsContact O-N 3.16Å; E149-Y153 HydrophobicContact CB-CE2 4.37Å; E149-Y153 WeakPolarHBondContact O-CD2 3.29Å; E149-Y153 PolarHBondContact O-N 2.86Å
150R91.9Very high91.6Very high144 Ų144105.3 Ų105.354%0.54348%0.477SS..Hα-helixtrans-58.2-41.4173-178-75.1-47.1-114.48.1112.4V146 K147 E152 K154V146-R150 VanDerWaalsContact O-CB 3.27Å; V146-R150 WeakPolarHBondContact O-CB 3.22Å; V146-R150 PolarHBondContact O-N 2.94Å; K147-R150 PolarHBondContact O-N 2.87Å; R150-E152 VanDerWaalsContact C-N 3.35Å; R150-K154 WeakPolarHBondContact O-CB 3.39Å; R150-K154 PolarHBondContact O-N 3.4Å
151D91.8Very high91.1Very high74 Ų74100.6 Ų100.640%0.39646%0.462SS..Hα-helixtrans-69.8-31177.6-66.7-32.4000112.3K147 R148 E149 R155K147-D151 WeakPolarHBondContact O-CB 3.23Å; K147-D151 PolarHBondContact O-N 2.74Å; R148-D151 PolarHBondContact O-N 2.9Å; E149-D151 VanDerWaalsContact C-N 3.32Å; E149-D151 PolarHBondContact O-N 2.88Å; D151-R155 PolarHBondContact O-N 3.03Å; D151-R155 VanDerWaalsContact O-N 3.16Å
152E89.4Confident90.8Very high81 Ų8197.8 Ų97.838%0.37945%0.451SS..Hα-helixtrans-73.6-45.1173.8-169.1-172.5135.800112.4R148 E149 R150 K154 R155 K156R148-E152 WeakPolarHBondContact O-CB 3.45Å; R148-E152 PolarHBondContact O-N 2.82Å; E149-E152 PolarHBondContact O-N 3.25Å; E149-E152 VanDerWaalsContact O-N 3.16Å; R150-E152 VanDerWaalsContact C-N 3.35Å; E152-K154 VanDerWaalsContact C-N 3.3Å; E152-K154 PolarHBondContact O-N 3.36Å; E152-R155 PolarHBondContact O-N 3.06Å; E152-K156 HydrophobicContact CG-CD 4.44Å; E152-K156 WeakPolarHBondContact O-CG 3.34Å; E152-K156 PolarHBondContact O-N 3.45Å; E152-K156 WeakPolarHBondContact OE1-CE 3.32Å; E152-K156 IonicContact OE1-NZ 2.68Å; E152-K156 PolarHBondContact OE1-NZ 3.37Å
153Y84.7Confident90.4Very high166 Ų16698.4 Ų98.465%0.65145%0.446SS*.Hα-helixtrans-61.5-38.7173.2-72.8-61.5000111.8E149 K156 W157E149-Y153 HydrophobicContact CB-CE2 4.37Å; E149-Y153 WeakPolarHBondContact O-CD2 3.29Å; E149-Y153 PolarHBondContact O-N 2.86Å; Y153-K156 PolarHBondContact O-N 2.96Å; Y153-W157 WeakPolarHBondContact O-CB 3.42Å; Y153-W157 PolarHBondContact O-N 3.08Å
154K87.5Confident90.3Very high103 Ų103101.4 Ų101.445%0.44845%0.452SS..Hα-helixtrans-58.8-49.1173.2-178.4179.4174.9-74.10111.1R150 E152 W157 E158R150-K154 WeakPolarHBondContact O-CB 3.39Å; R150-K154 PolarHBondContact O-N 3.4Å; E152-K154 VanDerWaalsContact C-N 3.3Å; E152-K154 PolarHBondContact O-N 3.36Å; K154-W157 PolarHBondContact O-N 2.96Å; K154-E158 WeakPolarHBondContact CE-OE1 3.49Å; K154-E158 IonicContact NZ-OE1 2.7Å; K154-E158 PolarHBondContact NZ-OE1 3.39Å; K154-E158 IonicContact NZ-OE2 2.74Å; K154-E158 PolarHBondContact NZ-OE2 2.92Å; K154-E158 WeakPolarHBondContact O-CG 3.36Å; K154-E158 PolarHBondContact O-N 2.95Å
155R88.1Confident90.1Very high121 Ų121104.2 Ų104.246%0.45746%0.457SS..Hα-helixtrans-62.3-45-179.6-155.5-163-31.294.94.1112D151 E152 W157 E158 E159D151-R155 PolarHBondContact O-N 3.03Å; D151-R155 VanDerWaalsContact O-N 3.16Å; E152-R155 PolarHBondContact O-N 3.06Å; R155-W157 VanDerWaalsContact C-N 3.31Å; R155-W157 PolarHBondContact O-N 3.34Å; R155-E158 PolarHBondContact O-N 3.45Å; R155-E158 VanDerWaalsContact O-N 3.12Å; R155-E159 WeakPolarHBondContact CD-OE1 3.37Å; R155-E159 VanDerWaalsContact CG-OE1 3.23Å; R155-E159 WeakPolarHBondContact CG-OE1 3.35Å; R155-E159 IonicContact NH1-OE1 3.77Å; R155-E159 VanDerWaalsContact O-CG 3.28Å; R155-E159 WeakPolarHBondContact O-CG 3.44Å; R155-E159 PolarHBondContact O-N 2.9Å
156K89Confident89.9Confident90 Ų90105 Ų10539%0.39146%0.462SS..Hα-helixtrans-58.8-41.1175.1-74171.6172.11700111.9E152 Y153 E159 E160E152-K156 HydrophobicContact CG-CD 4.44Å; E152-K156 WeakPolarHBondContact O-CG 3.34Å; E152-K156 PolarHBondContact O-N 3.45Å; E152-K156 WeakPolarHBondContact OE1-CE 3.32Å; E152-K156 IonicContact OE1-NZ 2.68Å; E152-K156 PolarHBondContact OE1-NZ 3.37Å; Y153-K156 PolarHBondContact O-N 2.96Å; K156-E159 PolarHBondContact O-N 3.22Å; K156-E160 WeakPolarHBondContact O-CG 3.14Å; K156-E160 PolarHBondContact O-N 3.27Å
157W92.1Very high89.6Confident161 Ų161106.7 Ų106.761%0.6147%0.468SS*.Hα-helixtrans-66.3-37.3174.8178.382.1000112.7Y153 K154 R155 L161Y153-W157 WeakPolarHBondContact O-CB 3.42Å; Y153-W157 PolarHBondContact O-N 3.08Å; K154-W157 PolarHBondContact O-N 2.96Å; R155-W157 VanDerWaalsContact C-N 3.31Å; R155-W157 PolarHBondContact O-N 3.34Å; W157-L161 HydrophobicContact CH2-CD2 3.68Å; W157-L161 HydrophobicContact CZ2-CD2 4.02Å; W157-L161 HydrophobicContact CZ3-CD2 4.13Å; W157-L161 VanDerWaalsContact O-CB 3.23Å; W157-L161 WeakPolarHBondContact O-CB 3.41Å; W157-L161 PolarHBondContact O-N 3.05Å
158E87.5Confident89.5Confident86 Ų86105.3 Ų105.340%0.40246%0.463SS..Hα-helixtrans-68.1-36.5173.7-68.6173.3134.600112.1K154 R155 S162K154-E158 WeakPolarHBondContact CE-OE1 3.49Å; K154-E158 IonicContact NZ-OE1 2.7Å; K154-E158 PolarHBondContact NZ-OE1 3.39Å; K154-E158 IonicContact NZ-OE2 2.74Å; K154-E158 PolarHBondContact NZ-OE2 2.92Å; K154-E158 WeakPolarHBondContact O-CG 3.36Å; K154-E158 PolarHBondContact O-N 2.95Å; R155-E158 PolarHBondContact O-N 3.45Å; R155-E158 VanDerWaalsContact O-N 3.12Å; E158-S162 PolarHBondContact O-N 3.25Å; E158-S162 VanDerWaalsContact O-N 3.12Å
159E89.1Confident89.5Confident83 Ų83101.4 Ų101.439%0.38846%0.46SS..Hα-helixtrans-65-50.2173.2-70.4158.9-152.500111.7R155 K156 S162 K163R155-E159 WeakPolarHBondContact CD-OE1 3.37Å; R155-E159 VanDerWaalsContact CG-OE1 3.23Å; R155-E159 WeakPolarHBondContact CG-OE1 3.35Å; R155-E159 IonicContact NH1-OE1 3.77Å; R155-E159 VanDerWaalsContact O-CG 3.28Å; R155-E159 WeakPolarHBondContact O-CG 3.44Å; R155-E159 PolarHBondContact O-N 2.9Å; K156-E159 PolarHBondContact O-N 3.22Å; E159-S162 PolarHBondContact O-N 3.41Å; E159-K163 WeakPolarHBondContact O-CG 3.5Å; E159-K163 PolarHBondContact O-N 2.61Å
160E89.9Confident89.5Confident106 Ų106101.9 Ų101.950%0.49547%0.467SS..Hα-helixtrans-68.2-33.7178.1-64.4-46132.600113K156 K163 R164K156-E160 WeakPolarHBondContact O-CG 3.14Å; K156-E160 PolarHBondContact O-N 3.27Å; E160-K163 PolarHBondContact O-N 2.91Å; E160-K163 IonicContact OE1-NZ 2.64Å; E160-K163 PolarHBondContact OE1-NZ 3.35Å; E160-K163 WeakPolarHBondContact OE2-CD 3.34Å; E160-K163 IonicContact OE2-NZ 3.24Å; E160-K163 PolarHBondContact OE2-NZ 3.37Å; E160-R164 WeakPolarHBondContact O-CB 3.36Å; E160-R164 PolarHBondContact O-N 2.89Å
161L84.2Confident89.6Confident59 Ų5998.5 Ų98.531%0.30946%0.462SS..Hα-helixtrans-62.5-46.4172.8178.863000110.8W157 K163 R164 E165W157-L161 HydrophobicContact CH2-CD2 3.68Å; W157-L161 HydrophobicContact CZ2-CD2 4.02Å; W157-L161 HydrophobicContact CZ3-CD2 4.13Å; W157-L161 VanDerWaalsContact O-CB 3.23Å; W157-L161 WeakPolarHBondContact O-CB 3.41Å; W157-L161 PolarHBondContact O-N 3.05Å; L161-K163 PolarHBondContact O-N 2.58Å; L161-R164 WeakPolarHBondContact O-CB 3.47Å; L161-R164 PolarHBondContact O-N 2.93Å; L161-R164 VanDerWaalsContact O-N 3.13Å; L161-E165 HydrophobicContact CD1-CG 4.41Å; L161-E165 WeakPolarHBondContact O-CG 3.48Å; L161-E165 PolarHBondContact O-N 2.84Å
162S90.7Very high89.7Confident50 Ų50101.2 Ų101.235%0.3547%0.473SS..Hα-helixtrans-65.9-37.1179.8-168.40000112.6E158 E159 R164 E165 Q166E158-S162 PolarHBondContact O-N 3.25Å; E158-S162 VanDerWaalsContact O-N 3.12Å; E159-S162 PolarHBondContact O-N 3.41Å; S162-R164 VanDerWaalsContact C-N 3.35Å; S162-E165 PolarHBondContact O-N 3.41Å; S162-Q166 VanDerWaalsContact O-CG 3.24Å; S162-Q166 WeakPolarHBondContact O-CG 3.5Å; S162-Q166 PolarHBondContact O-N 3.26Å; S162-Q166 PolarHBondContact OG-NE2 3.46Å
163K87.6Confident90Very high98 Ų98101 Ų10143%0.42648%0.48SS..Hα-helixtrans-62-41.9170.5-69171.1-169.4172.80111.9E159 E160 L161 Q166 L167E159-K163 WeakPolarHBondContact O-CG 3.5Å; E159-K163 PolarHBondContact O-N 2.61Å; E160-K163 PolarHBondContact O-N 2.91Å; E160-K163 IonicContact OE1-NZ 2.64Å; E160-K163 PolarHBondContact OE1-NZ 3.35Å; E160-K163 WeakPolarHBondContact OE2-CD 3.34Å; E160-K163 IonicContact OE2-NZ 3.24Å; E160-K163 PolarHBondContact OE2-NZ 3.37Å; L161-K163 PolarHBondContact O-N 2.58Å; K163-Q166 PolarHBondContact O-N 2.94Å; K163-L167 WeakPolarHBondContact O-CG 3.25Å; K163-L167 PolarHBondContact O-N 3.38Å
164R90.9Very high90.4Very high145 Ų14598.6 Ų98.655%0.54748%0.478SS..Hα-helixtrans-61-49.5176.4-172.5-158.3162.482.64.6110.7E160 L161 S162 Q166 L167 E168E160-R164 WeakPolarHBondContact O-CB 3.36Å; E160-R164 PolarHBondContact O-N 2.89Å; L161-R164 WeakPolarHBondContact O-CB 3.47Å; L161-R164 PolarHBondContact O-N 2.93Å; L161-R164 VanDerWaalsContact O-N 3.13Å; S162-R164 VanDerWaalsContact C-N 3.35Å; R164-Q166 VanDerWaalsContact C-N 3.28Å; R164-Q166 PolarHBondContact O-N 3.34Å; R164-L167 PolarHBondContact O-N 3.36Å; R164-L167 VanDerWaalsContact O-N 3.11Å; R164-E168 WeakPolarHBondContact CD-OE2 3.48Å; R164-E168 HydrophobicContact CG-CG 4.3Å; R164-E168 WeakPolarHBondContact CG-OE2 3.36Å; R164-E168 IonicContact CZ-OE1 2.69Å; R164-E168 VanDerWaalsContact CZ-OE1 3.24Å; R164-E168 IonicContact CZ-OE2 2.76Å; R164-E168 IonicContact NE-OE1 3.2Å; R164-E168 PolarHBondContact NE-OE1 2.92Å; R164-E168 IonicContact NE-OE2 3.55Å; R164-E168 PolarHBondContact NE-OE2 3.27Å; R164-E168 IonicContact NH2-OE1 2.86Å; R164-E168 PolarHBondContact NH2-OE1 2.91Å; R164-E168 IonicContact NH2-OE2 3.76Å; R164-E168 WeakPolarHBondContact O-CB 3.4Å; R164-E168 WeakPolarHBondContact O-CG 3.45Å; R164-E168 PolarHBondContact O-N 2.91Å
165E90.9Very high90.8Very high107 Ų10799.8 Ų99.850%0.549%0.485SS..Hα-helixtrans-58.2-39.5178.6-69.8169.5162.100111.8L161 S162 S169L161-E165 HydrophobicContact CD1-CG 4.41Å; L161-E165 WeakPolarHBondContact O-CG 3.48Å; L161-E165 PolarHBondContact O-N 2.84Å; S162-E165 PolarHBondContact O-N 3.41Å; E165-S169 WeakPolarHBondContact O-CB 3.34Å; E165-S169 PolarHBondContact O-N 2.86Å
166Q90.8Very high91.3Very high121 Ų12199.7 Ų99.757%0.56549%0.49SS*.Hα-helixtrans-66.6-41174.2-70.5165.222.400113.1S162 K163 R164 T170S162-Q166 VanDerWaalsContact O-CG 3.24Å; S162-Q166 WeakPolarHBondContact O-CG 3.5Å; S162-Q166 PolarHBondContact O-N 3.26Å; S162-Q166 PolarHBondContact OG-NE2 3.46Å; K163-Q166 PolarHBondContact O-N 2.94Å; R164-Q166 VanDerWaalsContact C-N 3.28Å; R164-Q166 PolarHBondContact O-N 3.34Å; Q166-T170 WeakPolarHBondContact O-CB 3.38Å; Q166-T170 PolarHBondContact O-N 2.88Å; Q166-T170 PolarHBondContact O-OG1 3.04Å
167L88Confident91.5Very high117 Ų11798.6 Ų98.661%0.61349%0.493SS*.Hα-helixtrans-70.6-38.3176.8-72.1171.6000111.9K163 R164 T170 V171K163-L167 WeakPolarHBondContact O-CG 3.25Å; K163-L167 PolarHBondContact O-N 3.38Å; R164-L167 PolarHBondContact O-N 3.36Å; R164-L167 VanDerWaalsContact O-N 3.11Å; L167-T170 PolarHBondContact O-N 3.34Å; L167-V171 WeakPolarHBondContact O-CB 3.4Å; L167-V171 WeakPolarHBondContact O-CG2 3.47Å; L167-V171 PolarHBondContact O-N 3.27Å
168E91.8Very high91.5Very high79 Ų7993.9 Ų93.937%0.36949%0.489SS..Hα-helixtrans-61.3-48.4174-74.1179.9120.900110.5R164 T170 V171 E172R164-E168 WeakPolarHBondContact CD-OE2 3.48Å; R164-E168 HydrophobicContact CG-CG 4.3Å; R164-E168 WeakPolarHBondContact CG-OE2 3.36Å; R164-E168 IonicContact CZ-OE1 2.69Å; R164-E168 VanDerWaalsContact CZ-OE1 3.24Å; R164-E168 IonicContact CZ-OE2 2.76Å; R164-E168 IonicContact NE-OE1 3.2Å; R164-E168 PolarHBondContact NE-OE1 2.92Å; R164-E168 IonicContact NE-OE2 3.55Å; R164-E168 PolarHBondContact NE-OE2 3.27Å; R164-E168 IonicContact NH2-OE1 2.86Å; R164-E168 PolarHBondContact NH2-OE1 2.91Å; R164-E168 IonicContact NH2-OE2 3.76Å; R164-E168 WeakPolarHBondContact O-CB 3.4Å; R164-E168 WeakPolarHBondContact O-CG 3.45Å; R164-E168 PolarHBondContact O-N 2.91Å; E168-T170 VanDerWaalsContact C-N 3.32Å; E168-T170 PolarHBondContact O-N 2.64Å; E168-V171 PolarHBondContact O-N 3.41Å; E168-V171 VanDerWaalsContact O-N 3.15Å; E168-E172 WeakPolarHBondContact O-CG 3.34Å; E168-E172 PolarHBondContact O-N 3.24Å
169S92.3Very high92Very high72 Ų7294.8 Ų94.850%0.50349%0.493SS..Hα-helixtrans-61.6-36.8175.1179.50000113.3E165 S173E165-S169 WeakPolarHBondContact O-CB 3.34Å; E165-S169 PolarHBondContact O-N 2.86Å; S169-S173 PolarHBondContact O-N 3.03Å; S169-S173 VanDerWaalsContact O-N 3.11Å
170T91.9Very high92.3Very high76 Ų7695 Ų9547%0.46649%0.494SS..Hα-helixtrans-65.7-41.8174-55.50000111.5Q166 L167 E168 S173 L174Q166-T170 WeakPolarHBondContact O-CB 3.38Å; Q166-T170 PolarHBondContact O-N 2.88Å; Q166-T170 PolarHBondContact O-OG1 3.04Å; L167-T170 PolarHBondContact O-N 3.34Å; E168-T170 VanDerWaalsContact C-N 3.32Å; E168-T170 PolarHBondContact O-N 2.64Å; T170-S173 PolarHBondContact O-N 3.25Å; T170-L174 HydrophobicContact CG2-CD1 4.12Å; T170-L174 WeakPolarHBondContact O-CG 3.49Å; T170-L174 PolarHBondContact O-N 3.35Å
171V92.6Very high92.5Very high73 Ų7393.4 Ų93.444%0.44250%0.495SS..Hα-helixtrans-66.9-40.6177.4167.90000111.5L167 E168 S173 L174 Q175L167-V171 WeakPolarHBondContact O-CB 3.4Å; L167-V171 WeakPolarHBondContact O-CG2 3.47Å; L167-V171 PolarHBondContact O-N 3.27Å; E168-V171 PolarHBondContact O-N 3.41Å; E168-V171 VanDerWaalsContact O-N 3.15Å; V171-S173 PolarHBondContact O-N 3.07Å; V171-L174 PolarHBondContact O-N 3.06Å; V171-Q175 HydrophobicContact CG1-CG 4.36Å; V171-Q175 WeakPolarHBondContact O-CB 3.31Å; V171-Q175 VanDerWaalsContact O-CG 3.28Å; V171-Q175 WeakPolarHBondContact O-CG 3.41Å; V171-Q175 PolarHBondContact O-N 2.94Å
172E95.6Very high93.1Very high131 Ų13192.9 Ų92.961%0.61250%0.496SS*.Hα-helixtrans-59.8-44.7174.3-72.8175.5166.800111.5E168 Q175 Q176E168-E172 WeakPolarHBondContact O-CG 3.34Å; E168-E172 PolarHBondContact O-N 3.24Å; E172-Q175 PolarHBondContact O-N 3.44Å; E172-Q176 PolarHBondContact O-N 3.41Å
173S95.2Very high93.4Very high77 Ų7795.6 Ų95.654%0.53850%0.503SS..Hα-helixtrans-63.1-43.5176.1-1770000112.9S169 T170 V171 Q175 Q176 S177S169-S173 PolarHBondContact O-N 3.03Å; S169-S173 VanDerWaalsContact O-N 3.11Å; T170-S173 PolarHBondContact O-N 3.25Å; V171-S173 PolarHBondContact O-N 3.07Å; S173-Q175 PolarHBondContact O-N 2.94Å; S173-Q176 PolarHBondContact O-N 3.44Å; S173-S177 PolarHBondContact O-N 3.14Å
174L93.1Very high93.8Very high115 Ų11596.4 Ų96.460%0.60251%0.511SS*.Hα-helixtrans-67.1-34.7176.1-71171.6000112.5T170 V171 A178T170-L174 HydrophobicContact CG2-CD1 4.12Å; T170-L174 WeakPolarHBondContact O-CG 3.49Å; T170-L174 PolarHBondContact O-N 3.35Å; V171-L174 PolarHBondContact O-N 3.06Å; L174-A178 VanDerWaalsContact O-CB 3.31Å; L174-A178 WeakPolarHBondContact O-CB 3.43Å; L174-A178 PolarHBondContact O-N 2.76Å
175Q96.1Very high94.1Very high128 Ų12895.4 Ų95.460%0.59851%0.513SS*.Hα-helixtrans-66.9-40.4173.6-76.7176.12.700111.9V171 E172 S173 A178 Q179V171-Q175 HydrophobicContact CG1-CG 4.36Å; V171-Q175 WeakPolarHBondContact O-CB 3.31Å; V171-Q175 VanDerWaalsContact O-CG 3.28Å; V171-Q175 WeakPolarHBondContact O-CG 3.41Å; V171-Q175 PolarHBondContact O-N 2.94Å; E172-Q175 PolarHBondContact O-N 3.44Å; S173-Q175 PolarHBondContact O-N 2.94Å; Q175-A178 PolarHBondContact O-N 3.07Å; Q175-Q179 WeakPolarHBondContact O-CB 3.39Å; Q175-Q179 PolarHBondContact O-N 3.4Å
176Q96.9Very high94.4Very high119 Ų11995 Ų9556%0.55651%0.514SS*.Hα-helixtrans-61.4-50.6173.4-178.3-179.4-25.200111.1E172 S173 A178 Q179 E180E172-Q176 PolarHBondContact O-N 3.41Å; S173-Q176 PolarHBondContact O-N 3.44Å; Q176-A178 VanDerWaalsContact C-N 3.29Å; Q176-A178 PolarHBondContact O-N 3.06Å; Q176-Q179 WeakPolarHBondContact O-CB 3.4Å; Q176-Q179 PolarHBondContact O-N 3.23Å; Q176-Q179 VanDerWaalsContact O-N 3.08Å; Q176-E180 HydrophobicContact CG-CG 4.43Å; Q176-E180 WeakPolarHBondContact CG-OE1 3.34Å; Q176-E180 PolarHBondContact NE2-OE1 2.82Å; Q176-E180 WeakPolarHBondContact O-CG 3.3Å; Q176-E180 PolarHBondContact O-N 2.95Å
177S94.6Very high94.8Very high67 Ų6794.2 Ų94.247%0.46951%0.51SS..Hα-helixtrans-62.3-35.3179.5-1770000112.8S173 S181S173-S177 PolarHBondContact O-N 3.14Å; S177-S181 VanDerWaalsContact O-CB 3.29Å; S177-S181 WeakPolarHBondContact O-CB 3.29Å; S177-S181 PolarHBondContact O-N 2.86Å
178A92.5Very high95.2Very high63 Ų6393.6 Ų93.652%0.52151%0.507SS..Hα-helixtrans-67.2-37.3173.300000112.8L174 Q175 Q176 S182L174-A178 VanDerWaalsContact O-CB 3.31Å; L174-A178 WeakPolarHBondContact O-CB 3.43Å; L174-A178 PolarHBondContact O-N 2.76Å; Q175-A178 PolarHBondContact O-N 3.07Å; Q176-A178 VanDerWaalsContact C-N 3.29Å; Q176-A178 PolarHBondContact O-N 3.06Å; A178-S182 PolarHBondContact O-N 3.42Å
179Q97Very high95.4Very high105 Ų10593 Ų9349%0.49151%0.509SS..Hα-helixtrans-66.8-47.717517960.737.700111.3Q175 Q176 S181 S182 E183Q175-Q179 WeakPolarHBondContact O-CB 3.39Å; Q175-Q179 PolarHBondContact O-N 3.4Å; Q176-Q179 WeakPolarHBondContact O-CB 3.4Å; Q176-Q179 PolarHBondContact O-N 3.23Å; Q176-Q179 VanDerWaalsContact O-N 3.08Å; Q179-S181 VanDerWaalsContact C-N 3.3Å; Q179-S181 PolarHBondContact O-N 2.98Å; Q179-S182 WeakPolarHBondContact O-CB 3.46Å; Q179-S182 PolarHBondContact O-N 2.99Å; Q179-S182 VanDerWaalsContact O-N 3.09Å; Q179-E183 WeakPolarHBondContact CG-OE1 3.45Å; Q179-E183 PolarHBondContact NE2-OE1 2.93Å; Q179-E183 WeakPolarHBondContact O-CG 3.49Å; Q179-E183 PolarHBondContact O-N 2.76Å
180E95.4Very high95.7Very high87 Ų8794.8 Ų94.841%0.40751%0.509SS..Hα-helixtrans-58.3-41.6175.5-69.5167175.200111.5Q176 E183 I184Q176-E180 HydrophobicContact CG-CG 4.43Å; Q176-E180 WeakPolarHBondContact CG-OE1 3.34Å; Q176-E180 PolarHBondContact NE2-OE1 2.82Å; Q176-E180 WeakPolarHBondContact O-CG 3.3Å; Q176-E180 PolarHBondContact O-N 2.95Å; E180-E183 PolarHBondContact O-N 3.1Å; E180-I184 WeakPolarHBondContact O-CG1 3.43Å; E180-I184 PolarHBondContact O-N 3.43Å
181S94.9Very high96Very high72 Ų7295.4 Ų95.450%0.50351%0.506SS..Hα-helixtrans-63.7-39.2174.3-171.40000112.6S177 Q179 I184 Q185S177-S181 VanDerWaalsContact O-CB 3.29Å; S177-S181 WeakPolarHBondContact O-CB 3.29Å; S177-S181 PolarHBondContact O-N 2.86Å; Q179-S181 VanDerWaalsContact C-N 3.3Å; Q179-S181 PolarHBondContact O-N 2.98Å; S181-I184 PolarHBondContact O-N 2.91Å; S181-Q185 WeakPolarHBondContact O-CB 3.46Å; S181-Q185 PolarHBondContact O-N 3.3Å
182S96.4Very high96.3Very high49 Ų4994.9 Ų94.934%0.34350%0.502SS..Hα-helixtrans-64.7-40.6175.1-166.20000112A178 Q179 Q185 D186A178-S182 PolarHBondContact O-N 3.42Å; Q179-S182 WeakPolarHBondContact O-CB 3.46Å; Q179-S182 PolarHBondContact O-N 2.99Å; Q179-S182 VanDerWaalsContact O-N 3.09Å; S182-Q185 WeakPolarHBondContact O-CB 3.32Å; S182-Q185 PolarHBondContact O-N 2.93Å; S182-D186 PolarHBondContact O-N 3.22Å
183E97.8Very high96.4Very high107 Ų10792.6 Ų92.650%0.549%0.494SS..Hα-helixtrans-64.8-40.8177.5-71.2171-162.500111.3Q179 E180 D186 E187Q179-E183 WeakPolarHBondContact CG-OE1 3.45Å; Q179-E183 PolarHBondContact NE2-OE1 2.93Å; Q179-E183 WeakPolarHBondContact O-CG 3.49Å; Q179-E183 PolarHBondContact O-N 2.76Å; E180-E183 PolarHBondContact O-N 3.1Å; E183-D186 PolarHBondContact O-N 3.37Å; E183-E187 PolarHBondContact O-N 2.89Å
184I95.6Very high96.6Very high114 Ų11493.9 Ų93.959%0.58549%0.487SS*.Hα-helixtrans-64.6-38172.7-66.6164.9000111.6E180 S181 L188E180-I184 WeakPolarHBondContact O-CG1 3.43Å; E180-I184 PolarHBondContact O-N 3.43Å; S181-I184 PolarHBondContact O-N 2.91Å; I184-L188 WeakPolarHBondContact O-CB 3.5Å; I184-L188 PolarHBondContact O-N 2.97Å
185Q96.9Very high96.8Very high124 Ų12493.5 Ų93.558%0.57949%0.485SS*.Hα-helixtrans-65.9-41.6176.5-172-173.6-73.100112S181 S182 L188 T189S181-Q185 WeakPolarHBondContact O-CB 3.46Å; S181-Q185 PolarHBondContact O-N 3.3Å; S182-Q185 WeakPolarHBondContact O-CB 3.32Å; S182-Q185 PolarHBondContact O-N 2.93Å; Q185-L188 PolarHBondContact O-N 2.71Å; Q185-T189 WeakPolarHBondContact O-CB 3.28Å; Q185-T189 PolarHBondContact O-N 3.38Å; Q185-T189 PolarHBondContact O-OG1 2.71Å
186D97.4Very high96.9Very high98 Ų9892.9 Ų92.952%0.52448%0.481SS..Hα-helixtrans-66.7-44176.8-74.5-22.7000111S182 E183 L188 T189 E190S182-D186 PolarHBondContact O-N 3.22Å; E183-D186 PolarHBondContact O-N 3.37Å; D186-L188 VanDerWaalsContact C-N 3.34Å; D186-L188 PolarHBondContact O-N 2.81Å; D186-T189 PolarHBondContact O-N 3.08Å; D186-E190 PolarHBondContact O-N 2.97Å
187E98.1Very high97Very high106 Ų10690 Ų9050%0.49548%0.477SS..Hα-helixtrans-55.6-45.7171-90.9-160-150.400112.5E183 T189 E190 K191E183-E187 PolarHBondContact O-N 2.89Å; E187-T189 VanDerWaalsContact C-N 3.35Å; E187-E190 PolarHBondContact O-N 3.1Å; E187-K191 WeakPolarHBondContact O-CD 3.48Å; E187-K191 VanDerWaalsContact O-CG 3.23Å; E187-K191 WeakPolarHBondContact O-CG 3.39Å; E187-K191 PolarHBondContact O-N 2.76Å; E187-K191 WeakPolarHBondContact OE2-CE 3.4Å; E187-K191 IonicContact OE2-NZ 2.72Å; E187-K191 PolarHBondContact OE2-NZ 2.92Å
188L97.1Very high97.1Very high103 Ų10391.4 Ų91.454%0.53948%0.476SS..Hα-helixtrans-67.6-37.6-179.9-176.160000111.4I184 Q185 D186 K191 V192I184-L188 WeakPolarHBondContact O-CB 3.5Å; I184-L188 PolarHBondContact O-N 2.97Å; Q185-L188 PolarHBondContact O-N 2.71Å; D186-L188 VanDerWaalsContact C-N 3.34Å; D186-L188 PolarHBondContact O-N 2.81Å; L188-K191 PolarHBondContact O-N 3.33Å; L188-V192 WeakPolarHBondContact O-CB 3.5Å; L188-V192 VanDerWaalsContact O-CG2 3.32Å; L188-V192 WeakPolarHBondContact O-CG2 3.41Å; L188-V192 PolarHBondContact O-N 2.98Å
189T96.8Very high97.4Very high68 Ų6894 Ų9442%0.41748%0.481SS..Hα-helixtrans-62.7-43.4174.4-57.70000110.9Q185 D186 E187 V192 D193Q185-T189 WeakPolarHBondContact O-CB 3.28Å; Q185-T189 PolarHBondContact O-N 3.38Å; Q185-T189 PolarHBondContact O-OG1 2.71Å; D186-T189 PolarHBondContact O-N 3.08Å; E187-T189 VanDerWaalsContact C-N 3.35Å; T189-V192 PolarHBondContact O-N 3.33Å; T189-D193 PolarHBondContact O-N 3.08Å
190E98.4Very high97.4Very high108 Ų10893.8 Ų93.851%0.50549%0.486SS..Hα-helixtrans-66.7-38.8175.9-158.5-149.5-178.400112.3D186 E187 V192 D193 R194D186-E190 PolarHBondContact O-N 2.97Å; E187-E190 PolarHBondContact O-N 3.1Å; E190-V192 VanDerWaalsContact C-N 3.35Å; E190-D193 PolarHBondContact O-N 2.89Å; E190-R194 VanDerWaalsContact CD-CZ 3.43Å; E190-R194 PolarHBondContact O-N 3.34Å; E190-R194 IonicContact OE1-CZ 3.12Å; E190-R194 IonicContact OE1-NH1 2.74Å; E190-R194 PolarHBondContact OE1-NH1 3.09Å; E190-R194 IonicContact OE2-CZ 2.93Å; E190-R194 IonicContact OE2-NH1 2.74Å; E190-R194 PolarHBondContact OE2-NH1 3.01Å; E190-R194 IonicContact OE2-NH2 3.76Å; E190-R194 PolarHBondContact OE2-NH2 3.01Å
191K98.3Very high97.5Very high90 Ų9094.1 Ų94.139%0.39149%0.494SS..Hα-helixtrans-60.3-43.7171.5-71.5161.2-168.9161.20111.1E187 L188 L195E187-K191 WeakPolarHBondContact O-CD 3.48Å; E187-K191 VanDerWaalsContact O-CG 3.23Å; E187-K191 WeakPolarHBondContact O-CG 3.39Å; E187-K191 PolarHBondContact O-N 2.76Å; E187-K191 WeakPolarHBondContact OE2-CE 3.4Å; E187-K191 IonicContact OE2-NZ 2.72Å; E187-K191 PolarHBondContact OE2-NZ 2.92Å; L188-K191 PolarHBondContact O-N 3.33Å; K191-L195 WeakPolarHBondContact O-CG 3.39Å; K191-L195 PolarHBondContact O-N 2.82Å; K191-L195 VanDerWaalsContact O-N 3.08Å
192V98.4Very high97.7Very high61 Ų6196.7 Ų96.737%0.3750%0.497SS..Hα-helixtrans-63.9-42.3176.4162.50000112L188 T189 E190 L195 K196L188-V192 WeakPolarHBondContact O-CB 3.5Å; L188-V192 VanDerWaalsContact O-CG2 3.32Å; L188-V192 WeakPolarHBondContact O-CG2 3.41Å; L188-V192 PolarHBondContact O-N 2.98Å; T189-V192 PolarHBondContact O-N 3.33Å; E190-V192 VanDerWaalsContact C-N 3.35Å; V192-L195 PolarHBondContact O-N 3.35Å; V192-K196 HydrophobicContact CG1-CD 4.41Å; V192-K196 VanDerWaalsContact CG1-CE 3.44Å; V192-K196 WeakPolarHBondContact O-CG 3.31Å; V192-K196 PolarHBondContact O-N 2.87Å
193D98.2Very high97.7Very high83 Ų83102.1 Ų102.144%0.44451%0.514SS..Hα-helixtrans-73.2-32.6180-79.3-6.5000113.2T189 E190 K196 A197T189-D193 PolarHBondContact O-N 3.08Å; E190-D193 PolarHBondContact O-N 2.89Å; D193-K196 PolarHBondContact O-N 2.69Å; D193-K196 WeakPolarHBondContact OD1-CD 3.44Å; D193-K196 WeakPolarHBondContact OD1-CE 3.41Å; D193-K196 IonicContact OD1-NZ 2.59Å; D193-K196 PolarHBondContact OD1-NZ 3.38Å; D193-A197 PolarHBondContact O-N 3.24Å
194R98.2Very high97.7Very high104 Ų10499.7 Ų99.739%0.39251%0.509SS..Hα-helixtrans-58.3-51.5165.8-80.5-175.9-75.1-108.2-11.1111.7E190 K196 A197 E198E190-R194 VanDerWaalsContact CD-CZ 3.43Å; E190-R194 PolarHBondContact O-N 3.34Å; E190-R194 IonicContact OE1-CZ 3.12Å; E190-R194 IonicContact OE1-NH1 2.74Å; E190-R194 PolarHBondContact OE1-NH1 3.09Å; E190-R194 IonicContact OE2-CZ 2.93Å; E190-R194 IonicContact OE2-NH1 2.74Å; E190-R194 PolarHBondContact OE2-NH1 3.01Å; E190-R194 IonicContact OE2-NH2 3.76Å; E190-R194 PolarHBondContact OE2-NH2 3.01Å; R194-K196 VanDerWaalsContact C-N 3.31Å; R194-K196 PolarHBondContact O-N 3.14Å; R194-A197 WeakPolarHBondContact O-CB 3.32Å; R194-A197 PolarHBondContact O-N 3.25Å; R194-E198 PolarHBondContact O-N 2.88Å
195L98.3Very high97.7Very high107 Ų10798.4 Ų98.456%0.5650%0.503SS*.Hα-helixtrans-62.5-34.9179.6-70.9170.1000112.7K191 V192 L199K191-L195 WeakPolarHBondContact O-CG 3.39Å; K191-L195 PolarHBondContact O-N 2.82Å; K191-L195 VanDerWaalsContact O-N 3.08Å; V192-L195 PolarHBondContact O-N 3.35Å; L195-L199 VanDerWaalsContact O-CB 3.26Å; L195-L199 WeakPolarHBondContact O-CB 3.49Å; L195-L199 PolarHBondContact O-N 3.03Å
196K98.3Very high97.6Very high115 Ų11597.8 Ų97.850%0.550%0.501SS..Hα-helixtrans-61.8-44.3170.4-72.1170.8-164.7156.80111.7V192 D193 R194 L199 V200V192-K196 HydrophobicContact CG1-CD 4.41Å; V192-K196 VanDerWaalsContact CG1-CE 3.44Å; V192-K196 WeakPolarHBondContact O-CG 3.31Å; V192-K196 PolarHBondContact O-N 2.87Å; D193-K196 PolarHBondContact O-N 2.69Å; D193-K196 WeakPolarHBondContact OD1-CD 3.44Å; D193-K196 WeakPolarHBondContact OD1-CE 3.41Å; D193-K196 IonicContact OD1-NZ 2.59Å; D193-K196 PolarHBondContact OD1-NZ 3.38Å; R194-K196 VanDerWaalsContact C-N 3.31Å; R194-K196 PolarHBondContact O-N 3.14Å; K196-L199 PolarHBondContact O-N 3.27Å; K196-V200 WeakPolarHBondContact O-CG2 3.48Å; K196-V200 PolarHBondContact O-N 2.78Å
197A98.1Very high97.5Very high58 Ų5896.1 Ų96.148%0.47950%0.497SS..Hα-helixtrans-65.3-44.7179.300000111.8D193 R194 V200 V201D193-A197 PolarHBondContact O-N 3.24Å; R194-A197 WeakPolarHBondContact O-CB 3.32Å; R194-A197 PolarHBondContact O-N 3.25Å; A197-V200 PolarHBondContact O-N 3.04Å; A197-V201 WeakPolarHBondContact O-CG2 3.48Å; A197-V201 PolarHBondContact O-N 3.47Å
198E98Very high97.3Very high97 Ų9795.9 Ų95.945%0.45350%0.499SS..Hα-helixtrans-58.9-47.1174-71.6171.2-153.500111.6R194 V200 V201 F202R194-E198 PolarHBondContact O-N 2.88Å; E198-V200 VanDerWaalsContact C-N 3.28Å; E198-V200 PolarHBondContact O-N 3.09Å; E198-V201 PolarHBondContact O-N 3.06Å; E198-F202 HydrophobicContact CB-CD2 4.48Å; E198-F202 HydrophobicContact CB-CE2 4.4Å; E198-F202 WeakPolarHBondContact O-CD2 3.41Å; E198-F202 PolarHBondContact O-N 2.77Å
199L97.8Very high97.2Very high119 Ų11996 Ų9662%0.62350%0.497SS*.Hα-helixtrans-59.5-36.8176.9-179.163.2000112.6L195 K196 K203L195-L199 VanDerWaalsContact O-CB 3.26Å; L195-L199 WeakPolarHBondContact O-CB 3.49Å; L195-L199 PolarHBondContact O-N 3.03Å; K196-L199 PolarHBondContact O-N 3.27Å; L199-K203 VanDerWaalsContact O-CB 3.27Å; L199-K203 WeakPolarHBondContact O-CB 3.31Å; L199-K203 PolarHBondContact O-N 3.46Å
200V97.9Very high97.1Very high99 Ų9998.4 Ų98.460%0.651%0.505SS*.Hα-helixtrans-65.3-44.6173.21690000110.9K196 A197 E198 K203 S204K196-V200 WeakPolarHBondContact O-CG2 3.48Å; K196-V200 PolarHBondContact O-N 2.78Å; A197-V200 PolarHBondContact O-N 3.04Å; E198-V200 VanDerWaalsContact C-N 3.28Å; E198-V200 PolarHBondContact O-N 3.09Å; V200-K203 PolarHBondContact O-N 3.32Å; V200-S204 PolarHBondContact O-N 3Å; V200-S204 PolarHBondContact O-OG 3.49Å; V200-S204 VanDerWaalsContact O-OG 3.12Å
201V97.7Very high96.9Very high94 Ų9496.8 Ų96.857%0.5750%0.502SS*.Hα-helixtrans-62.2-47.8178172.60000111.5A197 E198 K203 S204 L205A197-V201 WeakPolarHBondContact O-CG2 3.48Å; A197-V201 PolarHBondContact O-N 3.47Å; E198-V201 PolarHBondContact O-N 3.06Å; V201-K203 VanDerWaalsContact C-N 3.3Å; V201-K203 PolarHBondContact O-N 2.97Å; V201-S204 WeakPolarHBondContact CA-OG 3.35Å; V201-S204 PolarHBondContact O-N 3.29Å; V201-S204 PolarHBondContact O-OG 2.74Å; V201-L205 PolarHBondContact O-N 3Å
202F97.6Very high96.8Very high127 Ų12795.9 Ų95.956%0.55750%0.502SS*.Hα-helixtrans-58.1-42.1174.3-77.6-64000111.8E198 L205 M206E198-F202 HydrophobicContact CB-CD2 4.48Å; E198-F202 HydrophobicContact CB-CE2 4.4Å; E198-F202 WeakPolarHBondContact O-CD2 3.41Å; E198-F202 PolarHBondContact O-N 2.77Å; F202-L205 PolarHBondContact O-N 3.41Å; F202-M206 VanDerWaalsContact O-CG 3.29Å; F202-M206 WeakPolarHBondContact O-CG 3.37Å; F202-M206 PolarHBondContact O-N 2.7Å
203K97.7Very high96.7Very high162 Ų16297.6 Ų97.670%0.70451%0.509SS*.Hα-helixtrans-66.1-38.9178.5-173.9174.7179.8178.40113L199 V200 V201 S207L199-K203 VanDerWaalsContact O-CB 3.27Å; L199-K203 WeakPolarHBondContact O-CB 3.31Å; L199-K203 PolarHBondContact O-N 3.46Å; V200-K203 PolarHBondContact O-N 3.32Å; V201-K203 VanDerWaalsContact C-N 3.3Å; V201-K203 PolarHBondContact O-N 2.97Å; K203-S207 WeakPolarHBondContact O-CB 3.49Å; K203-S207 PolarHBondContact O-N 2.97Å
204S96.2Very high96.6Very high56 Ų5697.5 Ų97.539%0.39251%0.508SS..Hα-helixtrans-63.6-48171.837.80000111.6V200 V201 M206 S207 D208V200-S204 PolarHBondContact O-N 3Å; V200-S204 PolarHBondContact O-OG 3.49Å; V200-S204 VanDerWaalsContact O-OG 3.12Å; V201-S204 WeakPolarHBondContact CA-OG 3.35Å; V201-S204 PolarHBondContact O-N 3.29Å; V201-S204 PolarHBondContact O-OG 2.74Å; S204-M206 PolarHBondContact O-N 3.33Å; S204-S207 WeakPolarHBondContact O-CB 3.42Å; S204-S207 PolarHBondContact O-N 3.36Å; S204-D208 VanDerWaalsContact O-CG 3.31Å; S204-D208 PolarHBondContact O-N 3.35Å
205L96.4Very high96.6Very high88 Ų8895.7 Ų95.746%0.46151%0.511SS..Hα-helixtrans-57.3-48.8-178-175.365.8000112V201 F202 S207 D208 E209V201-L205 PolarHBondContact O-N 3Å; F202-L205 PolarHBondContact O-N 3.41Å; L205-S207 VanDerWaalsContact C-N 3.3Å; L205-S207 PolarHBondContact O-N 3.5Å; L205-D208 PolarHBondContact O-N 3.11Å; L205-E209 PolarHBondContact O-N 2.91Å
206M94.2Very high96.6Very high110 Ų11095.9 Ų95.954%0.54251%0.508SS..Hα-helixtrans-64.3-32.6177.1-63.6-69.895.600112.9F202 S204 E209 M210F202-M206 VanDerWaalsContact O-CG 3.29Å; F202-M206 WeakPolarHBondContact O-CG 3.37Å; F202-M206 PolarHBondContact O-N 2.7Å; S204-M206 PolarHBondContact O-N 3.33Å; M206-E209 WeakPolarHBondContact CE-OE2 3.47Å; M206-M210 VanDerWaalsContact O-CB 3.28Å; M206-M210 WeakPolarHBondContact O-CB 3.49Å; M206-M210 PolarHBondContact O-N 3.32Å
207S95Very high96.5Very high64 Ų6495.5 Ų95.545%0.44851%0.51SS..Hα-helixtrans-72.2-38.2175.8-172.60000112.2K203 S204 L205 T211K203-S207 WeakPolarHBondContact O-CB 3.49Å; K203-S207 PolarHBondContact O-N 2.97Å; S204-S207 WeakPolarHBondContact O-CB 3.42Å; S204-S207 PolarHBondContact O-N 3.36Å; L205-S207 VanDerWaalsContact C-N 3.3Å; L205-S207 PolarHBondContact O-N 3.5Å; S207-T211 WeakPolarHBondContact O-CB 3.32Å; S207-T211 WeakPolarHBondContact O-CG2 3.18Å; S207-T211 PolarHBondContact O-N 3.47Å; S207-T211 PolarHBondContact O-OG1 2.88Å
208D93.9Very high96.5Very high100 Ų10097.9 Ų97.954%0.53551%0.511SS..Hα-helixtrans-70.7-43.4179.8-68.1-17000110.8S204 L205 M210 T211 D212S204-D208 VanDerWaalsContact O-CG 3.31Å; S204-D208 PolarHBondContact O-N 3.35Å; L205-D208 PolarHBondContact O-N 3.11Å; D208-M210 PolarHBondContact O-N 3.49Å; D208-T211 PolarHBondContact O-N 3.29Å; D208-T211 PolarHBondContact O-OG1 3.36Å; D208-D212 WeakPolarHBondContact O-CB 3.3Å; D208-D212 PolarHBondContact O-N 2.9Å
209E95.9Very high96.5Very high105 Ų10596.9 Ų96.949%0.49151%0.507SS..Hα-helixtrans-62.1-42.4173.5-70.8-168.3122.800112.3L205 M206 L213L205-E209 PolarHBondContact O-N 2.91Å; M206-E209 WeakPolarHBondContact CE-OE2 3.47Å; E209-L213 WeakPolarHBondContact O-CB 3.3Å; E209-L213 WeakPolarHBondContact O-CG 3.21Å; E209-L213 PolarHBondContact O-N 3.11Å
210M94.5Very high96.4Very high119 Ų11997.6 Ų97.659%0.58651%0.505SS*.Hα-helixtrans-64.2-42.2177.7-169.768.9170.200112M206 D208 L213 D214M206-M210 VanDerWaalsContact O-CB 3.28Å; M206-M210 WeakPolarHBondContact O-CB 3.49Å; M206-M210 PolarHBondContact O-N 3.32Å; D208-M210 PolarHBondContact O-N 3.49Å; M210-L213 PolarHBondContact O-N 3.47Å; M210-D214 PolarHBondContact O-N 2.82Å
211T94.8Very high96.4Very high74 Ų7495 Ų9545%0.45449%0.494SS..Hα-helixtrans-75.2-28.9-179.452.50000113.4S207 D208 S215S207-T211 WeakPolarHBondContact O-CB 3.32Å; S207-T211 WeakPolarHBondContact O-CG2 3.18Å; S207-T211 PolarHBondContact O-N 3.47Å; S207-T211 PolarHBondContact O-OG1 2.88Å; D208-T211 PolarHBondContact O-N 3.29Å; D208-T211 PolarHBondContact O-OG1 3.36Å; T211-S215 VanDerWaalsContact O-CB 3.23Å; T211-S215 WeakPolarHBondContact O-CB 3.32Å; T211-S215 PolarHBondContact O-N 3.34Å; T211-S215 PolarHBondContact O-OG 3.22Å
212D96.6Very high96.4Very high72 Ų7296.5 Ų96.539%0.38549%0.489SS..Hα-helixtrans-68.5-41.7168.3169.159.5000111.9D208 S215 K216D208-D212 WeakPolarHBondContact O-CB 3.3Å; D208-D212 PolarHBondContact O-N 2.9Å; D212-S215 WeakPolarHBondContact O-CB 3.24Å; D212-S215 PolarHBondContact O-N 3.04Å; D212-K216 VanDerWaalsContact CG-NZ 3.33Å; D212-K216 WeakPolarHBondContact O-CB 3.39Å; D212-K216 VanDerWaalsContact O-CG 3.3Å; D212-K216 WeakPolarHBondContact O-CG 3.35Å; D212-K216 PolarHBondContact O-N 3.31Å; D212-K216 WeakPolarHBondContact OD1-CE 3.42Å; D212-K216 IonicContact OD1-NZ 3.29Å; D212-K216 PolarHBondContact OD1-NZ 2.89Å; D212-K216 VanDerWaalsContact OD2-CE 3.3Å; D212-K216 WeakPolarHBondContact OD2-CE 3.33Å; D212-K216 IonicContact OD2-NZ 2.59Å; D212-K216 PolarHBondContact OD2-NZ 2.8Å
213L95.9Very high96.4Very high97 Ų9796.7 Ų96.751%0.50849%0.486SS..Hα-helixtrans-60.7-49.2172.9-76.5170.2000112.1E209 M210 S215 K216 I217E209-L213 WeakPolarHBondContact O-CB 3.3Å; E209-L213 WeakPolarHBondContact O-CG 3.21Å; E209-L213 PolarHBondContact O-N 3.11Å; M210-L213 PolarHBondContact O-N 3.47Å; L213-S215 VanDerWaalsContact C-N 3.3Å; L213-S215 PolarHBondContact O-N 3.37Å; L213-K216 WeakPolarHBondContact O-CB 3.38Å; L213-K216 PolarHBondContact O-N 2.89Å; L213-I217 VanDerWaalsContact O-CG1 3.3Å; L213-I217 WeakPolarHBondContact O-CG1 3.23Å; L213-I217 PolarHBondContact O-N 3.32Å
214D96.6Very high96.4Very high80 Ų8093 Ų9343%0.42848%0.477SS..Hα-helixtrans-60.3-40.5174.9-102.9-6.7000111.7M210 K216 I217 Q218M210-D214 PolarHBondContact O-N 2.82Å; D214-K216 PolarHBondContact O-N 3.15Å; D214-I217 PolarHBondContact O-N 2.78Å; D214-Q218 WeakPolarHBondContact O-CB 3.37Å; D214-Q218 WeakPolarHBondContact O-CG 3.32Å; D214-Q218 PolarHBondContact O-N 2.89Å
215S97.4Very high96.5Very high66 Ų6694.6 Ų94.646%0.46248%0.481SS..Hα-helixtrans-61.1-44.3175.8-66.50000111.8T211 D212 L213 Q218 E219T211-S215 VanDerWaalsContact O-CB 3.23Å; T211-S215 WeakPolarHBondContact O-CB 3.32Å; T211-S215 PolarHBondContact O-N 3.34Å; T211-S215 PolarHBondContact O-OG 3.22Å; D212-S215 WeakPolarHBondContact O-CB 3.24Å; D212-S215 PolarHBondContact O-N 3.04Å; L213-S215 VanDerWaalsContact C-N 3.3Å; L213-S215 PolarHBondContact O-N 3.37Å; S215-Q218 PolarHBondContact O-N 3.01Å; S215-E219 VanDerWaalsContact O-CB 3.31Å; S215-E219 WeakPolarHBondContact O-CB 3.44Å; S215-E219 PolarHBondContact O-N 2.64Å
216K97.6Very high96.5Very high111 Ų11197.1 Ų97.148%0.48349%0.492SS..Hα-helixtrans-63.8-40.9175.3-74.9163.2175.7166.70112.1D212 L213 D214 E219 K220D212-K216 VanDerWaalsContact CG-NZ 3.33Å; D212-K216 WeakPolarHBondContact O-CB 3.39Å; D212-K216 VanDerWaalsContact O-CG 3.3Å; D212-K216 WeakPolarHBondContact O-CG 3.35Å; D212-K216 PolarHBondContact O-N 3.31Å; D212-K216 WeakPolarHBondContact OD1-CE 3.42Å; D212-K216 IonicContact OD1-NZ 3.29Å; D212-K216 PolarHBondContact OD1-NZ 2.89Å; D212-K216 VanDerWaalsContact OD2-CE 3.3Å; D212-K216 WeakPolarHBondContact OD2-CE 3.33Å; D212-K216 IonicContact OD2-NZ 2.59Å; D212-K216 PolarHBondContact OD2-NZ 2.8Å; L213-K216 WeakPolarHBondContact O-CB 3.38Å; L213-K216 PolarHBondContact O-N 2.89Å; D214-K216 PolarHBondContact O-N 3.15Å; K216-E219 PolarHBondContact O-N 2.8Å; K216-K220 WeakPolarHBondContact O-CB 3.09Å; K216-K220 WeakPolarHBondContact O-CG 3.37Å; K216-K220 PolarHBondContact O-N 3.09Å
217I97.1Very high96.7Very high107 Ų10795.2 Ų95.255%0.54948%0.484SS..Hα-helixtrans-64.2-50.4176.2-69.6164.5000110.4L213 D214 E219 K220 A221L213-I217 VanDerWaalsContact O-CG1 3.3Å; L213-I217 WeakPolarHBondContact O-CG1 3.23Å; L213-I217 PolarHBondContact O-N 3.32Å; D214-I217 PolarHBondContact O-N 2.78Å; I217-E219 VanDerWaalsContact C-N 3.3Å; I217-E219 PolarHBondContact O-N 3.47Å; I217-K220 PolarHBondContact O-N 3.25Å; I217-A221 PolarHBondContact O-N 3.18Å
218Q97.4Very high96.8Very high108 Ų10896.1 Ų96.151%0.50548%0.483SS..Hα-helixtrans-62.6-35.4177.6-71.4-175.923.600112.8D214 S215 A221 R222D214-Q218 WeakPolarHBondContact O-CB 3.37Å; D214-Q218 WeakPolarHBondContact O-CG 3.32Å; D214-Q218 PolarHBondContact O-N 2.89Å; S215-Q218 PolarHBondContact O-N 3.01Å; Q218-A221 PolarHBondContact O-N 3.35Å; Q218-R222 WeakPolarHBondContact O-CB 3.48Å; Q218-R222 WeakPolarHBondContact O-CG 3.41Å; Q218-R222 PolarHBondContact O-N 3.48Å; Q218-R222 PolarHBondContact O-NE 2.83Å
219E97.9Very high96.9Very high77 Ų7795 Ų9536%0.3648%0.482SS..Hα-helixtrans-70.7-39.6177.7-150.7-125.3129.700111.3S215 K216 I217 R222 R223S215-E219 VanDerWaalsContact O-CB 3.31Å; S215-E219 WeakPolarHBondContact O-CB 3.44Å; S215-E219 PolarHBondContact O-N 2.64Å; K216-E219 PolarHBondContact O-N 2.8Å; I217-E219 VanDerWaalsContact C-N 3.3Å; I217-E219 PolarHBondContact O-N 3.47Å; E219-R222 PolarHBondContact O-N 2.77Å; E219-R223 WeakPolarHBondContact O-CG 3.4Å; E219-R223 PolarHBondContact O-N 3.26Å; E219-R223 IonicContact OE1-CZ 3.14Å; E219-R223 IonicContact OE1-NE 2.71Å; E219-R223 PolarHBondContact OE1-NE 2.88Å; E219-R223 IonicContact OE1-NH2 2.8Å; E219-R223 PolarHBondContact OE1-NH2 3.44Å; E219-R223 IonicContact OE2-CZ 3.73Å; E219-R223 IonicContact OE2-NE 3.95Å; E219-R223 IonicContact OE2-NH2 2.75Å; E219-R223 PolarHBondContact OE2-NH2 3.43Å
220K97.2Very high97Very high133 Ų13397.3 Ų97.358%0.57849%0.487SS*.Hα-helixtrans-60.8-44.3170.5-71.3-80.5-175.7161.80111.8K216 I217 R223 V224K216-K220 WeakPolarHBondContact O-CB 3.09Å; K216-K220 WeakPolarHBondContact O-CG 3.37Å; K216-K220 PolarHBondContact O-N 3.09Å; I217-K220 PolarHBondContact O-N 3.25Å; K220-R223 PolarHBondContact O-N 2.92Å; K220-V224 WeakPolarHBondContact O-CG2 3.32Å; K220-V224 PolarHBondContact O-N 3.35Å; K220-V224 VanDerWaalsContact O-N 3.11Å
221A97.5Very high97.1Very high45 Ų4599.2 Ų99.237%0.37249%0.487SS..Hα-helixtrans-59.1-52.7175.200000111.4I217 Q218 R223 V224 D225I217-A221 PolarHBondContact O-N 3.18Å; Q218-A221 PolarHBondContact O-N 3.35Å; A221-R223 VanDerWaalsContact C-N 3.28Å; A221-R223 PolarHBondContact O-N 3.13Å; A221-V224 CarbonylContact O-C 3.6Å; A221-V224 WeakPolarHBondContact O-CA 3.39Å; A221-V224 WeakPolarHBondContact O-CB 3.33Å; A221-V224 PolarHBondContact O-N 3.33Å; A221-D225 PolarHBondContact O-N 2.89Å
222R97.6Very high97.2Very high126 Ų126100.7 Ų100.748%0.47549%0.491SS..Hα-helixtrans-55.8-37.6177-79.6-179.9-94.9112.9-4.8113.5Q218 E219 M226Q218-R222 WeakPolarHBondContact O-CB 3.48Å; Q218-R222 WeakPolarHBondContact O-CG 3.41Å; Q218-R222 PolarHBondContact O-N 3.48Å; Q218-R222 PolarHBondContact O-NE 2.83Å; E219-R222 PolarHBondContact O-N 2.77Å; R222-M226 WeakPolarHBondContact O-CB 3.39Å; R222-M226 WeakPolarHBondContact O-CG 3.44Å; R222-M226 PolarHBondContact O-N 3.45Å
223R96.9Very high97.2Very high130 Ų130102.1 Ų102.149%0.49150%0.499SS..Hα-helixtrans-66.3-37.7173.6-69.2-178.8-150.41739.6112.5E219 K220 A221 D227E219-R223 WeakPolarHBondContact O-CG 3.4Å; E219-R223 PolarHBondContact O-N 3.26Å; E219-R223 IonicContact OE1-CZ 3.14Å; E219-R223 IonicContact OE1-NE 2.71Å; E219-R223 PolarHBondContact OE1-NE 2.88Å; E219-R223 IonicContact OE1-NH2 2.8Å; E219-R223 PolarHBondContact OE1-NH2 3.44Å; E219-R223 IonicContact OE2-CZ 3.73Å; E219-R223 IonicContact OE2-NE 3.95Å; E219-R223 IonicContact OE2-NH2 2.75Å; E219-R223 PolarHBondContact OE2-NH2 3.43Å; K220-R223 PolarHBondContact O-N 2.92Å; A221-R223 VanDerWaalsContact C-N 3.28Å; A221-R223 PolarHBondContact O-N 3.13Å; R223-D227 PolarHBondContact O-N 3.32Å
224V98.3Very high97.3Very high85 Ų85101 Ų10152%0.51549%0.493SS..Hα-helixtrans-69.8-45.5176.7170.40000110.8K220 A221 M226 D227 I228K220-V224 WeakPolarHBondContact O-CG2 3.32Å; K220-V224 PolarHBondContact O-N 3.35Å; K220-V224 VanDerWaalsContact O-N 3.11Å; A221-V224 CarbonylContact O-C 3.6Å; A221-V224 WeakPolarHBondContact O-CA 3.39Å; A221-V224 WeakPolarHBondContact O-CB 3.33Å; A221-V224 PolarHBondContact O-N 3.33Å; V224-M226 VanDerWaalsContact C-N 3.31Å; V224-M226 PolarHBondContact O-N 3.22Å; V224-D227 PolarHBondContact O-N 3.46Å; V224-D227 VanDerWaalsContact O-N 3.1Å; V224-I228 HydrophobicContact CG1-CD1 3.78Å; V224-I228 HydrophobicContact CG1-CG1 4.36Å; V224-I228 WeakPolarHBondContact O-CG1 3.38Å; V224-I228 PolarHBondContact O-N 3.39Å
225D97.4Very high97.3Very high90 Ų90101 Ų10148%0.48150%0.496SS..Hα-helixtrans-59-42.2176.2-65-36000111.5A221 D227 I228 C229A221-D225 PolarHBondContact O-N 2.89Å; D225-D227 PolarHBondContact O-N 3.13Å; D225-I228 PolarHBondContact O-N 3.05Å; D225-C229 PolarHBondContact O-N 3.33Å; D225-C229 PolarHBondContact O-SG 3.49Å
226M97.6Very high97.3Very high141 Ų141100.2 Ų100.270%0.69549%0.493SS*.Hα-helixtrans-58.4-42.5173.1-83.6178.255.600113.1R222 V224 R230R222-M226 WeakPolarHBondContact O-CB 3.39Å; R222-M226 WeakPolarHBondContact O-CG 3.44Å; R222-M226 PolarHBondContact O-N 3.45Å; V224-M226 VanDerWaalsContact C-N 3.31Å; V224-M226 PolarHBondContact O-N 3.22Å; M226-R230 VanDerWaalsContact O-CB 3.28Å; M226-R230 WeakPolarHBondContact O-CB 3.48Å; M226-R230 PolarHBondContact O-N 3.44Å
227D97.7Very high97.2Very high70 Ų70101.8 Ų101.837%0.37450%0.5SS..Hα-helixtrans-70.6-37.9176.3-172.664.1000111.9R223 V224 D225 R230 R231R223-D227 PolarHBondContact O-N 3.32Å; V224-D227 PolarHBondContact O-N 3.46Å; V224-D227 VanDerWaalsContact O-N 3.1Å; D225-D227 PolarHBondContact O-N 3.13Å; D227-R230 PolarHBondContact O-N 2.96Å; D227-R231 VanDerWaalsContact O-CB 3.32Å; D227-R231 WeakPolarHBondContact O-CB 3.21Å; D227-R231 VanDerWaalsContact O-CG 3.24Å; D227-R231 WeakPolarHBondContact O-CG 3.45Å; D227-R231 PolarHBondContact O-N 2.92Å; D227-R231 WeakPolarHBondContact OD2-CD 3.44Å
228I96.4Very high97.1Very high83 Ų83102.1 Ų102.143%0.42650%0.502SS..Hα-helixtrans-58.7-51.7174.4-69.2168.6000110.3V224 D225 R230 R231 I232V224-I228 HydrophobicContact CG1-CD1 3.78Å; V224-I228 HydrophobicContact CG1-CG1 4.36Å; V224-I228 WeakPolarHBondContact O-CG1 3.38Å; V224-I228 PolarHBondContact O-N 3.39Å; D225-I228 PolarHBondContact O-N 3.05Å; I228-R230 PolarHBondContact O-N 3.11Å; I228-R231 PolarHBondContact O-N 3.24Å; I228-I232 HydrophobicContact CG2-CD1 3.86Å; I228-I232 VanDerWaalsContact O-CG1 3.31Å; I228-I232 WeakPolarHBondContact O-CG1 3.46Å; I228-I232 PolarHBondContact O-N 3.48Å
229C97.3Very high97Very high76 Ų76100.5 Ų100.551%0.51450%0.502SS..Hα-helixtrans-56.6-48.6174.9-71.40000111.7D225 R231 I232 D233D225-C229 PolarHBondContact O-N 3.33Å; D225-C229 PolarHBondContact O-SG 3.49Å; C229-R231 VanDerWaalsContact C-N 3.29Å; C229-R231 PolarHBondContact O-N 2.98Å; C229-I232 WeakPolarHBondContact O-CB 3.32Å; C229-I232 PolarHBondContact O-N 3.09Å; C229-I232 VanDerWaalsContact O-N 3.15Å; C229-D233 PolarHBondContact O-N 3.17Å
230R97.4Very high96.9Very high154 Ų154101.7 Ų101.758%0.58151%0.511SS*.Hα-helixtrans-62.1-35179.9-162.7-176.3102.689.8-0112.7M226 D227 I228 I234M226-R230 VanDerWaalsContact O-CB 3.28Å; M226-R230 WeakPolarHBondContact O-CB 3.48Å; M226-R230 PolarHBondContact O-N 3.44Å; D227-R230 PolarHBondContact O-N 2.96Å; I228-R230 PolarHBondContact O-N 3.11Å; R230-I234 HydrophobicContact CG-CD1 4.31Å; R230-I234 WeakPolarHBondContact O-CD1 3.28Å; R230-I234 VanDerWaalsContact O-CG1 3.22Å; R230-I234 WeakPolarHBondContact O-CG1 3.09Å; R230-I234 PolarHBondContact O-N 2.78Å; R230-I234 VanDerWaalsContact O-N 3.08Å
231R97.1Very high96.8Very high159 Ų15999.8 Ų99.860%0.651%0.51SS*.Hα-helixtrans-74.6-34.4176.2-73.517767.4-170.92112.1D227 I228 C229 T235D227-R231 VanDerWaalsContact O-CB 3.32Å; D227-R231 WeakPolarHBondContact O-CB 3.21Å; D227-R231 VanDerWaalsContact O-CG 3.24Å; D227-R231 WeakPolarHBondContact O-CG 3.45Å; D227-R231 PolarHBondContact O-N 2.92Å; D227-R231 WeakPolarHBondContact OD2-CD 3.44Å; I228-R231 PolarHBondContact O-N 3.24Å; C229-R231 VanDerWaalsContact C-N 3.29Å; C229-R231 PolarHBondContact O-N 2.98Å; R231-T235 WeakPolarHBondContact O-CB 3.44Å; R231-T235 PolarHBondContact O-N 3.21Å; R231-T235 PolarHBondContact O-OG1 2.99Å
232I96.6Very high96.5Very high105 Ų105100 Ų10054%0.53851%0.512SS..Hα-helixtrans-62.5-48.7170.4-68.7164.5000109.8I228 C229 I234 T235 A236I228-I232 HydrophobicContact CG2-CD1 3.86Å; I228-I232 VanDerWaalsContact O-CG1 3.31Å; I228-I232 WeakPolarHBondContact O-CG1 3.46Å; I228-I232 PolarHBondContact O-N 3.48Å; C229-I232 WeakPolarHBondContact O-CB 3.32Å; C229-I232 PolarHBondContact O-N 3.09Å; C229-I232 VanDerWaalsContact O-N 3.15Å; I232-I234 PolarHBondContact O-N 3.32Å; I232-T235 PolarHBondContact O-N 2.89Å; I232-T235 VanDerWaalsContact O-N 3.12Å; I232-A236 PolarHBondContact O-N 3.14Å
233D96.9Very high96.2Very high101 Ų101100.8 Ų100.854%0.5452%0.521SS..Hα-helixtrans-58-44.4177.3-75.4-20.4000113.1C229 T235 K237C229-D233 PolarHBondContact O-N 3.17Å; D233-T235 VanDerWaalsContact C-N 3.35Å; D233-K237 WeakPolarHBondContact O-CG 3.27Å; D233-K237 PolarHBondContact O-N 3.47Å; D233-K237 VanDerWaalsContact O-N 3.12Å
234I96.8Very high95.8Very high74 Ų7499.9 Ų99.938%0.37952%0.522SS..Hα-helixtrans-65-41.1176.7-70.5165.1000110.4R230 I232 K237 L238R230-I234 HydrophobicContact CG-CD1 4.31Å; R230-I234 WeakPolarHBondContact O-CD1 3.28Å; R230-I234 VanDerWaalsContact O-CG1 3.22Å; R230-I234 WeakPolarHBondContact O-CG1 3.09Å; R230-I234 PolarHBondContact O-N 2.78Å; R230-I234 VanDerWaalsContact O-N 3.08Å; I232-I234 PolarHBondContact O-N 3.32Å; I234-K237 PolarHBondContact O-N 2.95Å; I234-L238 HydrophobicContact CG2-CD1 3.97Å; I234-L238 VanDerWaalsContact O-CG 3.3Å; I234-L238 WeakPolarHBondContact O-CG 3.45Å; I234-L238 PolarHBondContact O-N 3.01Å
235T96.8Very high95.1Very high81 Ų81103.9 Ų103.950%0.49753%0.528SS..Hα-helixtrans-65.7-43.7178.9-55.80000111.2R231 I232 D233 K237 L238 C239R231-T235 WeakPolarHBondContact O-CB 3.44Å; R231-T235 PolarHBondContact O-N 3.21Å; R231-T235 PolarHBondContact O-OG1 2.99Å; I232-T235 PolarHBondContact O-N 2.89Å; I232-T235 VanDerWaalsContact O-N 3.12Å; D233-T235 VanDerWaalsContact C-N 3.35Å; T235-K237 PolarHBondContact O-N 2.81Å; T235-L238 PolarHBondContact O-N 3.17Å; T235-C239 PolarHBondContact O-N 3.3Å; T235-C239 PolarHBondContact O-SG 3.46Å; T235-C239 VanDerWaalsContact O-SG 3.4Å
236A97.1Very high94.3Very high48 Ų48105 Ų10540%0.39753%0.534SS..Hα-helixtrans-57.3-50.3175.300000111.4I232 L238 C239 D240I232-A236 PolarHBondContact O-N 3.14Å; A236-L238 VanDerWaalsContact C-N 3.29Å; A236-L238 PolarHBondContact O-N 3.41Å; A236-C239 WeakPolarHBondContact O-CA 3.39Å; A236-C239 WeakPolarHBondContact O-CB 3.23Å; A236-C239 PolarHBondContact O-N 3.27Å; A236-D240 PolarHBondContact O-N 3.44Å
237K96.2Very high93.3Very high145 Ų145101.4 Ų101.463%0.6352%0.523SS*.Hα-helixtrans-62.5-32.9177.5-71.9179.1178.81780113.5D233 I234 T235 V241D233-K237 WeakPolarHBondContact O-CG 3.27Å; D233-K237 PolarHBondContact O-N 3.47Å; D233-K237 VanDerWaalsContact O-N 3.12Å; I234-K237 PolarHBondContact O-N 2.95Å; T235-K237 PolarHBondContact O-N 2.81Å; K237-V241 VanDerWaalsContact O-CG2 3.3Å; K237-V241 WeakPolarHBondContact O-CG2 3.28Å; K237-V241 PolarHBondContact O-N 3.17Å; K237-V241 VanDerWaalsContact O-N 3.09Å
238L95.6Very high91.8Very high113 Ų113102 Ų10259%0.59252%0.523SS*.Hα-helixtrans-69.8-37.5173.4-73.3169.6000111.9I234 T235 A236 A242I234-L238 HydrophobicContact CG2-CD1 3.97Å; I234-L238 VanDerWaalsContact O-CG 3.3Å; I234-L238 WeakPolarHBondContact O-CG 3.45Å; I234-L238 PolarHBondContact O-N 3.01Å; T235-L238 PolarHBondContact O-N 3.17Å; A236-L238 VanDerWaalsContact C-N 3.29Å; A236-L238 PolarHBondContact O-N 3.41Å; L238-A242 VanDerWaalsContact O-CB 3.32Å; L238-A242 WeakPolarHBondContact O-CB 3.35Å; L238-A242 PolarHBondContact O-N 3.14Å
239C94.5Very high90Very high74 Ų74100.8 Ų100.850%0.552%0.518SS..Hα-helixtrans-63.3-45.4171.6-69.70000111.8T235 A236 V241 A242 Q243T235-C239 PolarHBondContact O-N 3.3Å; T235-C239 PolarHBondContact O-SG 3.46Å; T235-C239 VanDerWaalsContact O-SG 3.4Å; A236-C239 WeakPolarHBondContact O-CA 3.39Å; A236-C239 WeakPolarHBondContact O-CB 3.23Å; A236-C239 PolarHBondContact O-N 3.27Å; C239-V241 PolarHBondContact O-N 3.31Å; C239-A242 PolarHBondContact O-N 2.68Å; C239-Q243 WeakPolarHBondContact O-CB 3.16Å; C239-Q243 PolarHBondContact O-N 3.12Å
240D95.3Very high88Confident102 Ų102101.9 Ų101.955%0.54552%0.517SS..Hα-helixtrans-57.4-48.8176.7-64.7-32.3000111.5A236 A242 Q243 Q244A236-D240 PolarHBondContact O-N 3.44Å; D240-A242 PolarHBondContact O-N 2.6Å; D240-Q243 PolarHBondContact O-N 3.36Å; D240-Q244 WeakPolarHBondContact O-CB 3.43Å; D240-Q244 PolarHBondContact O-N 2.84Å
241V95.3Very high86.1Confident93 Ų9398.4 Ų98.456%0.56452%0.516SS*.Hα-helixtrans-64.4-39.5178.5169.50000111.9K237 C239 R245K237-V241 VanDerWaalsContact O-CG2 3.3Å; K237-V241 WeakPolarHBondContact O-CG2 3.28Å; K237-V241 PolarHBondContact O-N 3.17Å; K237-V241 VanDerWaalsContact O-N 3.09Å; C239-V241 PolarHBondContact O-N 3.31Å; V241-R245 WeakPolarHBondContact O-CB 3.4Å; V241-R245 PolarHBondContact O-N 3.36Å
242A91.4Very high84Confident50 Ų5096.7 Ų96.741%0.41351%0.512SS..Hα-helixtrans-66.7-39.5175.500000112L238 C239 D240 R245 N246L238-A242 VanDerWaalsContact O-CB 3.32Å; L238-A242 WeakPolarHBondContact O-CB 3.35Å; L238-A242 PolarHBondContact O-N 3.14Å; C239-A242 PolarHBondContact O-N 2.68Å; D240-A242 PolarHBondContact O-N 2.6Å; A242-R245 PolarHBondContact O-N 3.07Å; A242-N246 WeakPolarHBondContact O-CB 3.4Å; A242-N246 VanDerWaalsContact O-CG 3.32Å; A242-N246 PolarHBondContact O-N 2.96Å; A242-N246 PolarHBondContact O-ND2 3.12Å
243Q92.3Very high81.8Confident142 Ų14297.6 Ų97.666%0.66452%0.516SS*.Hα-helixtrans-68.6-40.9176.8-177.7166.5-28.500111.9C239 D240 N246 S247C239-Q243 WeakPolarHBondContact O-CB 3.16Å; C239-Q243 PolarHBondContact O-N 3.12Å; D240-Q243 PolarHBondContact O-N 3.36Å; Q243-N246 PolarHBondContact O-N 2.94Å; Q243-S247 PolarHBondContact O-N 3.25Å; Q243-S247 PolarHBondContact O-OG 2.85Å
244Q88.8Confident79.5Confident112 Ų11299.8 Ų99.852%0.52352%0.521SS..Hα-helixtrans-60.1-46.9171.7-180178.7-14.700111.1D240 N246 S247 E248D240-Q244 WeakPolarHBondContact O-CB 3.43Å; D240-Q244 PolarHBondContact O-N 2.84Å; Q244-N246 VanDerWaalsContact C-N 3.33Å; Q244-N246 PolarHBondContact O-N 3.43Å; Q244-S247 PolarHBondContact O-N 3.34Å; Q244-S247 PolarHBondContact O-OG 2.92Å; Q244-E248 HydrophobicContact CG-CG 4.4Å; Q244-E248 WeakPolarHBondContact CG-OE1 3.34Å; Q244-E248 PolarHBondContact NE2-OE1 3.28Å; Q244-E248 WeakPolarHBondContact O-CB 3.47Å; Q244-E248 WeakPolarHBondContact O-CG 3.36Å; Q244-E248 PolarHBondContact O-N 2.9Å
245R83.6Confident77Confident169 Ų169103.2 Ų103.264%0.63854%0.54SS*.Hα-helixtrans-60-44.2178.1-171.2-177.1-175.4133.85112V241 A242 S247 E248 D249V241-R245 WeakPolarHBondContact O-CB 3.4Å; V241-R245 PolarHBondContact O-N 3.36Å; A242-R245 PolarHBondContact O-N 3.07Å; R245-S247 PolarHBondContact O-N 3.5Å; R245-E248 PolarHBondContact O-N 3.17Å; R245-D249 IonicContact NE-OD2 3.77Å; R245-D249 PolarHBondContact O-N 2.94Å
246N78.9Confident74.3Confident112 Ų112105.2 Ų105.260%0.59955%0.552SS**Hα-helixtrans-63.6-38.8177.9-74.9-23.5000112.3A242 Q243 Q244 M250A242-N246 WeakPolarHBondContact O-CB 3.4Å; A242-N246 VanDerWaalsContact O-CG 3.32Å; A242-N246 PolarHBondContact O-N 2.96Å; A242-N246 PolarHBondContact O-ND2 3.12Å; Q243-N246 PolarHBondContact O-N 2.94Å; Q244-N246 VanDerWaalsContact C-N 3.33Å; Q244-N246 PolarHBondContact O-N 3.43Å; N246-M250 WeakPolarHBondContact O-CB 3.49Å; N246-M250 WeakPolarHBondContact O-CG 3.46Å; N246-M250 PolarHBondContact O-N 3.26Å
247S77.4Confident71.3Confident66 Ų66107.3 Ų107.346%0.46256%0.564SS.*Hα-helixtrans-72-34.9176.768.80000112.4Q243 Q244 R245 S251Q243-S247 PolarHBondContact O-N 3.25Å; Q243-S247 PolarHBondContact O-OG 2.85Å; Q244-S247 PolarHBondContact O-N 3.34Å; Q244-S247 PolarHBondContact O-OG 2.92Å; R245-S247 PolarHBondContact O-N 3.5Å; S247-S251 VanDerWaalsContact O-CB 3.3Å; S247-S251 WeakPolarHBondContact O-CB 3.46Å; S247-S251 PolarHBondContact O-N 3.02Å; S247-S251 PolarHBondContact O-OG 3.14Å
248E65.8Low69.6Low83 Ų83106.3 Ų106.339%0.38857%0.572SS.*Hα-helixtrans-67.7-43.5173.8-76.3-177.8-158.600112.9Q244 R245 S251 K252Q244-E248 HydrophobicContact CG-CG 4.4Å; Q244-E248 WeakPolarHBondContact CG-OE1 3.34Å; Q244-E248 PolarHBondContact NE2-OE1 3.28Å; Q244-E248 WeakPolarHBondContact O-CB 3.47Å; Q244-E248 WeakPolarHBondContact O-CG 3.36Å; Q244-E248 PolarHBondContact O-N 2.9Å; R245-E248 PolarHBondContact O-N 3.17Å; E248-S251 PolarHBondContact O-N 2.72Å; E248-K252 WeakPolarHBondContact O-CE 3.48Å; E248-K252 VanDerWaalsContact O-CG 3.29Å; E248-K252 WeakPolarHBondContact O-CG 3.46Å; E248-K252 PolarHBondContact O-N 3.48Å; E248-K252 IonicContact OE2-NZ 3.79Å
249D58.8Low66.6Low58 Ų58105.2 Ų105.231%0.3158%0.579SS.*Hα-helixtrans-71.2-35.3179-73.4-16.8000111.4R245 K252 M253R245-D249 IonicContact NE-OD2 3.77Å; R245-D249 PolarHBondContact O-N 2.94Å; D249-K252 PolarHBondContact O-N 3.49Å; D249-K252 IonicContact OD1-NZ 2.76Å; D249-K252 PolarHBondContact OD1-NZ 3.04Å; D249-M253 WeakPolarHBondContact O-CG 3.5Å; D249-M253 PolarHBondContact O-N 2.92Å; D249-M253 VanDerWaalsContact O-N 3.11Å
250M56Low63.7Low99 Ų99113.4 Ų113.449%0.48860%0.6SS.*Hα-helixtrans-62.5-41.4167.2-70.9-72.7-81.900112N246 K252 M253 F254N246-M250 WeakPolarHBondContact O-CB 3.49Å; N246-M250 WeakPolarHBondContact O-CG 3.46Å; N246-M250 PolarHBondContact O-N 3.26Å; M250-K252 VanDerWaalsContact C-N 3.29Å; M250-K252 PolarHBondContact O-N 3.28Å; M250-M253 HydrophobicContact CG-CE 4.42Å; M250-M253 PolarHBondContact O-N 3.48Å; M250-M253 VanDerWaalsContact O-N 3.16Å; M250-M253 HydrophobicContact SD-CE 3.62Å; M250-F254 HydrophobicContact CE-CE2 3.98Å; M250-F254 PolarHBondContact O-N 2.91Å
251S56.6Low60.7Low80 Ų80113.8 Ų113.856%0.55961%0.611SS**Hα-helixtrans-65.4-29.4176.4-60.20000113S247 E248S247-S251 VanDerWaalsContact O-CB 3.3Å; S247-S251 WeakPolarHBondContact O-CB 3.46Å; S247-S251 PolarHBondContact O-N 3.02Å; S247-S251 PolarHBondContact O-OG 3.14Å; E248-S251 PolarHBondContact O-N 2.72Å
252K53Low57.8Low123 Ų123117 Ų11754%0.53562%0.624SS.*Hα-helixtrans-72.4-35.7172.4-68.3160.2-151.81570111.8E248 D249 M250E248-K252 WeakPolarHBondContact O-CE 3.48Å; E248-K252 VanDerWaalsContact O-CG 3.29Å; E248-K252 WeakPolarHBondContact O-CG 3.46Å; E248-K252 PolarHBondContact O-N 3.48Å; E248-K252 IonicContact OE2-NZ 3.79Å; D249-K252 PolarHBondContact O-N 3.49Å; D249-K252 IonicContact OD1-NZ 2.76Å; D249-K252 PolarHBondContact OD1-NZ 3.04Å; M250-K252 VanDerWaalsContact C-N 3.29Å; M250-K252 PolarHBondContact O-N 3.28Å
253M51.5Low55.9Low124 Ų124119.7 Ų119.761%0.61164%0.637SS**Hα-helixtrans-76.4-32178.2-69.8-171.1-67.200113.9D249 M250 N255D249-M253 WeakPolarHBondContact O-CG 3.5Å; D249-M253 PolarHBondContact O-N 2.92Å; D249-M253 VanDerWaalsContact O-N 3.11Å; M250-M253 HydrophobicContact CG-CE 4.42Å; M250-M253 PolarHBondContact O-N 3.48Å; M250-M253 VanDerWaalsContact O-N 3.16Å; M250-M253 HydrophobicContact SD-CE 3.62Å; M253-N255 PolarHBondContact O-N 3.42Å; M253-N255 VanDerWaalsContact O-N 3.12Å
254F47.9Very low53Low147 Ų147119.8 Ų119.865%0.64564%0.637SS**THydrogen-bonded Turntrans-75.56.1-174.4-99.5-84.2000116.3M250 V256M250-F254 HydrophobicContact CE-CE2 3.98Å; M250-F254 PolarHBondContact O-N 2.91Å; F254-V256 PolarHBondContact O-N 2.83Å
255N43.5Very low50.3Low146 Ų146122.9 Ų122.978%0.78165%0.649SS**THydrogen-bonded Turntrans-77.57.2170.3-91.6-54.1000114.2M253M253-N255 PolarHBondContact O-N 3.42Å; M253-N255 VanDerWaalsContact O-N 3.12Å
256V41.5Very low47.6Very low124 Ų124118.4 Ų118.475%0.75266%0.655SS**SBendtrans-136.8137.3174.5-175.50000111.3F254F254-V256 PolarHBondContact O-N 2.83Å
257S33.1Very low45.4Very low92 Ų92118 Ų11864%0.64367%0.668SS**  trans-171.1163.3175.1-86.40000110.5
258P61.2Low43.4Very low124 Ų124119.8 Ų119.881%0.80569%0.686SS**  cis-136.6165.2-26.738.6-23.8000114
259A32.3Very low41.8Very low90 Ų90120.5 Ų120.574%0.74471%0.706SS**  trans175.3135.6146.800000116.1
260R33.4Very low40.4Very low245 Ų245123.3 Ų123.393%0.92573%0.729SS**  trans55.2153.1140.8-69.4177.1176.7164.7-0.5120.1
261S33.3Very low39.3Very low111 Ų111123.9 Ų123.978%0.77674%0.741SS**  cis-163.8170.1-540.30000112.4
262L33.4Very low38.2Very low161 Ų161129.5 Ų129.584%0.84375%0.75SS**  trans-70.5179.1169.2-110.477.8000113.3
263P52.5Low37.3Very low105 Ų105134.2 Ų134.268%0.68277%0.765SS**  cis-142.2179.6843.2-24.1000119.3
264E30.5Very low36.4Very low145 Ų145136.3 Ų136.368%0.67877%0.771SS**  trans64.3134.5145.9-75.9-142.2130.700127
265K32Very low35.6Very low177 Ų177136 Ų13677%0.7777%0.771SS**  trans57.5132141.3-68.4176.7176.3121.50123.1
266G27.6Very low35Very low74 Ų74139.5 Ų139.576%0.76377%0.774SS**  trans142.775.9131.900000122.8
267A32.2Very low34.7Very low105 Ų105141.6 Ų141.687%0.86877%0.772SS**  trans55.8150.4141.400000125
268A35.1Very low34.5Very low103 Ų103142.6 Ų142.685%0.85178%0.775SS**  trans67.6150.8161.700000118.7
269A33Very low32.9Very low97 Ų97144.2 Ų144.280%0.80278%0.775SS**  cis-168.2164-23.800000108
270C29.5Very low32.7Very low117 Ų117145.2 Ų145.279%0.79178%0.777SS**  cis-129.3-120.7-0.7-152.20000109.6
271C33.2Very low32.8Very low111 Ų111140.2 Ų140.275%0.7577%0.768SS**  cis-142.8128-8.8-157.20000112.9
272R33.6Very low33.1Very low198 Ų198142.7 Ų142.775%0.74777%0.767SS**  trans22.2110.9161.3-59.3-167.5179-132.5-2.6122.6
273R32.3Very low33.3Very low222 Ų222142.9 Ų142.984%0.83876%0.764SS**  61131.7126.1-63.3-176.1178.4-177.3-2.7119.5
274K33Very low32.2Very low169 Ų169144.5 Ų144.574%0.73577%0.767SS**  cis76.3120.435.4-164.8169.8-177.2177.40111.9
275E31.6Very low32.5Very low140 Ų140141.5 Ų141.565%0.65476%0.762SS**  cis-159.7173.413.5-138.9161.8-16600114.1
276R31.8Very low32.7Very low220 Ų220141.5 Ų141.583%0.8377%0.765SS**  trans1.8155.7146.5-74.5176.8173.5-163-2.7120.9
277K33.4Very low33.3Very low167 Ų167145.4 Ų145.473%0.72677%0.765SS**  cis-175.5131.4-1.7154.4178.8173.6-1740111.7
278T30.5Very low33.8Very low113 Ų113146.9 Ų146.969%0.69376%0.759SS**  trans58.1174.7165.851.70000117.3
279I27.3Very low33.7Very low158 Ų158146.6 Ų146.681%0.8176%0.756SS**  cis-152171.812.1-7.8173.3000111.7
280S27.7Very low33.9Very low111 Ų111149.9 Ų149.978%0.77676%0.755SS**  trans87.8155.6151.4-148.80000120.6
281D34.9Very low34.8Very low140 Ų140149.4 Ų149.475%0.74975%0.75SS**  trans-103.3177.7-173.2-54.6-85.7000115.1
282E40.5Very low34.8Very low163 Ų163148.2 Ų148.276%0.76274%0.743SS**  trans121.1131.6144.4-62.4-56.6172.900122.7
283E38.1Very low34.5Very low166 Ų166145.1 Ų145.178%0.77675%0.746SS**  trans54.8157.7155.2-60.7-175.6118.500121.2
284N28.5Very low34.6Very low138 Ų138139.3 Ų139.374%0.73874%0.74SS**  cis-151-179.713.8-155.94.6000115.4
285S37.4Very low34.7Very low82 Ų82139.7 Ų139.757%0.57374%0.744SS**  trans-56.8165.5-174.1600000120.8
286E36.6Very low34.9Very low178 Ų178141.7 Ų141.783%0.83275%0.754SS**  -171.5145.781.6-108.3-1809500117.9
287M40.2Very low35.2Very low155 Ų155139.7 Ų139.776%0.76475%0.753SS**  trans55101.2137.7-141.165.8-175.400126.4
288D41.3Very low35.2Very low137 Ų137138.2 Ų138.273%0.73376%0.758SS**  38129.8120.3-154.32.8000124.7
289A34.4Very low35.8Very low97 Ų97139.1 Ų139.180%0.80277%0.766SS**  trans175.3129.413700000115.5
290E37Very low36.5Very low166 Ų166134.8 Ų134.878%0.77676%0.76SS**  trans-84.1174.7166.9-90.4-75.9133.200111.8S292E290-S292 PolarHBondContact OE2-N 2.98Å
291P47.5Very low37.5Very low107 Ų107134.9 Ų134.970%0.69576%0.761SS**  cis-154.4161.73544.1-21.4000123.2
292S32.7Very low38.6Very low86 Ų86133.7 Ų133.760%0.60175%0.754SS**  trans77.5146.613469.40000124.9E290E290-S292 PolarHBondContact OE2-N 2.98Å
293T29.1Very low39.8Very low132 Ų132130.9 Ų130.981%0.8175%0.745SS**  trans64.7138165.255.10000118.3
294S33Very low41.3Very low100 Ų100129.4 Ų129.470%0.69974%0.741SS**  cis-172.3-172.5-14.143.20000107.5
295E34.9Very low43.2Very low178 Ų178127.2 Ų127.283%0.83273%0.732SS**  cis-141.6-113.316.8-63174.2105.400112.5
296E35.8Very low45Very low182 Ų182126.2 Ų126.285%0.8572%0.72SS**  trans-82.2172.7-172.5-67.1171.6135.300116
297E38.6Very low46.9Very low177 Ų177121.6 Ų121.683%0.82770%0.699SS**  cis-171.3112.4-34-175.2-174.8-118.200109.1
298V33.9Very low48.3Very low136 Ų136120 Ų12082%0.82469%0.691SS**  trans-151.4134.1163.51790000107.4G300V298-G300 PolarHBondContact O-N 3.22Å
299P43.2Very low49.9Very low132 Ų132118.8 Ų118.886%0.85768%0.679SS**  trans-71.4100.6-169.727.1-35.6000113.5
300G41.7Very low52.1Low67 Ų67119.5 Ų119.569%0.69166%0.661SS**  trans-82.5142.916600000112.1V298 L302V298-G300 PolarHBondContact O-N 3.22Å; G300-L302 PolarHBondContact O-N 3.34Å
301S49.1Very low53.7Low114 Ų114116.3 Ų116.380%0.79765%0.647SS**  trans-3.7113.8167540000117.5
302L56.4Low54.7Low115 Ų115116.7 Ų116.760%0.60264%0.643SS**  trans-56.7142.2155.2-75.1168.6000109.2G300G300-L302 PolarHBondContact O-N 3.34Å
303N66.6Low56.5Low104 Ų104117.2 Ų117.256%0.55664%0.639SS**  trans-64.5143.3175.2-58.2-60.7000109.6T305 D306 E307N303-T305 PolarHBondContact O-N 2.9Å; N303-T305 VanDerWaalsContact O-N 3.09Å; N303-D306 PolarHBondContact ND2-OD2 3.23Å; N303-D306 PolarHBondContact O-N 2.92Å; N303-E307 PolarHBondContact O-N 3.36Å
304I68.4Low58.6Low135 Ų135115.6 Ų115.669%0.69262%0.622SS**Hα-helixtrans-51.5-37.6176.3-68.1171000111.1D306 E307 M308I304-D306 VanDerWaalsContact C-N 3.3Å; I304-D306 PolarHBondContact O-N 3.1Å; I304-E307 PolarHBondContact O-N 2.84Å; I304-M308 HydrophobicContact CG2-CG 4.26Å; I304-M308 HydrophobicContact CG2-SD 4.13Å; I304-M308 WeakPolarHBondContact O-CB 3.44Å; I304-M308 VanDerWaalsContact O-CG 3.29Å; I304-M308 WeakPolarHBondContact O-CG 3.3Å; I304-M308 PolarHBondContact O-N 3.47Å
305T69.9Low60.1Low92 Ų92116 Ų11656%0.56462%0.616SS**Hα-helixtrans-59.5-37.1176.1-41.20000113.4N303 K309N303-T305 PolarHBondContact O-N 2.9Å; N303-T305 VanDerWaalsContact O-N 3.09Å; T305-K309 VanDerWaalsContact O-CG 3.26Å; T305-K309 WeakPolarHBondContact O-CG 3.38Å; T305-K309 PolarHBondContact O-N 2.58Å; T305-K309 VanDerWaalsContact O-N 3.17Å
306D74.6Confident61.3Low60 Ų60116.2 Ų116.232%0.32161%0.609SS.*Hα-helixtrans-87.7-30.8-177.1-57.2-45.1000111.4N303 I304 K309 R310N303-D306 PolarHBondContact ND2-OD2 3.23Å; N303-D306 PolarHBondContact O-N 2.92Å; I304-D306 VanDerWaalsContact C-N 3.3Å; I304-D306 PolarHBondContact O-N 3.1Å; D306-K309 PolarHBondContact O-N 3.49Å; D306-K309 IonicContact OD1-NZ 2.73Å; D306-K309 PolarHBondContact OD1-NZ 3.24Å; D306-R310 WeakPolarHBondContact O-CB 3.39Å; D306-R310 PolarHBondContact O-N 2.93Å
307E76.3Confident62.4Low82 Ų82115.2 Ų115.238%0.38360%0.604SS.*Hα-helixtrans-67.2-40.2167.6-175.3127.1-109.900112N303 I304 R310 M311N303-E307 PolarHBondContact O-N 3.36Å; I304-E307 PolarHBondContact O-N 2.84Å; E307-R310 WeakPolarHBondContact O-CB 3.45Å; E307-R310 PolarHBondContact O-N 3.34Å; E307-R310 IonicContact OE1-CZ 3.59Å; E307-R310 IonicContact OE1-NE 3.59Å; E307-R310 IonicContact OE1-NH2 3.37Å; E307-R310 PolarHBondContact OE1-NH2 3.2Å; E307-M311 WeakPolarHBondContact O-CG 3.35Å; E307-M311 PolarHBondContact O-N 2.78Å
308M70.4Confident63.2Low120 Ų120111.5 Ų111.559%0.59159%0.594SS**Hα-helixtrans-63.5-41.9172.5-75.5-173.276.800112I304 R310 M311 L312I304-M308 HydrophobicContact CG2-CG 4.26Å; I304-M308 HydrophobicContact CG2-SD 4.13Å; I304-M308 WeakPolarHBondContact O-CB 3.44Å; I304-M308 VanDerWaalsContact O-CG 3.29Å; I304-M308 WeakPolarHBondContact O-CG 3.3Å; I304-M308 PolarHBondContact O-N 3.47Å; M308-R310 VanDerWaalsContact C-N 3.33Å; M308-R310 PolarHBondContact O-N 2.69Å; M308-M311 PolarHBondContact O-N 2.9Å; M308-L312 WeakPolarHBondContact O-CB 3.4Å; M308-L312 PolarHBondContact O-N 2.96Å
309K74.1Confident64.1Low113 Ų113111.9 Ų111.949%0.49159%0.585SS.*Hα-helixtrans-60.3-42.4171-72167.1-161.8158.60111.6T305 D306 L312 N313T305-K309 VanDerWaalsContact O-CG 3.26Å; T305-K309 WeakPolarHBondContact O-CG 3.38Å; T305-K309 PolarHBondContact O-N 2.58Å; T305-K309 VanDerWaalsContact O-N 3.17Å; D306-K309 PolarHBondContact O-N 3.49Å; D306-K309 IonicContact OD1-NZ 2.73Å; D306-K309 PolarHBondContact OD1-NZ 3.24Å; K309-L312 PolarHBondContact O-N 2.88Å; K309-N313 WeakPolarHBondContact O-CB 3.42Å; K309-N313 PolarHBondContact O-N 3.08Å
310R81.2Confident64.4Low111 Ų111114.4 Ų114.442%0.41959%0.585SS.*Hα-helixtrans-61.3-44177.3-169.1-17562.767.4-2111.3D306 E307 M308 Q314D306-R310 WeakPolarHBondContact O-CB 3.39Å; D306-R310 PolarHBondContact O-N 2.93Å; E307-R310 WeakPolarHBondContact O-CB 3.45Å; E307-R310 PolarHBondContact O-N 3.34Å; E307-R310 IonicContact OE1-CZ 3.59Å; E307-R310 IonicContact OE1-NE 3.59Å; E307-R310 IonicContact OE1-NH2 3.37Å; E307-R310 PolarHBondContact OE1-NH2 3.2Å; M308-R310 VanDerWaalsContact C-N 3.33Å; M308-R310 PolarHBondContact O-N 2.69Å; R310-Q314 WeakPolarHBondContact O-CB 3.48Å; R310-Q314 PolarHBondContact O-N 3.24Å
311M70.4Confident64.5Low100 Ų100117.8 Ų117.849%0.49359%0.586SS.*Hα-helixtrans-66.4-40.5174.4-66.4-158.6-52.400112.6E307 M308 Q314 L315E307-M311 WeakPolarHBondContact O-CG 3.35Å; E307-M311 PolarHBondContact O-N 2.78Å; M308-M311 PolarHBondContact O-N 2.9Å; M311-Q314 PolarHBondContact O-N 3.16Å; M311-L315 VanDerWaalsContact O-CD1 3.32Å; M311-L315 WeakPolarHBondContact O-CD1 3.25Å; M311-L315 PolarHBondContact O-N 3.23Å
312L69.4Low64.3Low115 Ų115118.8 Ų118.860%0.60258%0.583SS**Hα-helixtrans-64.7-41.7179.1-160.385.4000111.8M308 K309 R316M308-L312 WeakPolarHBondContact O-CB 3.4Å; M308-L312 PolarHBondContact O-N 2.96Å; K309-L312 PolarHBondContact O-N 2.88Å; L312-R316 PolarHBondContact O-N 3.49Å
313N70.2Confident64Low96 Ų96119.9 Ų119.951%0.51359%0.589SS.*Hα-helixtrans-67.7-39.9172.6-74.63.1000111.2K309 L315 R316 E317K309-N313 WeakPolarHBondContact O-CB 3.42Å; K309-N313 PolarHBondContact O-N 3.08Å; N313-L315 VanDerWaalsContact C-N 3.34Å; N313-L315 PolarHBondContact O-N 2.97Å; N313-R316 CarbonylContact O-C 3.58Å; N313-R316 WeakPolarHBondContact O-CB 3.39Å; N313-R316 PolarHBondContact O-N 3.48Å; N313-R316 VanDerWaalsContact O-N 3.14Å; N313-E317 WeakPolarHBondContact O-CB 3.41Å; N313-E317 PolarHBondContact O-N 3.4Å
314Q71.6Confident63.1Low98 Ų98119.9 Ų119.946%0.45859%0.589SS.*Hα-helixtrans-66.1-34.7178.6-168.5159.916.300112.2R310 M311 E317 T318R310-Q314 WeakPolarHBondContact O-CB 3.48Å; R310-Q314 PolarHBondContact O-N 3.24Å; M311-Q314 PolarHBondContact O-N 3.16Å; Q314-E317 PolarHBondContact O-N 2.98Å; Q314-T318 PolarHBondContact O-N 3.46Å; Q314-T318 PolarHBondContact O-OG1 2.66Å
315L64.8Low62.2Low110 Ų110118.3 Ų118.358%0.57659%0.589SS**Hα-helixtrans-61.8-45.2169.3-98.976.5000111.8M311 N313 E317 T318 F319M311-L315 VanDerWaalsContact O-CD1 3.32Å; M311-L315 WeakPolarHBondContact O-CD1 3.25Å; M311-L315 PolarHBondContact O-N 3.23Å; N313-L315 VanDerWaalsContact C-N 3.34Å; N313-L315 PolarHBondContact O-N 2.97Å; L315-E317 PolarHBondContact O-N 2.96Å; L315-T318 PolarHBondContact O-N 3.43Å; L315-T318 PolarHBondContact O-OG1 3.48Å; L315-F319 PolarHBondContact O-N 2.91Å; L315-F319 VanDerWaalsContact O-N 3.09Å
316R61Low61.1Low182 Ų182121 Ų12169%0.68760%0.6SS**Hα-helixtrans-60.9-31.9175.6-178.1-171.4-60-78.6-3.4112.6L312 N313L312-R316 PolarHBondContact O-N 3.49Å; N313-R316 CarbonylContact O-C 3.58Å; N313-R316 WeakPolarHBondContact O-CB 3.39Å; N313-R316 PolarHBondContact O-N 3.48Å; N313-R316 VanDerWaalsContact O-N 3.14Å
317E58.3Low59.6Low160 Ų160122.1 Ų122.175%0.74861%0.612SS**Hα-helixtrans-91.8-18.2-175.7-159.4169.9-130.500113N313 Q314 L315N313-E317 WeakPolarHBondContact O-CB 3.41Å; N313-E317 PolarHBondContact O-N 3.4Å; Q314-E317 PolarHBondContact O-N 2.98Å; L315-E317 PolarHBondContact O-N 2.96Å
318T55.5Low58.1Low100 Ų100123.9 Ų123.961%0.61362%0.624SS**Hα-helixtrans-94-16.3170.853.70000114.6Q314 L315Q314-T318 PolarHBondContact O-N 3.46Å; Q314-T318 PolarHBondContact O-OG1 2.66Å; L315-T318 PolarHBondContact O-N 3.43Å; L315-T318 PolarHBondContact O-OG1 3.48Å
319F52.4Low56.8Low143 Ų143123.7 Ų123.763%0.62763%0.63SS**  trans-101.188.4166.5-81.8-88.7000108.7L315 I321L315-F319 PolarHBondContact O-N 2.91Å; L315-F319 VanDerWaalsContact O-N 3.09Å; F319-I321 HydrophobicContact CB-CD1 4.46Å; F319-I321 HydrophobicContact CB-CG1 4.37Å; F319-I321 PolarHBondContact O-N 2.74Å
320E49.6Very low55.6Low185 Ų185128.2 Ų128.286%0.86464%0.644SS**  trans-65.576.8159.6-69.4-180149.300108.4
321I43.4Very low54Low139 Ų139130.7 Ų130.771%0.71366%0.66SS**  trans-85.8108.7156.4-63.3169.3000104F319 D323F319-I321 HydrophobicContact CB-CD1 4.46Å; F319-I321 HydrophobicContact CB-CG1 4.37Å; F319-I321 PolarHBondContact O-N 2.74Å; I321-D323 PolarHBondContact O-N 3.49Å
322D46.2Very low52.9Low135 Ų135134.2 Ų134.272%0.72268%0.675SS**  trans-55.4122.9173.9-73.3-62.9000109.3D324D322-D324 PolarHBondContact O-N 2.99Å
323D50.2Low51.8Low138 Ų138132.5 Ų132.574%0.73867%0.667SS**  trans-81.357.2-176.5-151.6-8.4000110.1I321 C325I321-D323 PolarHBondContact O-N 3.49Å; D323-C325 PolarHBondContact O-N 2.96Å
324D46.5Very low51Low104 Ų104135.6 Ų135.656%0.55668%0.678SS**G310 helixtrans-66.77.4-177.6-111.8-27.5000113.3D322 D326 S327D322-D324 PolarHBondContact O-N 2.99Å; D324-D326 PolarHBondContact O-N 3.3Å; D324-S327 WeakPolarHBondContact O-CB 3.43Å; D324-S327 PolarHBondContact O-N 3.07Å; D324-S327 WeakPolarHBondContact OD1-CB 3.27Å; D324-S327 PolarHBondContact OD1-OG 3.07Å
325C49.3Very low50Low102 Ų102136.2 Ų136.269%0.68969%0.685SS**G310 helixtrans-58.1-27.9172.9-91.50000113.3D323D323-C325 PolarHBondContact O-N 2.96Å
326D47.8Very low49.4Very low149 Ų149134.3 Ų134.380%0.79768%0.678SS**G310 helixtrans-85.7-13.1175-83.7-2.6000113.6D324 L328D324-D326 PolarHBondContact O-N 3.3Å; D326-L328 VanDerWaalsContact C-N 3.25Å; D326-L328 PolarHBondContact O-N 3.11Å
327S43.9Very low48.8Very low82 Ų82130.5 Ų130.557%0.57367%0.67SS**THydrogen-bonded Turntrans-73.7-16.9174.8-70.70000112.8D324 T329D324-S327 WeakPolarHBondContact O-CB 3.43Å; D324-S327 PolarHBondContact O-N 3.07Å; D324-S327 WeakPolarHBondContact OD1-CB 3.27Å; D324-S327 PolarHBondContact OD1-OG 3.07Å; S327-T329 VanDerWaalsContact C-N 3.29Å; S327-T329 PolarHBondContact O-N 3.3Å
328L43.8Very low48.4Very low120 Ų120127.9 Ų127.963%0.62866%0.661SS**  trans-89.958.7169.7-79.8166.6000111.5D326 W330D326-L328 VanDerWaalsContact C-N 3.25Å; D326-L328 PolarHBondContact O-N 3.11Å; L328-W330 VanDerWaalsContact C-N 3.3Å; L328-W330 VanDerWaalsContact O-CD1 3.23Å; L328-W330 PolarHBondContact O-N 2.96Å
329T43.9Very low48Very low116 Ų116128.7 Ų128.771%0.71266%0.661SS**  trans-62.599.3149.750.80000107.6S327 E331S327-T329 VanDerWaalsContact C-N 3.29Å; S327-T329 PolarHBondContact O-N 3.3Å; T329-E331 PolarHBondContact O-N 3.3Å
330W47.5Very low47.5Very low208 Ų208131 Ų13179%0.78867%0.665SS**  trans-59.7100.2177.5-71.577.4000109.8L328 E332L328-W330 VanDerWaalsContact C-N 3.3Å; L328-W330 VanDerWaalsContact O-CD1 3.23Å; L328-W330 PolarHBondContact O-N 2.96Å; W330-E332 PolarHBondContact O-N 3.42Å
331E47.4Very low47.5Very low163 Ų163128 Ų12876%0.76265%0.651SS**  trans-67.6119.5159-72.5-164.1120.800107.5T329 N333T329-E331 PolarHBondContact O-N 3.3Å; E331-N333 PolarHBondContact O-N 3.04Å
332E47.9Very low47.7Very low173 Ų173125.9 Ų125.981%0.80864%0.641SS**  trans-72.273.2175.8-66.3-178.4129.600109.7W330 E334W330-E332 PolarHBondContact O-N 3.42Å; E332-E334 PolarHBondContact O-N 3Å
333N46.1Very low47.3Very low80 Ų80127.3 Ų127.343%0.42864%0.642SS.*  trans-56.3128.1168.5-99.872.4000109.5E331 D335 T336E331-N333 PolarHBondContact O-N 3.04Å; N333-D335 PolarHBondContact ND2-OD2 2.92Å; N333-D335 PolarHBondContact O-N 3.5Å; N333-D335 VanDerWaalsContact O-N 3.11Å; N333-T336 WeakPolarHBondContact O-CB 3.27Å; N333-T336 PolarHBondContact O-N 2.93Å
334E53.5Low47.2Very low161 Ų161125 Ų12575%0.75263%0.633SS**Hα-helixtrans-58.7-26.3177.4-62.4-173.6165.400111.6E332 T336 L337 L338E332-E334 PolarHBondContact O-N 3Å; E334-T336 VanDerWaalsContact C-N 3.29Å; E334-T336 PolarHBondContact O-N 3.49Å; E334-L337 PolarHBondContact O-N 3.5Å; E334-L338 PolarHBondContact O-N 3.39Å
335D50.1Low47.1Very low111 Ų111125.5 Ų125.559%0.59464%0.635SS**Hα-helixtrans-59-34.3172.2-45.8-72.2000113.4N333N333-D335 PolarHBondContact ND2-OD2 2.92Å; N333-D335 PolarHBondContact O-N 3.5Å; N333-D335 VanDerWaalsContact O-N 3.11Å
336T53.4Low47Very low70 Ų70130.3 Ų130.343%0.42964%0.641SS.*Hα-helixtrans-78.4-30.4-179.1-52.10000111.7N333 E334 L339N333-T336 WeakPolarHBondContact O-CB 3.27Å; N333-T336 PolarHBondContact O-N 2.93Å; E334-T336 VanDerWaalsContact C-N 3.29Å; E334-T336 PolarHBondContact O-N 3.49Å; T336-L339 PolarHBondContact O-N 2.88Å
337L48.7Very low46.9Very low101 Ų101129.6 Ų129.653%0.52964%0.637SS.*Hα-helixtrans-69.6-39176.7-71.1165.6000111.6E334 L339 W340 E341E334-L337 PolarHBondContact O-N 3.5Å; L337-L339 PolarHBondContact O-N 3.48Å; L337-W340 PolarHBondContact O-N 2.92Å; L337-W340 VanDerWaalsContact O-N 3.09Å; L337-E341 PolarHBondContact O-N 3.46Å
338L48.3Very low47.1Very low106 Ų106129.3 Ų129.356%0.55563%0.627SS**Hα-helixtrans-55.9-37.6175.8-73.2169.4000112.7E334 W340 E341 D342E334-L338 PolarHBondContact O-N 3.39Å; L338-W340 VanDerWaalsContact C-N 3.27Å; L338-W340 PolarHBondContact O-N 2.97Å; L338-E341 PolarHBondContact O-N 2.91Å; L338-D342 PolarHBondContact O-N 3.42Å
339L47.8Very low47.1Very low117 Ų117128.7 Ų128.761%0.61363%0.63SS**Hα-helixtrans-67.3-26.2-179.5-146.179.5000113.3T336 L337T336-L339 PolarHBondContact O-N 2.88Å; L337-L339 PolarHBondContact O-N 3.48Å
340W42.5Very low47Very low190 Ų190127.8 Ų127.872%0.7263%0.628SS**Hα-helixtrans-85.3-30.7177-79.176000112.8L337 L338 D342 F343 T344L337-W340 PolarHBondContact O-N 2.92Å; L337-W340 VanDerWaalsContact O-N 3.09Å; L338-W340 VanDerWaalsContact C-N 3.27Å; L338-W340 PolarHBondContact O-N 2.97Å; W340-D342 VanDerWaalsContact C-N 3.35Å; W340-D342 PolarHBondContact O-N 3.23Å; W340-F343 PolarHBondContact O-N 3.39Å; W340-T344 PolarHBondContact O-N 3.03Å
341E49Very low46.6Very low123 Ų123122.5 Ų122.558%0.57562%0.619SS**Hα-helixtrans-60.8-44.4174.2-66.4-162.1146.100111L337 L338 F343 T344 N345L337-E341 PolarHBondContact O-N 3.46Å; L338-E341 PolarHBondContact O-N 2.91Å; E341-F343 PolarHBondContact O-N 3.24Å; E341-T344 PolarHBondContact O-N 3.15Å; E341-T344 PolarHBondContact O-OG1 3.44Å; E341-N345 PolarHBondContact O-N 2.97Å; E341-N345 PolarHBondContact O-ND2 3.38Å
342D47.4Very low46.2Very low94 Ų94120.8 Ų120.850%0.50361%0.613SS.*Hα-helixtrans-59.7-46.1177.6-81.9-21.2000113.1L338 W340 T344 N345 Y346L338-D342 PolarHBondContact O-N 3.42Å; W340-D342 VanDerWaalsContact C-N 3.35Å; W340-D342 PolarHBondContact O-N 3.23Å; D342-T344 VanDerWaalsContact C-N 3.25Å; D342-T344 PolarHBondContact O-N 2.94Å; D342-N345 PolarHBondContact O-N 3.12Å; D342-N345 VanDerWaalsContact O-N 3.14Å; D342-Y346 WeakPolarHBondContact O-CD2 3.06Å; D342-Y346 PolarHBondContact O-N 3.48Å
343F38.3Very low45.7Very low165 Ų165115.8 Ų115.872%0.72460%0.601SS**Hα-helixtrans-62.8-30.3177.3-95.6-83.8000113.1W340 E341W340-F343 PolarHBondContact O-N 3.39Å; E341-F343 PolarHBondContact O-N 3.24Å
344T48.6Very low45.4Very low91 Ų91115.4 Ų115.456%0.55861%0.61SS**Hα-helixtrans-77.7-32173.763.70000113.2W340 E341 D342 N347W340-T344 PolarHBondContact O-N 3.03Å; E341-T344 PolarHBondContact O-N 3.15Å; E341-T344 PolarHBondContact O-OG1 3.44Å; D342-T344 VanDerWaalsContact C-N 3.25Å; D342-T344 PolarHBondContact O-N 2.94Å; T344-N347 PolarHBondContact O-N 3.46Å
345N44.4Very low44.6Very low113 Ų113113.4 Ų113.460%0.60461%0.608SS**Hα-helixtrans-66.9-36.6179.1-84.8-35.6000113.2E341 D342 N347E341-N345 PolarHBondContact O-N 2.97Å; E341-N345 PolarHBondContact O-ND2 3.38Å; D342-N345 PolarHBondContact O-N 3.12Å; D342-N345 VanDerWaalsContact O-N 3.14Å; N345-N347 VanDerWaalsContact C-N 3.33Å; N345-N347 PolarHBondContact O-N 3.03Å
346Y47.3Very low43.9Very low204 Ų204113.7 Ų113.780%0.861%0.614SS**Hα-helixtrans-74.6-19.7178.8-79.1-74.8000114.2D342 M348D342-Y346 WeakPolarHBondContact O-CD2 3.06Å; D342-Y346 PolarHBondContact O-N 3.48Å; Y346-M348 PolarHBondContact O-N 3.38Å; Y346-M348 VanDerWaalsContact O-N 3.08Å
347N45.8Very low43Very low134 Ų134115 Ų11572%0.71763%0.625SS**SBendtrans-84.633.4-179.6-158.10.8000113.3T344 N345T344-N347 PolarHBondContact O-N 3.46Å; N345-N347 VanDerWaalsContact C-N 3.33Å; N345-N347 PolarHBondContact O-N 3.03Å
348M47.6Very low42.3Very low76 Ų76115.1 Ų115.137%0.37464%0.64SS.*  trans-131.773.9-175.5-105.1-53.8-61.500116.8Y346 T351 I352Y346-M348 PolarHBondContact O-N 3.38Å; Y346-M348 VanDerWaalsContact O-N 3.08Å; M348-T351 WeakPolarHBondContact CE-OG1 3.42Å; M348-T351 HydrophobicContact SD-CG2 3.7Å; M348-T351 PolarHBondContact SD-N 2.8Å; M348-T351 PolarHBondContact SD-OG1 3.02Å; M348-I352 HydrophobicContact CE-CB 4.49Å; M348-I352 HydrophobicContact CE-CD1 3.76Å; M348-I352 HydrophobicContact CE-CG1 3.79Å
349P43.1Very low41.8Very low106 Ų106114.6 Ų114.669%0.68865%0.651SS**SBendtrans-96.8-26.6146.9-14.531.9000114
350C43.2Very low41.1Very low98 Ų98113.3 Ų113.366%0.66266%0.658SS**SBendtrans-97.5-32.9-154.6-73.60000117.9I352 A353C350-I352 VanDerWaalsContact C-N 3.31Å; C350-I352 PolarHBondContact O-N 3.37Å; C350-A353 PolarHBondContact O-N 3.48Å
351T38.1Very low40.6Very low97 Ų97110.4 Ų110.460%0.59567%0.665SS**Hα-helixtrans-71.7-22.9-170.1720000114.3M348 A353 A354M348-T351 WeakPolarHBondContact CE-OG1 3.42Å; M348-T351 HydrophobicContact SD-CG2 3.7Å; M348-T351 PolarHBondContact SD-N 2.8Å; M348-T351 PolarHBondContact SD-OG1 3.02Å; T351-A353 VanDerWaalsContact C-N 3.27Å; T351-A353 PolarHBondContact O-N 3Å; T351-A354 PolarHBondContact O-N 3.28Å
352I38.5Very low40.4Very low127 Ų127110.7 Ų110.765%0.65168%0.678SS**Hα-helixtrans-67.3-27.4177.3-72.2166.4000112M348 C350 A354M348-I352 HydrophobicContact CE-CB 4.49Å; M348-I352 HydrophobicContact CE-CD1 3.76Å; M348-I352 HydrophobicContact CE-CG1 3.79Å; C350-I352 VanDerWaalsContact C-N 3.31Å; C350-I352 PolarHBondContact O-N 3.37Å; I352-A354 VanDerWaalsContact C-N 3.33Å; I352-A354 PolarHBondContact O-N 3.29Å
353A37.7Very low39.7Very low67 Ų67109.6 Ų109.655%0.55469%0.689SS**Hα-helixtrans-73.3-23178.100000113.4C350 T351C350-A353 PolarHBondContact O-N 3.48Å; T351-A353 VanDerWaalsContact C-N 3.27Å; T351-A353 PolarHBondContact O-N 3Å
354A39.8Very low39.5Very low73 Ų73111.2 Ų111.260%0.60370%0.699SS**Hα-helixtrans-77.1-30-174.700000113.5T351 I352 T356T351-A354 PolarHBondContact O-N 3.28Å; I352-A354 VanDerWaalsContact C-N 3.33Å; I352-A354 PolarHBondContact O-N 3.29Å; A354-T356 PolarHBondContact O-N 3.27Å
355T37.8Very low38.9Very low119 Ų119110.4 Ų110.473%0.7371%0.708SS**THydrogen-bonded Turntrans-84.4-10.8-167.5-360000114.4
356T35Very low38.4Very low117 Ų117110.3 Ų110.372%0.71872%0.716SS**THydrogen-bonded Turntrans-100.7-5.2-179.747.90000114.6A354A354-T356 PolarHBondContact O-N 3.27Å
357C35Very low38.2Very low98 Ų98105.9 Ų105.966%0.66272%0.722SS**  trans-105.97.3-171.7-66.30000115A359C357-A359 PolarHBondContact O-N 3.23Å
358A33.4Very low37.8Very low102 Ų102108 Ų10884%0.84373%0.727SS**THydrogen-bonded Turntrans-74.745.2-179.200000114.1
359A38.3Very low37.5Very low95 Ų95108.8 Ų108.879%0.78575%0.747SS**THydrogen-bonded Turntrans-143.213.5-170.900000115.9C357C357-A359 PolarHBondContact O-N 3.23Å
360A32Very low37.6Very low91 Ų91108.6 Ų108.675%0.75275%0.753SS**  trans-155.6110.7167.400000113.7
361C33.1Very low37.7Very low129 Ų129109.9 Ų109.987%0.87275%0.754SS**  trans-121.4149.2156-56.40000106
362P44.6Very low38.3Very low129 Ų129109.9 Ų109.984%0.83876%0.755SS**  -149.2162.16339.9-21.2000117.8
363G32.6Very low38.7Very low71 Ų71109.6 Ų109.673%0.73276%0.755SS**  trans86.5149.5160.500000115.9
364E33.1Very low39.5Very low199 Ų199108.9 Ų108.993%0.9375%0.754SS**  cis-150.9151.8-10.1-69.8-168.3113.500110.2
365G36.3Very low40.6Very low74 Ų74109.7 Ų109.776%0.76376%0.756SS**  trans85.4165.2152.200000118.8
366S33.5Very low42.1Very low110 Ų110108.8 Ų108.877%0.76975%0.746SS**  trans52.689.3163.7-56.40000118.5E368S366-E368 VanDerWaalsContact C-N 3.33Å; S366-E368 PolarHBondContact O-N 3.16Å
367A43.4Very low44.2Very low112 Ų112104.6 Ų104.693%0.92673%0.726SS**  trans-78.786148.400000108.9
368E36.9Very low46.3Very low177 Ų177103.4 Ų103.483%0.82772%0.719SS**  trans-77.2148.6160.5-75.5-174.4118.100109.6S366S366-E368 VanDerWaalsContact C-N 3.33Å; S366-E368 PolarHBondContact O-N 3.16Å
369A41.8Very low48.6Very low94 Ų94103.4 Ų103.478%0.77770%0.704SS**  trans-69.2136.9176.200000109.4D371A369-D371 PolarHBondContact O-N 2.87Å; A369-D371 VanDerWaalsContact O-N 3.14Å
370A44.8Very low50.9Low101 Ų101103 Ų10384%0.83569%0.688SS**  trans-68.8110.5173.100000109.3
371D45.2Very low53.6Low126 Ų126103.7 Ų103.767%0.67468%0.679SS**  trans-62.7123175.1-100.9-40.5000110.1A369 D373 G374A369-D371 PolarHBondContact O-N 2.87Å; A369-D371 VanDerWaalsContact O-N 3.14Å; D371-D373 PolarHBondContact O-N 3.45Å; D371-G374 PolarHBondContact O-N 2.86Å; D371-G374 VanDerWaalsContact O-N 3.17Å
372P51.5Low56.1Low96 Ų96103.2 Ų103.262%0.62366%0.664SS**Hα-helixtrans-64.9-30.1-178.626.5-33.9000112.1G374 S375 L376P372-G374 PolarHBondContact O-N 3.3Å; P372-S375 PolarHBondContact O-N 3.49Å; P372-S375 VanDerWaalsContact O-N 3.17Å; P372-L376 PolarHBondContact O-N 2.94Å; P372-L376 VanDerWaalsContact O-N 3.09Å
373D47Very low57.9Low122 Ų122100 Ų10065%0.65264%0.642SS**Hα-helixtrans-61.8-31.1176.7-74.2-10.8000112.4D371 L376 G377D371-D373 PolarHBondContact O-N 3.45Å; D373-L376 PolarHBondContact O-N 3.39Å; D373-G377 PolarHBondContact O-N 2.67Å
374G53.9Low60.4Low51 Ų51100.7 Ų100.753%0.52663%0.626SS.*Hα-helixtrans-66.9-37.917600000112.7D371 P372 S378D371-G374 PolarHBondContact O-N 2.86Å; D371-G374 VanDerWaalsContact O-N 3.17Å; P372-G374 PolarHBondContact O-N 3.3Å; G374-S378 WeakPolarHBondContact O-CB 3.43Å; G374-S378 PolarHBondContact O-N 3.37Å; G374-S378 VanDerWaalsContact O-N 3.14Å
375S64Low63Low91 Ų9195.2 Ų95.264%0.63661%0.606SS**Hα-helixtrans-73.8-36.6176.7-168.10000112.2P372 L379P372-S375 PolarHBondContact O-N 3.49Å; P372-S375 VanDerWaalsContact O-N 3.17Å; S375-L379 PolarHBondContact O-N 2.75Å
376L67.9Low65.5Low99 Ų9997.3 Ų97.352%0.51860%0.599SS.*Hα-helixtrans-72.8-42.7177.7-177.359.8000111.5P372 D373 L379 I380P372-L376 PolarHBondContact O-N 2.94Å; P372-L376 VanDerWaalsContact O-N 3.09Å; D373-L376 PolarHBondContact O-N 3.39Å; L376-L379 PolarHBondContact O-N 3.27Å; L376-I380 HydrophobicContact CD1-CD1 4.34Å; L376-I380 HydrophobicContact CG-CD1 4.04Å; L376-I380 WeakPolarHBondContact O-CG1 3.48Å; L376-I380 PolarHBondContact O-N 2.88Å
377G80.8Confident68.1Low30 Ų3099.3 Ų99.331%0.30960%0.595SS.*Hα-helixtrans-59.5-46.217500000112.3D373 L379 I380 D381D373-G377 PolarHBondContact O-N 2.67Å; G377-L379 VanDerWaalsContact C-N 3.29Å; G377-L379 PolarHBondContact O-N 3.28Å; G377-I380 PolarHBondContact O-N 2.96Å; G377-D381 PolarHBondContact O-N 2.94Å
378S78.9Confident70.3Confident73 Ų7399.2 Ų99.251%0.5157%0.573SS.*Hα-helixtrans-60.9-36.7176.1-169.80000112.9G374 E382G374-S378 WeakPolarHBondContact O-CB 3.43Å; G374-S378 PolarHBondContact O-N 3.37Å; G374-S378 VanDerWaalsContact O-N 3.14Å; S378-E382 WeakPolarHBondContact O-CB 3.28Å; S378-E382 PolarHBondContact O-N 2.59Å
379L80.8Confident72.9Confident101 Ų10193.7 Ų93.753%0.52955%0.554SS.*Hα-helixtrans-70.5-37.8177-16972.8000111.5S375 L376 G377 E382 T383S375-L379 PolarHBondContact O-N 2.75Å; L376-L379 PolarHBondContact O-N 3.27Å; G377-L379 VanDerWaalsContact C-N 3.29Å; G377-L379 PolarHBondContact O-N 3.28Å; L379-E382 PolarHBondContact O-N 2.73Å; L379-T383 WeakPolarHBondContact O-CG2 3.3Å; L379-T383 PolarHBondContact O-N 2.97Å; L379-T383 PolarHBondContact O-OG1 2.76Å
380I86.2Confident75.2Confident88 Ų8894.9 Ų94.945%0.45154%0.538SS..Hα-helixtrans-63-50.4174.3-69.1165.1000109.9L376 G377 E382 T383 E384L376-I380 HydrophobicContact CD1-CD1 4.34Å; L376-I380 HydrophobicContact CG-CD1 4.04Å; L376-I380 WeakPolarHBondContact O-CG1 3.48Å; L376-I380 PolarHBondContact O-N 2.88Å; G377-I380 PolarHBondContact O-N 2.96Å; I380-E382 VanDerWaalsContact C-N 3.3Å; I380-E382 PolarHBondContact O-N 2.86Å; I380-T383 PolarHBondContact O-N 2.92Å; I380-T383 PolarHBondContact O-OG1 2.96Å; I380-E384 WeakPolarHBondContact O-CB 3.35Å; I380-E384 PolarHBondContact O-N 3.42Å
381D88.7Confident77.4Confident104 Ų10495.9 Ų95.956%0.55653%0.526SS*.Hα-helixtrans-57.9-40.4176.3-76-19.5000112.2G377 E384 T385G377-D381 PolarHBondContact O-N 2.94Å; D381-E384 PolarHBondContact O-N 3.36Å; D381-T385 WeakPolarHBondContact O-CB 3.37Å; D381-T385 WeakPolarHBondContact O-CG2 3.33Å; D381-T385 PolarHBondContact O-N 2.89Å; D381-T385 PolarHBondContact O-OG1 2.69Å
382E86.5Confident79.7Confident119 Ų11995.4 Ų95.456%0.55652%0.518SS*.Hα-helixtrans-67.6-41.7178.1-165.4161.9-128.100111.7S378 L379 I380 T385 L386S378-E382 WeakPolarHBondContact O-CB 3.28Å; S378-E382 PolarHBondContact O-N 2.59Å; L379-E382 PolarHBondContact O-N 2.73Å; I380-E382 VanDerWaalsContact C-N 3.3Å; I380-E382 PolarHBondContact O-N 2.86Å; E382-T385 WeakPolarHBondContact CA-OG1 3.36Å; E382-T385 PolarHBondContact O-OG1 3.36Å; E382-L386 WeakPolarHBondContact O-CG 3.43Å; E382-L386 PolarHBondContact O-N 3.09Å
383T83.1Confident81.6Confident61 Ų6194.8 Ų94.837%0.37451%0.507SS..Hα-helixtrans-67.5-38.917260.30000113L379 I380 T385 L386 F387L379-T383 WeakPolarHBondContact O-CG2 3.3Å; L379-T383 PolarHBondContact O-N 2.97Å; L379-T383 PolarHBondContact O-OG1 2.76Å; I380-T383 PolarHBondContact O-N 2.92Å; I380-T383 PolarHBondContact O-OG1 2.96Å; T383-T385 PolarHBondContact O-N 2.92Å; T383-L386 PolarHBondContact O-N 2.98Å; T383-F387 WeakPolarHBondContact O-CD2 3.28Å; T383-F387 PolarHBondContact O-N 2.99Å
384E84.1Confident83.7Confident87 Ų8795 Ų9541%0.40750%0.499SS..Hα-helixtrans-66.4-37.4178.2-165.2-175.9154.300111.4I380 D381 F387 K388I380-E384 WeakPolarHBondContact O-CB 3.35Å; I380-E384 PolarHBondContact O-N 3.42Å; D381-E384 PolarHBondContact O-N 3.36Å; E384-F387 PolarHBondContact O-N 2.96Å; E384-K388 VanDerWaalsContact CD-NZ 3.33Å; E384-K388 HydrophobicContact CG-CD 4.37Å; E384-K388 WeakPolarHBondContact O-CB 3.46Å; E384-K388 VanDerWaalsContact O-CG 3.28Å; E384-K388 WeakPolarHBondContact O-CG 3.35Å; E384-K388 PolarHBondContact O-N 3.04Å; E384-K388 WeakPolarHBondContact OE1-CE 3.39Å; E384-K388 IonicContact OE1-NZ 3.18Å; E384-K388 PolarHBondContact OE1-NZ 3.41Å
385T86.9Confident85.6Confident84 Ų8498.1 Ų98.152%0.51550%0.5SS..Hα-helixtrans-69.9-35.9173.750.40000112.7D381 E382 T383 K388 S389D381-T385 WeakPolarHBondContact O-CB 3.37Å; D381-T385 WeakPolarHBondContact O-CG2 3.33Å; D381-T385 PolarHBondContact O-N 2.89Å; D381-T385 PolarHBondContact O-OG1 2.69Å; E382-T385 WeakPolarHBondContact CA-OG1 3.36Å; E382-T385 PolarHBondContact O-OG1 3.36Å; T383-T385 PolarHBondContact O-N 2.92Å; T385-K388 PolarHBondContact O-N 3.38Å; T385-S389 WeakPolarHBondContact O-CB 3.28Å; T385-S389 PolarHBondContact O-N 3.01Å
386L89.2Confident87.1Confident117 Ų11799.3 Ų99.361%0.61350%0.496SS*.Hα-helixtrans-61.5-47.5170.1-74.8168.5000111.9E382 T383 K388 S389 R390E382-L386 WeakPolarHBondContact O-CG 3.43Å; E382-L386 PolarHBondContact O-N 3.09Å; T383-L386 PolarHBondContact O-N 2.98Å; L386-K388 PolarHBondContact O-N 3.32Å; L386-S389 PolarHBondContact O-N 3.39Å; L386-R390 WeakPolarHBondContact O-CB 3.46Å; L386-R390 PolarHBondContact O-N 3.47Å
387F88.4Confident88.4Confident153 Ų15398.3 Ų98.367%0.67149%0.493SS*.Hα-helixtrans-61.6-43.8176.5-76-60.9000112.3T383 E384 S389 R390 E391T383-F387 WeakPolarHBondContact O-CD2 3.28Å; T383-F387 PolarHBondContact O-N 2.99Å; E384-F387 PolarHBondContact O-N 2.96Å; F387-S389 PolarHBondContact O-N 3.23Å; F387-R390 PolarHBondContact O-N 3.25Å; F387-E391 WeakPolarHBondContact O-CB 3.48Å; F387-E391 PolarHBondContact O-N 3.41Å
388K90.4Very high89Confident110 Ų110100.7 Ų100.748%0.47850%0.498SS..Hα-helixtrans-62.7-38.8175.1-74.7167.9-178.2165.40112.9E384 T385 L386 R390 K392E384-K388 VanDerWaalsContact CD-NZ 3.33Å; E384-K388 HydrophobicContact CG-CD 4.37Å; E384-K388 WeakPolarHBondContact O-CB 3.46Å; E384-K388 VanDerWaalsContact O-CG 3.28Å; E384-K388 WeakPolarHBondContact O-CG 3.35Å; E384-K388 PolarHBondContact O-N 3.04Å; E384-K388 WeakPolarHBondContact OE1-CE 3.39Å; E384-K388 IonicContact OE1-NZ 3.18Å; E384-K388 PolarHBondContact OE1-NZ 3.41Å; T385-K388 PolarHBondContact O-N 3.38Å; L386-K388 PolarHBondContact O-N 3.32Å; K388-R390 VanDerWaalsContact C-N 3.33Å; K388-K392 WeakPolarHBondContact O-CB 3.37Å; K388-K392 PolarHBondContact O-N 2.99Å
389S91.2Very high89.7Confident60 Ų6098.8 Ų98.842%0.4249%0.49SS..Hα-helixtrans-64.1-42.1174.3-165.80000110.8T385 L386 F387 K392 E393T385-S389 WeakPolarHBondContact O-CB 3.28Å; T385-S389 PolarHBondContact O-N 3.01Å; L386-S389 PolarHBondContact O-N 3.39Å; F387-S389 PolarHBondContact O-N 3.23Å; S389-K392 WeakPolarHBondContact O-CB 3.49Å; S389-K392 PolarHBondContact O-N 3.49Å; S389-E393 WeakPolarHBondContact O-CG 3.46Å; S389-E393 PolarHBondContact O-N 3.33Å
390R90.3Very high90.5Very high120 Ų12098.1 Ų98.145%0.45348%0.484SS..Hα-helixtrans-70.6-38.7-179.4-168.357.1175.5-178.2-0.7113.2L386 F387 K388 K392 E393 Y394L386-R390 WeakPolarHBondContact O-CB 3.46Å; L386-R390 PolarHBondContact O-N 3.47Å; F387-R390 PolarHBondContact O-N 3.25Å; K388-R390 VanDerWaalsContact C-N 3.33Å; R390-K392 VanDerWaalsContact C-N 3.32Å; R390-E393 WeakPolarHBondContact CD-OE2 3.15Å; R390-E393 IonicContact CZ-OE2 2.8Å; R390-E393 IonicContact NE-OE2 3.8Å; R390-E393 IonicContact NH1-OE2 3.65Å; R390-E393 PolarHBondContact NH1-OE2 2.83Å; R390-E393 PolarHBondContact O-N 3.16Å; R390-Y394 HydrophobicContact CG-CD2 4.38Å; R390-Y394 HydrophobicContact CG-CE2 3.78Å; R390-Y394 VanDerWaalsContact NE-CZ 3.25Å; R390-Y394 PolarHBondContact NE-OH 3.47Å; R390-Y394 PolarHBondContact NH2-OH 2.85Å; R390-Y394 VanDerWaalsContact O-CD2 3.32Å; R390-Y394 WeakPolarHBondContact O-CD2 3.46Å; R390-Y394 PolarHBondContact O-N 3.18Å; R390-Y394 VanDerWaalsContact O-N 3.1Å
391E90.1Very high91Very high122 Ų12299 Ų9957%0.5749%0.489SS*.Hα-helixtrans-58.5-45.6170.2-178.9177.9-150.500110.7F387 E393 Y394 Q395F387-E391 WeakPolarHBondContact O-CB 3.48Å; F387-E391 PolarHBondContact O-N 3.41Å; E391-E393 PolarHBondContact O-N 3.16Å; E391-Y394 PolarHBondContact O-N 3.43Å; E391-Q395 WeakPolarHBondContact O-CG 3.19Å; E391-Q395 PolarHBondContact O-N 3.17Å
392K93.5Very high91.2Very high115 Ų115100.2 Ų100.250%0.549%0.491SS..Hα-helixtrans-62.4-41.2176.9-177.2178.9172.5-67.20112.8K388 S389 R390 Y394 Q395 E396K388-K392 WeakPolarHBondContact O-CB 3.37Å; K388-K392 PolarHBondContact O-N 2.99Å; S389-K392 WeakPolarHBondContact O-CB 3.49Å; S389-K392 PolarHBondContact O-N 3.49Å; R390-K392 VanDerWaalsContact C-N 3.32Å; K392-Y394 VanDerWaalsContact C-N 3.34Å; K392-Y394 PolarHBondContact O-N 3.15Å; K392-Q395 PolarHBondContact O-N 2.92Å; K392-E396 WeakPolarHBondContact CE-OE1 3.46Å; K392-E396 VanDerWaalsContact NZ-CD 3.26Å; K392-E396 IonicContact NZ-OE1 2.6Å; K392-E396 PolarHBondContact NZ-OE1 2.86Å; K392-E396 IonicContact NZ-OE2 2.83Å; K392-E396 PolarHBondContact NZ-OE2 3.31Å; K392-E396 WeakPolarHBondContact O-CG 3.44Å; K392-E396 PolarHBondContact O-N 2.97Å
393E92.6Very high91.7Very high84 Ų8499.5 Ų99.539%0.39349%0.489SS..Hα-helixtrans-59.8-42.2173.4-74.9173.4-178.200112.2S389 R390 E391 T397S389-E393 WeakPolarHBondContact O-CG 3.46Å; S389-E393 PolarHBondContact O-N 3.33Å; R390-E393 WeakPolarHBondContact CD-OE2 3.15Å; R390-E393 IonicContact CZ-OE2 2.8Å; R390-E393 IonicContact NE-OE2 3.8Å; R390-E393 IonicContact NH1-OE2 3.65Å; R390-E393 PolarHBondContact NH1-OE2 2.83Å; R390-E393 PolarHBondContact O-N 3.16Å; E391-E393 PolarHBondContact O-N 3.16Å; E393-T397 WeakPolarHBondContact O-CB 3.35Å; E393-T397 PolarHBondContact O-N 3Å; E393-T397 PolarHBondContact O-OG1 3.49Å
394Y91.1Very high92.4Very high125 Ų125102.1 Ų102.149%0.4950%0.497SS..Hα-helixtrans-67.3-41.6176-65.4-38.2000112.2R390 E391 K392 T397 I398R390-Y394 HydrophobicContact CG-CD2 4.38Å; R390-Y394 HydrophobicContact CG-CE2 3.78Å; R390-Y394 VanDerWaalsContact NE-CZ 3.25Å; R390-Y394 PolarHBondContact NE-OH 3.47Å; R390-Y394 PolarHBondContact NH2-OH 2.85Å; R390-Y394 VanDerWaalsContact O-CD2 3.32Å; R390-Y394 WeakPolarHBondContact O-CD2 3.46Å; R390-Y394 PolarHBondContact O-N 3.18Å; R390-Y394 VanDerWaalsContact O-N 3.1Å; E391-Y394 PolarHBondContact O-N 3.43Å; K392-Y394 VanDerWaalsContact C-N 3.34Å; K392-Y394 PolarHBondContact O-N 3.15Å; Y394-T397 WeakPolarHBondContact O-CB 3.44Å; Y394-T397 PolarHBondContact O-N 3.01Å; Y394-I398 VanDerWaalsContact O-CG1 3.27Å; Y394-I398 WeakPolarHBondContact O-CG1 3.34Å; Y394-I398 PolarHBondContact O-N 3.09Å
395Q93.2Very high92.9Very high118 Ų118104 Ų10455%0.55151%0.509SS*.Hα-helixtrans-62.9-41.7175.6-68.8-68.6-11.200112.4E391 K392 T397 I398 G399E391-Q395 WeakPolarHBondContact O-CG 3.19Å; E391-Q395 PolarHBondContact O-N 3.17Å; K392-Q395 PolarHBondContact O-N 2.92Å; Q395-T397 VanDerWaalsContact C-N 3.34Å; Q395-T397 PolarHBondContact O-N 2.67Å; Q395-I398 PolarHBondContact O-N 3.5Å; Q395-G399 PolarHBondContact O-N 3.31Å
396E95.2Very high93.3Very high116 Ų116102.8 Ų102.854%0.54251%0.508SS..Hα-helixtrans-65-37.2174.3-74.6178.5173.300111.9K392 Q400K392-E396 WeakPolarHBondContact CE-OE1 3.46Å; K392-E396 VanDerWaalsContact NZ-CD 3.26Å; K392-E396 IonicContact NZ-OE1 2.6Å; K392-E396 PolarHBondContact NZ-OE1 2.86Å; K392-E396 IonicContact NZ-OE2 2.83Å; K392-E396 PolarHBondContact NZ-OE2 3.31Å; K392-E396 WeakPolarHBondContact O-CG 3.44Å; K392-E396 PolarHBondContact O-N 2.97Å; E396-Q400 WeakPolarHBondContact O-CB 3.45Å; E396-Q400 PolarHBondContact O-N 3.46Å
397T95.6Very high93.7Very high77 Ų77101 Ų10147%0.47250%0.501SS..Hα-helixtrans-65.9-42.7175-56.50000112E393 Y394 Q395 Q400 I401E393-T397 WeakPolarHBondContact O-CB 3.35Å; E393-T397 PolarHBondContact O-N 3Å; E393-T397 PolarHBondContact O-OG1 3.49Å; Y394-T397 WeakPolarHBondContact O-CB 3.44Å; Y394-T397 PolarHBondContact O-N 3.01Å; Q395-T397 VanDerWaalsContact C-N 3.34Å; Q395-T397 PolarHBondContact O-N 2.67Å; T397-Q400 PolarHBondContact O-N 2.9Å; T397-I401 HydrophobicContact CG2-CD1 4.1Å; T397-I401 WeakPolarHBondContact O-CG1 2.72Å; T397-I401 PolarHBondContact O-N 2.9Å; T397-I401 VanDerWaalsContact O-N 3.11Å
398I92.2Very high94Very high81 Ų8196.5 Ų96.542%0.41549%0.493SS..Hα-helixtrans-61.7-50.7176-69.7162000110.1Y394 Q395 Q400 I401 E402Y394-I398 VanDerWaalsContact O-CG1 3.27Å; Y394-I398 WeakPolarHBondContact O-CG1 3.34Å; Y394-I398 PolarHBondContact O-N 3.09Å; Q395-I398 PolarHBondContact O-N 3.5Å; I398-Q400 VanDerWaalsContact C-N 3.28Å; I398-Q400 PolarHBondContact O-N 3.35Å; I398-I401 PolarHBondContact O-N 3.06Å; I398-I401 VanDerWaalsContact O-N 3.07Å; I398-E402 HydrophobicContact CG2-CG 4.4Å; I398-E402 WeakPolarHBondContact O-CG 3.36Å; I398-E402 PolarHBondContact O-N 2.8Å
399G95.4Very high94.3Very high32 Ų3298.2 Ų98.233%0.3350%0.5SS..Hα-helixtrans-60.9-34179.100000113.8Q395 M403Q395-G399 PolarHBondContact O-N 3.31Å; G399-M403 WeakPolarHBondContact O-CB 3.44Å; G399-M403 PolarHBondContact O-N 3.06Å
400Q97.7Very high94.6Very high88 Ų8899 Ų9941%0.41151%0.506SS..Hα-helixtrans-64.2-46172.2179.562.429.300111.7E396 T397 I398 M403 E404E396-Q400 WeakPolarHBondContact O-CB 3.45Å; E396-Q400 PolarHBondContact O-N 3.46Å; T397-Q400 PolarHBondContact O-N 2.9Å; I398-Q400 VanDerWaalsContact C-N 3.28Å; I398-Q400 PolarHBondContact O-N 3.35Å; Q400-M403 PolarHBondContact O-N 3.37Å; Q400-E404 PolarHBondContact NE2-OE1 3.11Å; Q400-E404 WeakPolarHBondContact O-CG 3.47Å; Q400-E404 PolarHBondContact O-N 3.45Å
401I95.4Very high95Very high107 Ų10796.8 Ų96.855%0.54950%0.503SS..Hα-helixtrans-63.9-40.9178.1-67.6165.3000111.1T397 I398 E404 L405T397-I401 HydrophobicContact CG2-CD1 4.1Å; T397-I401 WeakPolarHBondContact O-CG1 2.72Å; T397-I401 PolarHBondContact O-N 2.9Å; T397-I401 VanDerWaalsContact O-N 3.11Å; I398-I401 PolarHBondContact O-N 3.06Å; I398-I401 VanDerWaalsContact O-N 3.07Å; I401-E404 PolarHBondContact O-N 3.25Å; I401-L405 WeakPolarHBondContact O-CB 3.44Å; I401-L405 PolarHBondContact O-N 2.93Å
402E93.9Very high95.4Very high128 Ų12897.7 Ų97.760%0.59851%0.509SS*.Hα-helixtrans-63-41.2175.4-70.7-176.6154.400112.3I398 L405 A406I398-E402 HydrophobicContact CG2-CG 4.4Å; I398-E402 WeakPolarHBondContact O-CG 3.36Å; I398-E402 PolarHBondContact O-N 2.8Å; E402-L405 PolarHBondContact O-N 3Å; E402-A406 WeakPolarHBondContact O-CB 3.31Å; E402-A406 PolarHBondContact O-N 3.32Å
403M96.6Very high95.5Very high104 Ų10496.2 Ų96.251%0.51251%0.506SS..Hα-helixtrans-66.5-40.5176.2-179.3172.956.500112.3G399 Q400 A406 T407G399-M403 WeakPolarHBondContact O-CB 3.44Å; G399-M403 PolarHBondContact O-N 3.06Å; Q400-M403 PolarHBondContact O-N 3.37Å; M403-A406 PolarHBondContact O-N 3.47Å; M403-T407 WeakPolarHBondContact O-CB 3.49Å; M403-T407 PolarHBondContact O-N 2.81Å; M403-T407 PolarHBondContact O-OG1 3.28Å
404E96.6Very high95.8Very high116 Ų11696.5 Ų96.554%0.54250%0.504SS..Hα-helixtrans-64.9-42.6173.8-74.8-178.6-15500111.8Q400 I401 A406 T407 A408Q400-E404 PolarHBondContact NE2-OE1 3.11Å; Q400-E404 WeakPolarHBondContact O-CG 3.47Å; Q400-E404 PolarHBondContact O-N 3.45Å; I401-E404 PolarHBondContact O-N 3.25Å; E404-A406 PolarHBondContact O-N 2.85Å; E404-T407 PolarHBondContact O-N 2.91Å; E404-A408 WeakPolarHBondContact O-CB 3.46Å; E404-A408 PolarHBondContact O-N 2.95Å
405L94.7Very high96.1Very high127 Ų12795.6 Ų95.667%0.66550%0.504SS*.Hα-helixtrans-59.9-46.1174.6-174.275.1000111.7I401 E402 T407 A408 K409I401-L405 WeakPolarHBondContact O-CB 3.44Å; I401-L405 PolarHBondContact O-N 2.93Å; E402-L405 PolarHBondContact O-N 3Å; L405-T407 VanDerWaalsContact C-N 3.31Å; L405-T407 PolarHBondContact O-N 3.1Å; L405-A408 PolarHBondContact O-N 2.83Å; L405-K409 VanDerWaalsContact O-CB 3.3Å; L405-K409 WeakPolarHBondContact O-CB 3.45Å; L405-K409 PolarHBondContact O-N 2.7Å
406A95.6Very high96.3Very high59 Ų5994.6 Ų94.649%0.48850%0.502SS..Hα-helixtrans-62.1-39.3176.400000112E402 M403 E404 S410E402-A406 WeakPolarHBondContact O-CB 3.31Å; E402-A406 PolarHBondContact O-N 3.32Å; M403-A406 PolarHBondContact O-N 3.47Å; E404-A406 PolarHBondContact O-N 2.85Å; A406-S410 PolarHBondContact O-N 3.41Å
407T97.3Very high96.5Very high78 Ų7894.9 Ų94.948%0.47950%0.503SS..Hα-helixtrans-66.9-49.3178.2-57.90000111M403 E404 L405 K409 S410 D411M403-T407 WeakPolarHBondContact O-CB 3.49Å; M403-T407 PolarHBondContact O-N 2.81Å; M403-T407 PolarHBondContact O-OG1 3.28Å; E404-T407 PolarHBondContact O-N 2.91Å; L405-T407 VanDerWaalsContact C-N 3.31Å; L405-T407 PolarHBondContact O-N 3.1Å; T407-K409 VanDerWaalsContact C-N 3.32Å; T407-K409 PolarHBondContact O-N 2.83Å; T407-S410 WeakPolarHBondContact O-CB 3.44Å; T407-S410 PolarHBondContact O-N 3.48Å; T407-S410 VanDerWaalsContact O-N 3.12Å; T407-D411 PolarHBondContact O-N 2.88Å
408A94.8Very high96.6Very high59 Ų5995.1 Ų95.149%0.48850%0.498SS..Hα-helixtrans-61.5-37.6176.900000112.7E404 L405 D411 M412E404-A408 WeakPolarHBondContact O-CB 3.46Å; E404-A408 PolarHBondContact O-N 2.95Å; L405-A408 PolarHBondContact O-N 2.83Å; A408-D411 PolarHBondContact O-N 3.32Å; A408-M412 WeakPolarHBondContact O-CB 3.42Å; A408-M412 PolarHBondContact O-N 2.94Å
409K97.8Very high96.9Very high147 Ų14798.8 Ų98.864%0.63951%0.508SS*.Hα-helixtrans-63.9-40.3173.5-172.4176.4-177.2177.90111.9L405 T407 N413L405-K409 VanDerWaalsContact O-CB 3.3Å; L405-K409 WeakPolarHBondContact O-CB 3.45Å; L405-K409 PolarHBondContact O-N 2.7Å; T407-K409 VanDerWaalsContact C-N 3.32Å; T407-K409 PolarHBondContact O-N 2.83Å; K409-N413 PolarHBondContact O-N 2.85Å; K409-N413 VanDerWaalsContact O-N 3.15Å
410S97.9Very high97Very high77 Ų77102.6 Ų102.654%0.53852%0.519SS..Hα-helixtrans-64.2-47.7175.2-167.60000111.9A406 T407 M412 N413 R414A406-S410 PolarHBondContact O-N 3.41Å; T407-S410 WeakPolarHBondContact O-CB 3.44Å; T407-S410 PolarHBondContact O-N 3.48Å; T407-S410 VanDerWaalsContact O-N 3.12Å; S410-M412 PolarHBondContact O-N 3.42Å; S410-N413 PolarHBondContact O-N 2.78Å; S410-R414 PolarHBondContact O-N 2.87Å
411D98Very high97Very high73 Ų73105.3 Ų105.339%0.3953%0.531SS..Hα-helixtrans-66.2-35.9179.2-97.2-26.8000113.1T407 A408 R414 H415T407-D411 PolarHBondContact O-N 2.88Å; A408-D411 PolarHBondContact O-N 3.32Å; D411-R414 PolarHBondContact O-N 3.36Å; D411-R414 IonicContact OD1-CZ 3.91Å; D411-R414 IonicContact OD1-NE 3.1Å; D411-R414 PolarHBondContact OD1-NE 2.94Å; D411-R414 IonicContact OD1-NH2 3.53Å; D411-R414 PolarHBondContact OD1-NH2 3.26Å; D411-H415 PolarHBondContact O-CD2 3.31Å; D411-H415 VanDerWaalsContact O-CD2 3.28Å; D411-H415 PolarHBondContact O-N 3.16Å
412M97.8Very high97.1Very high141 Ų141106.3 Ų106.370%0.69554%0.536SS*.Hα-helixtrans-64.8-40.9173.6-173.212464.100111.7A408 S410 H415 L416A408-M412 WeakPolarHBondContact O-CB 3.42Å; A408-M412 PolarHBondContact O-N 2.94Å; S410-M412 PolarHBondContact O-N 3.42Å; M412-H415 PolarHBondContact O-N 3.17Å; M412-L416 WeakPolarHBondContact O-CB 3.42Å; M412-L416 PolarHBondContact O-N 3.5Å
413N97.2Very high97.2Very high83 Ų83102.7 Ų102.744%0.44452%0.524SS..Hα-helixtrans-64.9-41.3173.8-75.1-16.3000112K409 S410 L416 H417K409-N413 PolarHBondContact O-N 2.85Å; K409-N413 VanDerWaalsContact O-N 3.15Å; S410-N413 PolarHBondContact O-N 2.78Å; N413-L416 WeakPolarHBondContact O-CB 3.48Å; N413-L416 PolarHBondContact O-N 2.96Å; N413-H417 PolarHBondContact O-CD2 2.68Å; N413-H417 PolarHBondContact O-N 3.38Å
414R98.1Very high97.3Very high91 Ų91101.8 Ų101.834%0.34353%0.527SS..Hα-helixtrans-58.3-49.3174.2-177.2-17553.759.68.1111.2S410 D411 L416 H417 E418S410-R414 PolarHBondContact O-N 2.87Å; D411-R414 PolarHBondContact O-N 3.36Å; D411-R414 IonicContact OD1-CZ 3.91Å; D411-R414 IonicContact OD1-NE 3.1Å; D411-R414 PolarHBondContact OD1-NE 2.94Å; D411-R414 IonicContact OD1-NH2 3.53Å; D411-R414 PolarHBondContact OD1-NH2 3.26Å; R414-L416 VanDerWaalsContact C-N 3.32Å; R414-L416 PolarHBondContact O-N 2.94Å; R414-H417 PolarHBondContact O-N 3.01Å; R414-E418 IonicContact CZ-OE1 3.06Å; R414-E418 IonicContact NH1-OE1 3.98Å; R414-E418 PolarHBondContact NH1-OE1 2.99Å; R414-E418 IonicContact NH1-OE2 2.7Å; R414-E418 PolarHBondContact NH1-OE2 3.45Å; R414-E418 VanDerWaalsContact NH1-OE2 3.1Å; R414-E418 WeakPolarHBondContact O-CG 3.48Å; R414-E418 PolarHBondContact O-N 2.83Å
415H97.9Very high97.3Very high106 Ų106102.1 Ų102.149%0.49153%0.531SS..Hα-helixtrans-64.6-32.1176.8-76.8-49.8000113.6D411 M412 E418 Y419D411-H415 PolarHBondContact O-CD2 3.31Å; D411-H415 VanDerWaalsContact O-CD2 3.28Å; D411-H415 PolarHBondContact O-N 3.16Å; M412-H415 PolarHBondContact O-N 3.17Å; H415-E418 IonicContact CE1-OE2 3.64Å; H415-E418 IonicContact CG-OE2 3.82Å; H415-E418 IonicContact ND1-OE2 2.72Å; H415-E418 PolarHBondContact ND1-OE2 2.96Å; H415-Y419 WeakPolarHBondContact O-CB 3.37Å; H415-Y419 PolarHBondContact O-N 3Å
416L97.8Very high97.5Very high97 Ų97102.4 Ų102.451%0.50853%0.527SS..Hα-helixtrans-64.7-43.1172.9-17861.5000111.6M412 N413 R414 Y419 M420M412-L416 WeakPolarHBondContact O-CB 3.42Å; M412-L416 PolarHBondContact O-N 3.5Å; N413-L416 WeakPolarHBondContact O-CB 3.48Å; N413-L416 PolarHBondContact O-N 2.96Å; R414-L416 VanDerWaalsContact C-N 3.32Å; R414-L416 PolarHBondContact O-N 2.94Å; L416-Y419 PolarHBondContact O-N 3.43Å; L416-M420 WeakPolarHBondContact O-CG 3.46Å; L416-M420 PolarHBondContact O-N 3.41Å
417H98.1Very high97.6Very high121 Ų121108.8 Ų108.856%0.5654%0.538SS*.Hα-helixtrans-64.1-46.4174.2-72-58.7000112.4N413 R414 Y419 M420 E421N413-H417 PolarHBondContact O-CD2 2.68Å; N413-H417 PolarHBondContact O-N 3.38Å; R414-H417 PolarHBondContact O-N 3.01Å; H417-Y419 VanDerWaalsContact C-N 3.27Å; H417-Y419 PolarHBondContact O-N 3.37Å; H417-M420 WeakPolarHBondContact O-CB 3.34Å; H417-M420 PolarHBondContact O-N 2.9Å; H417-M420 VanDerWaalsContact O-N 3.09Å; H417-E421 PolarHBondContact O-N 3.48Å
418E97.7Very high97.6Very high82 Ų82106.7 Ų106.738%0.38353%0.532SS..Hα-helixtrans-56.2-41.4174.8-71165.7-178.800111.8R414 H415 E421 M422R414-E418 IonicContact CZ-OE1 3.06Å; R414-E418 IonicContact NH1-OE1 3.98Å; R414-E418 PolarHBondContact NH1-OE1 2.99Å; R414-E418 IonicContact NH1-OE2 2.7Å; R414-E418 PolarHBondContact NH1-OE2 3.45Å; R414-E418 VanDerWaalsContact NH1-OE2 3.1Å; R414-E418 WeakPolarHBondContact O-CG 3.48Å; R414-E418 PolarHBondContact O-N 2.83Å; H415-E418 IonicContact CE1-OE2 3.64Å; H415-E418 IonicContact CG-OE2 3.82Å; H415-E418 IonicContact ND1-OE2 2.72Å; H415-E418 PolarHBondContact ND1-OE2 2.96Å; E418-E421 PolarHBondContact O-N 2.87Å; E418-M422 WeakPolarHBondContact O-CB 3.49Å; E418-M422 VanDerWaalsContact O-CG 3.28Å; E418-M422 WeakPolarHBondContact O-CG 3.46Å; E418-M422 PolarHBondContact O-N 3.14Å
419Y98.1Very high97.7Very high158 Ų158108.2 Ų108.262%0.6253%0.531SS*.Hα-helixtrans-65.8-40.8175.3179.5-100.8000112.5H415 L416 H417 M422 C423H415-Y419 WeakPolarHBondContact O-CB 3.37Å; H415-Y419 PolarHBondContact O-N 3Å; L416-Y419 PolarHBondContact O-N 3.43Å; H417-Y419 VanDerWaalsContact C-N 3.27Å; H417-Y419 PolarHBondContact O-N 3.37Å; Y419-M422 PolarHBondContact O-N 3.05Å; Y419-C423 VanDerWaalsContact CZ-SG 3.53Å; Y419-C423 WeakPolarHBondContact O-CB 3.43Å; Y419-C423 PolarHBondContact O-N 3.06Å; Y419-C423 PolarHBondContact O-SG 3.36Å; Y419-C423 VanDerWaalsContact O-SG 3.38Å
420M97.4Very high97.6Very high113 Ų113104.6 Ų104.656%0.55752%0.519SS*.Hα-helixtrans-62.6-42.8175-73.1174.265.100112.3L416 H417 C423 S424L416-M420 WeakPolarHBondContact O-CG 3.46Å; L416-M420 PolarHBondContact O-N 3.41Å; H417-M420 WeakPolarHBondContact O-CB 3.34Å; H417-M420 PolarHBondContact O-N 2.9Å; H417-M420 VanDerWaalsContact O-N 3.09Å; M420-C423 PolarHBondContact O-N 2.99Å; M420-S424 WeakPolarHBondContact O-CB 3.42Å; M420-S424 PolarHBondContact O-N 3.18Å
421E97.9Very high97.6Very high144 Ų144105.2 Ų105.267%0.67352%0.519SS*.Hα-helixtrans-62.8-45.5175-69.4-165.7151.500111.8H417 E418 C423 S424 M425H417-E421 PolarHBondContact O-N 3.48Å; E418-E421 PolarHBondContact O-N 2.87Å; E421-C423 VanDerWaalsContact C-N 3.34Å; E421-C423 PolarHBondContact O-N 3.39Å; E421-S424 WeakPolarHBondContact O-CB 3.45Å; E421-S424 PolarHBondContact O-N 2.75Å; E421-S424 VanDerWaalsContact O-N 3.17Å; E421-M425 WeakPolarHBondContact O-CB 3.24Å; E421-M425 PolarHBondContact O-N 3.29Å
422M97.4Very high97.5Very high129 Ų129107.6 Ų107.664%0.63553%0.528SS*.Hα-helixtrans-59.3-41.7175-77-76.5-7800112.3E418 Y419 K426E418-M422 WeakPolarHBondContact O-CB 3.49Å; E418-M422 VanDerWaalsContact O-CG 3.28Å; E418-M422 WeakPolarHBondContact O-CG 3.46Å; E418-M422 PolarHBondContact O-N 3.14Å; Y419-M422 PolarHBondContact O-N 3.05Å; M422-K426 VanDerWaalsContact O-CB 3.3Å; M422-K426 WeakPolarHBondContact O-CB 3.49Å; M422-K426 PolarHBondContact O-N 2.9Å
423C97.1Very high97.3Very high51 Ų51105.2 Ų105.235%0.34552%0.516SS..Hα-helixtrans-65.1-40.2174.3-77.20000112.6Y419 M420 E421 R427Y419-C423 VanDerWaalsContact CZ-SG 3.53Å; Y419-C423 WeakPolarHBondContact O-CB 3.43Å; Y419-C423 PolarHBondContact O-N 3.06Å; Y419-C423 PolarHBondContact O-SG 3.36Å; Y419-C423 VanDerWaalsContact O-SG 3.38Å; M420-C423 PolarHBondContact O-N 2.99Å; E421-C423 VanDerWaalsContact C-N 3.34Å; E421-C423 PolarHBondContact O-N 3.39Å; C423-R427 WeakPolarHBondContact O-CB 3.37Å; C423-R427 PolarHBondContact O-N 3.5Å
424S97.8Very high97.2Very high85 Ų85105 Ų10559%0.59451%0.513SS*.Hα-helixtrans-63.5-48.7175.5-171.60000111.5M420 E421 K426 R427 G428M420-S424 WeakPolarHBondContact O-CB 3.42Å; M420-S424 PolarHBondContact O-N 3.18Å; E421-S424 WeakPolarHBondContact O-CB 3.45Å; E421-S424 PolarHBondContact O-N 2.75Å; E421-S424 VanDerWaalsContact O-N 3.17Å; S424-K426 PolarHBondContact O-N 3Å; S424-R427 PolarHBondContact O-N 2.96Å; S424-R427 VanDerWaalsContact O-N 3.15Å; S424-G428 PolarHBondContact O-N 2.85Å
425M97.5Very high96.9Very high124 Ų124103.5 Ų103.561%0.61151%0.514SS*.Hα-helixtrans-61-44.8177.5-169.8-175-6000111.7E421 R427 G428 L429E421-M425 WeakPolarHBondContact O-CB 3.24Å; E421-M425 PolarHBondContact O-N 3.29Å; M425-R427 VanDerWaalsContact C-N 3.34Å; M425-R427 PolarHBondContact O-N 3.29Å; M425-G428 PolarHBondContact O-N 3.1Å; M425-G428 VanDerWaalsContact O-N 3.16Å; M425-L429 WeakPolarHBondContact O-CG 3.49Å; M425-L429 PolarHBondContact O-N 3.14Å
426K97.7Very high96.7Very high133 Ų133101.7 Ų101.758%0.57851%0.512SS*.Hα-helixtrans-55.7-47.7172.9-179.4-169.3170.5-171.70111.3M422 S424 G428 L429 D430M422-K426 VanDerWaalsContact O-CB 3.3Å; M422-K426 WeakPolarHBondContact O-CB 3.49Å; M422-K426 PolarHBondContact O-N 2.9Å; S424-K426 PolarHBondContact O-N 3Å; K426-G428 VanDerWaalsContact C-N 3.26Å; K426-G428 PolarHBondContact O-N 3.28Å; K426-L429 PolarHBondContact O-N 2.7Å; K426-L429 VanDerWaalsContact O-N 3.09Å; K426-D430 PolarHBondContact O-N 2.87Å
427R97.5Very high96.5Very high193 Ų193103.8 Ų103.873%0.72851%0.513SS*.Hα-helixtrans-62-35.1179.4-155.3178.293.6105.4-2.8111.9C423 S424 M425 V431C423-R427 WeakPolarHBondContact O-CB 3.37Å; C423-R427 PolarHBondContact O-N 3.5Å; S424-R427 PolarHBondContact O-N 2.96Å; S424-R427 VanDerWaalsContact O-N 3.15Å; M425-R427 VanDerWaalsContact C-N 3.34Å; M425-R427 PolarHBondContact O-N 3.29Å; R427-V431 WeakPolarHBondContact O-CG2 3.23Å; R427-V431 PolarHBondContact O-N 2.89Å
428G97.4Very high96.1Very high34 Ų34105.4 Ų105.435%0.35152%0.515SS..Hα-helixtrans-63-46.9170.500000113S424 M425 K426 V431 Q432S424-G428 PolarHBondContact O-N 2.85Å; M425-G428 PolarHBondContact O-N 3.1Å; M425-G428 VanDerWaalsContact O-N 3.16Å; K426-G428 VanDerWaalsContact C-N 3.26Å; K426-G428 PolarHBondContact O-N 3.28Å; G428-V431 PolarHBondContact O-N 3.04Å; G428-Q432 WeakPolarHBondContact O-CG 3.45Å; G428-Q432 PolarHBondContact O-N 2.77Å
429L97.3Very high95.6Very high91 Ų91108.1 Ų108.148%0.47653%0.529SS..Hα-helixtrans-64.1-38.5176.7-68.7172.4000112.6M425 K426 Q432 M433M425-L429 WeakPolarHBondContact O-CG 3.49Å; M425-L429 PolarHBondContact O-N 3.14Å; K426-L429 PolarHBondContact O-N 2.7Å; K426-L429 VanDerWaalsContact O-N 3.09Å; L429-Q432 PolarHBondContact O-N 3.35Å; L429-M433 WeakPolarHBondContact O-CB 3.22Å; L429-M433 WeakPolarHBondContact O-CG 3.36Å; L429-M433 PolarHBondContact O-N 3.09Å
430D96.3Very high95Very high71 Ų71107 Ų10738%0.3853%0.532SS..Hα-helixtrans-63.1-40.7175.3-76.5-37.7000111.4K426 M433 E434K426-D430 PolarHBondContact O-N 2.87Å; D430-M433 PolarHBondContact O-N 3.44Å; D430-M433 VanDerWaalsContact OD1-CE 3.28Å; D430-M433 WeakPolarHBondContact OD1-CE 3.28Å; D430-E434 WeakPolarHBondContact O-CB 3.47Å; D430-E434 PolarHBondContact O-N 2.93Å
431V96.8Very high94Very high89 Ų89110.2 Ų110.254%0.53954%0.543SS..Hα-helixtrans-66.1-40.3173.6170.20000111.9R427 G428 T435R427-V431 WeakPolarHBondContact O-CG2 3.23Å; R427-V431 PolarHBondContact O-N 2.89Å; G428-V431 PolarHBondContact O-N 3.04Å; V431-T435 WeakPolarHBondContact O-CB 3.46Å; V431-T435 PolarHBondContact O-N 3.36Å; V431-T435 PolarHBondContact O-OG1 3.04Å
432Q96.4Very high92.1Very high123 Ų123105.2 Ų105.258%0.57553%0.53SS*.Hα-helixtrans-64.7-46.6174.7-72.8179.23.300111.5G428 L429 E434 T435 C436G428-Q432 WeakPolarHBondContact O-CG 3.45Å; G428-Q432 PolarHBondContact O-N 2.77Å; L429-Q432 PolarHBondContact O-N 3.35Å; Q432-E434 VanDerWaalsContact C-N 3.35Å; Q432-E434 PolarHBondContact O-N 2.88Å; Q432-T435 WeakPolarHBondContact O-CB 3.47Å; Q432-T435 PolarHBondContact O-N 3.46Å; Q432-T435 VanDerWaalsContact O-N 3.16Å; Q432-C436 PolarHBondContact O-N 3.32Å; Q432-C436 PolarHBondContact O-SG 2.89Å
433M94.6Very high90Very high91 Ų91102.3 Ų102.345%0.44853%0.534SS..Hα-helixtrans-58.4-44.5176.1-80.6-159.7-68.900112.1L429 D430 T435 C436 R437L429-M433 WeakPolarHBondContact O-CB 3.22Å; L429-M433 WeakPolarHBondContact O-CG 3.36Å; L429-M433 PolarHBondContact O-N 3.09Å; D430-M433 PolarHBondContact O-N 3.44Å; D430-M433 VanDerWaalsContact OD1-CE 3.28Å; D430-M433 WeakPolarHBondContact OD1-CE 3.28Å; M433-T435 VanDerWaalsContact C-N 3.31Å; M433-T435 PolarHBondContact O-N 3.05Å; M433-C436 PolarHBondContact O-N 2.8Å; M433-R437 WeakPolarHBondContact O-CB 3.24Å; M433-R437 VanDerWaalsContact O-CG 3.28Å; M433-R437 WeakPolarHBondContact O-CG 3.35Å; M433-R437 PolarHBondContact O-N 2.92Å
434E93.9Very high87.8Confident80 Ų80110.6 Ų110.637%0.37456%0.558SS.*Hα-helixtrans-69-31.1178.5-169.151.8-142.300112.3D430 Q432 R437 R438D430-E434 WeakPolarHBondContact O-CB 3.47Å; D430-E434 PolarHBondContact O-N 2.93Å; Q432-E434 VanDerWaalsContact C-N 3.35Å; Q432-E434 PolarHBondContact O-N 2.88Å; E434-R437 WeakPolarHBondContact OE2-CD 3.35Å; E434-R437 IonicContact OE2-CZ 2.58Å; E434-R437 IonicContact OE2-NE 3.43Å; E434-R437 IonicContact OE2-NH1 3.8Å; E434-R437 PolarHBondContact OE2-NH1 2.95Å; E434-R438 WeakPolarHBondContact O-CB 3.49Å; E434-R438 PolarHBondContact O-N 3.46Å
435T92.2Very high85.3Confident59 Ų59112.9 Ų112.936%0.36256%0.563SS.*Hα-helixtrans-66.6-46.6170.8-56.70000111.4V431 Q432 M433 R437 R438 M439V431-T435 WeakPolarHBondContact O-CB 3.46Å; V431-T435 PolarHBondContact O-N 3.36Å; V431-T435 PolarHBondContact O-OG1 3.04Å; Q432-T435 WeakPolarHBondContact O-CB 3.47Å; Q432-T435 PolarHBondContact O-N 3.46Å; Q432-T435 VanDerWaalsContact O-N 3.16Å; M433-T435 VanDerWaalsContact C-N 3.31Å; M433-T435 PolarHBondContact O-N 3.05Å; T435-R437 PolarHBondContact O-N 3.24Å; T435-R438 WeakPolarHBondContact O-CB 3.49Å; T435-R438 PolarHBondContact O-N 3.36Å; T435-R438 VanDerWaalsContact O-N 3.17Å; T435-M439 WeakPolarHBondContact O-CG 2.97Å; T435-M439 PolarHBondContact O-N 3.35Å
436C93.6Very high82.7Confident68 Ų68112.5 Ų112.546%0.45957%0.573SS.*Hα-helixtrans-61.6-43.8175.4-67.10000112.1Q432 M433 R438 M439 I440Q432-C436 PolarHBondContact O-N 3.32Å; Q432-C436 PolarHBondContact O-SG 2.89Å; M433-C436 PolarHBondContact O-N 2.8Å; C436-R438 VanDerWaalsContact C-N 3.32Å; C436-R438 PolarHBondContact O-N 3.04Å; C436-M439 PolarHBondContact O-N 2.96Å; C436-I440 VanDerWaalsContact O-CG1 3.31Å; C436-I440 WeakPolarHBondContact O-CG1 3.39Å; C436-I440 PolarHBondContact O-N 3.29Å
437R93.9Very high80.5Confident140 Ų140111.6 Ų111.653%0.52858%0.58SS.*Hα-helixtrans-56.6-45.2172.1-74.6168.8-176.21663.4111.2M433 E434 T435 I440 K441M433-R437 WeakPolarHBondContact O-CB 3.24Å; M433-R437 VanDerWaalsContact O-CG 3.28Å; M433-R437 WeakPolarHBondContact O-CG 3.35Å; M433-R437 PolarHBondContact O-N 2.92Å; E434-R437 WeakPolarHBondContact OE2-CD 3.35Å; E434-R437 IonicContact OE2-CZ 2.58Å; E434-R437 IonicContact OE2-NE 3.43Å; E434-R437 IonicContact OE2-NH1 3.8Å; E434-R437 PolarHBondContact OE2-NH1 2.95Å; T435-R437 PolarHBondContact O-N 3.24Å; R437-I440 PolarHBondContact O-N 2.72Å; R437-K441 WeakPolarHBondContact O-CB 3.31Å; R437-K441 PolarHBondContact O-N 2.97Å
438R89.8Confident77.6Confident156 Ų156108 Ų10859%0.58958%0.584SS**Hα-helixtrans-63.5-40.1178.6-165.2177.3-56.813911.3112.2E434 T435 C436 K441 G442E434-R438 WeakPolarHBondContact O-CB 3.49Å; E434-R438 PolarHBondContact O-N 3.46Å; T435-R438 WeakPolarHBondContact O-CB 3.49Å; T435-R438 PolarHBondContact O-N 3.36Å; T435-R438 VanDerWaalsContact O-N 3.17Å; C436-R438 VanDerWaalsContact C-N 3.32Å; C436-R438 PolarHBondContact O-N 3.04Å; R438-K441 PolarHBondContact O-N 2.78Å; R438-G442 PolarHBondContact O-N 2.75Å
439M87.1Confident75.2Confident138 Ų138115.5 Ų115.568%0.6861%0.608SS**Hα-helixtrans-63.9-47.4173.7-69.7175.667.600112T435 C436 K441 G442 G443T435-M439 WeakPolarHBondContact O-CG 2.97Å; T435-M439 PolarHBondContact O-N 3.35Å; C436-M439 PolarHBondContact O-N 2.96Å; M439-K441 VanDerWaalsContact C-N 3.31Å; M439-K441 PolarHBondContact O-N 2.92Å; M439-G442 PolarHBondContact O-N 2.72Å; M439-G443 PolarHBondContact O-N 3.14Å
440I85.9Confident72.2Confident135 Ų135116.6 Ų116.669%0.69262%0.623SS**Hα-helixtrans-61.7-40.3177.7-67.9163.3000111.1C436 R437C436-I440 VanDerWaalsContact O-CG1 3.31Å; C436-I440 WeakPolarHBondContact O-CG1 3.39Å; C436-I440 PolarHBondContact O-N 3.29Å; R437-I440 PolarHBondContact O-N 2.72Å
441K75Confident70Confident180 Ų180118.6 Ų118.678%0.78364%0.643SS**Hα-helixtrans-75.9-30.5-179.5-156.4165.3-176.7175.70112.5R437 R438 M439R437-K441 WeakPolarHBondContact O-CB 3.31Å; R437-K441 PolarHBondContact O-N 2.97Å; R438-K441 PolarHBondContact O-N 2.78Å; M439-K441 VanDerWaalsContact C-N 3.31Å; M439-K441 PolarHBondContact O-N 2.92Å
442G58.8Low67.3Low39 Ų39121.4 Ų121.440%0.40266%0.66SS.*Hα-helixtrans-77.4-25.2172.200000114.1R438 M439 R444 N445R438-G442 PolarHBondContact O-N 2.75Å; M439-G442 PolarHBondContact O-N 2.72Å; G442-R444 PolarHBondContact O-N 3.47Å; G442-N445 PolarHBondContact O-N 3.05Å
443G53.8Low64.9Low69 Ų69119.6 Ų119.671%0.71167%0.666SS**THydrogen-bonded Turntrans-62.75.4-179.700000116.5M439M439-G443 PolarHBondContact O-N 3.14Å
444R49.9Very low62.2Low225 Ų225121.3 Ų121.385%0.84969%0.687SS**THydrogen-bonded Turntrans-109.1-3.8172.5-60.6-171.868.7-168.6-0.1113.8G442G442-R444 PolarHBondContact O-N 3.47Å
445N46.4Very low59.8Low133 Ų133123.2 Ų123.271%0.71171%0.709SS**SBendtrans-136.4102.1-175.7-71.479.9000110.4G442G442-N445 PolarHBondContact O-N 3.05Å
446S42.8Very low57.1Low116 Ų116128.3 Ų128.381%0.81173%0.734SS**PPolyproline II helixtrans-58.2148175.7-56.90000112
447P51.9Low54.7Low113 Ų113130.1 Ų130.173%0.73475%0.747SS**PPolyproline II helixtrans-76.3128.9-168.329.5-35.3000113
448S36.7Very low52Low117 Ų117127.1 Ų127.182%0.81876%0.76SS**PPolyproline II helixtrans-98.6116.7156.7-66.60000108.5
449F45.6Very low49.5Very low192 Ų192126.7 Ų126.784%0.84277%0.77SS**PPolyproline II helixtrans-73.1125.7173.2-81.2-100.8000110.4
450S35.2Very low47.4Very low115 Ų115127.1 Ų127.180%0.80478%0.78SS**  trans-144.286.6161.4630000110
451S50.3Low45.1Very low113 Ų113127.5 Ų127.579%0.7978%0.783SS**  trans-73.8121.1173.1-45.10000110.4
452V40.3Very low43.7Very low147 Ų147127 Ų12789%0.89178%0.784SS**  trans-158.7149.8151.668.70000109.4
453A45.4Very low42.8Very low85 Ų85133.6 Ų133.670%0.70281%0.808SS**  trans-91.3157-176.200000113
454S36.6Very low42.2Very low128 Ų128138.1 Ų138.190%0.89581%0.811SS**  trans-151.5143.3141.8-76.10000109.7
455S45.6Very low42Very low119 Ų119134.9 Ų134.983%0.83281%0.81SS**  trans-103.8129.2175.5-54.50000109.3
456D34.2Very low42Very low166 Ų166136.4 Ų136.489%0.88881%0.813SS**  trans-173.7150.3155.5-121.9-2.2000107.9
457S42.8Very low41.8Very low106 Ų106138.6 Ų138.674%0.74181%0.814SS**  cis-144.2161.2-12.552.80000107.7
458G37.3Very low41.1Very low77 Ų77137.2 Ų137.279%0.79481%0.807SS**  trans-77.4160.2-168.200000115.9
459N37.8Very low41.5Very low148 Ų148139.3 Ų139.379%0.79181%0.809SS**  trans-165.191.4134.6-17285.2000110.4
460T43.3Very low41.2Very low146 Ų146139 Ų13990%0.89681%0.807SS**  trans-137.480.1165.552.70000107.5
461D37.3Very low41.4Very low143 Ų143141.2 Ų141.277%0.76581%0.81SS**  trans-107.4155.2169.8-135.3-42.7000108.7
462E45Very low40.8Very low171 Ų171140 Ų14080%0.79981%0.807SS**  trans-83.4137.6-155.7-61.3178.4112.400113.2
463I41.1Very low40.6Very low176 Ų176142.2 Ų142.290%0.90381%0.808SS**  trans-110.195.4156.8-61.7-179.1000106.2
464Q40Very low40.3Very low164 Ų164142.7 Ų142.777%0.76681%0.811SS**  trans-77.8157.9175.9-171.4170.37.200110.6E466Q464-E466 PolarHBondContact O-N 3.32Å
465D47.2Very low40.7Very low158 Ų158145.1 Ų145.185%0.84581%0.809SS**  trans-58.9129.8178.4-55.8-81.7000112.9
466E46.5Very low40.6Very low164 Ų164145 Ų14577%0.76680%0.802SS**  trans-163.898.7162.4-108.1-74.6153.800109.4Q464Q464-E466 PolarHBondContact O-N 3.32Å
467I37.3Very low41.5Very low162 Ų162142.8 Ų142.883%0.83180%0.798SS**  trans-174.487.2151.3-92.9150.1000103.2
468S37Very low41.5Very low84 Ų84145.6 Ų145.659%0.58780%0.803SS**  6882.182.4-71.90000112.7
469D45.8Very low42.1Very low161 Ų161151.4 Ų151.486%0.86183%0.832SS**  trans-52.1139.7144.3-67.9-61.9000109.1
470K38.8Very low42.3Very low186 Ų186151.6 Ų151.681%0.80983%0.834SS**  trans-154.163.2170.4-148.7169.4-170.8173.20114.1
471D39.3Very low42.3Very low162 Ų162151.8 Ų151.887%0.86683%0.83SS**  trans-56.1144.7146.8-71.8-52.3000109.6
472A37.6Very low42.6Very low88 Ų88152.3 Ų152.373%0.72783%0.834SS**  trans-144.278.5-178.100000109.9
473E36.7Very low42.4Very low193 Ų193151.2 Ų151.290%0.90284%0.836SS**  trans-60146.3161.4-69.2-165.9123.500110.3
474A40.2Very low42.5Very low94 Ų94149.7 Ų149.778%0.77783%0.832SS**  trans-11773.1-177.700000111
475E44.8Very low42.7Very low180 Ų180148.7 Ų148.784%0.84184%0.836SS**  trans-67.5138.6166.6-96.8-90.4104.900110.8
476V42Very low42.3Very low115 Ų115148.1 Ų148.170%0.69784%0.836SS**  trans-105.3120.8-175.6176.70000110.3L478V476-L478 PolarHBondContact O-N 3.28Å
477P53.6Low42Very low121 Ų121146.8 Ų146.879%0.78684%0.841SS**  trans-76123.5176.530-33000111.4
478L43.4Very low42.4Very low165 Ų165145.6 Ų145.686%0.86484%0.842SS**  trans-74.4145.7172.3-70.2167.9000112.2V476V476-L478 PolarHBondContact O-N 3.28Å
479S49.8Very low42.9Very low198 Ų198151.2 Ų151.2100%1.38587%0.865SS**  trans-158.50160.9-72.60000110.1

Retrieved 479 of 479 residues in 314 ms (Link to these results)