A0A087XXW8_POEFO Loading...

Schwannomin interacting protein 1

AlphaFold DB , UniProt , Accession A0A087XXW8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 263 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
1C40.7Very low39.7Very low190 Ų190125.3 Ų125.3100%1.28477%0.766SS**  099.50-66.60000109
2G39.6Very low39.5Very low71 Ų71127.4 Ų127.473%0.73276%0.76SS**  trans-91.9176.2172.200000111.9
3S42.9Very low39.6Very low111 Ų111132.8 Ų132.878%0.77676%0.759SS**  trans84110.2164.4-51.20000116.6
4N41.5Very low39.5Very low152 Ų152129.3 Ų129.381%0.81375%0.747SS**  161.763.6121.6-77.1-23.3000113.1
5H39.4Very low39.6Very low193 Ų193129.3 Ų129.389%0.89474%0.742SS**SBendtrans-136.419.9167.7-114.752.2000115.1
6V43.3Very low40Very low105 Ų105128.6 Ų128.664%0.63674%0.74SS**SBendtrans-106.2-1.2178.7-165.10000112.5F10V6-F10 HydrophobicContact CG1-CD2 4.23Å; V6-F10 HydrophobicContact CG1-CE2 4.35Å
7G38.2Very low40.5Very low58 Ų58131.7 Ų131.760%0.59874%0.743SS**Hα-helixtrans-81.9-27-172.200000116.6
8S38.2Very low40.9Very low112 Ų112133.2 Ų133.278%0.78374%0.743SS**Hα-helixtrans-91-28.5-169.6-147.70000113.8
9S38.7Very low41.2Very low82 Ų82131.4 Ų131.457%0.57373%0.728SS**Hα-helixtrans-80.9-17.717856.10000113.6
10F37.7Very low41.7Very low140 Ų140130.3 Ų130.361%0.61473%0.727SS**Hα-helixtrans-80.2-30.5177.2-104.8-90.8000113.3V6 R13 S14V6-F10 HydrophobicContact CG1-CD2 4.23Å; V6-F10 HydrophobicContact CG1-CE2 4.35Å; F10-R13 PolarHBondContact O-N 3.32Å; F10-S14 PolarHBondContact O-N 3.31Å
11F37Very low41.9Very low164 Ų164129 Ų12972%0.71972%0.716SS**Hα-helixtrans-73.4-31.5178.8-109.9-91000112.9
12H37.1Very low42.2Very low151 Ų151123.6 Ų123.670%0.69967%0.673SS**Hα-helixtrans-76.4-27.8175.3-122.6-17.8000113.2
13R40.3Very low42.9Very low197 Ų197125 Ų12574%0.74367%0.668SS**Hα-helixtrans-80.1-17.1178.7-155.9171.6-169.3-141.32.7113.6F10F10-R13 PolarHBondContact O-N 3.32Å
14S38.1Very low43.4Very low84 Ų84122.1 Ų122.159%0.58765%0.65SS**Hα-helixtrans-85.3-26.8178.8-127.20000113.8F10F10-S14 PolarHBondContact O-N 3.31Å
15L40.8Very low43.8Very low130 Ų130119.8 Ų119.868%0.68164%0.638SS**Hα-helixtrans-81.1-21.3180-95.8150.1000114.4K17L15-K17 VanDerWaalsContact C-N 3.25Å; L15-K17 PolarHBondContact O-N 3.46Å
16V46.4Very low44Very low117 Ų117119.5 Ų119.571%0.70963%0.629SS**THydrogen-bonded Turntrans-76.5-13.3178.8178.90000112.3
17K48.7Very low44.2Very low182 Ų182124 Ų12479%0.79163%0.634SS**THydrogen-bonded Turntrans-90.50.8-178.5-82.4-171.4175.5-174.40115.7L15L15-K17 VanDerWaalsContact C-N 3.25Å; L15-K17 PolarHBondContact O-N 3.46Å
18Q47.3Very low44.8Very low159 Ų159125.4 Ų125.474%0.74363%0.629SS**SBendtrans-119.4-3.2-174-81.9-170.122.900117.7
19Q47.6Very low45.4Very low98 Ų98126.4 Ų126.446%0.45862%0.619SS.*  trans-147.577.4-179.5-62.3-71.915.500113.2H21 L22Q19-H21 PolarHBondContact O-N 3Å; Q19-H21 VanDerWaalsContact O-N 3.17Å; Q19-H21 PolarHBondContact OE1-CE1 3.19Å; Q19-H21 PolarHBondContact OE1-ND1 2.6Å; Q19-L22 HydrophobicContact CB-CB 4.42Å; Q19-L22 HydrophobicContact CB-CD1 3.82Å; Q19-L22 HydrophobicContact CB-CG 4.1Å; Q19-L22 HydrophobicContact CG-CD1 4.02Å; Q19-L22 PolarHBondContact O-N 3.48Å
20P49.5Very low46.1Very low110 Ų110125 Ų12571%0.71461%0.612SS**Hα-helixtrans-62.4-20.1175.524.3-32.2000113.3A24P20-A24 WeakPolarHBondContact O-CB 3.43Å; P20-A24 PolarHBondContact O-N 3.47Å
21H47.8Very low47.1Very low103 Ų103124.5 Ų124.548%0.47761%0.612SS.*Hα-helixtrans-72.9-32.2-179.881.7-90.8000113.4Q19 N25Q19-H21 PolarHBondContact O-N 3Å; Q19-H21 VanDerWaalsContact O-N 3.17Å; Q19-H21 PolarHBondContact OE1-CE1 3.19Å; Q19-H21 PolarHBondContact OE1-ND1 2.6Å; H21-N25 WeakPolarHBondContact O-CB 3.48Å; H21-N25 PolarHBondContact O-N 3.33Å; H21-N25 VanDerWaalsContact O-N 3.13Å
22L45.3Very low48.2Very low76 Ų76123.6 Ų123.640%0.39861%0.608SS.*Hα-helixtrans-72.8-46.3-179.4-68.3173.6000110.7Q19 A24 N25 W26Q19-L22 HydrophobicContact CB-CB 4.42Å; Q19-L22 HydrophobicContact CB-CD1 3.82Å; Q19-L22 HydrophobicContact CB-CG 4.1Å; Q19-L22 HydrophobicContact CG-CD1 4.02Å; Q19-L22 PolarHBondContact O-N 3.48Å; L22-A24 VanDerWaalsContact C-N 3.3Å; L22-A24 PolarHBondContact O-N 2.98Å; L22-N25 WeakPolarHBondContact O-CB 3.44Å; L22-N25 PolarHBondContact O-N 3.15Å; L22-N25 VanDerWaalsContact O-N 3.09Å; L22-W26 PolarHBondContact O-N 2.86Å
23V56Low49.3Very low101 Ų101121.5 Ų121.561%0.61260%0.601SS**Hα-helixtrans-61.9-38.8179.2-1760000111.3R27V23-R27 WeakPolarHBondContact O-CB 3.38Å; V23-R27 PolarHBondContact O-N 3.4Å; V23-R27 VanDerWaalsContact O-N 3.07Å
24A52.2Low50.8Low50 Ų50118.3 Ų118.341%0.41360%0.595SS.*Hα-helixtrans-66.1-35.7174.700000112.9P20 L22 N28P20-A24 WeakPolarHBondContact O-CB 3.43Å; P20-A24 PolarHBondContact O-N 3.47Å; L22-A24 VanDerWaalsContact C-N 3.3Å; L22-A24 PolarHBondContact O-N 2.98Å; A24-N28 WeakPolarHBondContact O-CB 3.46Å; A24-N28 PolarHBondContact O-N 3.29Å; A24-N28 PolarHBondContact O-ND2 3.06Å; A24-N28 VanDerWaalsContact O-ND2 3.08Å
25N49.3Very low52.5Low103 Ų103121.9 Ų121.955%0.55160%0.596SS**Hα-helixtrans-72.6-40.9178.2-159.11.6000111.8H21 L22 N28 K29H21-N25 WeakPolarHBondContact O-CB 3.48Å; H21-N25 PolarHBondContact O-N 3.33Å; H21-N25 VanDerWaalsContact O-N 3.13Å; L22-N25 WeakPolarHBondContact O-CB 3.44Å; L22-N25 PolarHBondContact O-N 3.15Å; L22-N25 VanDerWaalsContact O-N 3.09Å; N25-N28 PolarHBondContact O-N 3.35Å; N25-K29 VanDerWaalsContact O-CB 3.32Å; N25-K29 WeakPolarHBondContact O-CB 3.43Å; N25-K29 PolarHBondContact O-N 3.44Å
26W44.8Very low53.7Low187 Ų187121.2 Ų121.271%0.70859%0.589SS**Hα-helixtrans-63-42.6173.2-75.3104.3000112.4L22 K29 A30L22-W26 PolarHBondContact O-N 2.86Å; W26-K29 PolarHBondContact O-N 3.31Å; W26-A30 WeakPolarHBondContact O-CB 3.47Å; W26-A30 PolarHBondContact O-N 2.91Å
27R46.9Very low54.7Low199 Ų199118.4 Ų118.475%0.75158%0.575SS**Hα-helixtrans-65.8-40.1177-161.5174.8-170.7176.92.1112.3V23 Q31V23-R27 WeakPolarHBondContact O-CB 3.38Å; V23-R27 PolarHBondContact O-N 3.4Å; V23-R27 VanDerWaalsContact O-N 3.07Å; R27-Q31 WeakPolarHBondContact O-CB 3.38Å; R27-Q31 PolarHBondContact O-N 3.46Å
28N50.6Low55.7Low89 Ų89114.5 Ų114.548%0.47656%0.561SS.*Hα-helixtrans-65.3-39.8173.5-97.9-82.5000112.7A24 N25 Q31 K32A24-N28 WeakPolarHBondContact O-CB 3.46Å; A24-N28 PolarHBondContact O-N 3.29Å; A24-N28 PolarHBondContact O-ND2 3.06Å; A24-N28 VanDerWaalsContact O-ND2 3.08Å; N25-N28 PolarHBondContact O-N 3.35Å; N28-Q31 PolarHBondContact O-N 3.3Å; N28-K32 WeakPolarHBondContact O-CB 3.36Å; N28-K32 WeakPolarHBondContact O-CG 3.42Å; N28-K32 PolarHBondContact O-N 3.47Å
29K52.1Low57Low132 Ų132113.1 Ų113.157%0.57455%0.549SS*.Hα-helixtrans-69.9-38.5179.7-161170.8-174.3177.50111.8N25 W26 N33N25-K29 VanDerWaalsContact O-CB 3.32Å; N25-K29 WeakPolarHBondContact O-CB 3.43Å; N25-K29 PolarHBondContact O-N 3.44Å; W26-K29 PolarHBondContact O-N 3.31Å; K29-N33 VanDerWaalsContact O-CG 3.29Å; K29-N33 PolarHBondContact O-N 3.36Å; K29-N33 VanDerWaalsContact O-N 3.12Å; K29-N33 PolarHBondContact O-OD1 2.97Å
30A53.5Low58.2Low53 Ų53113.7 Ų113.744%0.43855%0.552SS.*Hα-helixtrans-64-45172.900000112.1W26 K32 N33 E34W26-A30 WeakPolarHBondContact O-CB 3.47Å; W26-A30 PolarHBondContact O-N 2.91Å; A30-K32 PolarHBondContact O-N 2.85Å; A30-N33 PolarHBondContact O-N 3.03Å; A30-E34 PolarHBondContact O-N 2.99Å
31Q57.6Low59.3Low130 Ų130115.9 Ų115.961%0.60755%0.55SS**Hα-helixtrans-68.2-33.5179.9-165.8177.6-3.200113R27 N28 R35R27-Q31 WeakPolarHBondContact O-CB 3.38Å; R27-Q31 PolarHBondContact O-N 3.46Å; N28-Q31 PolarHBondContact O-N 3.3Å; Q31-R35 WeakPolarHBondContact O-CB 3.49Å; Q31-R35 PolarHBondContact O-N 3.41Å; Q31-R35 VanDerWaalsContact O-N 3.1Å
32K59.4Low60.3Low145 Ų145117.6 Ų117.663%0.6356%0.562SS**Hα-helixtrans-66.8-42.5171.8-78.6-176.6177.6-176.20112N28 A30 E34 R35 E36N28-K32 WeakPolarHBondContact O-CB 3.36Å; N28-K32 WeakPolarHBondContact O-CG 3.42Å; N28-K32 PolarHBondContact O-N 3.47Å; A30-K32 PolarHBondContact O-N 2.85Å; K32-E34 PolarHBondContact O-N 3.04Å; K32-R35 PolarHBondContact O-N 3.31Å; K32-E36 WeakPolarHBondContact O-CB 3.32Å; K32-E36 PolarHBondContact O-N 3.48Å
33N62.1Low61.2Low106 Ų106118 Ų11857%0.56758%0.577SS**Hα-helixtrans-63.9-39.7177.3-74.6-2.5000112.1K29 A30 S37K29-N33 VanDerWaalsContact O-CG 3.29Å; K29-N33 PolarHBondContact O-N 3.36Å; K29-N33 VanDerWaalsContact O-N 3.12Å; K29-N33 PolarHBondContact O-OD1 2.97Å; A30-N33 PolarHBondContact O-N 3.03Å; N33-S37 WeakPolarHBondContact O-CB 3.34Å; N33-S37 PolarHBondContact O-N 2.99Å
34E70.8Confident61.3Low131 Ų131119.9 Ų119.961%0.61258%0.582SS**Hα-helixtrans-66.5-43.7175.4-74.5-178169.600111.9A30 K32 E36 S37 I38A30-E34 PolarHBondContact O-N 2.99Å; K32-E34 PolarHBondContact O-N 3.04Å; E34-E36 VanDerWaalsContact C-N 3.33Å; E34-E36 PolarHBondContact O-N 2.81Å; E34-S37 PolarHBondContact O-N 3.4Å; E34-I38 WeakPolarHBondContact O-CB 3.4Å; E34-I38 WeakPolarHBondContact O-CD1 3.49Å; E34-I38 WeakPolarHBondContact O-CG1 3.33Å; E34-I38 PolarHBondContact O-N 3.38Å
35R74.4Confident61.1Low159 Ų159119.6 Ų119.660%0.658%0.584SS**Hα-helixtrans-63.9-37.2178.8-169.5-179.2177.2-134.51.6112.7Q31 K32 R39Q31-R35 WeakPolarHBondContact O-CB 3.49Å; Q31-R35 PolarHBondContact O-N 3.41Å; Q31-R35 VanDerWaalsContact O-N 3.1Å; K32-R35 PolarHBondContact O-N 3.31Å; R35-R39 PolarHBondContact O-N 3Å; R35-R39 VanDerWaalsContact O-N 3.15Å
36E65.9Low61.3Low116 Ų116119.7 Ų119.754%0.54259%0.593SS.*Hα-helixtrans-75.6-37.9177.2-167.3142.5-165.900112K32 E34 I38 R39 Q40K32-E36 WeakPolarHBondContact O-CB 3.32Å; K32-E36 PolarHBondContact O-N 3.48Å; E34-E36 VanDerWaalsContact C-N 3.33Å; E34-E36 PolarHBondContact O-N 2.81Å; E36-I38 PolarHBondContact O-N 3.4Å; E36-R39 PolarHBondContact O-N 3.31Å; E36-Q40 WeakPolarHBondContact O-CB 3.31Å; E36-Q40 VanDerWaalsContact O-CG 3.3Å; E36-Q40 WeakPolarHBondContact O-CG 3.4Å; E36-Q40 PolarHBondContact O-N 3.37Å
37S67.3Low61.5Low58 Ų58119.6 Ų119.641%0.40660%0.598SS.*Hα-helixtrans-63.5-38.9172.6-1740000112.6N33 E34 Q40 K41N33-S37 WeakPolarHBondContact O-CB 3.34Å; N33-S37 PolarHBondContact O-N 2.99Å; E34-S37 PolarHBondContact O-N 3.4Å; S37-Q40 PolarHBondContact O-N 3.2Å; S37-K41 WeakPolarHBondContact O-CB 3.46Å; S37-K41 PolarHBondContact O-N 3.2Å
38I68.5Low61.3Low100 Ų100118.8 Ų118.851%0.51360%0.6SS.*Hα-helixtrans-67.1-44175.4-68.2163.1000110.7E34 E36 Q40 K41 L42E34-I38 WeakPolarHBondContact O-CB 3.4Å; E34-I38 WeakPolarHBondContact O-CD1 3.49Å; E34-I38 WeakPolarHBondContact O-CG1 3.33Å; E34-I38 PolarHBondContact O-N 3.38Å; E36-I38 PolarHBondContact O-N 3.4Å; I38-Q40 VanDerWaalsContact C-N 3.34Å; I38-Q40 PolarHBondContact O-N 3.33Å; I38-K41 PolarHBondContact O-N 3.31Å; I38-L42 HydrophobicContact CG2-CD1 3.86Å; I38-L42 HydrophobicContact CG2-CG 4.4Å; I38-L42 WeakPolarHBondContact O-CB 3.3Å; I38-L42 WeakPolarHBondContact O-CG 3.23Å; I38-L42 PolarHBondContact O-N 2.92Å
39R75.8Confident60.9Low129 Ų129121.5 Ų121.549%0.48762%0.615SS.*Hα-helixtrans-61.2-41.1174.7-85.1-170.8-86.3-149.85.6112.5R35 E36 L42 A43R35-R39 PolarHBondContact O-N 3Å; R35-R39 VanDerWaalsContact O-N 3.15Å; E36-R39 PolarHBondContact O-N 3.31Å; R39-L42 PolarHBondContact O-N 2.97Å; R39-A43 VanDerWaalsContact O-CB 3.3Å; R39-A43 WeakPolarHBondContact O-CB 3.32Å; R39-A43 PolarHBondContact O-N 2.83Å
40Q71.3Confident60.7Low111 Ų111122.6 Ų122.652%0.51963%0.627SS.*Hα-helixtrans-66.5-40.1175.4-71.8174.32.300112.2E36 S37 I38 A43 L44E36-Q40 WeakPolarHBondContact O-CB 3.31Å; E36-Q40 VanDerWaalsContact O-CG 3.3Å; E36-Q40 WeakPolarHBondContact O-CG 3.4Å; E36-Q40 PolarHBondContact O-N 3.37Å; S37-Q40 PolarHBondContact O-N 3.2Å; I38-Q40 VanDerWaalsContact C-N 3.34Å; I38-Q40 PolarHBondContact O-N 3.33Å; Q40-A43 PolarHBondContact O-N 3.19Å; Q40-L44 WeakPolarHBondContact O-CB 3.31Å; Q40-L44 PolarHBondContact O-N 3.13Å
41K74.3Confident59.8Low156 Ų156122.8 Ų122.868%0.67863%0.634SS**Hα-helixtrans-65-38.9174.9-92.9-177.4173.5-174.40113.2S37 I38 G45S37-K41 WeakPolarHBondContact O-CB 3.46Å; S37-K41 PolarHBondContact O-N 3.2Å; I38-K41 PolarHBondContact O-N 3.31Å; K41-G45 PolarHBondContact O-N 2.85Å; K41-G45 VanDerWaalsContact O-N 3.11Å
42L68.1Low59.3Low139 Ų139123 Ų12373%0.72865%0.647SS**Hα-helixtrans-70.8-37.3176.1-71.7169.3000111.6I38 R39I38-L42 HydrophobicContact CG2-CD1 3.86Å; I38-L42 HydrophobicContact CG2-CG 4.4Å; I38-L42 WeakPolarHBondContact O-CB 3.3Å; I38-L42 WeakPolarHBondContact O-CG 3.23Å; I38-L42 PolarHBondContact O-N 2.92Å; R39-L42 PolarHBondContact O-N 2.97Å
43A64.1Low58.4Low85 Ų85119.6 Ų119.670%0.70265%0.653SS**Hα-helixtrans-71-27.8176.600000113.7R39 Q40R39-A43 VanDerWaalsContact O-CB 3.3Å; R39-A43 WeakPolarHBondContact O-CB 3.32Å; R39-A43 PolarHBondContact O-N 2.83Å; Q40-A43 PolarHBondContact O-N 3.19Å
44L58.8Low57.5Low139 Ų139122.4 Ų122.473%0.72867%0.666SS**THydrogen-bonded Turntrans-103.65-178.7-70.4168.3000114.5Q40Q40-L44 WeakPolarHBondContact O-CB 3.31Å; Q40-L44 PolarHBondContact O-N 3.13Å
45G47.4Very low56Low44 Ų44126.4 Ų126.445%0.45468%0.677SS.*THydrogen-bonded Turntrans42.385.7169.400000115.2K41 F47K41-G45 PolarHBondContact O-N 2.85Å; K41-G45 VanDerWaalsContact O-N 3.11Å; G45-F47 PolarHBondContact O-N 3.02Å
46S53.9Low54Low105 Ų105124.2 Ų124.273%0.73468%0.682SS**  trans21.669.3160.2-1770000115.8F48S46-F48 VanDerWaalsContact C-N 3.33Å
47F49.4Very low53Low185 Ų185124.3 Ų124.381%0.81170%0.695SS**  trans-92.29.7178.7-128.6-90.1000113.9G45G45-F47 PolarHBondContact O-N 3.02Å
48F42.2Very low51.2Low182 Ų182126.9 Ų126.980%0.79871%0.711SS**  trans-137.686.7171-85-90.2000108.7S46S46-F48 VanDerWaalsContact C-N 3.33Å
49D41.4Very low49.8Very low147 Ų147127 Ų12779%0.78672%0.722SS**  trans-90.3115.4153.7-177.250.6000105.9
50D48.8Very low48.7Very low154 Ų154131.3 Ų131.382%0.82474%0.744SS**  trans-121.896.6-175.6-136-7.6000108.1
51G35.1Very low47.5Very low58 Ų58131 Ų13160%0.59875%0.753SS**  trans-175.1140.7173.900000112.7
52P46.7Very low46.3Very low135 Ų135127.3 Ų127.388%0.87776%0.76SS**  trans-103.3140.3-131.836-31.7000116.1
53G40Very low45.8Very low72 Ų72129.6 Ų129.674%0.74276%0.764SS**  trans82.8114.6143.700000118
54I42.8Very low45.2Very low166 Ų166129.2 Ų129.285%0.85176%0.755SS**  158.3116.2110.8-71.5-98.4000108.5
55Y39.3Very low45.4Very low215 Ų215126.4 Ų126.484%0.84375%0.747SS**  trans69.1103.9155.3-133.2-105.6000119.3
56T32.8Very low45.7Very low113 Ų113131 Ų13169%0.69376%0.76SS**  169.3118102.9-61.30000109.1
57S44.6Very low45.8Very low117 Ų117130 Ų13082%0.81875%0.753SS**  trans-71.3123.9171.143.90000112.1
58C29.7Very low46.2Very low112 Ų112124.5 Ų124.576%0.75774%0.737SS**  trans-155.9128.8143.557.20000112.7
59S40.1Very low46.9Very low104 Ų104124.2 Ų124.273%0.72773%0.731SS**  trans77.295.5147.7-49.50000119.5S61S59-S61 PolarHBondContact O-N 3.4Å
60K51.4Low47.6Very low219 Ų219124 Ų12495%0.95273%0.729SS**  trans-36.5108.5145.7-64.6174.2176.5175.60110.8
61S47Very low48Very low103 Ų103125 Ų12572%0.7273%0.729SS**  trans-143.196158.360.40000109S59 K63S59-S61 PolarHBondContact O-N 3.4Å; S61-K63 PolarHBondContact O-N 2.69Å
62G49.3Very low49Very low79 Ų79127.2 Ų127.281%0.81474%0.735SS**PPolyproline II helixtrans-63.8120.8167.600000108.5
63K56.9Low49.2Very low187 Ų187123.4 Ų123.481%0.81372%0.72SS**PPolyproline II helixtrans-68130.7172-65.2173.4-179.7173.10107.9S61S61-K63 PolarHBondContact O-N 2.69Å
64P51.5Low50.1Low78 Ų78128.2 Ų128.251%0.50673%0.726SS.*PPolyproline II helixtrans-65.3146.6175.727.2-32.6000110
65S62.8Low50.6Low80 Ų80128 Ų12856%0.55973%0.726SS**PPolyproline II helixtrans-61.1154-177.970.90000111.9S67 S68S65-S67 PolarHBondContact O-N 3.29Å; S65-S67 VanDerWaalsContact O-N 3.09Å; S65-S68 WeakPolarHBondContact O-CB 3.45Å; S65-S68 PolarHBondContact O-N 3.28Å
66L54.6Low51.5Low139 Ų139126.5 Ų126.573%0.72873%0.732SS**Hα-helixtrans-50.2-32.9175.8-99.3159.1000113S68 R69 L70L66-S68 VanDerWaalsContact C-N 3.3Å; L66-S68 PolarHBondContact O-N 3.07Å; L66-R69 PolarHBondContact O-N 3.32Å; L66-L70 PolarHBondContact O-N 3.01Å
67S56.2Low52.7Low86 Ų86129.6 Ų129.660%0.60174%0.738SS**Hα-helixtrans-61-33.7175-74.40000113.7S65S65-S67 PolarHBondContact O-N 3.29Å; S65-S67 VanDerWaalsContact O-N 3.09Å
68S56.2Low53.4Low68 Ų68131.1 Ų131.148%0.47674%0.736SS.*Hα-helixtrans-73.3-29.5178.6173.20000112.5S65 L66S65-S68 WeakPolarHBondContact O-CB 3.45Å; S65-S68 PolarHBondContact O-N 3.28Å; L66-S68 VanDerWaalsContact C-N 3.3Å; L66-S68 PolarHBondContact O-N 3.07Å
69R56.9Low54.3Low176 Ų176131.4 Ų131.466%0.66474%0.738SS**Hα-helixtrans-75-26.7176.1-73.7-174.1-167.8-148.6-1.4113.2L66L66-R69 PolarHBondContact O-N 3.32Å
70L57.7Low54.5Low143 Ų143135.7 Ų135.775%0.74974%0.744SS**Hα-helixtrans-83.4-12.2-178-67.5171.5000114L66L66-L70 PolarHBondContact O-N 3.01Å
71Q57.1Low54.6Low175 Ų175131.1 Ų131.182%0.81873%0.734SS**SBendtrans-92.3-15.2178.1-76.7-179.8-1000114.3G73Q71-G73 PolarHBondContact O-N 3.3Å
72S55.5Low54.6Low104 Ų104132.4 Ų132.473%0.72773%0.733SS**SBendtrans-9093.5169.3-175.60000108.5
73G51.4Low55.1Low55 Ų55136.4 Ų136.457%0.56774%0.736SS**  trans-55.5153.9-174.800000115Q71Q71-G73 PolarHBondContact O-N 3.3Å
74M58.3Low54.8Low174 Ų174131.9 Ų131.986%0.85773%0.727SS**  trans57.297145.9-59.8159.361.900115.3
75N53.4Low55Low161 Ų161132.2 Ų132.286%0.86175%0.745SS**  trans-179.168.3142.4-82.6-31000110.2Q77N75-Q77 PolarHBondContact O-N 2.91Å
76L57.6Low54.2Low184 Ų184133.7 Ų133.796%0.96376%0.755SS**  trans-83.789.8159.4-88.1155.3000107I78L76-I78 PolarHBondContact O-N 2.93Å
77Q58.9Low54Low177 Ų177134.5 Ų134.583%0.82776%0.76SS**  trans-82.1114.1177.2-161.1170.6-0.100108.4N75 C79N75-Q77 PolarHBondContact O-N 2.91Å; Q77-C79 PolarHBondContact O-N 3.36Å
78I58.2Low53.9Low150 Ų150139.8 Ų139.877%0.76977%0.772SS**  trans-61.9125.3175.1-62.6169.9000108.1L76 F80L76-I78 PolarHBondContact O-N 2.93Å; I78-F80 PolarHBondContact O-N 3.48Å
79C49.3Very low53.6Low118 Ų118143.7 Ų143.780%0.79779%0.788SS**  trans-73.1107.2175.5-60.90000109.7Q77 V81Q77-C79 PolarHBondContact O-N 3.36Å; C79-V81 PolarHBondContact O-N 3.48Å
80F43.7Very low53.3Low194 Ų194140.7 Ų140.785%0.85179%0.794SS**  trans-77.2114.9165.7-119.5-94.6000108.4I78I78-F80 PolarHBondContact O-N 3.48Å
81V53.6Low53.1Low122 Ų122141.8 Ų141.874%0.73980%0.8SS**  trans-81.5117.7170-1750000106.9C79C79-V81 PolarHBondContact O-N 3.48Å
82N47.9Very low52.7Low131 Ų131138.3 Ų138.370%0.70180%0.801SS**  trans-84.6109169.3-118.623.1000107.6S84N82-S84 PolarHBondContact O-N 3.2Å; N82-S84 VanDerWaalsContact O-N 3.14Å
83D58.8Low52.5Low163 Ų163140.6 Ų140.687%0.87281%0.806SS**  trans-70.1100.3156.4-89-29.6000107.1
84S50.7Low52.1Low92 Ų92144.8 Ų144.864%0.64382%0.815SS**  trans-124.9104.2166.9-64.50000106.7N82N82-S84 PolarHBondContact O-N 3.2Å; N82-S84 VanDerWaalsContact O-N 3.14Å
85G56.3Low51.2Low84 Ų84141 Ų14187%0.86681%0.806SS**  trans-57.9147.1175.600000111.7
86S45.9Very low50.5Low111 Ų111142.8 Ų142.878%0.77681%0.806SS**  trans-133.6110.915368.10000108.6
87D50.5Low49.7Very low157 Ų157140.4 Ų140.484%0.8480%0.799SS**  trans-41.4132.8156.3-82.3-42.1000110.7
88K54.7Low48.8Very low197 Ų197140.7 Ų140.786%0.85780%0.8SS**  trans-149.8105.1157-135.7176.3179.6175.40108.9
89D49.1Very low47.7Very low150 Ų150139.7 Ų139.780%0.80280%0.802SS**  trans-53.7132.8169.9-57.1-62000110.5
90S51.6Low47.1Very low112 Ų112139.2 Ų139.278%0.78380%0.8SS**  trans-139.2106.9158.562.20000108.8
91D53.2Low47Very low166 Ų166137.9 Ų137.989%0.88880%0.8SS**  trans-56.8128.8168.6-64.3-64.8000110.9
92A48.6Very low46.2Very low102 Ų102139.2 Ų139.284%0.84380%0.803SS**  trans-149111.2156.400000109.4
93D50.8Low45.9Very low153 Ų153138.7 Ų138.782%0.81881%0.805SS**  trans-43.3129.6169.1-172.625.2000114
94D42Very low45Very low142 Ų142136.3 Ų136.376%0.75980%0.798SS**  trans-156.8108.2141.8-139.1-14000113
95S40.4Very low44.2Very low95 Ų95139.7 Ų139.766%0.66481%0.809SS**  trans21.1103.1143.2-43.10000119.1
96K39.1Very low43.4Very low198 Ų198140.7 Ų140.786%0.86180%0.802SS**  trans-93.8115.3158-72.6-179178.2173.40109.7E98K96-E98 PolarHBondContact O-N 3.21Å
97T39.8Very low43.5Very low135 Ų135141.7 Ų141.783%0.82881%0.806SS**  trans-75.6114.6163.340.70000110
98E40.3Very low42.9Very low182 Ų182141.3 Ų141.385%0.8580%0.801SS**  trans-46.3129159.3-46.3-86.8130.100111.3K96K96-E98 PolarHBondContact O-N 3.21Å
99T35.3Very low42.7Very low130 Ų130137.9 Ų137.980%0.79880%0.802SS**  trans-150.691.1153.5157.90000109.3
100S36.7Very low42.6Very low108 Ų108138.9 Ų138.976%0.75580%0.799SS**  trans3.7127.8148.9-1650000118.1
101L41.8Very low42.7Very low165 Ų165143 Ų14386%0.86481%0.806SS**  trans-40128.9146.3-62.1158.4000111
102D35.8Very low42.3Very low150 Ų150140.7 Ų140.780%0.80280%0.803SS**  trans-162.7127.2131.9-152.141.5000110.9
103T42.4Very low42.6Very low121 Ų121141.4 Ų141.474%0.74280%0.802SS**  trans-98.4133.1174.4-60.70000108
104P39.8Very low42.6Very low112 Ų112139.6 Ų139.673%0.72780%0.801SS**  trans-128.1119.914221.4-3000112.5
105L33.7Very low42.9Very low164 Ų164143 Ų14386%0.85981%0.805SS**  trans-0.2136.7149.9-60.3166.7000119
106S40.6Very low43.4Very low105 Ų105143.3 Ų143.373%0.73481%0.807SS**  trans-57169.3172.4-47.60000114.7
107P47.4Very low44.1Very low131 Ų131141 Ų14185%0.85180%0.804SS**  -133.5135.1105.113.27.6000114.6
108M38.8Very low44.8Very low149 Ų149145.5 Ų145.573%0.73481%0.806SS**  trans-62.7127.4168.2-71.2148.559.300111.6
109S49.8Very low45Very low126 Ų126143.2 Ų143.288%0.88180%0.8SS**  trans-86.7105.8159.7-87.90000109.8
110K45.9Very low45.6Very low171 Ų171142 Ų14274%0.74379%0.792SS**  trans-81.3116.3161.1-65.5177.2179.3177.70107.9
111Q53.9Low46.1Very low198 Ų198142.6 Ų142.693%0.92579%0.791SS**  trans-132.3124.1150.6-74.4-163.3-64.800109.5
112S46.3Very low46.3Very low117 Ų117142.8 Ų142.882%0.81879%0.788SS**  trans-82.6140.7-173.5-27.80000111.1
113S53.6Low46.9Very low118 Ų118142.8 Ų142.883%0.82579%0.788SS**  trans-156.387.7153.461.60000107.6
114S50.8Low47.1Very low114 Ų114143.3 Ų143.380%0.79779%0.786SS**  64.297.188-159.30000113.9
115Y48.5Very low47.6Very low214 Ų214144 Ų14484%0.83979%0.793SS**  trans29.3110.2143.1-87-95.8000120.3
116S52.1Low48.4Very low102 Ų102141.9 Ų141.971%0.71378%0.779SS**  -154.497.512558.80000105.4
117D51.9Low49Very low148 Ų148139.2 Ų139.279%0.79176%0.761SS**  36.670.181-145.87.8000112.1
118R56.2Low49.3Very low230 Ų230136.9 Ų136.987%0.86874%0.74SS**  trans-133.291.3159.2-82.4-160.5160.7-167.3-5.8107.8
119D44Very low50.2Low135 Ų135138.5 Ų138.572%0.72275%0.746SS**  trans47.779.7132.6-142.713.6000113.8T121D119-T121 PolarHBondContact O-N 3.45Å
120T48.6Very low51Low105 Ų105139.4 Ų139.464%0.64474%0.741SS**  trans-48.792.5146.540.90000108.8E122T120-E122 HydrophobicContact CG2-CG 4.42Å; T120-E122 PolarHBondContact O-N 3.33Å
121T46Very low52.1Low120 Ų120133.4 Ų133.474%0.73672%0.716SS**  trans-71.369.9148.959.30000107D119 D123D119-T121 PolarHBondContact O-N 3.45Å; T121-D123 PolarHBondContact O-N 2.92Å
122E47.1Very low53.7Low168 Ų168130.2 Ų130.279%0.78571%0.706SS**  trans-68.177.2151.9-75.9176-163.800106.3T120T120-E122 HydrophobicContact CG2-CG 4.42Å; T120-E122 PolarHBondContact O-N 3.33Å
123D47.8Very low55.6Low150 Ų150132.3 Ų132.380%0.80270%0.7SS**  trans-149.379.3172.1-151.720.3000108.2T121T121-D123 PolarHBondContact O-N 2.92Å
124D46.3Very low57.2Low132 Ų132132.8 Ų132.871%0.70669%0.693SS**SBendtrans168.713.4138.1-128.70.8000112.8E126D124-E126 PolarHBondContact O-N 3.17Å
125S49.7Very low59Low126 Ų126130.4 Ų130.488%0.88168%0.676SS**  trans-80.261.7162.9-63.90000109.5S127S125-S127 PolarHBondContact O-N 2.81Å
126E51.8Low61Low120 Ų120126.1 Ų126.156%0.56166%0.659SS**  trans-51.8113.9159.8-72.3-171156.300106.9D124 L128D124-E126 PolarHBondContact O-N 3.17Å; E126-L128 PolarHBondContact O-N 3.33Å; E126-L128 VanDerWaalsContact O-N 3.08Å
127S52.5Low62.9Low50 Ų50125.9 Ų125.935%0.3565%0.646SS.*  trans-49.1120.5176.2110.10000107.4S125 E129 D130S125-S127 PolarHBondContact O-N 2.81Å; S127-E129 PolarHBondContact O-N 2.8Å; S127-E129 PolarHBondContact OG-N 3.19Å; S127-D130 PolarHBondContact O-N 2.95Å; S127-D130 VanDerWaalsContact OG-CG 3.29Å; S127-D130 PolarHBondContact OG-N 3.15Å; S127-D130 PolarHBondContact OG-OD2 3.39Å
128L53.7Low64.8Low81 Ų81126.4 Ų126.442%0.42464%0.641SS.*THydrogen-bonded Turntrans-65.2-7.4177-67.2-178.3000112E126 M131 K139E126-L128 PolarHBondContact O-N 3.33Å; E126-L128 VanDerWaalsContact O-N 3.08Å; L128-M131 HydrophobicContact CD2-CE 3.33Å; L128-M131 HydrophobicContact CG-CE 4.46Å; L128-K139 HydrophobicContact CD2-CD 3.92Å
129E56.9Low66.5Low183 Ų183119.5 Ų119.586%0.85562%0.618SS**THydrogen-bonded Turntrans-88.7-25.7-173.8-60.4-175.3171.200111.9S127S127-E129 PolarHBondContact O-N 2.8Å; S127-E129 PolarHBondContact OG-N 3.19Å
130D67.8Low68.9Low146 Ų146117.3 Ų117.378%0.78161%0.606SS**SBendtrans-95.7-0.2-178.9-67.2-46.7000114.5S127S127-D130 PolarHBondContact O-N 2.95Å; S127-D130 VanDerWaalsContact OG-CG 3.29Å; S127-D130 PolarHBondContact OG-N 3.15Å; S127-D130 PolarHBondContact OG-OD2 3.39Å
131M69.4Low71.1Confident44 Ų44117.2 Ų117.222%0.21760%0.598CS.*SBendtrans-86.1135178.8-79.8-169.3-79.700112.9L128 K139L128-M131 HydrophobicContact CD2-CE 3.33Å; L128-M131 HydrophobicContact CG-CE 4.46Å; M131-K139 HydrophobicContact CE-CD 3.79Å; M131-K139 HydrophobicContact SD-CD 4.39Å
132D86.4Confident73.4Confident131 Ų131114.3 Ų114.370%0.70159%0.586SS**  trans-51.9143.4170.4-76.8-20.5000111.8L134 S135 R136D132-L134 PolarHBondContact O-N 3.37Å; D132-L134 VanDerWaalsContact O-N 3.08Å; D132-S135 WeakPolarHBondContact O-CA 3.49Å; D132-S135 WeakPolarHBondContact O-CB 3.48Å; D132-S135 PolarHBondContact O-N 3.43Å; D132-R136 PolarHBondContact O-N 3.45Å
133F85.5Confident75.7Confident162 Ų162112.2 Ų112.271%0.71158%0.576SS**Hα-helixtrans-49-42.8-174.5178.2-94.4000113.6R136 Q137F133-R136 PolarHBondContact O-N 3.36Å; F133-Q137 WeakPolarHBondContact O-CB 3.49Å; F133-Q137 PolarHBondContact O-N 2.92Å
134L87.3Confident77.9Confident128 Ų128107.5 Ų107.567%0.6756%0.558SS**Hα-helixtrans-66.5-38.8179.6-71.2168.5000112.5D132 K138D132-L134 PolarHBondContact O-N 3.37Å; D132-L134 VanDerWaalsContact O-N 3.08Å; L134-K138 WeakPolarHBondContact O-CB 3.45Å; L134-K138 PolarHBondContact O-N 2.98Å
135S90.5Very high80.3Confident64 Ų64107.1 Ų107.145%0.44855%0.55SS.*Hα-helixtrans-67-44.2176.3-61.30000110.5D132 K138 K139D132-S135 WeakPolarHBondContact O-CA 3.49Å; D132-S135 WeakPolarHBondContact O-CB 3.48Å; D132-S135 PolarHBondContact O-N 3.43Å; S135-K138 PolarHBondContact O-N 3.18Å; S135-K139 PolarHBondContact O-N 3.2Å
136R90.3Very high82.5Confident123 Ų123105.8 Ų105.846%0.46453%0.533SS..Hα-helixtrans-62.5-45.3175.6-169.8175.1-178.7-149.51.3112.2D132 F133 K138 K139 L140D132-R136 PolarHBondContact O-N 3.45Å; F133-R136 PolarHBondContact O-N 3.36Å; R136-K138 VanDerWaalsContact C-N 3.34Å; R136-K138 PolarHBondContact O-N 3.22Å; R136-K139 PolarHBondContact O-N 3.17Å; R136-L140 HydrophobicContact CG-CD1 4.19Å; R136-L140 WeakPolarHBondContact O-CG 3.36Å; R136-L140 PolarHBondContact O-N 3.43Å
137Q90.6Very high84.6Confident98 Ų98102.9 Ų102.946%0.45853%0.529SS..Hα-helixtrans-58.4-45.8175.3-178.1-175.32.700111.3F133 L140 Q141F133-Q137 WeakPolarHBondContact O-CB 3.49Å; F133-Q137 PolarHBondContact O-N 2.92Å; Q137-L140 PolarHBondContact O-N 3.44Å; Q137-Q141 VanDerWaalsContact O-CB 3.3Å; Q137-Q141 WeakPolarHBondContact O-CB 3.39Å; Q137-Q141 PolarHBondContact O-N 3.07Å
138K92.1Very high86.6Confident158 Ų158107 Ų10769%0.68755%0.546SS*.Hα-helixtrans-63.9-41179.2-172180178.7-174.30111.9L134 S135 R136 Q141 A142L134-K138 WeakPolarHBondContact O-CB 3.45Å; L134-K138 PolarHBondContact O-N 2.98Å; S135-K138 PolarHBondContact O-N 3.18Å; R136-K138 VanDerWaalsContact C-N 3.34Å; R136-K138 PolarHBondContact O-N 3.22Å; K138-Q141 PolarHBondContact O-N 3.38Å; K138-A142 WeakPolarHBondContact O-CB 3.48Å; K138-A142 PolarHBondContact O-N 3.04Å
139K93.3Very high88.6Confident86 Ų86106.4 Ų106.437%0.37455%0.553SS.*Hα-helixtrans-62.1-52.6176.2-171174.9-176.2170.10111.1L128 M131 S135 R136 Q141 A142 E143L128-K139 HydrophobicContact CD2-CD 3.92Å; M131-K139 HydrophobicContact CE-CD 3.79Å; M131-K139 HydrophobicContact SD-CD 4.39Å; S135-K139 PolarHBondContact O-N 3.2Å; R136-K139 PolarHBondContact O-N 3.17Å; K139-Q141 VanDerWaalsContact C-N 3.31Å; K139-Q141 PolarHBondContact O-N 3.23Å; K139-A142 WeakPolarHBondContact O-CB 3.36Å; K139-A142 PolarHBondContact O-N 3.36Å; K139-A142 VanDerWaalsContact O-N 3.11Å; K139-E143 PolarHBondContact O-N 3.42Å
140L93.2Very high90.5Very high89 Ų89102.7 Ų102.747%0.46654%0.537SS..Hα-helixtrans-60.4-39.5177.9-71171.3000112.4R136 Q137 A142 E143 A144R136-L140 HydrophobicContact CG-CD1 4.19Å; R136-L140 WeakPolarHBondContact O-CG 3.36Å; R136-L140 PolarHBondContact O-N 3.43Å; Q137-L140 PolarHBondContact O-N 3.44Å; L140-A142 VanDerWaalsContact C-N 3.35Å; L140-A142 PolarHBondContact O-N 2.72Å; L140-E143 PolarHBondContact O-N 3.46Å; L140-A144 WeakPolarHBondContact O-CB 3.38Å; L140-A144 PolarHBondContact O-N 2.91Å
141Q94.3Very high91.8Very high102 Ų10298 Ų9848%0.47752%0.519SS..Hα-helixtrans-65.4-38.8176.3-168.3-171.723.500112Q137 K138 K139 K145Q137-Q141 VanDerWaalsContact O-CB 3.3Å; Q137-Q141 WeakPolarHBondContact O-CB 3.39Å; Q137-Q141 PolarHBondContact O-N 3.07Å; K138-Q141 PolarHBondContact O-N 3.38Å; K139-Q141 VanDerWaalsContact C-N 3.31Å; K139-Q141 PolarHBondContact O-N 3.23Å; Q141-K145 HydrophobicContact CG-CD 4.36Å; Q141-K145 WeakPolarHBondContact O-CB 3.48Å; Q141-K145 VanDerWaalsContact O-CG 3.23Å; Q141-K145 WeakPolarHBondContact O-CG 3.31Å; Q141-K145 PolarHBondContact O-N 3.4Å; Q141-K145 VanDerWaalsContact O-N 3.08Å
142A95.8Very high93Very high59 Ų59103.2 Ų103.249%0.48854%0.54SS..Hα-helixtrans-66.2-43.4176.600000111.3K138 K139 L140 K145 L146K138-A142 WeakPolarHBondContact O-CB 3.48Å; K138-A142 PolarHBondContact O-N 3.04Å; K139-A142 WeakPolarHBondContact O-CB 3.36Å; K139-A142 PolarHBondContact O-N 3.36Å; K139-A142 VanDerWaalsContact O-N 3.11Å; L140-A142 VanDerWaalsContact C-N 3.35Å; L140-A142 PolarHBondContact O-N 2.72Å; A142-K145 PolarHBondContact O-N 3.04Å; A142-L146 WeakPolarHBondContact O-CB 3.32Å; A142-L146 PolarHBondContact O-N 3.47Å
143E95.3Very high93.5Very high124 Ų124100.4 Ų100.458%0.57953%0.529SS*.Hα-helixtrans-61.2-49.4176.1-173.1-179.3167.400111.8K139 L140 K145 L146 A147K139-E143 PolarHBondContact O-N 3.42Å; L140-E143 PolarHBondContact O-N 3.46Å; E143-K145 VanDerWaalsContact C-N 3.31Å; E143-K145 PolarHBondContact O-N 2.82Å; E143-L146 WeakPolarHBondContact O-CB 3.41Å; E143-L146 PolarHBondContact O-N 3.28Å; E143-L146 VanDerWaalsContact O-N 3.12Å; E143-A147 WeakPolarHBondContact O-CB 3.45Å; E143-A147 PolarHBondContact O-N 3.49Å
144A93.8Very high94.1Very high51 Ų5198.3 Ų98.342%0.42152%0.523SS..Hα-helixtrans-59.8-40.6177.400000112.2L140 A147 L148L140-A144 WeakPolarHBondContact O-CB 3.38Å; L140-A144 PolarHBondContact O-N 2.91Å; A144-A147 PolarHBondContact O-N 3.32Å; A144-L148 WeakPolarHBondContact O-CB 3.45Å; A144-L148 WeakPolarHBondContact O-CG 3.5Å; A144-L148 PolarHBondContact O-N 2.89Å
145K95.9Very high94.4Very high125 Ų12595 Ų9554%0.54351%0.514SS..Hα-helixtrans-63.8-41.7175.4-77.3172.3-178.6169.90111.9Q141 A142 E143 A149Q141-K145 HydrophobicContact CG-CD 4.36Å; Q141-K145 WeakPolarHBondContact O-CB 3.48Å; Q141-K145 VanDerWaalsContact O-CG 3.23Å; Q141-K145 WeakPolarHBondContact O-CG 3.31Å; Q141-K145 PolarHBondContact O-N 3.4Å; Q141-K145 VanDerWaalsContact O-N 3.08Å; A142-K145 PolarHBondContact O-N 3.04Å; E143-K145 VanDerWaalsContact C-N 3.31Å; E143-K145 PolarHBondContact O-N 2.82Å; K145-A149 WeakPolarHBondContact O-CB 3.43Å; K145-A149 PolarHBondContact O-N 3.32Å
146L96.4Very high94.6Very high98 Ų9898.8 Ų98.851%0.51352%0.522SS..Hα-helixtrans-65.1-48.1177.2-176.364000111.2A142 E143 L148 A149 M150A142-L146 WeakPolarHBondContact O-CB 3.32Å; A142-L146 PolarHBondContact O-N 3.47Å; E143-L146 WeakPolarHBondContact O-CB 3.41Å; E143-L146 PolarHBondContact O-N 3.28Å; E143-L146 VanDerWaalsContact O-N 3.12Å; L146-L148 PolarHBondContact O-N 3.38Å; L146-A149 WeakPolarHBondContact O-CB 3.2Å; L146-A149 PolarHBondContact O-N 2.93Å; L146-A149 VanDerWaalsContact O-N 3.13Å; L146-M150 HydrophobicContact CD1-CE 3.68Å; L146-M150 HydrophobicContact CD1-SD 4.3Å; L146-M150 HydrophobicContact CD2-CE 4.28Å; L146-M150 HydrophobicContact CG-CE 3.96Å; L146-M150 HydrophobicContact CG-SD 4.07Å; L146-M150 WeakPolarHBondContact O-CG 3.5Å; L146-M150 PolarHBondContact O-N 2.87Å
147A95.6Very high94.9Very high59 Ų5998.7 Ų98.749%0.48853%0.529SS..Hα-helixtrans-58.1-46.4177.900000111.6E143 A144 A149 M150 A151E143-A147 WeakPolarHBondContact O-CB 3.45Å; E143-A147 PolarHBondContact O-N 3.49Å; A144-A147 PolarHBondContact O-N 3.32Å; A147-A149 VanDerWaalsContact C-N 3.33Å; A147-A149 PolarHBondContact O-N 3.22Å; A147-M150 PolarHBondContact O-N 3.49Å; A147-A151 PolarHBondContact O-N 2.94Å
148L94.6Very high95.1Very high135 Ų13598.8 Ų98.871%0.70753%0.529SS*.Hα-helixtrans-60.8-39.8175.2-78169.2000112.7A144 L146 M150A144-L148 WeakPolarHBondContact O-CB 3.45Å; A144-L148 WeakPolarHBondContact O-CG 3.5Å; A144-L148 PolarHBondContact O-N 2.89Å; L146-L148 PolarHBondContact O-N 3.38Å; L148-M150 VanDerWaalsContact C-N 3.32Å; L148-M150 PolarHBondContact O-N 3.13Å
149A96.6Very high95Very high69 Ų6995.6 Ų95.657%0.5752%0.523SS*.Hα-helixtrans-66.5-34.7176.700000112.4K145 L146 A147 P153K145-A149 WeakPolarHBondContact O-CB 3.43Å; K145-A149 PolarHBondContact O-N 3.32Å; L146-A149 WeakPolarHBondContact O-CB 3.2Å; L146-A149 PolarHBondContact O-N 2.93Å; L146-A149 VanDerWaalsContact O-N 3.13Å; A147-A149 VanDerWaalsContact C-N 3.33Å; A147-A149 PolarHBondContact O-N 3.22Å; A149-P153 VanDerWaalsContact O-CD 3.28Å; A149-P153 WeakPolarHBondContact O-CD 3.41Å
150M96.8Very high95Very high106 Ų10695.5 Ų95.552%0.52252%0.524SS..Hα-helixtrans-81.6-24.8179.7-70.9-179.7168.900113.9L146 A147 L148 K152 P153 M154L146-M150 HydrophobicContact CD1-CE 3.68Å; L146-M150 HydrophobicContact CD1-SD 4.3Å; L146-M150 HydrophobicContact CD2-CE 4.28Å; L146-M150 HydrophobicContact CG-CE 3.96Å; L146-M150 HydrophobicContact CG-SD 4.07Å; L146-M150 WeakPolarHBondContact O-CG 3.5Å; L146-M150 PolarHBondContact O-N 2.87Å; A147-M150 PolarHBondContact O-N 3.49Å; L148-M150 VanDerWaalsContact C-N 3.32Å; L148-M150 PolarHBondContact O-N 3.13Å; M150-K152 PolarHBondContact O-N 3.09Å; M150-P153 WeakPolarHBondContact O-CD 3.41Å; M150-P153 VanDerWaalsContact O-CG 3.23Å; M150-P153 WeakPolarHBondContact O-CG 3.35Å; M150-M154 WeakPolarHBondContact O-CB 3.44Å; M150-M154 PolarHBondContact O-N 3.37Å
151A94.4Very high94.9Very high48 Ų4894.1 Ų94.140%0.39752%0.519SS..Hα-helixtrans-55.2-49-174.200000113.2A147 M154 A155A147-A151 PolarHBondContact O-N 2.94Å; A151-M154 PolarHBondContact O-N 3.07Å; A151-A155 WeakPolarHBondContact O-CB 3.4Å; A151-A155 PolarHBondContact O-N 2.95Å
152K95Very high94.6Very high152 Ų15293.3 Ų93.366%0.66152%0.515SS*.Hα-helixtrans-65.9-49.8-178.9-174.1174.8-174.1172.30114.2M150 M154 A155 K156M150-K152 PolarHBondContact O-N 3.09Å; K152-M154 VanDerWaalsContact C-N 3.32Å; K152-A155 PolarHBondContact O-N 3.5Å; K152-K156 PolarHBondContact O-N 2.96Å; K152-K156 VanDerWaalsContact O-N 3.13Å
153P97.1Very high94.1Very high72 Ų7296.2 Ų96.247%0.46852%0.517SS..Hα-helixtrans-64.7-37176.122.8-31.7000112.1A149 M150 K156 M157A149-P153 VanDerWaalsContact O-CD 3.28Å; A149-P153 WeakPolarHBondContact O-CD 3.41Å; M150-P153 WeakPolarHBondContact O-CD 3.41Å; M150-P153 VanDerWaalsContact O-CG 3.23Å; M150-P153 WeakPolarHBondContact O-CG 3.35Å; P153-K156 PolarHBondContact O-N 3.38Å; P153-M157 WeakPolarHBondContact O-CB 3.18Å; P153-M157 PolarHBondContact O-N 3.32Å
154M96.6Very high93.5Very high119 Ų11997.2 Ų97.259%0.58652%0.521SS*.Hα-helixtrans-62.1-44.6175.9-170.6173.574.700111.6M150 A151 K152 K156 M157 Q158M150-M154 WeakPolarHBondContact O-CB 3.44Å; M150-M154 PolarHBondContact O-N 3.37Å; A151-M154 PolarHBondContact O-N 3.07Å; K152-M154 VanDerWaalsContact C-N 3.32Å; M154-K156 VanDerWaalsContact C-N 3.35Å; M154-K156 PolarHBondContact O-N 2.93Å; M154-M157 HydrophobicContact CG-CE 4.39Å; M154-M157 WeakPolarHBondContact O-CB 3.23Å; M154-M157 PolarHBondContact O-N 3.47Å; M154-Q158 WeakPolarHBondContact O-CB 3.5Å; M154-Q158 PolarHBondContact O-N 3.17Å
155A93.6Very high92.9Very high58 Ų58100.7 Ų100.748%0.47953%0.533SS..Hα-helixtrans-61-40.4174.800000112.7A151 K152 Q158 V159A151-A155 WeakPolarHBondContact O-CB 3.4Å; A151-A155 PolarHBondContact O-N 2.95Å; K152-A155 PolarHBondContact O-N 3.5Å; A155-Q158 PolarHBondContact O-N 3.41Å; A155-V159 WeakPolarHBondContact O-CG2 3.48Å; A155-V159 PolarHBondContact O-N 3.14Å; A155-V159 VanDerWaalsContact O-N 3.14Å
156K95.9Very high92Very high143 Ų143100.3 Ų100.362%0.62253%0.528SS*.Hα-helixtrans-64.8-42175-74.4-177.5175.8-173.80112.5K152 P153 M154 Q158 V159 E160K152-K156 PolarHBondContact O-N 2.96Å; K152-K156 VanDerWaalsContact O-N 3.13Å; P153-K156 PolarHBondContact O-N 3.38Å; M154-K156 VanDerWaalsContact C-N 3.35Å; M154-K156 PolarHBondContact O-N 2.93Å; K156-Q158 VanDerWaalsContact C-N 3.33Å; K156-V159 PolarHBondContact O-N 3.5Å; K156-E160 PolarHBondContact O-N 2.94Å
157M96.4Very high90.7Very high122 Ų122104.9 Ų104.960%0.60154%0.544SS*.Hα-helixtrans-61.9-44.5176.9-179.7173.965.500110.5P153 M154 V159 E160 V161P153-M157 WeakPolarHBondContact O-CB 3.18Å; P153-M157 PolarHBondContact O-N 3.32Å; M154-M157 HydrophobicContact CG-CE 4.39Å; M154-M157 WeakPolarHBondContact O-CB 3.23Å; M154-M157 PolarHBondContact O-N 3.47Å; M157-V159 PolarHBondContact O-N 2.94Å; M157-E160 PolarHBondContact O-N 3.42Å; M157-E160 VanDerWaalsContact O-N 3.17Å; M157-V161 WeakPolarHBondContact O-CG2 3.28Å; M157-V161 PolarHBondContact O-N 3.46Å
158Q94.4Very high89.5Confident99 Ų99111.2 Ų111.246%0.46356%0.56SS.*Hα-helixtrans-56.4-46.9176.8-175.961.126.200112.1M154 A155 K156 E160 V161 E162M154-Q158 WeakPolarHBondContact O-CB 3.5Å; M154-Q158 PolarHBondContact O-N 3.17Å; A155-Q158 PolarHBondContact O-N 3.41Å; K156-Q158 VanDerWaalsContact C-N 3.33Å; Q158-E160 VanDerWaalsContact C-N 3.32Å; Q158-E160 PolarHBondContact O-N 3.13Å; Q158-V161 PolarHBondContact O-N 3.11Å; Q158-E162 WeakPolarHBondContact CG-OE1 3.46Å; Q158-E162 PolarHBondContact NE2-OE1 3.26Å; Q158-E162 WeakPolarHBondContact O-CG 3.15Å; Q158-E162 PolarHBondContact O-N 2.89Å
159V90.9Very high88.6Confident91 Ų91105.1 Ų105.155%0.55253%0.529SS*.Hα-helixtrans-61.3-38.4177.81720000112.3A155 K156 M157 K163A155-V159 WeakPolarHBondContact O-CG2 3.48Å; A155-V159 PolarHBondContact O-N 3.14Å; A155-V159 VanDerWaalsContact O-N 3.14Å; K156-V159 PolarHBondContact O-N 3.5Å; M157-V159 PolarHBondContact O-N 2.94Å; V159-K163 WeakPolarHBondContact O-CB 3.38Å; V159-K163 PolarHBondContact O-N 3.11Å
160E91.5Very high87.8Confident84 Ų84105.3 Ų105.339%0.39352%0.524SS..Hα-helixtrans-71.6-35.9177.6-166.164.1-144.400111.8K156 M157 Q158 K163 Q164K156-E160 PolarHBondContact O-N 2.94Å; M157-E160 PolarHBondContact O-N 3.42Å; M157-E160 VanDerWaalsContact O-N 3.17Å; Q158-E160 VanDerWaalsContact C-N 3.32Å; Q158-E160 PolarHBondContact O-N 3.13Å; E160-K163 PolarHBondContact O-N 3.39Å; E160-K163 IonicContact OE1-NZ 2.85Å; E160-K163 PolarHBondContact OE1-NZ 2.99Å; E160-K163 IonicContact OE2-NZ 3.31Å; E160-K163 PolarHBondContact OE2-NZ 3.37Å; E160-Q164 WeakPolarHBondContact O-CG 3.41Å; E160-Q164 PolarHBondContact O-N 2.98Å
161V92.4Very high87.3Confident60 Ų60100.3 Ų100.336%0.36450%0.5SS..Hα-helixtrans-61.9-47.2173.3171.20000110.7M157 Q158 K163 Q164 N165M157-V161 WeakPolarHBondContact O-CG2 3.28Å; M157-V161 PolarHBondContact O-N 3.46Å; Q158-V161 PolarHBondContact O-N 3.11Å; V161-K163 VanDerWaalsContact C-N 3.3Å; V161-K163 PolarHBondContact O-N 2.83Å; V161-Q164 PolarHBondContact O-N 2.94Å; V161-Q164 VanDerWaalsContact O-N 3.15Å; V161-N165 WeakPolarHBondContact O-CB 3.45Å; V161-N165 PolarHBondContact O-N 2.97Å
162E88.6Confident86.8Confident86 Ų8699.8 Ų99.840%0.40250%0.495SS..Hα-helixtrans-61.4-39.6177.6-74.5168.9-173.400112.1Q158 Q164 N165 R166Q158-E162 WeakPolarHBondContact CG-OE1 3.46Å; Q158-E162 PolarHBondContact NE2-OE1 3.26Å; Q158-E162 WeakPolarHBondContact O-CG 3.15Å; Q158-E162 PolarHBondContact O-N 2.89Å; E162-Q164 VanDerWaalsContact C-N 3.32Å; E162-Q164 PolarHBondContact O-N 3.21Å; E162-N165 CarbonylContact O-C 3.57Å; E162-N165 PolarHBondContact O-N 3.08Å; E162-R166 WeakPolarHBondContact O-CG 3.43Å; E162-R166 PolarHBondContact O-N 3.04Å
163K84.3Confident86.4Confident119 Ų11999 Ų9952%0.51750%0.498SS..Hα-helixtrans-62.6-37.6175.2-178.7-179.4156.6-140.70112.6V159 E160 V161V159-K163 WeakPolarHBondContact O-CB 3.38Å; V159-K163 PolarHBondContact O-N 3.11Å; E160-K163 PolarHBondContact O-N 3.39Å; E160-K163 IonicContact OE1-NZ 2.85Å; E160-K163 PolarHBondContact OE1-NZ 2.99Å; E160-K163 IonicContact OE2-NZ 3.31Å; E160-K163 PolarHBondContact OE2-NZ 3.37Å; V161-K163 VanDerWaalsContact C-N 3.3Å; V161-K163 PolarHBondContact O-N 2.83Å
164Q82.3Confident85.9Confident145 Ų145100.9 Ų100.968%0.67850%0.504SS*.Hα-helixtrans-71.3-33.2174.5-70-179.412.900112.4E160 V161 E162 R166E160-Q164 WeakPolarHBondContact O-CG 3.41Å; E160-Q164 PolarHBondContact O-N 2.98Å; V161-Q164 PolarHBondContact O-N 2.94Å; V161-Q164 VanDerWaalsContact O-N 3.15Å; E162-Q164 VanDerWaalsContact C-N 3.32Å; E162-Q164 PolarHBondContact O-N 3.21Å; Q164-R166 VanDerWaalsContact C-N 3.28Å; Q164-R166 PolarHBondContact O-N 3.42Å
165N82.4Confident85.5Confident124 Ų12495.9 Ų95.966%0.66348%0.479SS*.THydrogen-bonded Turntrans-84.14.2-179.5-72.4-17.9000114.2V161 E162 K167V161-N165 WeakPolarHBondContact O-CB 3.45Å; V161-N165 PolarHBondContact O-N 2.97Å; E162-N165 CarbonylContact O-C 3.57Å; E162-N165 PolarHBondContact O-N 3.08Å; N165-K167 PolarHBondContact O-N 2.91Å
166R77.1Confident84.9Confident118 Ų11897.1 Ų97.145%0.44548%0.483SS..SBendtrans-58134175.4-72.2-177.3172.6-134-15.8110E162 Q164 K168 L217 E220E162-R166 WeakPolarHBondContact O-CG 3.43Å; E162-R166 PolarHBondContact O-N 3.04Å; Q164-R166 VanDerWaalsContact C-N 3.28Å; Q164-R166 PolarHBondContact O-N 3.42Å; R166-K168 PolarHBondContact O-N 3.06Å; R166-L217 VanDerWaalsContact NH1-CD2 3.28Å; R166-E220 IonicContact NH2-OE2 3.91Å
167K68.7Low84.4Confident193 Ų19398.7 Ų98.784%0.83949%0.492SS*.PPolyproline II helixtrans-52.1133.9-179.3-64.3178.6-176.8174.80109.6N165 S169N165-K167 PolarHBondContact O-N 2.91Å; K167-S169 PolarHBondContact O-N 3.33Å
168K69.9Low83.8Confident193 Ų19395.8 Ų95.884%0.83948%0.477SS*.PPolyproline II helixtrans-61135174.2-63.9179.6-177.8177.60108.4R166R166-K168 PolarHBondContact O-N 3.06Å
169S76.6Confident83.3Confident6 Ų695.2 Ų95.24%0.04248%0.482CS..PPolyproline II helixtrans-62.6129.9-176.6160.30000109.2K167 V171 A172 D209K167-S169 PolarHBondContact O-N 3.33Å; S169-V171 PolarHBondContact O-N 2.95Å; S169-V171 VanDerWaalsContact OG-CB 3.23Å; S169-V171 WeakPolarHBondContact OG-CB 3.41Å; S169-V171 VanDerWaalsContact OG-CG2 3.3Å; S169-V171 WeakPolarHBondContact OG-CG2 3.12Å; S169-V171 PolarHBondContact OG-N 2.87Å; S169-V171 VanDerWaalsContact OG-N 3.13Å; S169-A172 WeakPolarHBondContact O-CB 3.4Å; S169-A172 PolarHBondContact O-N 2.96Å; S169-D209 PolarHBondContact OG-OD1 2.91Å; S169-D209 PolarHBondContact OG-OD2 3.05Å
170P78.9Confident83.1Confident74 Ų7494.7 Ų94.748%0.48147%0.474SS..THydrogen-bonded Turntrans-48.8-22.9170.5-27.430.2000114.3A172 D173 L174 D209P170-A172 PolarHBondContact O-N 3.12Å; P170-D173 PolarHBondContact O-N 3.36Å; P170-L174 WeakPolarHBondContact O-CG 3.48Å; P170-L174 PolarHBondContact O-N 2.96Å; P170-D209 VanDerWaalsContact CD-OD1 3.31Å; P170-D209 WeakPolarHBondContact CD-OD1 3.26Å
171V85.6Confident83.1Confident1 Ų190.7 Ų90.71%0.00646%0.455CS..Hα-helixtrans-60.5-31.3175.2179.90000111.7S169 D173 L174 L175 I181 L185 V205 I206 D209S169-V171 PolarHBondContact O-N 2.95Å; S169-V171 VanDerWaalsContact OG-CB 3.23Å; S169-V171 WeakPolarHBondContact OG-CB 3.41Å; S169-V171 VanDerWaalsContact OG-CG2 3.3Å; S169-V171 WeakPolarHBondContact OG-CG2 3.12Å; S169-V171 PolarHBondContact OG-N 2.87Å; S169-V171 VanDerWaalsContact OG-N 3.13Å; V171-D173 PolarHBondContact O-N 3.43Å; V171-L174 PolarHBondContact O-N 3.41Å; V171-L175 HydrophobicContact CG1-CB 4.25Å; V171-L175 HydrophobicContact CG1-CD1 3.65Å; V171-L175 HydrophobicContact CG1-CG 4.06Å; V171-L175 WeakPolarHBondContact O-CB 3.37Å; V171-L175 PolarHBondContact O-N 2.9Å; V171-I181 HydrophobicContact CG1-CG2 4.34Å; V171-L185 HydrophobicContact CB-CD1 4.04Å; V171-L185 HydrophobicContact CG1-CD1 3.88Å; V171-L185 HydrophobicContact CG2-CD1 3.97Å; V171-V205 HydrophobicContact CG2-CG1 4.26Å; V171-I206 HydrophobicContact CG1-CG1 4.2Å; V171-D209 HydrophobicContact CG2-CB 3.27Å; V171-D209 VanDerWaalsContact CG2-OD2 3.32Å; V171-D209 WeakPolarHBondContact CG2-OD2 3.43Å
172A84.6Confident82.8Confident36 Ų3689 Ų8930%0.29845%0.446SS..Hα-helixtrans-60.4-35.7177.900000112.3S169 P170S169-A172 WeakPolarHBondContact O-CB 3.4Å; S169-A172 PolarHBondContact O-N 2.96Å; P170-A172 PolarHBondContact O-N 3.12Å
173D86.1Confident82.7Confident135 Ų13590 Ų9072%0.72245%0.45SS*.Hα-helixtrans-84-34.4-179.4-60.4-32.1000111.9P170 V171 P176P170-D173 PolarHBondContact O-N 3.36Å; V171-D173 PolarHBondContact O-N 3.43Å; D173-P176 WeakPolarHBondContact O-CD 3.46Å
174L86.8Confident83Confident113 Ų11385.5 Ų85.559%0.59243%0.434SS*.Hα-helixtrans-83.4-24.7-177.8-65.5173000113.4P170 V171 P176 V205P170-L174 WeakPolarHBondContact O-CG 3.48Å; P170-L174 PolarHBondContact O-N 2.96Å; V171-L174 PolarHBondContact O-N 3.41Å; L174-P176 WeakPolarHBondContact O-CD 3.39Å; L174-V205 HydrophobicContact CB-CG1 3.79Å; L174-V205 HydrophobicContact CD1-CG1 3.72Å; L174-V205 HydrophobicContact CG-CG1 4.43Å
175L87.8Confident83.3Confident14 Ų1478.9 Ų78.97%0.07340%0.403CS..  trans-120.259.5174.9-59.4-177.2000111.8V171 H177 M178 M198 Q202 V205 I206V171-L175 HydrophobicContact CG1-CB 4.25Å; V171-L175 HydrophobicContact CG1-CD1 3.65Å; V171-L175 HydrophobicContact CG1-CG 4.06Å; V171-L175 WeakPolarHBondContact O-CB 3.37Å; V171-L175 PolarHBondContact O-N 2.9Å; L175-H177 PolarHBondContact O-N 3.5Å; L175-M178 PolarHBondContact O-N 2.85Å; L175-M198 HydrophobicContact CD1-CE 3.59Å; L175-Q202 HydrophobicContact CD1-CB 4.5Å; L175-Q202 HydrophobicContact CD2-CB 3.7Å; L175-Q202 HydrophobicContact CD2-CG 3.58Å; L175-V205 HydrophobicContact CG-CG1 4.44Å; L175-I206 HydrophobicContact CD1-CD1 4.14Å; L175-I206 HydrophobicContact CD1-CG1 3.95Å
176P81.9Confident83.4Confident84 Ų8477 Ų7755%0.54539%0.391SS..THydrogen-bonded Turntrans-65.7-19.2-171.324.5-31.9000113.6D173 L174 M178D173-P176 WeakPolarHBondContact O-CD 3.46Å; L174-P176 WeakPolarHBondContact O-CD 3.39Å; P176-M178 VanDerWaalsContact C-N 3.28Å; P176-M178 PolarHBondContact O-N 3.13Å
177H84.6Confident83.9Confident176 Ų17677.8 Ų77.882%0.81540%0.398SS*.THydrogen-bonded Turntrans-81.4-5.6178-68.856.6000113.2L175L175-H177 PolarHBondContact O-N 3.5Å
178M85.2Confident84.8Confident60 Ų6077.8 Ų77.830%0.29639%0.393SS..  trans-131.860.7-173.9-60.8-67.6-83.700112.1L175 P176 H180 I181L175-M178 PolarHBondContact O-N 2.85Å; P176-M178 VanDerWaalsContact C-N 3.28Å; P176-M178 PolarHBondContact O-N 3.13Å; M178-H180 WeakPolarHBondContact CE-CE1 3.32Å; M178-H180 PolarHBondContact O-N 3.39Å; M178-H180 VanDerWaalsContact SD-CE1 3.6Å; M178-I181 HydrophobicContact CB-CB 4.38Å; M178-I181 HydrophobicContact CB-CG1 3.71Å; M178-I181 HydrophobicContact CE-CG1 4.38Å; M178-I181 VanDerWaalsContact O-CB 3.31Å; M178-I181 WeakPolarHBondContact O-CB 3.43Å; M178-I181 PolarHBondContact O-N 2.87Å
179P82.7Confident85.9Confident88 Ų8871.1 Ų71.157%0.57137%0.37SS*.Hα-helixtrans-65.2-23.9-173.626.3-35.7000114.1I181 S182P179-I181 PolarHBondContact O-N 3.05Å; P179-S182 PolarHBondContact O-N 3.43Å; P179-S182 PolarHBondContact O-OG 3.44Å
180H88.1Confident86.6Confident80 Ų8073 Ų7337%0.3738%0.38SS..Hα-helixtrans-66.5-25175.260.9-82.7000112.6M178 C184M178-H180 WeakPolarHBondContact CE-CE1 3.32Å; M178-H180 PolarHBondContact O-N 3.39Å; M178-H180 VanDerWaalsContact SD-CE1 3.6Å; H180-C184 WeakPolarHBondContact O-CB 3.39Å; H180-C184 PolarHBondContact O-N 3.47Å; H180-C184 PolarHBondContact O-SG 2.9Å; H180-C184 VanDerWaalsContact O-SG 3.36Å
181I90.4Very high87.2Confident0 Ų075.8 Ų75.80%039%0.385CS..Hα-helixtrans-68.3-42.9179.3-62.1-63.4000110.7V171 M178 P179 E183 C184 L185 L190 D194 I206V171-I181 HydrophobicContact CG1-CG2 4.34Å; M178-I181 HydrophobicContact CB-CB 4.38Å; M178-I181 HydrophobicContact CB-CG1 3.71Å; M178-I181 HydrophobicContact CE-CG1 4.38Å; M178-I181 VanDerWaalsContact O-CB 3.31Å; M178-I181 WeakPolarHBondContact O-CB 3.43Å; M178-I181 PolarHBondContact O-N 2.87Å; P179-I181 PolarHBondContact O-N 3.05Å; I181-E183 VanDerWaalsContact C-N 3.33Å; I181-E183 PolarHBondContact O-N 2.97Å; I181-C184 PolarHBondContact O-N 3.1Å; I181-L185 HydrophobicContact CG2-CD1 3.98Å; I181-L185 HydrophobicContact CG2-CG 4.48Å; I181-L185 WeakPolarHBondContact O-CB 3.49Å; I181-L185 VanDerWaalsContact O-CG 3.32Å; I181-L185 WeakPolarHBondContact O-CG 3.48Å; I181-L185 PolarHBondContact O-N 3.28Å; I181-L190 HydrophobicContact CD1-CD2 4Å; I181-L190 HydrophobicContact CG2-CD2 4.21Å; I181-D194 HydrophobicContact CD1-CB 3.69Å; I181-I206 HydrophobicContact CG2-CD1 3.78Å; I181-I206 HydrophobicContact CG2-CG1 4.37Å
182S86.6Confident87.5Confident25 Ų2581.3 Ų81.318%0.17542%0.42CS..Hα-helixtrans-65.4-37.9178.965.70000111.7P179 L185 M186P179-S182 PolarHBondContact O-N 3.43Å; P179-S182 PolarHBondContact O-OG 3.44Å; S182-L185 PolarHBondContact O-N 3.44Å; S182-M186 VanDerWaalsContact O-CG 3.31Å; S182-M186 WeakPolarHBondContact O-CG 3.35Å; S182-M186 PolarHBondContact O-N 2.94Å
183E86.9Confident87.8Confident105 Ų10583.8 Ų83.849%0.49143%0.432SS..Hα-helixtrans-65.8-45.5173.5-172.1-178.7176.200112I181 L185 M186 K187I181-E183 VanDerWaalsContact C-N 3.33Å; I181-E183 PolarHBondContact O-N 2.97Å; E183-L185 VanDerWaalsContact C-N 3.28Å; E183-L185 PolarHBondContact O-N 3.14Å; E183-M186 PolarHBondContact O-N 2.91Å; E183-K187 HydrophobicContact CG-CD 4.16Å; E183-K187 WeakPolarHBondContact O-CB 3.47Å; E183-K187 WeakPolarHBondContact O-CG 3.3Å; E183-K187 PolarHBondContact O-N 2.99Å; E183-K187 WeakPolarHBondContact OE1-CE 3.44Å; E183-K187 IonicContact OE1-NZ 2.6Å; E183-K187 PolarHBondContact OE1-NZ 3Å
184C90.2Very high88.1Confident26 Ų2679 Ų7918%0.17641%0.406CS..Hα-helixtrans-61.5-36.2175.1-77.90000112.2H180 I181 K187 R188 S189 L190H180-C184 WeakPolarHBondContact O-CB 3.39Å; H180-C184 PolarHBondContact O-N 3.47Å; H180-C184 PolarHBondContact O-SG 2.9Å; H180-C184 VanDerWaalsContact O-SG 3.36Å; I181-C184 PolarHBondContact O-N 3.1Å; C184-K187 CarbonylContact O-C 3.59Å; C184-K187 PolarHBondContact O-N 3.49Å; C184-R188 PolarHBondContact O-N 3.12Å; C184-S189 PolarHBondContact O-N 3.27Å; C184-L190 HydrophobicContact CB-CD2 3.75Å; C184-L190 HydrophobicContact CB-CG 3.98Å
185L88.5Confident88.3Confident5 Ų576.2 Ų76.23%0.02639%0.391CS..Hα-helixtrans-64.2-49.1174.3-80.3166.5000111.5V171 I181 S182 E183 K187 R188 L190 I206 L210V171-L185 HydrophobicContact CB-CD1 4.04Å; V171-L185 HydrophobicContact CG1-CD1 3.88Å; V171-L185 HydrophobicContact CG2-CD1 3.97Å; I181-L185 HydrophobicContact CG2-CD1 3.98Å; I181-L185 HydrophobicContact CG2-CG 4.48Å; I181-L185 WeakPolarHBondContact O-CB 3.49Å; I181-L185 VanDerWaalsContact O-CG 3.32Å; I181-L185 WeakPolarHBondContact O-CG 3.48Å; I181-L185 PolarHBondContact O-N 3.28Å; S182-L185 PolarHBondContact O-N 3.44Å; E183-L185 VanDerWaalsContact C-N 3.28Å; E183-L185 PolarHBondContact O-N 3.14Å; L185-K187 VanDerWaalsContact C-N 3.25Å; L185-K187 PolarHBondContact O-N 3.49Å; L185-R188 PolarHBondContact O-N 2.88Å; L185-L190 HydrophobicContact CD2-CD1 3.27Å; L185-L190 HydrophobicContact CD2-CG 4.23Å; L185-L190 HydrophobicContact CG-CD1 3.67Å; L185-L190 HydrophobicContact CG-CG 4.22Å; L185-I206 HydrophobicContact CD1-CG2 4.48Å; L185-I206 HydrophobicContact CD2-CG2 4.13Å; L185-L210 HydrophobicContact CD2-CD1 4.25Å; L185-L210 HydrophobicContact CD2-CD2 3.58Å; L185-L210 HydrophobicContact CD2-CG 3.92Å
186M84.2Confident88.5Confident84 Ų8485.1 Ų85.141%0.41442%0.424SS..Hα-helixtrans-58.4-38.2177-72.9-68.9145.800112.4S182 E183 R188S182-M186 VanDerWaalsContact O-CG 3.31Å; S182-M186 WeakPolarHBondContact O-CG 3.35Å; S182-M186 PolarHBondContact O-N 2.94Å; E183-M186 PolarHBondContact O-N 2.91Å; M186-R188 VanDerWaalsContact C-N 3.32Å
187K87.1Confident88.9Confident135 Ų13588.5 Ų88.559%0.58744%0.438SS*.THydrogen-bonded Turntrans-85.6-1.4178.4-67.9177.3178.9175.60113.8E183 C184 L185 S189E183-K187 HydrophobicContact CG-CD 4.16Å; E183-K187 WeakPolarHBondContact O-CB 3.47Å; E183-K187 WeakPolarHBondContact O-CG 3.3Å; E183-K187 PolarHBondContact O-N 2.99Å; E183-K187 WeakPolarHBondContact OE1-CE 3.44Å; E183-K187 IonicContact OE1-NZ 2.6Å; E183-K187 PolarHBondContact OE1-NZ 3Å; C184-K187 CarbonylContact O-C 3.59Å; C184-K187 PolarHBondContact O-N 3.49Å; L185-K187 VanDerWaalsContact C-N 3.25Å; L185-K187 PolarHBondContact O-N 3.49Å; K187-S189 PolarHBondContact O-N 3.02Å
188R88.9Confident89.2Confident193 Ų19381.1 Ų81.173%0.72840%0.404SS*.THydrogen-bonded Turntrans51.241.3-173.4-58.1178.7176.9168.5-2.8112.6C184 L185 M186C184-R188 PolarHBondContact O-N 3.12Å; L185-R188 PolarHBondContact O-N 2.88Å; M186-R188 VanDerWaalsContact C-N 3.32Å
189S91.6Very high89.7Confident53 Ų5382.2 Ų82.237%0.37141%0.414SS..  trans-123.720.7-171.768.80000114C184 K187C184-S189 PolarHBondContact O-N 3.27Å; K187-S189 PolarHBondContact O-N 3.02Å
190L91.2Very high90.3Very high47 Ų4784.9 Ų84.925%0.24642%0.423CS..  trans-58.5136.8175.4-85173.9000111.7I181 C184 L185 D194 L195 I206I181-L190 HydrophobicContact CD1-CD2 4Å; I181-L190 HydrophobicContact CG2-CD2 4.21Å; C184-L190 HydrophobicContact CB-CD2 3.75Å; C184-L190 HydrophobicContact CB-CG 3.98Å; L185-L190 HydrophobicContact CD2-CD1 3.27Å; L185-L190 HydrophobicContact CD2-CG 4.23Å; L185-L190 HydrophobicContact CG-CD1 3.67Å; L185-L190 HydrophobicContact CG-CG 4.22Å; L190-D194 HydrophobicContact CD2-CB 4.32Å; L190-L195 HydrophobicContact CD2-CD2 4.37Å; L190-I206 HydrophobicContact CD1-CG2 4.33Å
191K92.1Very high90.6Very high132 Ų13283.3 Ų83.357%0.57443%0.428SS*.  trans-110.9154.9176.6-60.6174.8-174.5168.70110.8T193 D194K191-T193 WeakPolarHBondContact CB-OG1 3.48Å; K191-T193 PolarHBondContact O-N 3.01Å; K191-T193 VanDerWaalsContact O-N 3.15Å; K191-D194 WeakPolarHBondContact CB-OD2 3.44Å; K191-D194 PolarHBondContact N-OD2 3.3Å; K191-D194 WeakPolarHBondContact O-CB 3.18Å; K191-D194 PolarHBondContact O-N 3.35Å
192P91.8Very high90.7Very high116 Ų11686.4 Ų86.475%0.75344%0.442SS*.G310 helixtrans-58.5-28.2175-24.734.3000113.8D194 L195 R196P192-D194 VanDerWaalsContact C-N 3.27Å; P192-D194 PolarHBondContact O-N 2.96Å; P192-L195 PolarHBondContact O-N 2.95Å; P192-R196 PolarHBondContact O-N 3.01Å
193T91.7Very high91.1Very high88 Ų8887.8 Ų87.854%0.5445%0.447SS..G310 helixtrans-64-33.7175.247.10000112.5K191 L195K191-T193 WeakPolarHBondContact CB-OG1 3.48Å; K191-T193 PolarHBondContact O-N 3.01Å; K191-T193 VanDerWaalsContact O-N 3.15Å; T193-L195 PolarHBondContact O-N 3.11Å
194D91.1Very high91.5Very high36 Ų3687.1 Ų87.119%0.19344%0.444CS..G310 helixtrans-73.1-18.6-175.7-49.2-22.8000111.4I181 L190 K191 P192I181-D194 HydrophobicContact CD1-CB 3.69Å; L190-D194 HydrophobicContact CD2-CB 4.32Å; K191-D194 WeakPolarHBondContact CB-OD2 3.44Å; K191-D194 PolarHBondContact N-OD2 3.3Å; K191-D194 WeakPolarHBondContact O-CB 3.18Å; K191-D194 PolarHBondContact O-N 3.35Å; P192-D194 VanDerWaalsContact C-N 3.27Å; P192-D194 PolarHBondContact O-N 2.96Å
195L91.9Very high91.7Very high53 Ų5387.6 Ų87.628%0.27745%0.447SS..G310 helixtrans-104.4-9.3-175-57.7-178.4000113.6L190 P192 T193 D197 M198 L203 I206L190-L195 HydrophobicContact CD2-CD2 4.37Å; P192-L195 PolarHBondContact O-N 2.95Å; T193-L195 PolarHBondContact O-N 3.11Å; L195-D197 VanDerWaalsContact C-N 3.35Å; L195-D197 PolarHBondContact O-N 3.49Å; L195-M198 HydrophobicContact CD2-SD 3.63Å; L195-M198 WeakPolarHBondContact O-CB 3.21Å; L195-M198 PolarHBondContact O-N 3.49Å; L195-L203 HydrophobicContact CB-CD2 3.95Å; L195-L203 HydrophobicContact CD2-CD2 4.09Å; L195-L203 HydrophobicContact CG-CD2 4.41Å; L195-I206 HydrophobicContact CD2-CD1 3.68Å
196R90.9Very high91.9Very high202 Ų20287.7 Ų87.776%0.76245%0.447SS*.THydrogen-bonded Turntrans-66.2-34.7-163.8-159.2174.9-155.2143.94.8114P192P192-R196 PolarHBondContact O-N 3.01Å
197D90.1Very high92.3Very high155 Ų15586.4 Ų86.483%0.82944%0.443SS*.THydrogen-bonded Turntrans-102.313.7-175.7-57.5-40.7000112.3L195L195-D197 VanDerWaalsContact C-N 3.35Å; L195-D197 PolarHBondContact O-N 3.49Å
198M92.3Very high92.7Very high21 Ų2183.7 Ų83.710%0.10344%0.436CS..  trans-85.5144.3-179.3-63.2-171.565.600111.7L175 L195 Q202 L203 I206L175-M198 HydrophobicContact CD1-CE 3.59Å; L195-M198 HydrophobicContact CD2-SD 3.63Å; L195-M198 WeakPolarHBondContact O-CB 3.21Å; L195-M198 PolarHBondContact O-N 3.49Å; M198-Q202 HydrophobicContact CB-CB 4.33Å; M198-Q202 HydrophobicContact CE-CB 3.36Å; M198-Q202 HydrophobicContact CE-CG 4.46Å; M198-L203 HydrophobicContact CB-CD2 3.83Å; M198-L203 HydrophobicContact CB-CG 3.87Å; M198-L203 HydrophobicContact CG-CD2 4.44Å; M198-L203 HydrophobicContact SD-CD2 4.01Å; M198-I206 HydrophobicContact CE-CD1 3.45Å; M198-I206 VanDerWaalsContact CE-CD1 3.45Å; M198-I206 HydrophobicContact CE-CG1 4.32Å; M198-I206 HydrophobicContact SD-CD1 3.69Å
199T94.8Very high92.8Very high83 Ų8375.1 Ų75.151%0.50940%0.404SS..  trans-72.7157.9171.974.70000110.6G201 Q202 L203T199-G201 PolarHBondContact O-N 2.91Å; T199-Q202 PolarHBondContact O-N 2.91Å; T199-Q202 WeakPolarHBondContact OG1-CG 3.42Å; T199-Q202 PolarHBondContact OG1-N 3.41Å; T199-L203 PolarHBondContact O-N 2.95Å
200L95.2Very high92.9Very high144 Ų14475.7 Ų75.775%0.75440%0.403SS*.Hα-helixtrans-52.6-40.8175.8-179.663.2000112.1L203 Q204L200-L203 PolarHBondContact O-N 3.21Å; L200-Q204 WeakPolarHBondContact O-CB 3.49Å; L200-Q204 PolarHBondContact O-N 3.39Å
201G94.8Very high93Very high46 Ų4678.3 Ų78.347%0.47441%0.413SS..Hα-helixtrans-63.9-40.4177.700000113T199 Q204 V205T199-G201 PolarHBondContact O-N 2.91Å; G201-Q204 WeakPolarHBondContact O-CB 3.34Å; G201-Q204 PolarHBondContact O-N 3.34Å; G201-V205 WeakPolarHBondContact O-CG2 3.35Å; G201-V205 PolarHBondContact O-N 3.08Å; G201-V205 VanDerWaalsContact O-N 3.07Å
202Q93.6Very high93.1Very high65 Ų6575.2 Ų75.230%0.30441%0.408SS..Hα-helixtrans-69.9-38178.1-62.1170.6-4100111.9L175 M198 T199 Q204 V205 I206L175-Q202 HydrophobicContact CD1-CB 4.5Å; L175-Q202 HydrophobicContact CD2-CB 3.7Å; L175-Q202 HydrophobicContact CD2-CG 3.58Å; M198-Q202 HydrophobicContact CB-CB 4.33Å; M198-Q202 HydrophobicContact CE-CB 3.36Å; M198-Q202 HydrophobicContact CE-CG 4.46Å; T199-Q202 PolarHBondContact O-N 2.91Å; T199-Q202 WeakPolarHBondContact OG1-CG 3.42Å; T199-Q202 PolarHBondContact OG1-N 3.41Å; Q202-Q204 VanDerWaalsContact C-N 3.32Å; Q202-V205 WeakPolarHBondContact O-CB 3.47Å; Q202-V205 PolarHBondContact O-N 3.47Å; Q202-I206 PolarHBondContact O-N 3.22Å
203L94.1Very high93Very high54 Ų5471.6 Ų71.628%0.28338%0.381SS..Hα-helixtrans-63.6-39.7172.5-67.3173.8000111.3L195 M198 T199 L200 V205 I206 V207L195-L203 HydrophobicContact CB-CD2 3.95Å; L195-L203 HydrophobicContact CD2-CD2 4.09Å; L195-L203 HydrophobicContact CG-CD2 4.41Å; M198-L203 HydrophobicContact CB-CD2 3.83Å; M198-L203 HydrophobicContact CB-CG 3.87Å; M198-L203 HydrophobicContact CG-CD2 4.44Å; M198-L203 HydrophobicContact SD-CD2 4.01Å; T199-L203 PolarHBondContact O-N 2.95Å; L200-L203 PolarHBondContact O-N 3.21Å; L203-V205 VanDerWaalsContact C-N 3.32Å; L203-V205 PolarHBondContact O-N 3.39Å; L203-I206 PolarHBondContact O-N 2.88Å; L203-V207 WeakPolarHBondContact O-CG2 3.47Å; L203-V207 PolarHBondContact O-N 2.98Å
204Q95.3Very high93.1Very high91 Ų9171.8 Ų71.843%0.42538%0.378SS..Hα-helixtrans-62.2-39.5175.9-170.564.649.500112L200 G201 Q202 I206 V207 N208L200-Q204 WeakPolarHBondContact O-CB 3.49Å; L200-Q204 PolarHBondContact O-N 3.39Å; G201-Q204 WeakPolarHBondContact O-CB 3.34Å; G201-Q204 PolarHBondContact O-N 3.34Å; Q202-Q204 VanDerWaalsContact C-N 3.32Å; Q204-I206 VanDerWaalsContact C-N 3.34Å; Q204-I206 PolarHBondContact O-N 3.44Å; Q204-V207 PolarHBondContact O-N 3.03Å; Q204-N208 PolarHBondContact NE2-OD1 3.33Å; Q204-N208 WeakPolarHBondContact O-CB 3.3Å; Q204-N208 PolarHBondContact O-N 3.35Å; Q204-N208 PolarHBondContact O-OD1 3.5Å
205V93.8Very high93.3Very high37 Ų3775.8 Ų75.822%0.22440%0.396CS..Hα-helixtrans-58.7-45.8173.9168.40000110.9V171 L174 L175 G201 Q202 L203 N208 D209V171-V205 HydrophobicContact CG2-CG1 4.26Å; L174-V205 HydrophobicContact CB-CG1 3.79Å; L174-V205 HydrophobicContact CD1-CG1 3.72Å; L174-V205 HydrophobicContact CG-CG1 4.43Å; L175-V205 HydrophobicContact CG-CG1 4.44Å; G201-V205 WeakPolarHBondContact O-CG2 3.35Å; G201-V205 PolarHBondContact O-N 3.08Å; G201-V205 VanDerWaalsContact O-N 3.07Å; Q202-V205 WeakPolarHBondContact O-CB 3.47Å; Q202-V205 PolarHBondContact O-N 3.47Å; L203-V205 VanDerWaalsContact C-N 3.32Å; L203-V205 PolarHBondContact O-N 3.39Å; V205-N208 PolarHBondContact O-N 2.96Å; V205-D209 WeakPolarHBondContact O-CB 3.38Å; V205-D209 PolarHBondContact O-N 3.21Å
206I92.8Very high93.3Very high6 Ų676.1 Ų76.13%0.03140%0.403CS..Hα-helixtrans-62.5-45.3176.4-67175.2000111.3V171 L175 I181 L185 L190 L195 M198 Q202 L203 Q204 N208 D209 L210V171-I206 HydrophobicContact CG1-CG1 4.2Å; L175-I206 HydrophobicContact CD1-CD1 4.14Å; L175-I206 HydrophobicContact CD1-CG1 3.95Å; I181-I206 HydrophobicContact CG2-CD1 3.78Å; I181-I206 HydrophobicContact CG2-CG1 4.37Å; L185-I206 HydrophobicContact CD1-CG2 4.48Å; L185-I206 HydrophobicContact CD2-CG2 4.13Å; L190-I206 HydrophobicContact CD1-CG2 4.33Å; L195-I206 HydrophobicContact CD2-CD1 3.68Å; M198-I206 HydrophobicContact CE-CD1 3.45Å; M198-I206 VanDerWaalsContact CE-CD1 3.45Å; M198-I206 HydrophobicContact CE-CG1 4.32Å; M198-I206 HydrophobicContact SD-CD1 3.69Å; Q202-I206 PolarHBondContact O-N 3.22Å; L203-I206 PolarHBondContact O-N 2.88Å; Q204-I206 VanDerWaalsContact C-N 3.34Å; Q204-I206 PolarHBondContact O-N 3.44Å; I206-N208 PolarHBondContact O-N 3.39Å; I206-D209 PolarHBondContact O-N 2.93Å; I206-L210 HydrophobicContact CG2-CD1 3.93Å; I206-L210 HydrophobicContact CG2-CG 4.36Å; I206-L210 WeakPolarHBondContact O-CB 3.46Å; I206-L210 WeakPolarHBondContact O-CG 3.41Å; I206-L210 PolarHBondContact O-N 3.41Å
207V94.1Very high93.4Very high57 Ų5768.4 Ų68.435%0.34538%0.376SS..Hα-helixtrans-61.6-44.6-179.9168.40000111.1L203 Q204 L210 H211L203-V207 WeakPolarHBondContact O-CG2 3.47Å; L203-V207 PolarHBondContact O-N 2.98Å; Q204-V207 PolarHBondContact O-N 3.03Å; V207-L210 PolarHBondContact O-N 2.99Å; V207-H211 VanDerWaalsContact CG1-CE1 3.41Å; V207-H211 WeakPolarHBondContact CG1-CE1 3.37Å; V207-H211 PolarHBondContact O-N 3.3Å; V207-H211 PolarHBondContact O-ND1 3.21Å
208N94.8Very high93.7Very high79 Ų7965.3 Ų65.342%0.42236%0.36SS..Hα-helixtrans-63.4-43.7178.6-70.8-8.7000111.5Q204 V205 I206 L210 H211 S212Q204-N208 PolarHBondContact NE2-OD1 3.33Å; Q204-N208 WeakPolarHBondContact O-CB 3.3Å; Q204-N208 PolarHBondContact O-N 3.35Å; Q204-N208 PolarHBondContact O-OD1 3.5Å; V205-N208 PolarHBondContact O-N 2.96Å; I206-N208 PolarHBondContact O-N 3.39Å; N208-L210 PolarHBondContact O-N 3.08Å; N208-H211 PolarHBondContact O-N 2.91Å; N208-S212 PolarHBondContact O-N 3.03Å; N208-S212 PolarHBondContact O-OG 3.4Å
209D91.7Very high93.9Very high13 Ų1370.2 Ų70.27%0.0738%0.382CS..Hα-helixtrans-61.7-43.5175.7-177.662.3000112.2S169 P170 V171 V205 I206 H211 S212 Q213S169-D209 PolarHBondContact OG-OD1 2.91Å; S169-D209 PolarHBondContact OG-OD2 3.05Å; P170-D209 VanDerWaalsContact CD-OD1 3.31Å; P170-D209 WeakPolarHBondContact CD-OD1 3.26Å; V171-D209 HydrophobicContact CG2-CB 3.27Å; V171-D209 VanDerWaalsContact CG2-OD2 3.32Å; V171-D209 WeakPolarHBondContact CG2-OD2 3.43Å; V205-D209 WeakPolarHBondContact O-CB 3.38Å; V205-D209 PolarHBondContact O-N 3.21Å; I206-D209 PolarHBondContact O-N 2.93Å; D209-H211 VanDerWaalsContact C-N 3.35Å; D209-H211 PolarHBondContact O-N 2.93Å; D209-S212 PolarHBondContact O-N 2.86Å; D209-Q213 WeakPolarHBondContact O-CB 3.39Å; D209-Q213 VanDerWaalsContact O-CG 3.32Å; D209-Q213 WeakPolarHBondContact O-CG 3.37Å; D209-Q213 PolarHBondContact O-N 3.04Å; D209-Q213 PolarHBondContact OD2-NE2 3.41Å
210L92.5Very high93.9Very high65 Ų6569.9 Ų69.934%0.3438%0.375SS..Hα-helixtrans-62.1-41.5175.7-74.8173.7000112L185 I206 V207 N208 Q213 I214L185-L210 HydrophobicContact CD2-CD1 4.25Å; L185-L210 HydrophobicContact CD2-CD2 3.58Å; L185-L210 HydrophobicContact CD2-CG 3.92Å; I206-L210 HydrophobicContact CG2-CD1 3.93Å; I206-L210 HydrophobicContact CG2-CG 4.36Å; I206-L210 WeakPolarHBondContact O-CB 3.46Å; I206-L210 WeakPolarHBondContact O-CG 3.41Å; I206-L210 PolarHBondContact O-N 3.41Å; V207-L210 PolarHBondContact O-N 2.99Å; N208-L210 PolarHBondContact O-N 3.08Å; L210-Q213 PolarHBondContact O-N 3Å; L210-I214 WeakPolarHBondContact O-CD1 3.23Å; L210-I214 WeakPolarHBondContact O-CG1 3.45Å; L210-I214 PolarHBondContact O-N 3.41Å
211H94.7Very high93.9Very high101 Ų10167.5 Ų67.547%0.46836%0.363SS..Hα-helixtrans-61.7-48174.3-71148.7000111.6V207 N208 D209 Q213 I214 E215V207-H211 VanDerWaalsContact CG1-CE1 3.41Å; V207-H211 WeakPolarHBondContact CG1-CE1 3.37Å; V207-H211 PolarHBondContact O-N 3.3Å; V207-H211 PolarHBondContact O-ND1 3.21Å; N208-H211 PolarHBondContact O-N 2.91Å; D209-H211 VanDerWaalsContact C-N 3.35Å; D209-H211 PolarHBondContact O-N 2.93Å; H211-Q213 VanDerWaalsContact C-N 3.32Å; H211-Q213 PolarHBondContact O-N 3.5Å; H211-I214 WeakPolarHBondContact O-CB 3.33Å; H211-I214 PolarHBondContact O-N 3.44Å; H211-I214 VanDerWaalsContact O-N 3.11Å; H211-E215 WeakPolarHBondContact O-CG 3.38Å; H211-E215 PolarHBondContact O-N 2.9Å
212S92.4Very high94.1Very high67 Ų6769.3 Ų69.347%0.46936%0.364SS..Hα-helixtrans-62.9-36.5176.8-61.80000112.9N208 D209 S216N208-S212 PolarHBondContact O-N 3.03Å; N208-S212 PolarHBondContact O-OG 3.4Å; D209-S212 PolarHBondContact O-N 2.86Å; S212-S216 WeakPolarHBondContact O-CB 3.39Å; S212-S216 PolarHBondContact O-N 2.97Å; S212-S216 PolarHBondContact O-OG 3.42Å
213Q91.3Very high94.3Very high40 Ų4071.9 Ų71.919%0.18738%0.376CS..Hα-helixtrans-65.1-40.6172.6-76.3-172.959.200111.8D209 L210 H211 S216 L217D209-Q213 WeakPolarHBondContact O-CB 3.39Å; D209-Q213 VanDerWaalsContact O-CG 3.32Å; D209-Q213 WeakPolarHBondContact O-CG 3.37Å; D209-Q213 PolarHBondContact O-N 3.04Å; D209-Q213 PolarHBondContact OD2-NE2 3.41Å; L210-Q213 PolarHBondContact O-N 3Å; H211-Q213 VanDerWaalsContact C-N 3.32Å; H211-Q213 PolarHBondContact O-N 3.5Å; Q213-S216 WeakPolarHBondContact CA-OG 3.41Å; Q213-S216 PolarHBondContact O-OG 2.95Å; Q213-S216 VanDerWaalsContact O-OG 3.11Å; Q213-L217 VanDerWaalsContact O-CB 3.26Å; Q213-L217 WeakPolarHBondContact O-CB 3.16Å; Q213-L217 WeakPolarHBondContact O-CD1 3.19Å; Q213-L217 WeakPolarHBondContact O-CG 3.5Å; Q213-L217 PolarHBondContact O-N 3.29Å
214I93.2Very high94.4Very high93 Ų9373.7 Ų73.748%0.47739%0.386SS..Hα-helixtrans-63.4-48.2176.8-71.5162.2000110.4L210 H211 L217 N218L210-I214 WeakPolarHBondContact O-CD1 3.23Å; L210-I214 WeakPolarHBondContact O-CG1 3.45Å; L210-I214 PolarHBondContact O-N 3.41Å; H211-I214 WeakPolarHBondContact O-CB 3.33Å; H211-I214 PolarHBondContact O-N 3.44Å; H211-I214 VanDerWaalsContact O-N 3.11Å; I214-L217 PolarHBondContact O-N 3.47Å; I214-N218 WeakPolarHBondContact O-CB 3.48Å; I214-N218 PolarHBondContact O-N 3Å; I214-N218 PolarHBondContact O-ND2 2.86Å
215E95.7Very high94.5Very high120 Ų12072.4 Ų72.456%0.56138%0.381SS*.Hα-helixtrans-58.9-53.5178.9-72.3171.717900111.2H211 L217 N218 E219H211-E215 WeakPolarHBondContact O-CG 3.38Å; H211-E215 PolarHBondContact O-N 2.9Å; E215-L217 PolarHBondContact O-N 2.88Å; E215-N218 PolarHBondContact O-N 3.35Å; E215-N218 VanDerWaalsContact O-N 3.14Å; E215-E219 WeakPolarHBondContact O-CG 3.35Å; E215-E219 PolarHBondContact O-N 3.35Å
216S91.8Very high94.7Very high60 Ų6076.1 Ų76.142%0.4240%0.399SS..Hα-helixtrans-61.1-40.2179.555.30000113.6S212 Q213 N218 E219 E220S212-S216 WeakPolarHBondContact O-CB 3.39Å; S212-S216 PolarHBondContact O-N 2.97Å; S212-S216 PolarHBondContact O-OG 3.42Å; Q213-S216 WeakPolarHBondContact CA-OG 3.41Å; Q213-S216 PolarHBondContact O-OG 2.95Å; Q213-S216 VanDerWaalsContact O-OG 3.11Å; S216-N218 VanDerWaalsContact C-N 3.34Å; S216-E219 PolarHBondContact O-N 2.91Å; S216-E220 WeakPolarHBondContact O-CB 3.48Å; S216-E220 PolarHBondContact O-N 2.99Å
217L91.9Very high94.9Very high39 Ų3980.3 Ų80.320%0.20442%0.421CS..Hα-helixtrans-68.5-33.4176.7-71.9171.1000112.7R166 Q213 I214 E215 L221R166-L217 VanDerWaalsContact NH1-CD2 3.28Å; Q213-L217 VanDerWaalsContact O-CB 3.26Å; Q213-L217 WeakPolarHBondContact O-CB 3.16Å; Q213-L217 WeakPolarHBondContact O-CD1 3.19Å; Q213-L217 WeakPolarHBondContact O-CG 3.5Å; Q213-L217 PolarHBondContact O-N 3.29Å; I214-L217 PolarHBondContact O-N 3.47Å; E215-L217 PolarHBondContact O-N 2.88Å; L217-L221 WeakPolarHBondContact O-CB 3.42Å; L217-L221 PolarHBondContact O-N 2.94Å
218N97Very high95Very high90 Ų9082.9 Ų82.948%0.48142%0.424SS..Hα-helixtrans-69.9-42.2175.9-72.7-22.1000110.9I214 E215 S216 L221 V222I214-N218 WeakPolarHBondContact O-CB 3.48Å; I214-N218 PolarHBondContact O-N 3Å; I214-N218 PolarHBondContact O-ND2 2.86Å; E215-N218 PolarHBondContact O-N 3.35Å; E215-N218 VanDerWaalsContact O-N 3.14Å; S216-N218 VanDerWaalsContact C-N 3.34Å; N218-L221 PolarHBondContact O-N 3.13Å; N218-V222 WeakPolarHBondContact O-CG2 3.39Å; N218-V222 PolarHBondContact O-N 3.32Å
219E96.8Very high95.2Very high125 Ų12582.8 Ų82.858%0.58442%0.424SS*.Hα-helixtrans-60.8-49173.8-71.6176.6-178.400111.5E215 S216 L221 V222 Q223E215-E219 WeakPolarHBondContact O-CG 3.35Å; E215-E219 PolarHBondContact O-N 3.35Å; S216-E219 PolarHBondContact O-N 2.91Å; E219-L221 VanDerWaalsContact C-N 3.33Å; E219-L221 PolarHBondContact O-N 3.15Å; E219-V222 PolarHBondContact O-N 3.03Å; E219-Q223 WeakPolarHBondContact O-CG 3.38Å; E219-Q223 PolarHBondContact O-N 2.92Å
220E94.2Very high95.5Very high76 Ų7687.7 Ų87.736%0.35545%0.446SS..Hα-helixtrans-59-44.1176.4-174.2-176-167.200111.1R166 S216 V222 Q223 L224R166-E220 IonicContact NH2-OE2 3.91Å; S216-E220 WeakPolarHBondContact O-CB 3.48Å; S216-E220 PolarHBondContact O-N 2.99Å; E220-V222 VanDerWaalsContact C-N 3.35Å; E220-V222 PolarHBondContact O-N 3.31Å; E220-Q223 PolarHBondContact O-N 3.41Å; E220-L224 HydrophobicContact CG-CD1 4.05Å; E220-L224 HydrophobicContact CG-CG 4.44Å; E220-L224 WeakPolarHBondContact O-CB 3.3Å; E220-L224 VanDerWaalsContact O-CG 3.3Å; E220-L224 WeakPolarHBondContact O-CG 3.48Å; E220-L224 PolarHBondContact O-N 2.91Å
221L96.4Very high95.7Very high94 Ų9489.1 Ų89.149%0.49245%0.454SS..Hα-helixtrans-59.3-45.7176.5175.962.5000111.4L217 N218 E219 L224 L225L217-L221 WeakPolarHBondContact O-CB 3.42Å; L217-L221 PolarHBondContact O-N 2.94Å; N218-L221 PolarHBondContact O-N 3.13Å; E219-L221 VanDerWaalsContact C-N 3.33Å; E219-L221 PolarHBondContact O-N 3.15Å; L221-L224 PolarHBondContact O-N 2.88Å; L221-L225 HydrophobicContact CD1-CD1 4.14Å; L221-L225 HydrophobicContact CD1-CG 4.14Å; L221-L225 HydrophobicContact CG-CD1 3.99Å; L221-L225 HydrophobicContact CG-CG 4.43Å; L221-L225 WeakPolarHBondContact O-CB 3.34Å; L221-L225 WeakPolarHBondContact O-CG 3.28Å; L221-L225 PolarHBondContact O-N 3.44Å
222V98.4Very high95.9Very high83 Ų8388.9 Ų88.950%0.50345%0.453SS..Hα-helixtrans-61.5-45.9177.9170.70000110.5N218 E219 E220 L224 L225 L226N218-V222 WeakPolarHBondContact O-CG2 3.39Å; N218-V222 PolarHBondContact O-N 3.32Å; E219-V222 PolarHBondContact O-N 3.03Å; E220-V222 VanDerWaalsContact C-N 3.35Å; E220-V222 PolarHBondContact O-N 3.31Å; V222-L224 PolarHBondContact O-N 3.26Å; V222-L225 PolarHBondContact O-N 2.9Å; V222-L226 HydrophobicContact CG1-CD1 4.32Å; V222-L226 WeakPolarHBondContact O-CG 3.43Å; V222-L226 PolarHBondContact O-N 3.5Å
223Q97.4Very high96.1Very high119 Ų11991.5 Ų91.556%0.55646%0.459SS*.Hα-helixtrans-59.8-46.5177-69.6173.91400112E219 E220 L225 L226 I227E219-Q223 WeakPolarHBondContact O-CG 3.38Å; E219-Q223 PolarHBondContact O-N 2.92Å; E220-Q223 PolarHBondContact O-N 3.41Å; Q223-L225 VanDerWaalsContact C-N 3.29Å; Q223-L225 PolarHBondContact O-N 3.45Å; Q223-L226 PolarHBondContact O-N 3.34Å; Q223-I227 WeakPolarHBondContact O-CG1 3.36Å; Q223-I227 PolarHBondContact O-N 3.49Å
224L95.4Very high96.4Very high93 Ų9394.5 Ų94.549%0.48747%0.473SS..Hα-helixtrans-63.2-34.9177.1-71.2173000112.4E220 L221 V222 R228E220-L224 HydrophobicContact CG-CD1 4.05Å; E220-L224 HydrophobicContact CG-CG 4.44Å; E220-L224 WeakPolarHBondContact O-CB 3.3Å; E220-L224 VanDerWaalsContact O-CG 3.3Å; E220-L224 WeakPolarHBondContact O-CG 3.48Å; E220-L224 PolarHBondContact O-N 2.91Å; L221-L224 PolarHBondContact O-N 2.88Å; V222-L224 PolarHBondContact O-N 3.26Å; L224-R228 WeakPolarHBondContact O-CB 3.49Å; L224-R228 PolarHBondContact O-N 2.94Å
225L98.1Very high96.6Very high64 Ų6495.1 Ų95.134%0.33547%0.474SS..Hα-helixtrans-67.4-40.6174.7-72170.4000111.9L221 V222 Q223 R228 D229L221-L225 HydrophobicContact CD1-CD1 4.14Å; L221-L225 HydrophobicContact CD1-CG 4.14Å; L221-L225 HydrophobicContact CG-CD1 3.99Å; L221-L225 HydrophobicContact CG-CG 4.43Å; L221-L225 WeakPolarHBondContact O-CB 3.34Å; L221-L225 WeakPolarHBondContact O-CG 3.28Å; L221-L225 PolarHBondContact O-N 3.44Å; V222-L225 PolarHBondContact O-N 2.9Å; Q223-L225 VanDerWaalsContact C-N 3.29Å; Q223-L225 PolarHBondContact O-N 3.45Å; L225-R228 WeakPolarHBondContact O-CB 3.42Å; L225-R228 PolarHBondContact O-N 3.49Å; L225-D229 VanDerWaalsContact O-CG 3.24Å; L225-D229 PolarHBondContact O-N 2.75Å
226L98.1Very high96.7Very high114 Ų11494.1 Ų94.160%0.59747%0.472SS*.Hα-helixtrans-63.6-46.8175-68.3173.4000111.3V222 Q223 R228 D229 E230V222-L226 HydrophobicContact CG1-CD1 4.32Å; V222-L226 WeakPolarHBondContact O-CG 3.43Å; V222-L226 PolarHBondContact O-N 3.5Å; Q223-L226 PolarHBondContact O-N 3.34Å; L226-R228 VanDerWaalsContact C-N 3.31Å; L226-R228 PolarHBondContact O-N 3.07Å; L226-D229 PolarHBondContact O-N 3.34Å; L226-D229 VanDerWaalsContact O-N 3.13Å; L226-E230 PolarHBondContact O-N 3.43Å
227I97.2Very high97Very high94 Ų9493.8 Ų93.848%0.48247%0.473SS..Hα-helixtrans-60.8-41.7176.6-67165.7000110.7Q223 D229 E230 L231Q223-I227 WeakPolarHBondContact O-CG1 3.36Å; Q223-I227 PolarHBondContact O-N 3.49Å; I227-D229 VanDerWaalsContact C-N 3.3Å; I227-D229 PolarHBondContact O-N 3.2Å; I227-E230 PolarHBondContact O-N 3.08Å; I227-L231 HydrophobicContact CG2-CD1 3.84Å; I227-L231 HydrophobicContact CG2-CG 4.24Å; I227-L231 WeakPolarHBondContact O-CB 3.45Å; I227-L231 VanDerWaalsContact O-CG 3.28Å; I227-L231 WeakPolarHBondContact O-CG 3.27Å; I227-L231 PolarHBondContact O-N 2.68Å
228R96.9Very high97.3Very high112 Ų11296.5 Ų96.542%0.42349%0.486SS..Hα-helixtrans-58-45174.9179.7-157.768.2-163.2-6.1111.2L224 L225 L226 L231 H232L224-R228 WeakPolarHBondContact O-CB 3.49Å; L224-R228 PolarHBondContact O-N 2.94Å; L225-R228 WeakPolarHBondContact O-CB 3.42Å; L225-R228 PolarHBondContact O-N 3.49Å; L226-R228 VanDerWaalsContact C-N 3.31Å; L226-R228 PolarHBondContact O-N 3.07Å; R228-L231 PolarHBondContact O-N 2.97Å; R228-H232 WeakPolarHBondContact O-CB 3.41Å; R228-H232 PolarHBondContact O-CD2 3.33Å; R228-H232 VanDerWaalsContact O-CG 3.27Å; R228-H232 PolarHBondContact O-N 2.97Å
229D98.3Very high97.2Very high76 Ų7696.9 Ų96.941%0.40649%0.487SS..Hα-helixtrans-68.6-37.2-177.6-67.5-10.7000111.4L225 L226 I227 H232 M233L225-D229 VanDerWaalsContact O-CG 3.24Å; L225-D229 PolarHBondContact O-N 2.75Å; L226-D229 PolarHBondContact O-N 3.34Å; L226-D229 VanDerWaalsContact O-N 3.13Å; I227-D229 VanDerWaalsContact C-N 3.3Å; I227-D229 PolarHBondContact O-N 3.2Å; D229-H232 PolarHBondContact O-N 3.16Å; D229-M233 PolarHBondContact O-N 3.34Å
230E98.1Very high97.3Very high117 Ų11794.5 Ų94.555%0.54748%0.481SS..Hα-helixtrans-61.6-50.7171.4-172.162.8-15400111.6L226 I227 H232 M233 E234L226-E230 PolarHBondContact O-N 3.43Å; I227-E230 PolarHBondContact O-N 3.08Å; E230-H232 VanDerWaalsContact C-N 3.27Å; E230-H232 PolarHBondContact O-N 3.13Å; E230-M233 WeakPolarHBondContact O-CA 3.3Å; E230-M233 WeakPolarHBondContact O-CB 3.47Å; E230-M233 PolarHBondContact O-N 2.96Å; E230-E234 PolarHBondContact O-N 3.38Å
231L96.6Very high97.4Very high95 Ų9595.6 Ų95.650%0.49749%0.489SS..Hα-helixtrans-63-33.3178.1-70.4173000112.5I227 R228 Q235I227-L231 HydrophobicContact CG2-CD1 3.84Å; I227-L231 HydrophobicContact CG2-CG 4.24Å; I227-L231 WeakPolarHBondContact O-CB 3.45Å; I227-L231 VanDerWaalsContact O-CG 3.28Å; I227-L231 WeakPolarHBondContact O-CG 3.27Å; I227-L231 PolarHBondContact O-N 2.68Å; R228-L231 PolarHBondContact O-N 2.97Å; L231-Q235 VanDerWaalsContact O-CB 3.3Å; L231-Q235 WeakPolarHBondContact O-CB 3.48Å; L231-Q235 PolarHBondContact O-N 3.04Å
232H97.6Very high97.4Very high96 Ų9695.8 Ų95.844%0.44449%0.49SS..Hα-helixtrans-66.8-40.7172.7-79.7-161.3000111.3R228 D229 E230 Q235 D236R228-H232 WeakPolarHBondContact O-CB 3.41Å; R228-H232 PolarHBondContact O-CD2 3.33Å; R228-H232 VanDerWaalsContact O-CG 3.27Å; R228-H232 PolarHBondContact O-N 2.97Å; D229-H232 PolarHBondContact O-N 3.16Å; E230-H232 VanDerWaalsContact C-N 3.27Å; E230-H232 PolarHBondContact O-N 3.13Å; H232-Q235 PolarHBondContact O-N 3.34Å; H232-D236 WeakPolarHBondContact O-CB 3.26Å; H232-D236 PolarHBondContact O-N 3.41Å
233M98.4Very high97.3Very high121 Ų12197 Ų9760%0.59649%0.49SS*.Hα-helixtrans-63.8-43.5175.8-167.3-177.3-43.100111.5D229 E230 D236 A237D229-M233 PolarHBondContact O-N 3.34Å; E230-M233 WeakPolarHBondContact O-CA 3.3Å; E230-M233 WeakPolarHBondContact O-CB 3.47Å; E230-M233 PolarHBondContact O-N 2.96Å; M233-D236 PolarHBondContact O-N 2.96Å; M233-A237 PolarHBondContact O-N 3.47Å
234E97.8Very high97.3Very high104 Ų10495.6 Ų95.649%0.48649%0.487SS..Hα-helixtrans-62.4-42.7174.6-171-177.4179.900111.6E230 A237 M238E230-E234 PolarHBondContact O-N 3.38Å; E234-A237 PolarHBondContact O-N 3.11Å; E234-M238 HydrophobicContact CG-CE 4.38Å; E234-M238 WeakPolarHBondContact O-CG 3.47Å; E234-M238 PolarHBondContact O-N 2.97Å
235Q97Very high97.3Very high105 Ų10597 Ų9749%0.49149%0.494SS..Hα-helixtrans-60.9-45.4174.1172.6171.185.900112.2L231 H232 A237 M238 L239L231-Q235 VanDerWaalsContact O-CB 3.3Å; L231-Q235 WeakPolarHBondContact O-CB 3.48Å; L231-Q235 PolarHBondContact O-N 3.04Å; H232-Q235 PolarHBondContact O-N 3.34Å; Q235-A237 VanDerWaalsContact C-N 3.3Å; Q235-A237 PolarHBondContact O-N 2.97Å; Q235-M238 PolarHBondContact O-N 2.69Å; Q235-L239 HydrophobicContact CG-CD1 4.2Å; Q235-L239 HydrophobicContact CG-CG 4.49Å; Q235-L239 WeakPolarHBondContact O-CG 3.3Å; Q235-L239 PolarHBondContact O-N 3Å
236D97.7Very high97.1Very high100 Ų10097.2 Ų97.254%0.53550%0.498SS..Hα-helixtrans-62-40.7178.4-76.6-16.4000110.7H232 M233 L239 V240H232-D236 WeakPolarHBondContact O-CB 3.26Å; H232-D236 PolarHBondContact O-N 3.41Å; M233-D236 PolarHBondContact O-N 2.96Å; D236-L239 PolarHBondContact O-N 3.31Å; D236-V240 WeakPolarHBondContact O-CG2 3.42Å; D236-V240 PolarHBondContact O-N 3.5Å; D236-V240 VanDerWaalsContact O-N 3.13Å
237A98.1Very high97Very high52 Ų5298.3 Ų98.343%0.4349%0.494SS..Hα-helixtrans-61-48.317400000112M233 E234 Q235 L239 V240 D241M233-A237 PolarHBondContact O-N 3.47Å; E234-A237 PolarHBondContact O-N 3.11Å; Q235-A237 VanDerWaalsContact C-N 3.3Å; Q235-A237 PolarHBondContact O-N 2.97Å; A237-L239 VanDerWaalsContact C-N 3.29Å; A237-L239 PolarHBondContact O-N 3.36Å; A237-V240 WeakPolarHBondContact O-CB 3.35Å; A237-V240 PolarHBondContact O-N 3.26Å; A237-V240 VanDerWaalsContact O-N 3.16Å; A237-D241 PolarHBondContact O-N 2.95Å
238M96.8Very high96.9Very high97 Ų9799 Ų9948%0.47850%0.495SS..Hα-helixtrans-60.7-37176.9-73.8-170.6-71.400112.8E234 Q235 V240 D241 I242E234-M238 HydrophobicContact CG-CE 4.38Å; E234-M238 WeakPolarHBondContact O-CG 3.47Å; E234-M238 PolarHBondContact O-N 2.97Å; Q235-M238 PolarHBondContact O-N 2.69Å; M238-V240 VanDerWaalsContact C-N 3.34Å; M238-D241 PolarHBondContact O-N 3.44Å; M238-I242 VanDerWaalsContact O-CG1 3.26Å; M238-I242 WeakPolarHBondContact O-CG1 3.2Å; M238-I242 PolarHBondContact O-N 3.35Å
239L96.6Very high96.7Very high98 Ų9896.3 Ų96.351%0.51350%0.497SS..Hα-helixtrans-66.3-37.4177.5-74.6174.6000112.1Q235 D236 A237 I242 E243Q235-L239 HydrophobicContact CG-CD1 4.2Å; Q235-L239 HydrophobicContact CG-CG 4.49Å; Q235-L239 WeakPolarHBondContact O-CG 3.3Å; Q235-L239 PolarHBondContact O-N 3Å; D236-L239 PolarHBondContact O-N 3.31Å; A237-L239 VanDerWaalsContact C-N 3.29Å; A237-L239 PolarHBondContact O-N 3.36Å; L239-I242 PolarHBondContact O-N 3.47Å; L239-E243 PolarHBondContact O-N 3.38Å
240V98.2Very high96.4Very high75 Ų7597.5 Ų97.546%0.45550%0.5SS..Hα-helixtrans-63.6-46.7173.3172.70000110.5D236 A237 M238 I242 E243 D244D236-V240 WeakPolarHBondContact O-CG2 3.42Å; D236-V240 PolarHBondContact O-N 3.5Å; D236-V240 VanDerWaalsContact O-N 3.13Å; A237-V240 WeakPolarHBondContact O-CB 3.35Å; A237-V240 PolarHBondContact O-N 3.26Å; A237-V240 VanDerWaalsContact O-N 3.16Å; M238-V240 VanDerWaalsContact C-N 3.34Å; V240-I242 VanDerWaalsContact C-N 3.3Å; V240-I242 PolarHBondContact O-N 2.92Å; V240-E243 WeakPolarHBondContact O-CB 3.38Å; V240-E243 PolarHBondContact O-N 3.41Å; V240-E243 VanDerWaalsContact O-N 3.07Å; V240-D244 PolarHBondContact O-N 2.96Å
241D97Very high96.2Very high98 Ų9895.4 Ų95.452%0.52450%0.498SS..Hα-helixtrans-58.3-42.8176.8-69.8-24.1000111.7A237 M238 E243 D244 L245A237-D241 PolarHBondContact O-N 2.95Å; M238-D241 PolarHBondContact O-N 3.44Å; D241-E243 PolarHBondContact O-N 2.89Å; D241-D244 PolarHBondContact O-N 3.46Å; D241-L245 WeakPolarHBondContact O-CB 3.34Å; D241-L245 WeakPolarHBondContact O-CG 3.34Å; D241-L245 PolarHBondContact O-N 2.99Å
242I94.8Very high95.9Very high99 Ų9995.9 Ų95.951%0.50850%0.498SS..Hα-helixtrans-61.4-44.1175.3-70165.3000110.9M238 L239 V240 T246M238-I242 VanDerWaalsContact O-CG1 3.26Å; M238-I242 WeakPolarHBondContact O-CG1 3.2Å; M238-I242 PolarHBondContact O-N 3.35Å; L239-I242 PolarHBondContact O-N 3.47Å; V240-I242 VanDerWaalsContact C-N 3.3Å; V240-I242 PolarHBondContact O-N 2.92Å; I242-T246 VanDerWaalsContact O-CB 3.27Å; I242-T246 WeakPolarHBondContact O-CB 3.48Å; I242-T246 PolarHBondContact O-N 2.9Å; I242-T246 PolarHBondContact O-OG1 2.97Å
243E96.8Very high95.5Very high107 Ų10798 Ų9850%0.551%0.508SS..Hα-helixtrans-62.4-45.4178.6-173.7176.9178.300111.3L239 V240 D241 T246 R247L239-E243 PolarHBondContact O-N 3.38Å; V240-E243 WeakPolarHBondContact O-CB 3.38Å; V240-E243 PolarHBondContact O-N 3.41Å; V240-E243 VanDerWaalsContact O-N 3.07Å; D241-E243 PolarHBondContact O-N 2.89Å; E243-T246 PolarHBondContact O-N 3.42Å; E243-R247 WeakPolarHBondContact O-CB 3.44Å; E243-R247 PolarHBondContact O-N 3.35Å; E243-R247 IonicContact OE1-CZ 3.81Å; E243-R247 IonicContact OE1-NH2 2.69Å; E243-R247 PolarHBondContact OE1-NH2 2.94Å
244D97.3Very high95Very high91 Ų9198.7 Ų98.749%0.48751%0.508SS..Hα-helixtrans-65.5-44.8180-78.1-15.1000112V240 D241 T246 R247 H248V240-D244 PolarHBondContact O-N 2.96Å; D241-D244 PolarHBondContact O-N 3.46Å; D244-T246 VanDerWaalsContact C-N 3.33Å; D244-T246 PolarHBondContact O-N 2.86Å; D244-R247 PolarHBondContact O-N 2.97Å; D244-H248 WeakPolarHBondContact O-CB 3.39Å; D244-H248 PolarHBondContact O-N 3.32Å
245L95.6Very high94.6Very high121 Ų12198.7 Ų98.763%0.63451%0.507SS*.Hα-helixtrans-61.7-42.1175-71.7173.5000111.7D241 H248 A249D241-L245 WeakPolarHBondContact O-CB 3.34Å; D241-L245 WeakPolarHBondContact O-CG 3.34Å; D241-L245 PolarHBondContact O-N 2.99Å; L245-H248 PolarHBondContact O-N 2.96Å; L245-A249 WeakPolarHBondContact O-CB 3.42Å; L245-A249 PolarHBondContact O-N 3.38Å
246T93.6Very high94Very high69 Ų6998.7 Ų98.742%0.42351%0.51SS..Hα-helixtrans-64.9-47178.2-570000110.7I242 E243 D244 H248 A249 E250I242-T246 VanDerWaalsContact O-CB 3.27Å; I242-T246 WeakPolarHBondContact O-CB 3.48Å; I242-T246 PolarHBondContact O-N 2.9Å; I242-T246 PolarHBondContact O-OG1 2.97Å; E243-T246 PolarHBondContact O-N 3.42Å; D244-T246 VanDerWaalsContact C-N 3.33Å; D244-T246 PolarHBondContact O-N 2.86Å; T246-H248 VanDerWaalsContact C-N 3.33Å; T246-H248 PolarHBondContact O-N 3.29Å; T246-A249 PolarHBondContact O-N 3.38Å; T246-E250 WeakPolarHBondContact O-CG 3.4Å; T246-E250 PolarHBondContact O-N 2.95Å
247R96.3Very high93.4Very high137 Ų13795.9 Ų95.952%0.51750%0.501SS..Hα-helixtrans-60.7-42.6177.8-168.8-169.6-48.9-73.3-0.1111.8E243 D244 S251E243-R247 WeakPolarHBondContact O-CB 3.44Å; E243-R247 PolarHBondContact O-N 3.35Å; E243-R247 IonicContact OE1-CZ 3.81Å; E243-R247 IonicContact OE1-NH2 2.69Å; E243-R247 PolarHBondContact OE1-NH2 2.94Å; D244-R247 PolarHBondContact O-N 2.97Å; R247-S251 WeakPolarHBondContact O-CB 3.5Å; R247-S251 PolarHBondContact O-N 3.28Å
248H95.6Very high92.6Very high109 Ų10999.2 Ų99.251%0.50551%0.508SS..Hα-helixtrans-64.3-44.9177176.3-101.8000111.6D244 L245 T246 E250 S251 Q252D244-H248 WeakPolarHBondContact O-CB 3.39Å; D244-H248 PolarHBondContact O-N 3.32Å; L245-H248 PolarHBondContact O-N 2.96Å; T246-H248 VanDerWaalsContact C-N 3.33Å; T246-H248 PolarHBondContact O-N 3.29Å; H248-E250 PolarHBondContact O-N 3.34Å; H248-S251 PolarHBondContact O-N 3.04Å; H248-Q252 PolarHBondContact CE1-NE2 3.49Å; H248-Q252 PolarHBondContact NE2-NE2 2.71Å; H248-Q252 WeakPolarHBondContact O-CG 3.4Å; H248-Q252 PolarHBondContact O-N 3.48Å
249A92Very high91.5Very high55 Ų55102.3 Ų102.346%0.45551%0.514SS..Hα-helixtrans-60.8-43.9176.800000112.3L245 T246 S251 Q252 Q253L245-A249 WeakPolarHBondContact O-CB 3.42Å; L245-A249 PolarHBondContact O-N 3.38Å; T246-A249 PolarHBondContact O-N 3.38Å; A249-S251 PolarHBondContact O-N 2.94Å; A249-Q252 PolarHBondContact O-N 3.38Å; A249-Q253 PolarHBondContact O-N 3.11Å
250E93.1Very high90.3Very high101 Ų101102.3 Ų102.347%0.47252%0.518SS..Hα-helixtrans-62.5-42.1175.6-73179.6-178.100112.4T246 H248 Q253 K254T246-E250 WeakPolarHBondContact O-CG 3.4Å; T246-E250 PolarHBondContact O-N 2.95Å; H248-E250 PolarHBondContact O-N 3.34Å; E250-Q253 PolarHBondContact O-N 3.37Å; E250-K254 WeakPolarHBondContact O-CG 3.28Å; E250-K254 PolarHBondContact O-N 3.16Å
251S93.5Very high88.6Confident74 Ų74105.6 Ų105.652%0.51753%0.533SS..Hα-helixtrans-61.8-45.2176.6-173.80000111.5R247 H248 A249 Q253 K254 H255R247-S251 WeakPolarHBondContact O-CB 3.5Å; R247-S251 PolarHBondContact O-N 3.28Å; H248-S251 PolarHBondContact O-N 3.04Å; A249-S251 PolarHBondContact O-N 2.94Å; S251-Q253 VanDerWaalsContact C-N 3.34Å; S251-Q253 PolarHBondContact O-N 2.92Å; S251-K254 PolarHBondContact O-N 3Å; S251-H255 PolarHBondContact O-N 3.4Å
252Q91Very high86.7Confident105 Ų105106 Ų10649%0.49154%0.543SS..Hα-helixtrans-60.8-42.5175-74.3-163.3-9.700112.1H248 A249 H255 L256H248-Q252 PolarHBondContact CE1-NE2 3.49Å; H248-Q252 PolarHBondContact NE2-NE2 2.71Å; H248-Q252 WeakPolarHBondContact O-CG 3.4Å; H248-Q252 PolarHBondContact O-N 3.48Å; A249-Q252 PolarHBondContact O-N 3.38Å; Q252-H255 PolarHBondContact O-N 3.01Å; Q252-L256 WeakPolarHBondContact O-CB 3.48Å; Q252-L256 WeakPolarHBondContact O-CG 3.48Å; Q252-L256 PolarHBondContact O-N 3.19Å
253Q88.8Confident84.4Confident140 Ų140113 Ų11365%0.65457%0.57SS**Hα-helixtrans-63.5-42178.1-171.4177.63.300112A249 E250 S251 L256 A257A249-Q253 PolarHBondContact O-N 3.11Å; E250-Q253 PolarHBondContact O-N 3.37Å; S251-Q253 VanDerWaalsContact C-N 3.34Å; S251-Q253 PolarHBondContact O-N 2.92Å; Q253-L256 PolarHBondContact O-N 3.09Å; Q253-A257 WeakPolarHBondContact O-CB 3.42Å; Q253-A257 PolarHBondContact O-N 3.15Å
254K88.6Confident83.8Confident135 Ų135113.3 Ų113.359%0.58757%0.573SS**Hα-helixtrans-60.6-48.5174.7-74.7174.9-177.7171.70111.6E250 S251 L256 A257 E258E250-K254 WeakPolarHBondContact O-CG 3.28Å; E250-K254 PolarHBondContact O-N 3.16Å; S251-K254 PolarHBondContact O-N 3Å; K254-L256 VanDerWaalsContact C-N 3.31Å; K254-L256 PolarHBondContact O-N 3.34Å; K254-A257 WeakPolarHBondContact O-CB 3.33Å; K254-A257 PolarHBondContact O-N 3.31Å; K254-A257 VanDerWaalsContact O-N 3.15Å; K254-E258 WeakPolarHBondContact O-CG 3.33Å; K254-E258 PolarHBondContact O-N 3.2Å
255H87.9Confident83.1Confident104 Ų104114.4 Ų114.448%0.48158%0.578SS.*Hα-helixtrans-62.4-37.8178.8-177-106.4000112.4S251 Q252 R259S251-H255 PolarHBondContact O-N 3.4Å; Q252-H255 PolarHBondContact O-N 3.01Å; H255-R259 WeakPolarHBondContact O-CG 3.34Å; H255-R259 PolarHBondContact O-N 2.93Å; H255-R259 VanDerWaalsContact O-N 3.16Å
256L85.7Confident82.4Confident105 Ų105114.1 Ų114.155%0.5557%0.574SS.*Hα-helixtrans-64.7-43.9173-74.6168.4000111.9Q252 Q253 K254 R259 T260Q252-L256 WeakPolarHBondContact O-CB 3.48Å; Q252-L256 WeakPolarHBondContact O-CG 3.48Å; Q252-L256 PolarHBondContact O-N 3.19Å; Q253-L256 PolarHBondContact O-N 3.09Å; K254-L256 VanDerWaalsContact C-N 3.31Å; K254-L256 PolarHBondContact O-N 3.34Å; L256-R259 PolarHBondContact O-N 3.24Å; L256-T260 VanDerWaalsContact O-CG2 3.28Å; L256-T260 WeakPolarHBondContact O-CG2 3.42Å; L256-T260 PolarHBondContact O-N 3.35Å; L256-T260 PolarHBondContact O-OG1 2.89Å
257A83.4Confident81.7Confident42 Ų42116.7 Ų116.735%0.34758%0.583SS.*Hα-helixtrans-61.6-46.6177.800000111.8Q253 K254 R259 T260 L261Q253-A257 WeakPolarHBondContact O-CB 3.42Å; Q253-A257 PolarHBondContact O-N 3.15Å; K254-A257 WeakPolarHBondContact O-CB 3.33Å; K254-A257 PolarHBondContact O-N 3.31Å; K254-A257 VanDerWaalsContact O-N 3.15Å; A257-R259 VanDerWaalsContact C-N 3.32Å; A257-R259 PolarHBondContact O-N 3.06Å; A257-T260 WeakPolarHBondContact CA-OG1 3.5Å; A257-T260 PolarHBondContact O-N 3.5Å; A257-T260 VanDerWaalsContact O-N 3.11Å; A257-T260 PolarHBondContact O-OG1 3.4Å; A257-L261 PolarHBondContact O-N 3.48Å
258E82.5Confident80.8Confident122 Ų122115.4 Ų115.457%0.5759%0.587SS**Hα-helixtrans-60.4-38.5177.3-72.6172.7-176.400112.6K254 L261 S262K254-E258 WeakPolarHBondContact O-CG 3.33Å; K254-E258 PolarHBondContact O-N 3.2Å; E258-L261 PolarHBondContact O-N 3.32Å; E258-S262 WeakPolarHBondContact O-CB 3.45Å; E258-S262 PolarHBondContact O-N 3.36Å; E258-S262 PolarHBondContact O-OG 3.14Å
259R73.3Confident79.8Confident162 Ų162115.9 Ų115.961%0.61159%0.593SS**Hα-helixtrans-70.5-29.9175.2-71.6-179.282.8-176.610113.4H255 L256 A257H255-R259 WeakPolarHBondContact O-CG 3.34Å; H255-R259 PolarHBondContact O-N 2.93Å; H255-R259 VanDerWaalsContact O-N 3.16Å; L256-R259 PolarHBondContact O-N 3.24Å; A257-R259 VanDerWaalsContact C-N 3.32Å; A257-R259 PolarHBondContact O-N 3.06Å
260T71.2Confident78.9Confident98 Ų98120.2 Ų120.260%0.60160%0.603SS**Hα-helixtrans-77.8-28.9176.3580000112.9L256 A257L256-T260 VanDerWaalsContact O-CG2 3.28Å; L256-T260 WeakPolarHBondContact O-CG2 3.42Å; L256-T260 PolarHBondContact O-N 3.35Å; L256-T260 PolarHBondContact O-OG1 2.89Å; A257-T260 WeakPolarHBondContact CA-OG1 3.5Å; A257-T260 PolarHBondContact O-N 3.5Å; A257-T260 VanDerWaalsContact O-N 3.11Å; A257-T260 PolarHBondContact O-OG1 3.4Å
261L63.3Low77.9Confident144 Ų144121.7 Ų121.775%0.75461%0.613SS**Hα-helixtrans-80-19.3175-86145.7000113.6A257 E258 K263A257-L261 PolarHBondContact O-N 3.48Å; E258-L261 PolarHBondContact O-N 3.32Å; L261-K263 VanDerWaalsContact C-N 3.32Å
262S57Low76.6Confident105 Ų105125.7 Ų125.773%0.73462%0.621SS**THydrogen-bonded Turntrans-89.611.7178-59.60000114E258E258-S262 WeakPolarHBondContact O-CB 3.45Å; E258-S262 PolarHBondContact O-N 3.36Å; E258-S262 PolarHBondContact O-OG 3.14Å
263K45.9Very low75.2Confident246 Ų246127.5 Ų127.5100%1.0763%0.633SS**  trans-119.70174.7-80-177.3173.7-178.90109.9L261L261-K263 VanDerWaalsContact C-N 3.32Å

Retrieved 263 of 263 residues in 166.9 ms (Link to these results)