YI036_YEAST Loading...

Putative uncharacterized membrane protein YIR036W-A

AlphaFold DB , UniProt , Accession A0A023PYI5, Species YEAST (Saccharomyces cerevisiae (strain ATCC 204508 / S288c), Baker's yeast), Gene n/a, Length 133 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M36.9Very low33.2Very low249 Ų249164.6 Ų164.6100%1.22780%0.795SS**  0112.20-133.5173.7173.200106.1
2L30.7Very low33Very low170 Ų170161.6 Ų161.689%0.8978%0.779SS**PPolyproline II helixtrans-79.6130.5-158.6-72.5146.5000111.3
3L29.5Very low32.8Very low146 Ų146158.1 Ų158.176%0.76478%0.781SS**PPolyproline II helixtrans-58.1137.6168.9-142.779.1000108.5D5L3-D5 PolarHBondContact O-N 3.17Å; L3-D5 VanDerWaalsContact O-N 3.16Å
4P35.8Very low32.7Very low105 Ų105162.2 Ų162.268%0.68278%0.783SS**PPolyproline II helixtrans-69116.7-179.4-1125.5000110.2F6P4-F6 PolarHBondContact O-N 3.02Å
5D35.3Very low32.6Very low124 Ų124156.2 Ų156.266%0.66376%0.762SS**THydrogen-bonded Turntrans-59.37.8-179.6-73.7-49.5000115.8L3L3-D5 PolarHBondContact O-N 3.17Å; L3-D5 VanDerWaalsContact O-N 3.16Å
6F33.7Very low32.8Very low179 Ų179153 Ų15379%0.78576%0.755SS**THydrogen-bonded Turntrans-87.8-13.2-176.7-115.2-97.3000114.7P4P4-F6 PolarHBondContact O-N 3.02Å
7L32.3Very low32.7Very low147 Ų147155.7 Ų155.777%0.7775%0.754SS**SBendtrans-95.1-13.9177-73.8171.8000113.7Q9L7-Q9 VanDerWaalsContact C-N 3.31Å; L7-Q9 PolarHBondContact O-N 3.29Å
8H32.6Very low32.9Very low125 Ų125152.2 Ų152.258%0.57974%0.74SS**THydrogen-bonded Turntrans-79.6-7.6175.8-98.8170.8000114.3H12H8-H12 AromaticContact CD2-CD2 3.61Å; H8-H12 AromaticContact CD2-NE2 3.35Å; H8-H12 PolarHBondContact CD2-NE2 3.36Å; H8-H12 VanDerWaalsContact CD2-NE2 3.35Å; H8-H12 AromaticContact NE2-NE2 3.9Å; H8-H12 PolarHBondContact O-CD2 2.9Å
9Q31.9Very low33Very low160 Ų160148.5 Ų148.575%0.74873%0.727SS**THydrogen-bonded Turntrans-105.3-2.5-168.5-118.7177.9-1.200116.4L7L7-Q9 VanDerWaalsContact C-N 3.31Å; L7-Q9 PolarHBondContact O-N 3.29Å
10R32.8Very low32.9Very low225 Ų225147.5 Ų147.585%0.84972%0.721SS**SBendtrans-123.3-1179.6-79.8-166.2178.8-171.91.4117.1
11F34.1Very low32.9Very low181 Ų181145.7 Ų145.779%0.79471%0.714SS**SBendtrans-128.45.2177.7-71.1-78.3000114.6
12H31.1Very low32.8Very low128 Ų128138 Ų13859%0.59368%0.682SS**  trans-114.988.3179.5-72.6-74.1000111.6H8H8-H12 AromaticContact CD2-CD2 3.61Å; H8-H12 AromaticContact CD2-NE2 3.35Å; H8-H12 PolarHBondContact CD2-NE2 3.36Å; H8-H12 VanDerWaalsContact CD2-NE2 3.35Å; H8-H12 AromaticContact NE2-NE2 3.9Å; H8-H12 PolarHBondContact O-CD2 2.9Å
13S30.4Very low32.8Very low116 Ų116135.1 Ų135.181%0.81167%0.666SS**SBendtrans-176.32.2153.452.50000115.8
14R31.1Very low32.9Very low216 Ų216134.9 Ų134.982%0.81567%0.665SS**SBendtrans-121.5125.6170.1-74.7-173.5177.7-170.1-1.5111V16R14-V16 PolarHBondContact O-N 3.03Å; R14-V16 VanDerWaalsContact O-N 3.17Å
15P31.1Very low32.5Very low72 Ų72138.3 Ų138.347%0.46867%0.67SS.*  trans-58.5125-177.825.4-31.6000108R17 D18P15-R17 HydrophobicContact CB-CB 4.47Å; P15-R17 PolarHBondContact O-N 3.44Å; P15-D18 PolarHBondContact O-N 2.96Å
16V35.5Very low32.2Very low105 Ų105139.5 Ų139.564%0.63667%0.669SS**THydrogen-bonded Turntrans-53.4-9173.51750000112.4R14 V19 E20R14-V16 PolarHBondContact O-N 3.03Å; R14-V16 VanDerWaalsContact O-N 3.17Å; V16-V19 PolarHBondContact O-N 2.82Å; V16-E20 PolarHBondContact O-N 3.5Å
17R31.9Very low31.7Very low199 Ų199137.7 Ų137.775%0.75167%0.672SS**Hα-helixtrans-69.3-27171.8-58.2-174.3-151.7-162.55.2114P15 V19P15-R17 HydrophobicContact CB-CB 4.47Å; P15-R17 PolarHBondContact O-N 3.44Å; R17-V19 VanDerWaalsContact C-N 3.34Å
18D35.3Very low31.4Very low92 Ų92134.3 Ų134.349%0.49266%0.66SS.*Hα-helixtrans-82.2-16.7173.8-67.3-28.3000112.3P15 T22P15-D18 PolarHBondContact O-N 2.96Å; D18-T22 WeakPolarHBondContact O-CB 3.46Å; D18-T22 PolarHBondContact O-N 3.41Å; D18-T22 VanDerWaalsContact O-N 3.16Å; D18-T22 PolarHBondContact O-OG1 3.21Å
19V34.5Very low31Very low82 Ų82134.6 Ų134.650%0.49767%0.671SS.*Hα-helixtrans-76.5-37.6176.9-178.90000110V16 R17 T22 I23V16-V19 PolarHBondContact O-N 2.82Å; R17-V19 VanDerWaalsContact C-N 3.34Å; V19-T22 PolarHBondContact O-N 2.97Å; V19-I23 HydrophobicContact CG1-CD1 3.89Å; V19-I23 VanDerWaalsContact O-CD1 3.3Å; V19-I23 WeakPolarHBondContact O-CD1 3.4Å; V19-I23 WeakPolarHBondContact O-CG1 3.39Å; V19-I23 PolarHBondContact O-N 2.85Å; V19-I23 VanDerWaalsContact O-N 3.09Å
20E31.4Very low30.8Very low129 Ų129131.2 Ų131.260%0.60366%0.661SS**Hα-helixtrans-64.4-42.3173.9-68.2177.8155.500111.5V16 T22 I23 D24V16-E20 PolarHBondContact O-N 3.5Å; E20-T22 VanDerWaalsContact C-N 3.31Å; E20-T22 PolarHBondContact O-N 3.43Å; E20-I23 PolarHBondContact O-N 3.23Å; E20-D24 PolarHBondContact O-N 3.2Å
21D33.5Very low30.4Very low109 Ų109126.1 Ų126.158%0.58365%0.645SS**Hα-helixtrans-72.5-19.6176.7-78.8-11.7000114.3
22T34.6Very low30.1Very low88 Ų88120.8 Ų120.854%0.5463%0.63SS.*Hα-helixtrans-86-27175.2-51.60000111.6D18 V19 E20 K25D18-T22 WeakPolarHBondContact O-CB 3.46Å; D18-T22 PolarHBondContact O-N 3.41Å; D18-T22 VanDerWaalsContact O-N 3.16Å; D18-T22 PolarHBondContact O-OG1 3.21Å; V19-T22 PolarHBondContact O-N 2.97Å; E20-T22 VanDerWaalsContact C-N 3.31Å; E20-T22 PolarHBondContact O-N 3.43Å; T22-K25 PolarHBondContact O-N 3.11Å
23I31.2Very low29.9Very low110 Ų110119.5 Ų119.556%0.56463%0.627SS**Hα-helixtrans-70.5-35.1177.4-73.2164000111V19 E20 K25 F26V19-I23 HydrophobicContact CG1-CD1 3.89Å; V19-I23 VanDerWaalsContact O-CD1 3.3Å; V19-I23 WeakPolarHBondContact O-CD1 3.4Å; V19-I23 WeakPolarHBondContact O-CG1 3.39Å; V19-I23 PolarHBondContact O-N 2.85Å; V19-I23 VanDerWaalsContact O-N 3.09Å; E20-I23 PolarHBondContact O-N 3.23Å; I23-K25 PolarHBondContact O-N 3.01Å; I23-F26 PolarHBondContact O-N 2.87Å
24D30.5Very low29.8Very low140 Ų140122.3 Ų122.375%0.74963%0.628SS**THydrogen-bonded Turntrans-70.6-10.3178.3-89.5-7000114.6E20E20-D24 PolarHBondContact O-N 3.2Å
25K28.3Very low29.7Very low178 Ų178122.5 Ų122.577%0.77463%0.628SS**THydrogen-bonded Turntrans-94.5-6.7175.1-74.8176.7-179.7168.20114T22 I23 V27T22-K25 PolarHBondContact O-N 3.11Å; I23-K25 PolarHBondContact O-N 3.01Å; K25-V27 VanDerWaalsContact C-N 3.31Å; K25-V27 PolarHBondContact O-N 2.8Å; K25-V27 VanDerWaalsContact O-N 3.13Å
26F27.5Very low29.6Very low149 Ų149122.7 Ų122.765%0.65463%0.625SS**  trans-86.972.7171.8-99.8-94.8000110.7I23 C28I23-F26 PolarHBondContact O-N 2.87Å; F26-C28 HydrophobicContact CD1-CB 3.82Å; F26-C28 PolarHBondContact O-N 3.24Å
27V24.7Very low29.3Very low141 Ų141126.5 Ų126.586%0.85564%0.636SS**  trans-68.575.2156.8-179.70000107.3K25K25-V27 VanDerWaalsContact C-N 3.31Å; K25-V27 PolarHBondContact O-N 2.8Å; K25-V27 VanDerWaalsContact O-N 3.13Å
28C24.5Very low29.3Very low76 Ų76120 Ų12051%0.51462%0.619SS.*SBendtrans-154.678.7-178-127.40000107.7F26 V30F26-C28 HydrophobicContact CD1-CB 3.82Å; F26-C28 PolarHBondContact O-N 3.24Å; C28-V30 VanDerWaalsContact O-CG2 3.3Å; C28-V30 WeakPolarHBondContact O-CG2 3.41Å; C28-V30 PolarHBondContact O-N 3.29Å
29T25.1Very low29Very low131 Ų131120.4 Ų120.480%0.80463%0.628SS**  trans19.960157-0.40000114.8F31T29-F31 VanDerWaalsContact C-N 3.26Å; T29-F31 PolarHBondContact O-N 2.88Å
30V27.7Very low28.9Very low89 Ų89121.9 Ų121.954%0.53963%0.628SS.*  trans-78.592.4171.2179.50000103.4C28 S32C28-V30 VanDerWaalsContact O-CG2 3.3Å; C28-V30 WeakPolarHBondContact O-CG2 3.41Å; C28-V30 PolarHBondContact O-N 3.29Å; V30-S32 PolarHBondContact O-N 3.48Å
31F24.9Very low28.8Very low118 Ų118125.7 Ų125.752%0.51864%0.637SS.*  trans-51115.3153.2-75.7-65.7000105.7T29 L33 C99T29-F31 VanDerWaalsContact C-N 3.26Å; T29-F31 PolarHBondContact O-N 2.88Å; F31-L33 PolarHBondContact O-N 3.08Å; F31-C99 HydrophobicContact CD1-CB 3.78Å; F31-C99 WeakPolarHBondContact CD1-SG 3.49Å; F31-C99 HydrophobicContact CE1-CB 3.31Å; F31-C99 WeakPolarHBondContact CE1-SG 3.33Å; F31-C99 HydrophobicContact CZ-CB 3.92Å
32S27.2Very low28.5Very low68 Ų68123.4 Ų123.448%0.47663%0.63SS.*  trans-68.464.3178.3-66.60000109.9V30 Q34 R35V30-S32 PolarHBondContact O-N 3.48Å; S32-Q34 PolarHBondContact O-N 3.45Å; S32-R35 PolarHBondContact O-N 2.82Å; S32-R35 VanDerWaalsContact O-N 3.11Å
33L27.2Very low28.2Very low102 Ų102125.3 Ų125.353%0.53465%0.645SS.*G310 helixtrans-65.2-18.6159.4-75.8167000110F31 R35 L36 A95F31-L33 PolarHBondContact O-N 3.08Å; L33-R35 PolarHBondContact O-N 3.45Å; L33-L36 PolarHBondContact O-N 3.22Å; L33-A95 HydrophobicContact CD2-CB 4.33Å
34Q29.1Very low28Very low175 Ų175129.1 Ų129.182%0.81865%0.654SS**G310 helixtrans-70.8-7.7167.7-78.3-178-3200114.7S32S32-Q34 PolarHBondContact O-N 3.45Å
35R27.8Very low28Very low220 Ų220127.4 Ų127.483%0.8366%0.659SS**G310 helixtrans-112.30.8171.6-78.3-173176.2176.90.8114.4S32 L33 Q37S32-R35 PolarHBondContact O-N 2.82Å; S32-R35 VanDerWaalsContact O-N 3.11Å; L33-R35 PolarHBondContact O-N 3.45Å; R35-Q37 PolarHBondContact O-N 2.89Å
36L28.9Very low28.2Very low75 Ų75122.6 Ų122.639%0.39364%0.644SS.*  trans-96.272.3164.6-89.8147000107.7L33 T38L33-L36 PolarHBondContact O-N 3.22Å; L36-T38 HydrophobicContact CB-CG2 4.21Å; L36-T38 HydrophobicContact CD2-CG2 3.63Å; L36-T38 PolarHBondContact O-N 2.88Å
37Q30.5Very low28.5Very low186 Ų186121.6 Ų121.687%0.86965%0.646SS**  trans-63.975.7154.8-80.1-176.1-3300107.2R35 S39R35-Q37 PolarHBondContact O-N 2.89Å; Q37-S39 PolarHBondContact O-N 3.03Å
38T30.8Very low28.9Very low63 Ų63117.8 Ų117.839%0.38762%0.621SS.*  trans-77.783167.953.30000106.7L36 F40L36-T38 HydrophobicContact CB-CG2 4.21Å; L36-T38 HydrophobicContact CD2-CG2 3.63Å; L36-T38 PolarHBondContact O-N 2.88Å; T38-F40 PolarHBondContact O-N 3.31Å
39S30.3Very low29.5Very low99 Ų99116 Ų11669%0.69261%0.612SS**  trans-64.7112.816153.70000107.5Q37Q37-S39 PolarHBondContact O-N 3.03Å
40F32Very low30.2Very low113 Ų113116.2 Ų116.250%0.49660%0.602SS.*  trans-86.8111168.6-77.7-88.8000108.1T38 S42 F87T38-F40 PolarHBondContact O-N 3.31Å; F40-S42 PolarHBondContact O-N 3.27Å; F40-F87 AromaticContact CD2-CE2 3.99Å; F40-F87 HydrophobicContact CD2-CE2 3.99Å; F40-F87 HydrophobicContact CD2-CZ 4.49Å; F40-F87 AromaticContact CE2-CE2 3.68Å; F40-F87 HydrophobicContact CE2-CE2 3.68Å; F40-F87 HydrophobicContact CE2-CZ 4.19Å; F40-F87 HydrophobicContact CZ-CE2 4.08Å
41R29.6Very low31Very low209 Ų209116.4 Ų116.479%0.78960%0.599SS**  trans-80.4105.2168.4-166176.8-174.2-164.30.4107.6
42S26.4Very low31.9Very low62 Ų62112.7 Ų112.743%0.43459%0.585SS.*  trans-56139.3163.4163.20000108.9F40 Y44F40-S42 PolarHBondContact O-N 3.27Å; S42-Y44 PolarHBondContact O-N 3.35Å; S42-Y44 PolarHBondContact OG-N 2.97Å
43C28.5Very low32.7Very low128 Ų128114 Ų11487%0.86559%0.587SS**SBendtrans-636.6174.9-51.40000113.4
44Y26Very low33.5Very low189 Ų189112.9 Ų112.974%0.74158%0.578SS**SBendtrans-120.384.7179.4-62-83.1000110S42 V46S42-Y44 PolarHBondContact O-N 3.35Å; S42-Y44 PolarHBondContact OG-N 2.97Å; Y44-V46 PolarHBondContact O-N 2.95Å
45A30.2Very low34Very low105 Ų105106.8 Ų106.887%0.86855%0.551SS**SBendtrans41.96.2147.100000122.9
46V33Very low34.5Very low76 Ų76104.5 Ų104.546%0.46156%0.555SS.*SBendtrans-142.1123.4178.9-167.90000109.2Y44 D48Y44-V46 PolarHBondContact O-N 2.95Å; V46-D48 VanDerWaalsContact C-N 3.26Å; V46-D48 WeakPolarHBondContact CG1-OD1 3.49Å; V46-D48 PolarHBondContact O-N 3.39Å
47D34Very low34.9Very low128 Ų128104.6 Ų104.668%0.68456%0.562SS**  trans-7274.8-178.8-67.6-45.8000111.4A49D47-A49 PolarHBondContact O-N 2.79Å
48D33.9Very low35.4Very low61 Ų61103.7 Ų103.733%0.32656%0.555SS.*  trans-87.2103.5174.3-67.9-10.4000109.4V46 F50 G67 G68V46-D48 VanDerWaalsContact C-N 3.26Å; V46-D48 WeakPolarHBondContact CG1-OD1 3.49Å; V46-D48 PolarHBondContact O-N 3.39Å; D48-F50 HydrophobicContact CB-CE2 4.17Å; D48-F50 HydrophobicContact CB-CZ 4.39Å; D48-G67 VanDerWaalsContact OD1-O 3.09Å; D48-G68 WeakPolarHBondContact OD1-CA 3.34Å; D48-G68 PolarHBondContact OD1-N 3.31Å
49A37.5Very low35.8Very low39 Ų39106.3 Ų106.332%0.32256%0.563SS.*EExtended strand (participates in β ladder)trans-92.6139.7169.200000109.9D47 T66D47-A49 PolarHBondContact O-N 2.79Å; A49-T66 WeakPolarHBondContact CB-O 3.47Å; A49-T66 CarbonylContact O-C 3.58Å; A49-T66 WeakPolarHBondContact O-CA 3.11Å; A49-T66 PolarHBondContact O-N 3.34Å; A49-T66 VanDerWaalsContact O-O 3.06Å; A49-T66 PolarHBondContact O-OG1 3.45Å
50F39.8Very low36.5Very low136 Ų136106 Ų10660%0.59655%0.551SS**EExtended strand (participates in β ladder)trans-113.3131.3175-62.4-89.4000109.4D48 P65D48-F50 HydrophobicContact CB-CE2 4.17Å; D48-F50 HydrophobicContact CB-CZ 4.39Å; F50-P65 HydrophobicContact CD1-CB 4.16Å; F50-P65 HydrophobicContact CE1-CB 3.91Å
51I44.4Very low36.8Very low92 Ų92106.1 Ų106.147%0.47256%0.556SS.*EExtended strand (participates in β ladder)trans-99.5119.9166.3-61.5177.5000107.2L53 A63 N64 T66I51-L53 HydrophobicContact CG2-CG 4.21Å; I51-A63 WeakPolarHBondContact O-CA 3.4Å; I51-N64 PolarHBondContact N-O 3.45Å; I51-N64 PolarHBondContact O-N 3.42Å; I51-T66 HydrophobicContact CD1-CG2 3.78Å; I51-T66 HydrophobicContact CG1-CG2 4.05Å
52V43Very low37.5Very low40 Ų40100.9 Ų100.924%0.24254%0.54CS..EExtended strand (participates in β ladder)trans-109.6120.4171.7-168.60000108.4F54 Q60 A63V52-F54 HydrophobicContact CB-CE2 4.04Å; V52-F54 HydrophobicContact CB-CZ 4.45Å; V52-F54 HydrophobicContact CG1-CD2 4.19Å; V52-F54 HydrophobicContact CG1-CE1 4.27Å; V52-F54 HydrophobicContact CG1-CE2 3.4Å; V52-F54 VanDerWaalsContact CG1-CE2 3.4Å; V52-F54 HydrophobicContact CG1-CZ 3.43Å; V52-F54 VanDerWaalsContact CG1-CZ 3.43Å; V52-Q60 HydrophobicContact CG1-CG 4.23Å; V52-A63 HydrophobicContact CG2-CB 4.31Å
53L43.3Very low38.2Very low96 Ų9699.8 Ų99.850%0.50354%0.535SS..EExtended strand (participates in β ladder)trans-102.9132.9176.1-72.5155.9000109.2I51 L61 Q62I51-L53 HydrophobicContact CG2-CG 4.21Å; L53-L61 HydrophobicContact CB-CB 4.43Å; L53-L61 PolarHBondContact O-N 2.63Å; L53-Q62 PolarHBondContact N-O 2.69Å
54F44.2Very low38.9Very low79 Ų7997.5 Ų97.535%0.34652%0.515SS..EExtended strand (participates in β ladder)trans-115148.7174.6-65.8-85.5000110.7V52 H59 Q60 L88V52-F54 HydrophobicContact CB-CE2 4.04Å; V52-F54 HydrophobicContact CB-CZ 4.45Å; V52-F54 HydrophobicContact CG1-CD2 4.19Å; V52-F54 HydrophobicContact CG1-CE1 4.27Å; V52-F54 HydrophobicContact CG1-CE2 3.4Å; V52-F54 VanDerWaalsContact CG1-CE2 3.4Å; V52-F54 HydrophobicContact CG1-CZ 3.43Å; V52-F54 VanDerWaalsContact CG1-CZ 3.43Å; F54-H59 CarbonylContact C-O 3.6Å; F54-H59 VanDerWaalsContact CA-O 3.31Å; F54-H59 WeakPolarHBondContact CA-O 3.44Å; F54-Q60 HydrophobicContact CD1-CB 4.39Å; F54-Q60 HydrophobicContact CE1-CB 4.14Å; F54-L88 HydrophobicContact CE1-CD2 4.29Å; F54-L88 HydrophobicContact CE2-CD2 4.46Å; F54-L88 HydrophobicContact CZ-CD2 3.59Å
55D39.8Very low39.5Very low46 Ų4693 Ų9325%0.24651%0.508CS..  trans-76.9172.6165.378.5-2000110.9S57 F58 H59 L61D55-S57 PolarHBondContact O-N 3.11Å; D55-S57 VanDerWaalsContact O-N 3.08Å; D55-S57 WeakPolarHBondContact OD1-CA 3.44Å; D55-S57 WeakPolarHBondContact OD1-CB 3.2Å; D55-S57 PolarHBondContact OD1-N 3.43Å; D55-F58 PolarHBondContact O-N 2.96Å; D55-F58 VanDerWaalsContact O-N 3.09Å; D55-F58 PolarHBondContact OD1-N 2.81Å; D55-H59 PolarHBondContact N-O 2.7Å; D55-H59 WeakPolarHBondContact OD1-CA 3.5Å; D55-H59 WeakPolarHBondContact OD1-CB 3.28Å; D55-H59 IonicContact OD1-CG 2.92Å; D55-H59 PolarHBondContact OD1-N 3.47Å; D55-H59 IonicContact OD1-ND1 2.74Å; D55-H59 IonicContact OD2-CG 3.61Å; D55-H59 IonicContact OD2-ND1 3.57Å; D55-H59 PolarHBondContact OD2-ND1 3.19Å; D55-L61 HydrophobicContact CB-CD1 3.73Å; D55-L61 HydrophobicContact CB-CD2 3.92Å; D55-L61 HydrophobicContact CB-CG 3.78Å
56N38.1Very low40Very low172 Ų17291 Ų9192%0.9249%0.485SS*.THydrogen-bonded Turntrans-65.7-7.8176.8-66.3-30.9000113.9
57S38Very low40.1Very low78 Ų7888.9 Ų88.955%0.54548%0.479SS..THydrogen-bonded Turntrans-104.28.9177.3-52.20000112.5D55 H59D55-S57 PolarHBondContact O-N 3.11Å; D55-S57 VanDerWaalsContact O-N 3.08Å; D55-S57 WeakPolarHBondContact OD1-CA 3.44Å; D55-S57 WeakPolarHBondContact OD1-CB 3.2Å; D55-S57 PolarHBondContact OD1-N 3.43Å; S57-H59 VanDerWaalsContact C-N 3.27Å; S57-H59 WeakPolarHBondContact CB-ND1 3.45Å; S57-H59 PolarHBondContact O-N 2.85Å
58F39.8Very low40.1Very low166 Ų16685 Ų8573%0.72847%0.469SS*.SBendtrans65.118.2-174.9-56.3-88000115.6D55D55-F58 PolarHBondContact O-N 2.96Å; D55-F58 VanDerWaalsContact O-N 3.09Å; D55-F58 PolarHBondContact OD1-N 2.81Å
59H39.6Very low40.1Very low119 Ų11988.3 Ų88.355%0.55149%0.492SS*.  trans-77.2133.6165.3-53.4116000110F54 D55 S57 L61F54-H59 CarbonylContact C-O 3.6Å; F54-H59 VanDerWaalsContact CA-O 3.31Å; F54-H59 WeakPolarHBondContact CA-O 3.44Å; D55-H59 PolarHBondContact N-O 2.7Å; D55-H59 WeakPolarHBondContact OD1-CA 3.5Å; D55-H59 WeakPolarHBondContact OD1-CB 3.28Å; D55-H59 IonicContact OD1-CG 2.92Å; D55-H59 PolarHBondContact OD1-N 3.47Å; D55-H59 IonicContact OD1-ND1 2.74Å; D55-H59 IonicContact OD2-CG 3.61Å; D55-H59 IonicContact OD2-ND1 3.57Å; D55-H59 PolarHBondContact OD2-ND1 3.19Å; S57-H59 VanDerWaalsContact C-N 3.27Å; S57-H59 WeakPolarHBondContact CB-ND1 3.45Å; S57-H59 PolarHBondContact O-N 2.85Å; H59-L61 PolarHBondContact O-N 3.16Å
60Q45.2Very low40Very low91 Ų9191.3 Ų91.343%0.42551%0.51SS..EExtended strand (participates in β ladder)trans-65.8116.2171.9179.4-178.1-1200109.1V52 F54 Y84V52-Q60 HydrophobicContact CG1-CG 4.23Å; F54-Q60 HydrophobicContact CD1-CB 4.39Å; F54-Q60 HydrophobicContact CE1-CB 4.14Å; Q60-Y84 PolarHBondContact OE1-OH 3.21Å
61L39Very low39.6Very low117 Ų11790.5 Ų90.561%0.61351%0.511SS*.EExtended strand (participates in β ladder)trans-82.9-37.2176.6-71174.4000111.2L53 D55 H59L53-L61 HydrophobicContact CB-CB 4.43Å; L53-L61 PolarHBondContact O-N 2.63Å; D55-L61 HydrophobicContact CB-CD1 3.73Å; D55-L61 HydrophobicContact CB-CD2 3.92Å; D55-L61 HydrophobicContact CB-CG 3.78Å; H59-L61 PolarHBondContact O-N 3.16Å
62Q43.6Very low39.2Very low98 Ų9894.9 Ų94.946%0.45853%0.53SS..EExtended strand (participates in β ladder)trans-167139.1-179.8-164.8165.11.800110.7L53 N64L53-Q62 PolarHBondContact N-O 2.69Å; Q62-N64 PolarHBondContact NE2-ND2 2.97Å; Q62-N64 PolarHBondContact NE2-OD1 3.38Å
63A41.7Very low38.8Very low40 Ų40100.4 Ų100.433%0.33156%0.558SS.*EExtended strand (participates in β ladder)trans-119.2113.3160.900000107.5I51 V52I51-A63 WeakPolarHBondContact O-CA 3.4Å; V52-A63 HydrophobicContact CG2-CB 4.31Å
64N43Very low38.4Very low80 Ų80101.8 Ų101.843%0.42857%0.566SS.*EExtended strand (participates in β ladder)trans-108.8130.5172.5-86.62.2000108.7I51 Q62 T66I51-N64 PolarHBondContact N-O 3.45Å; I51-N64 PolarHBondContact O-N 3.42Å; Q62-N64 PolarHBondContact NE2-ND2 2.97Å; Q62-N64 PolarHBondContact NE2-OD1 3.38Å; N64-T66 PolarHBondContact O-N 3.47Å
65P39.1Very low37.6Very low93 Ų93106 Ų10660%0.60459%0.591SS**EExtended strand (participates in β ladder)trans-63.4116.9162.527.1-30000107.6F50F50-P65 HydrophobicContact CD1-CB 4.16Å; F50-P65 HydrophobicContact CE1-CB 3.91Å
66T40.3Very low37.1Very low63 Ų63107.5 Ų107.539%0.38761%0.61SS.*EExtended strand (participates in β ladder)trans-111.574.8173.751.10000107.7A49 I51 N64A49-T66 WeakPolarHBondContact CB-O 3.47Å; A49-T66 CarbonylContact O-C 3.58Å; A49-T66 WeakPolarHBondContact O-CA 3.11Å; A49-T66 PolarHBondContact O-N 3.34Å; A49-T66 VanDerWaalsContact O-O 3.06Å; A49-T66 PolarHBondContact O-OG1 3.45Å; I51-T66 HydrophobicContact CD1-CG2 3.78Å; I51-T66 HydrophobicContact CG1-CG2 4.05Å; N64-T66 PolarHBondContact O-N 3.47Å
67G35.1Very low36.9Very low33 Ų33106.7 Ų106.734%0.3460%0.6SS.*SBendtrans147.1133.7-177.800000109.5D48D48-G67 VanDerWaalsContact OD1-O 3.09Å
68G33.8Very low36.8Very low46 Ų46110 Ų11047%0.47461%0.61SS.*  trans109.1114.5177.200000114.1D48 C70D48-G68 WeakPolarHBondContact OD1-CA 3.34Å; D48-G68 PolarHBondContact OD1-N 3.31Å; G68-C70 VanDerWaalsContact C-N 3.31Å; G68-C70 PolarHBondContact O-N 3.09Å
69T34.2Very low36.8Very low131 Ų131105.8 Ų105.880%0.80460%0.599SS**  trans-65.392163.648.50000108.5N71T69-N71 VanDerWaalsContact C-N 3.27Å; T69-N71 PolarHBondContact O-N 2.83Å
70C34.2Very low36.5Very low102 Ų102102.5 Ų102.569%0.68959%0.59SS**  trans-6291.9166.5170.80000108.4G68 Q72G68-C70 VanDerWaalsContact C-N 3.31Å; G68-C70 PolarHBondContact O-N 3.09Å; C70-Q72 PolarHBondContact O-N 3.45Å
71N31.8Very low35.7Very low118 Ų118104.5 Ų104.563%0.63160%0.603SS**  trans-65.9125.2158.2-85.8-23.5000106.5T69 N73 N74T69-N71 VanDerWaalsContact C-N 3.27Å; T69-N71 PolarHBondContact O-N 2.83Å; N71-N73 PolarHBondContact O-N 3.13Å; N71-N74 PolarHBondContact O-N 3.21Å
72Q35.9Very low35.5Very low184 Ų184103.5 Ų103.586%0.8660%0.602SS**THydrogen-bonded Turntrans-53.9-7.4-177.8-73.5177.5-11.700115C70C70-Q72 PolarHBondContact O-N 3.45Å
73N35.2Very low35.3Very low156 Ų156102.6 Ų102.683%0.83460%0.6SS**THydrogen-bonded Turntrans-94.1-6.6176-66.4-9000114.3N71N71-N73 PolarHBondContact O-N 3.13Å
74N34.2Very low35.3Very low125 Ų125103.2 Ų103.267%0.66859%0.594SS**  trans-103.591.1169-91-8.4000107.9N71 A76N71-N74 PolarHBondContact O-N 3.21Å; N74-A76 PolarHBondContact O-N 3.19Å
75L27.8Very low35.2Very low169 Ų169106 Ų10689%0.88560%0.603SS**  trans-61.386.2154.2-89.1109.2000106.8H77L75-H77 PolarHBondContact O-N 2.74Å; L75-H77 VanDerWaalsContact O-N 3.07Å
76A30.5Very low35.3Very low77 Ų77107.7 Ų107.764%0.63661%0.606SS**  trans-51.5117.4170.300000106.8N74 I78N74-A76 PolarHBondContact O-N 3.19Å; A76-I78 PolarHBondContact O-N 3.04Å
77H32.5Very low35.8Very low155 Ų155108.1 Ų108.172%0.71860%0.602SS**  trans-42.3102.1176.5-173.4-81.6000108.8L75 P79L75-H77 PolarHBondContact O-N 2.74Å; L75-H77 VanDerWaalsContact O-N 3.07Å; H77-P79 WeakPolarHBondContact O-CD 3.13Å
78I35.7Very low36.6Very low147 Ų147109 Ų10975%0.75460%0.599SS**  trans-57.9111.9169.9-63.6170.9000103.8A76 S80A76-I78 PolarHBondContact O-N 3.04Å; I78-S80 PolarHBondContact O-N 3.44Å; I78-S80 VanDerWaalsContact O-N 3.08Å
79P40Very low37.4Very low77 Ų77112.8 Ų112.850%0.561%0.608SS.*  trans-53.1126.617620.1-29.3000106.3H77 D83H77-P79 WeakPolarHBondContact O-CD 3.13Å; P79-D83 HydrophobicContact CB-CB 3.86Å
80S32.8Very low38.3Very low50 Ų50111.5 Ų111.535%0.3560%0.595SS.*  trans-55.9152.5-177.673.10000108I78 T82 D83 Y84I78-S80 PolarHBondContact O-N 3.44Å; I78-S80 VanDerWaalsContact O-N 3.08Å; S80-T82 CarbonylContact O-C 3.54Å; S80-T82 PolarHBondContact O-N 2.92Å; S80-T82 WeakPolarHBondContact OG-CB 3.4Å; S80-T82 PolarHBondContact OG-OG1 3.5Å; S80-D83 PolarHBondContact N-OD2 3.2Å; S80-D83 PolarHBondContact O-N 3.46Å; S80-D83 PolarHBondContact OG-OD2 3.43Å; S80-Y84 PolarHBondContact O-N 2.92Å
81L30.1Very low39.3Very low134 Ų134109.2 Ų109.270%0.70258%0.576SS**Hα-helixtrans-49.5-23.3179.5-149.888.7000112.8K85L81-K85 WeakPolarHBondContact O-CG 3.37Å; L81-K85 PolarHBondContact O-N 3.03Å
82T34.4Very low40.3Very low96 Ų96109.6 Ų109.659%0.58957%0.572SS**Hα-helixtrans-68.6-44.1173.9-22.30000113.5S80 Y84 K85 L86S80-T82 CarbonylContact O-C 3.54Å; S80-T82 PolarHBondContact O-N 2.92Å; S80-T82 WeakPolarHBondContact OG-CB 3.4Å; S80-T82 PolarHBondContact OG-OG1 3.5Å; T82-Y84 VanDerWaalsContact C-N 3.33Å; T82-K85 PolarHBondContact O-N 2.84Å; T82-L86 PolarHBondContact O-N 3.17Å; T82-L86 VanDerWaalsContact O-N 3.13Å
83D38.3Very low40.9Very low78 Ų78102.7 Ų102.742%0.41755%0.547SS..Hα-helixtrans-69.2-35.8-178.5-58.7-49.6000110.9P79 S80 L86 F87P79-D83 HydrophobicContact CB-CB 3.86Å; S80-D83 PolarHBondContact N-OD2 3.2Å; S80-D83 PolarHBondContact O-N 3.46Å; S80-D83 PolarHBondContact OG-OD2 3.43Å; D83-L86 PolarHBondContact O-N 3.3Å; D83-F87 WeakPolarHBondContact O-CB 3.44Å; D83-F87 PolarHBondContact O-N 2.67Å
84Y42.5Very low41.6Very low54 Ų5498.5 Ų98.521%0.21253%0.527CS..Hα-helixtrans-65.4-39.8174-172.4-108.4000112.5Q60 S80 T82 F87 L88Q60-Y84 PolarHBondContact OE1-OH 3.21Å; S80-Y84 PolarHBondContact O-N 2.92Å; T82-Y84 VanDerWaalsContact C-N 3.33Å; Y84-F87 PolarHBondContact O-N 2.84Å; Y84-L88 HydrophobicContact CD1-CD1 3.7Å; Y84-L88 HydrophobicContact CD1-CG 4.26Å; Y84-L88 HydrophobicContact CE1-CD1 3.27Å; Y84-L88 HydrophobicContact CE1-CD2 4.47Å; Y84-L88 HydrophobicContact CE1-CG 3.94Å; Y84-L88 HydrophobicContact CE2-CG 4.43Å; Y84-L88 WeakPolarHBondContact O-CB 3.49Å; Y84-L88 WeakPolarHBondContact O-CG 2.98Å; Y84-L88 PolarHBondContact O-N 2.99Å
85K40.2Very low42.4Very low139 Ų13993.4 Ų93.460%0.60450%0.502SS*.Hα-helixtrans-64.4-41.2175.3-74176.5-175.6-177.10111.7L81 T82 L89L81-K85 WeakPolarHBondContact O-CG 3.37Å; L81-K85 PolarHBondContact O-N 3.03Å; T82-K85 PolarHBondContact O-N 2.84Å; K85-L89 WeakPolarHBondContact O-CB 3.42Å; K85-L89 PolarHBondContact O-N 2.69Å
86L42.6Very low43.3Very low127 Ų12789.9 Ų89.967%0.66548%0.484SS*.Hα-helixtrans-65.8-41.7177.5-142.697.2000111.1T82 D83 L89 L90T82-L86 PolarHBondContact O-N 3.17Å; T82-L86 VanDerWaalsContact O-N 3.13Å; D83-L86 PolarHBondContact O-N 3.3Å; L86-L89 PolarHBondContact O-N 2.96Å; L86-L90 WeakPolarHBondContact O-CB 3.35Å; L86-L90 PolarHBondContact O-N 3.24Å
87F50.4Low44.1Very low72 Ų7292 Ų9232%0.31648%0.483SS..Hα-helixtrans-62.3-47.1175.9177-99.8000112.2F40 D83 Y84 L89 L90 L91F40-F87 AromaticContact CD2-CE2 3.99Å; F40-F87 HydrophobicContact CD2-CE2 3.99Å; F40-F87 HydrophobicContact CD2-CZ 4.49Å; F40-F87 AromaticContact CE2-CE2 3.68Å; F40-F87 HydrophobicContact CE2-CE2 3.68Å; F40-F87 HydrophobicContact CE2-CZ 4.19Å; F40-F87 HydrophobicContact CZ-CE2 4.08Å; D83-F87 WeakPolarHBondContact O-CB 3.44Å; D83-F87 PolarHBondContact O-N 2.67Å; Y84-F87 PolarHBondContact O-N 2.84Å; F87-L89 VanDerWaalsContact C-N 3.32Å; F87-L89 PolarHBondContact O-N 2.75Å; F87-L90 PolarHBondContact O-N 3.34Å; F87-L91 WeakPolarHBondContact O-CB 3.45Å; F87-L91 PolarHBondContact O-N 2.8Å
88L52Low44.5Very low52 Ų5287.4 Ų87.427%0.27247%0.469SS..Hα-helixtrans-61.8-40.2175.4-74.4177.2000112.2F54 Y84 L90 L91 F92F54-L88 HydrophobicContact CE1-CD2 4.29Å; F54-L88 HydrophobicContact CE2-CD2 4.46Å; F54-L88 HydrophobicContact CZ-CD2 3.59Å; Y84-L88 HydrophobicContact CD1-CD1 3.7Å; Y84-L88 HydrophobicContact CD1-CG 4.26Å; Y84-L88 HydrophobicContact CE1-CD1 3.27Å; Y84-L88 HydrophobicContact CE1-CD2 4.47Å; Y84-L88 HydrophobicContact CE1-CG 3.94Å; Y84-L88 HydrophobicContact CE2-CG 4.43Å; Y84-L88 WeakPolarHBondContact O-CB 3.49Å; Y84-L88 WeakPolarHBondContact O-CG 2.98Å; Y84-L88 PolarHBondContact O-N 2.99Å; L88-L90 VanDerWaalsContact C-N 3.33Å; L88-L91 PolarHBondContact O-N 2.95Å; L88-F92 VanDerWaalsContact O-CB 3.22Å; L88-F92 WeakPolarHBondContact O-CB 3.37Å; L88-F92 PolarHBondContact O-N 3.4Å
89L50.6Low44.7Very low126 Ų12682.2 Ų82.266%0.6645%0.445SS*.Hα-helixtrans-62.8-42.5176.2-162.383.5000111K85 L86 F87 A93K85-L89 WeakPolarHBondContact O-CB 3.42Å; K85-L89 PolarHBondContact O-N 2.69Å; L86-L89 PolarHBondContact O-N 2.96Å; F87-L89 VanDerWaalsContact C-N 3.32Å; F87-L89 PolarHBondContact O-N 2.75Å; L89-A93 VanDerWaalsContact O-CB 3.31Å; L89-A93 WeakPolarHBondContact O-CB 3.5Å; L89-A93 PolarHBondContact O-N 3.34Å
90L53.2Low44.6Very low103 Ų10381.5 Ų81.554%0.53944%0.436SS..Hα-helixtrans-69.2-42.6178.8-166.771.1000111.7L86 F87 L88 A93 T94L86-L90 WeakPolarHBondContact O-CB 3.35Å; L86-L90 PolarHBondContact O-N 3.24Å; F87-L90 PolarHBondContact O-N 3.34Å; L88-L90 VanDerWaalsContact C-N 3.33Å; L90-A93 PolarHBondContact O-N 3.11Å; L90-T94 WeakPolarHBondContact O-CB 3.3Å; L90-T94 PolarHBondContact O-N 2.85Å; L90-T94 PolarHBondContact O-OG1 3.35Å
91L55.1Low44.6Very low54 Ų5484.1 Ų84.128%0.28345%0.452SS..Hα-helixtrans-63.1-42.6176-169.173.6000110.9F87 L88 T94 A95F87-L91 WeakPolarHBondContact O-CB 3.45Å; F87-L91 PolarHBondContact O-N 2.8Å; L88-L91 PolarHBondContact O-N 2.95Å; L91-T94 PolarHBondContact O-N 3.39Å; L91-A95 VanDerWaalsContact O-CB 3.22Å; L91-A95 WeakPolarHBondContact O-CB 3.3Å; L91-A95 PolarHBondContact O-N 3.42Å
92F51.8Low45Very low126 Ų12681.2 Ų81.255%0.55344%0.443SS*.Hα-helixtrans-65.4-41.2175.7-170.9-102.3000112L88 L96L88-F92 VanDerWaalsContact O-CB 3.22Å; L88-F92 WeakPolarHBondContact O-CB 3.37Å; L88-F92 PolarHBondContact O-N 3.4Å; F92-L96 HydrophobicContact CD1-CD1 3.64Å; F92-L96 HydrophobicContact CD1-CG 4.33Å; F92-L96 HydrophobicContact CE1-CD1 3.36Å; F92-L96 HydrophobicContact CE1-CG 4.11Å; F92-L96 HydrophobicContact CZ-CD1 4.07Å; F92-L96 HydrophobicContact CZ-CG 4.42Å; F92-L96 WeakPolarHBondContact O-CB 3.45Å; F92-L96 WeakPolarHBondContact O-CG 3.34Å; F92-L96 PolarHBondContact O-N 2.7Å
93A49.3Very low45.2Very low40 Ų4080 Ų8033%0.33144%0.439SS..Hα-helixtrans-64.2-42.4174.300000111.7L89 L90 L96 I97L89-A93 VanDerWaalsContact O-CB 3.31Å; L89-A93 WeakPolarHBondContact O-CB 3.5Å; L89-A93 PolarHBondContact O-N 3.34Å; L90-A93 PolarHBondContact O-N 3.11Å; A93-L96 PolarHBondContact O-N 3.33Å; A93-I97 WeakPolarHBondContact O-CB 3.29Å; A93-I97 WeakPolarHBondContact O-CD1 3.25Å; A93-I97 WeakPolarHBondContact O-CG1 3.07Å; A93-I97 PolarHBondContact O-N 2.89Å
94T50.5Low45.2Very low67 Ų6785.4 Ų85.441%0.41146%0.459SS..Hα-helixtrans-71.5-37.5-179.7-44.20000111.3L90 L91 I97 S98L90-T94 WeakPolarHBondContact O-CB 3.3Å; L90-T94 PolarHBondContact O-N 2.85Å; L90-T94 PolarHBondContact O-OG1 3.35Å; L91-T94 PolarHBondContact O-N 3.39Å; T94-I97 PolarHBondContact O-N 3.41Å; T94-S98 VanDerWaalsContact O-CB 3.28Å; T94-S98 WeakPolarHBondContact O-CB 3.28Å; T94-S98 PolarHBondContact O-N 3.35Å; T94-S98 PolarHBondContact O-OG 3.08Å
95A49Very low45.1Very low18 Ų1886 Ų8615%0.14947%0.47CS..Hα-helixtrans-61.4-50.4169.700000110L33 L91 I97 S98 C99L33-A95 HydrophobicContact CD2-CB 4.33Å; L91-A95 VanDerWaalsContact O-CB 3.22Å; L91-A95 WeakPolarHBondContact O-CB 3.3Å; L91-A95 PolarHBondContact O-N 3.42Å; A95-I97 PolarHBondContact O-N 3.21Å; A95-S98 WeakPolarHBondContact CA-OG 3.15Å; A95-S98 PolarHBondContact O-N 3.16Å; A95-S98 VanDerWaalsContact O-N 3.16Å; A95-S98 PolarHBondContact O-OG 3.18Å; A95-C99 WeakPolarHBondContact O-CB 3.17Å; A95-C99 PolarHBondContact O-N 3.09Å; A95-C99 PolarHBondContact O-SG 2.78Å
96L47.2Very low45Very low95 Ų9581.4 Ų81.450%0.49746%0.458SS..Hα-helixtrans-56.2-38.2175.1-80.7171.6000112.8F92 A93 I100F92-L96 HydrophobicContact CD1-CD1 3.64Å; F92-L96 HydrophobicContact CD1-CG 4.33Å; F92-L96 HydrophobicContact CE1-CD1 3.36Å; F92-L96 HydrophobicContact CE1-CG 4.11Å; F92-L96 HydrophobicContact CZ-CD1 4.07Å; F92-L96 HydrophobicContact CZ-CG 4.42Å; F92-L96 WeakPolarHBondContact O-CB 3.45Å; F92-L96 WeakPolarHBondContact O-CG 3.34Å; F92-L96 PolarHBondContact O-N 2.7Å; A93-L96 PolarHBondContact O-N 3.33Å; L96-I100 VanDerWaalsContact O-CD1 3.24Å; L96-I100 WeakPolarHBondContact O-CD1 3.08Å; L96-I100 WeakPolarHBondContact O-CG1 3.24Å
97I47Very low45.2Very low121 Ų12181.1 Ų81.162%0.62146%0.457SS*.Hα-helixtrans-75.8-36.2178.9-66.5162.3000112A93 T94 A95 I100A93-I97 WeakPolarHBondContact O-CB 3.29Å; A93-I97 WeakPolarHBondContact O-CD1 3.25Å; A93-I97 WeakPolarHBondContact O-CG1 3.07Å; A93-I97 PolarHBondContact O-N 2.89Å; T94-I97 PolarHBondContact O-N 3.41Å; A95-I97 PolarHBondContact O-N 3.21Å; I97-I100 WeakPolarHBondContact O-CB 3.36Å; I97-I100 PolarHBondContact O-N 2.9Å
98S41.5Very low45Very low60 Ų6080.4 Ų80.442%0.4246%0.461SS..Hα-helixtrans-82.6-23.9179.555.60000113.4T94 A95 I100T94-S98 VanDerWaalsContact O-CB 3.28Å; T94-S98 WeakPolarHBondContact O-CB 3.28Å; T94-S98 PolarHBondContact O-N 3.35Å; T94-S98 PolarHBondContact O-OG 3.08Å; A95-S98 WeakPolarHBondContact CA-OG 3.15Å; A95-S98 PolarHBondContact O-N 3.16Å; A95-S98 VanDerWaalsContact O-N 3.16Å; A95-S98 PolarHBondContact O-OG 3.18Å; S98-I100 PolarHBondContact O-N 2.82Å
99C39.4Very low44.9Very low37 Ų3784.1 Ų84.125%0.2548%0.475CS..THydrogen-bonded Turntrans-746.7165.8-650000112.8F31 A95 P101F31-C99 HydrophobicContact CD1-CB 3.78Å; F31-C99 WeakPolarHBondContact CD1-SG 3.49Å; F31-C99 HydrophobicContact CE1-CB 3.31Å; F31-C99 WeakPolarHBondContact CE1-SG 3.33Å; F31-C99 HydrophobicContact CZ-CB 3.92Å; A95-C99 WeakPolarHBondContact O-CB 3.17Å; A95-C99 PolarHBondContact O-N 3.09Å; A95-C99 PolarHBondContact O-SG 2.78Å; C99-P101 WeakPolarHBondContact O-CD 3.38Å
100I38.9Very low44.9Very low62 Ų6283.2 Ų83.232%0.31847%0.47SS..  trans-103.572.8167.5-63.1164.6000109.1L96 I97 S98 S102 S103L96-I100 VanDerWaalsContact O-CD1 3.24Å; L96-I100 WeakPolarHBondContact O-CD1 3.08Å; L96-I100 WeakPolarHBondContact O-CG1 3.24Å; I97-I100 WeakPolarHBondContact O-CB 3.36Å; I97-I100 PolarHBondContact O-N 2.9Å; S98-I100 PolarHBondContact O-N 2.82Å; I100-S102 PolarHBondContact O-N 3.36Å; I100-S103 WeakPolarHBondContact CG2-OG 3.22Å
101P33.2Very low45.3Very low106 Ų10680.8 Ų80.869%0.68847%0.465SS*.SBendtrans-72.510415230-24.2000105.4C99C99-P101 WeakPolarHBondContact O-CD 3.38Å
102S37.5Very low45.6Very low73 Ų7381.3 Ų81.351%0.5147%0.471SS..SBendtrans81.382-173.5770000116.5I100 F104 S105 A106I100-S102 PolarHBondContact O-N 3.36Å; S102-F104 PolarHBondContact O-N 2.79Å; S102-S105 PolarHBondContact O-N 2.64Å; S102-S105 WeakPolarHBondContact OG-CB 3.33Å; S102-A106 PolarHBondContact O-N 2.83Å
103S38.9Very low46Very low71 Ų7179 Ų7950%0.49746%0.464SS..Hα-helixtrans-61.5-13.7176.2-10.50000114.9I100 L107I100-S103 WeakPolarHBondContact CG2-OG 3.22Å; S103-L107 WeakPolarHBondContact O-CD1 3.34Å
104F38.9Very low46.9Very low191 Ų19185.7 Ų85.784%0.83848%0.48SS*.Hα-helixtrans-80.4-29.4169.5-101.1-94.7000113.3S102 S108S102-F104 PolarHBondContact O-N 2.79Å; F104-S108 WeakPolarHBondContact O-CB 3.17Å; F104-S108 PolarHBondContact O-N 3.01Å; F104-S108 PolarHBondContact O-OG 3.25Å
105S39.3Very low47.9Very low65 Ų6590.2 Ų90.246%0.45549%0.494SS..Hα-helixtrans-82-43.3-176-167.50000112.6S102 S108 F109S102-S105 PolarHBondContact O-N 2.64Å; S102-S105 WeakPolarHBondContact OG-CB 3.33Å; S105-S108 WeakPolarHBondContact CA-OG 3.44Å; S105-S108 PolarHBondContact O-N 2.84Å; S105-S108 PolarHBondContact O-OG 3.33Å; S105-F109 WeakPolarHBondContact O-CB 3.37Å; S105-F109 PolarHBondContact O-N 2.9Å
106A39.6Very low48.7Very low43 Ų4397.3 Ų97.336%0.35552%0.517SS..Hα-helixtrans-67.6-42179.800000112.5S102 F109 L110S102-A106 PolarHBondContact O-N 2.83Å; A106-F109 PolarHBondContact O-N 2.91Å; A106-L110 WeakPolarHBondContact O-CB 3.22Å; A106-L110 WeakPolarHBondContact O-CG 3.39Å; A106-L110 PolarHBondContact O-N 3.2Å
107L45.4Very low49.7Very low121 Ų12195.5 Ų95.563%0.63451%0.513SS*.Hα-helixtrans-68.3-38.4174.8-72.3174.6000112.1S103 L110 A111S103-L107 WeakPolarHBondContact O-CD1 3.34Å; L107-L110 PolarHBondContact O-N 2.84Å; L107-A111 VanDerWaalsContact O-CB 3.25Å; L107-A111 WeakPolarHBondContact O-CB 3.2Å; L107-A111 PolarHBondContact O-N 2.85Å
108S46.3Very low51.1Low58 Ų5896.6 Ų96.641%0.40651%0.513SS..Hα-helixtrans-70.1-34.3175.2620000112.3F104 S105 A111 T112F104-S108 WeakPolarHBondContact O-CB 3.17Å; F104-S108 PolarHBondContact O-N 3.01Å; F104-S108 PolarHBondContact O-OG 3.25Å; S105-S108 WeakPolarHBondContact CA-OG 3.44Å; S105-S108 PolarHBondContact O-N 2.84Å; S105-S108 PolarHBondContact O-OG 3.33Å; S108-A111 PolarHBondContact O-N 3.47Å; S108-T112 VanDerWaalsContact O-CB 3.28Å; S108-T112 WeakPolarHBondContact O-CB 3.4Å; S108-T112 PolarHBondContact O-N 2.92Å; S108-T112 PolarHBondContact O-OG1 2.71Å
109F49.6Very low52.7Low129 Ų12996.9 Ų96.957%0.56652%0.515SS*.Hα-helixtrans-65.2-47.7172.2-176-106.6000111.1S105 A106 A111 T112 L113S105-F109 WeakPolarHBondContact O-CB 3.37Å; S105-F109 PolarHBondContact O-N 2.9Å; A106-F109 PolarHBondContact O-N 2.91Å; F109-A111 VanDerWaalsContact C-N 3.34Å; F109-A111 PolarHBondContact O-N 2.95Å; F109-T112 CarbonylContact O-C 3.22Å; F109-T112 WeakPolarHBondContact O-CB 3.5Å; F109-T112 PolarHBondContact O-N 3.23Å; F109-T112 VanDerWaalsContact O-N 3.11Å; F109-L113 HydrophobicContact CD1-CD1 3.86Å; F109-L113 HydrophobicContact CD1-CG 4.33Å; F109-L113 HydrophobicContact CE1-CD1 3.41Å; F109-L113 VanDerWaalsContact CE1-CD1 3.41Å; F109-L113 HydrophobicContact CE1-CG 4.03Å; F109-L113 HydrophobicContact CZ-CD1 3.91Å; F109-L113 HydrophobicContact CZ-CD2 4.23Å; F109-L113 HydrophobicContact CZ-CG 4.13Å; F109-L113 WeakPolarHBondContact O-CG 3.35Å; F109-L113 PolarHBondContact O-N 3.48Å
110L51.5Low54.3Low107 Ų107101.3 Ų101.356%0.5653%0.532SS*.Hα-helixtrans-60.9-40.9173.5-74.5172.2000112.1A106 L107 T112 L113 R114A106-L110 WeakPolarHBondContact O-CB 3.22Å; A106-L110 WeakPolarHBondContact O-CG 3.39Å; A106-L110 PolarHBondContact O-N 3.2Å; L107-L110 PolarHBondContact O-N 2.84Å; L110-T112 VanDerWaalsContact C-N 3.32Å; L110-T112 PolarHBondContact O-N 3.2Å; L110-L113 PolarHBondContact O-N 2.9Å; L110-R114 WeakPolarHBondContact O-CB 3.5Å; L110-R114 PolarHBondContact O-N 3.23Å
111A60.6Low56.1Low52 Ų52104.8 Ų104.843%0.4355%0.545SS..Hα-helixtrans-63.7-38174.100000111.9L107 S108 F109 R114 K115L107-A111 VanDerWaalsContact O-CB 3.25Å; L107-A111 WeakPolarHBondContact O-CB 3.2Å; L107-A111 PolarHBondContact O-N 2.85Å; S108-A111 PolarHBondContact O-N 3.47Å; F109-A111 VanDerWaalsContact C-N 3.34Å; F109-A111 PolarHBondContact O-N 2.95Å; A111-R114 PolarHBondContact O-N 3.4Å; A111-K115 WeakPolarHBondContact O-CG 3.31Å; A111-K115 PolarHBondContact O-N 3.03Å
112T62.8Low58.3Low65 Ų65107 Ų10740%0.39954%0.543SS..Hα-helixtrans-68.2-44.7176.9-59.70000111.3S108 F109 L110 R114 K115 R116S108-T112 VanDerWaalsContact O-CB 3.28Å; S108-T112 WeakPolarHBondContact O-CB 3.4Å; S108-T112 PolarHBondContact O-N 2.92Å; S108-T112 PolarHBondContact O-OG1 2.71Å; F109-T112 CarbonylContact O-C 3.22Å; F109-T112 WeakPolarHBondContact O-CB 3.5Å; F109-T112 PolarHBondContact O-N 3.23Å; F109-T112 VanDerWaalsContact O-N 3.11Å; L110-T112 VanDerWaalsContact C-N 3.32Å; L110-T112 PolarHBondContact O-N 3.2Å; T112-R114 VanDerWaalsContact C-N 3.32Å; T112-R114 PolarHBondContact O-N 2.97Å; T112-K115 PolarHBondContact O-N 3.44Å; T112-R116 PolarHBondContact O-N 3.35Å
113L60.5Low60.1Low77 Ų77112.1 Ų112.140%0.40355%0.552SS.*Hα-helixtrans-60-42.5173.3-72.5179.8000111.4F109 L110 K115 R116 S117F109-L113 HydrophobicContact CD1-CD1 3.86Å; F109-L113 HydrophobicContact CD1-CG 4.33Å; F109-L113 HydrophobicContact CE1-CD1 3.41Å; F109-L113 VanDerWaalsContact CE1-CD1 3.41Å; F109-L113 HydrophobicContact CE1-CG 4.03Å; F109-L113 HydrophobicContact CZ-CD1 3.91Å; F109-L113 HydrophobicContact CZ-CD2 4.23Å; F109-L113 HydrophobicContact CZ-CG 4.13Å; F109-L113 WeakPolarHBondContact O-CG 3.35Å; F109-L113 PolarHBondContact O-N 3.48Å; L110-L113 PolarHBondContact O-N 2.9Å; L113-K115 VanDerWaalsContact C-N 3.34Å; L113-K115 PolarHBondContact O-N 3.33Å; L113-R116 PolarHBondContact O-N 3.16Å; L113-S117 WeakPolarHBondContact O-CB 3.5Å; L113-S117 PolarHBondContact O-N 3.18Å
114R67.5Low61.9Low181 Ų181113.3 Ų113.368%0.68355%0.55SS*.Hα-helixtrans-64.6-37.4176.7-163.9172.9-173.5165.20.3112.2L110 A111 T112 K118L110-R114 WeakPolarHBondContact O-CB 3.5Å; L110-R114 PolarHBondContact O-N 3.23Å; A111-R114 PolarHBondContact O-N 3.4Å; T112-R114 VanDerWaalsContact C-N 3.32Å; T112-R114 PolarHBondContact O-N 2.97Å; R114-K118 WeakPolarHBondContact O-CG 3.31Å; R114-K118 PolarHBondContact O-N 2.77Å
115K70.9Confident63.8Low162 Ų162111.4 Ų111.470%0.70454%0.541SS*.Hα-helixtrans-66.3-44.5173-78.3-176.9180-179.80111.7A111 T112 L113 K118 S119A111-K115 WeakPolarHBondContact O-CG 3.31Å; A111-K115 PolarHBondContact O-N 3.03Å; T112-K115 PolarHBondContact O-N 3.44Å; L113-K115 VanDerWaalsContact C-N 3.34Å; L113-K115 PolarHBondContact O-N 3.33Å; K115-K118 PolarHBondContact O-N 2.92Å; K115-S119 PolarHBondContact O-N 2.82Å
116R66.1Low65.7Low168 Ų168112.5 Ų112.563%0.63455%0.545SS*.Hα-helixtrans-60.6-48.3176.6-75.9-173.5179.4-171.80.9111.8T112 L113 K118 S119 E120T112-R116 PolarHBondContact O-N 3.35Å; L113-R116 PolarHBondContact O-N 3.16Å; R116-K118 VanDerWaalsContact C-N 3.31Å; R116-K118 PolarHBondContact O-N 3.06Å; R116-S119 WeakPolarHBondContact O-CA 3.39Å; R116-S119 WeakPolarHBondContact O-CB 3.37Å; R116-S119 PolarHBondContact O-N 3.08Å; R116-E120 PolarHBondContact O-N 2.77Å
117S67.9Low67.3Low57 Ų57116.3 Ų116.340%0.39956%0.557SS.*Hα-helixtrans-58.8-40.1177.4-179.10000112.8L113 K121L113-S117 WeakPolarHBondContact O-CB 3.5Å; L113-S117 PolarHBondContact O-N 3.18Å; S117-K121 WeakPolarHBondContact O-CG 3.41Å; S117-K121 PolarHBondContact O-N 3.44Å
118K76Confident68.7Low143 Ų143118.2 Ų118.262%0.62256%0.556SS**Hα-helixtrans-66.7-38.8174.1-75.2-175.9176.6-173.80112.6R114 K115 R116 K122R114-K118 WeakPolarHBondContact O-CG 3.31Å; R114-K118 PolarHBondContact O-N 2.77Å; K115-K118 PolarHBondContact O-N 2.92Å; R116-K118 VanDerWaalsContact C-N 3.31Å; R116-K118 PolarHBondContact O-N 3.06Å; K118-K122 WeakPolarHBondContact O-CB 3.43Å; K118-K122 PolarHBondContact O-N 3.38Å
119S75.2Confident70Confident67 Ų67121.2 Ų121.247%0.46957%0.567SS.*Hα-helixtrans-65.8-43.1177.5-178.90000111.7K115 R116 K122 R123K115-S119 PolarHBondContact O-N 2.82Å; R116-S119 WeakPolarHBondContact O-CA 3.39Å; R116-S119 WeakPolarHBondContact O-CB 3.37Å; R116-S119 PolarHBondContact O-N 3.08Å; S119-K122 WeakPolarHBondContact O-CB 3.49Å; S119-K122 PolarHBondContact O-N 3.3Å; S119-R123 PolarHBondContact O-N 3.38Å
120E73.6Confident71.1Confident129 Ų129119.3 Ų119.360%0.60357%0.57SS**Hα-helixtrans-63.4-47.4175.6-75.2178.8164.200111.6R116 K122 R123 E124R116-E120 PolarHBondContact O-N 2.77Å; E120-K122 PolarHBondContact O-N 3.38Å; E120-R123 PolarHBondContact O-N 2.89Å; E120-R123 VanDerWaalsContact O-N 3.11Å; E120-E124 WeakPolarHBondContact O-CB 3.39Å; E120-E124 PolarHBondContact O-N 3.47Å
121K76.8Confident71.5Confident135 Ų135122 Ų12259%0.58758%0.581SS**Hα-helixtrans-58.5-34.6173.7-75.3-176.9178.4-176.20112.7S117 K125S117-K121 WeakPolarHBondContact O-CG 3.41Å; S117-K121 PolarHBondContact O-N 3.44Å; K121-K125 WeakPolarHBondContact O-CG 3.37Å; K121-K125 PolarHBondContact O-N 2.69Å; K121-K125 VanDerWaalsContact O-N 3.08Å
122K79.9Confident71.4Confident152 Ų152125.4 Ų125.466%0.66159%0.592SS**Hα-helixtrans-70.2-45.3175.5-169.5177.4-179.8-178.10111.1K118 S119 E120 E124 K125 T126K118-K122 WeakPolarHBondContact O-CB 3.43Å; K118-K122 PolarHBondContact O-N 3.38Å; S119-K122 WeakPolarHBondContact O-CB 3.49Å; S119-K122 PolarHBondContact O-N 3.3Å; E120-K122 PolarHBondContact O-N 3.38Å; K122-E124 VanDerWaalsContact C-N 3.33Å; K122-E124 PolarHBondContact O-N 2.94Å; K122-K125 PolarHBondContact O-N 3.26Å; K122-T126 PolarHBondContact O-N 2.84Å; K122-T126 PolarHBondContact O-OG1 2.79Å
123R75.4Confident71Confident181 Ų181131.7 Ų131.768%0.68363%0.634SS**Hα-helixtrans-60.2-42.6175-79.9-178126.3-179.3-1.4111.8S119 E120 T126 M127S119-R123 PolarHBondContact O-N 3.38Å; E120-R123 PolarHBondContact O-N 2.89Å; E120-R123 VanDerWaalsContact O-N 3.11Å; R123-T126 PolarHBondContact O-N 2.91Å; R123-M127 WeakPolarHBondContact O-CB 3.36Å; R123-M127 WeakPolarHBondContact O-CG 3.16Å; R123-M127 PolarHBondContact O-N 3.08Å
124E76.4Confident71.6Confident97 Ų97134.5 Ų134.545%0.45365%0.645SS.*Hα-helixtrans-63.5-42.7177.5-162.6-174.4165.100111.3E120 K122 M127 R128E120-E124 WeakPolarHBondContact O-CB 3.39Å; E120-E124 PolarHBondContact O-N 3.47Å; K122-E124 VanDerWaalsContact C-N 3.33Å; K122-E124 PolarHBondContact O-N 2.94Å; E124-M127 PolarHBondContact O-N 3.03Å; E124-R128 WeakPolarHBondContact O-CG 3.35Å; E124-R128 PolarHBondContact O-N 3.38Å; E124-R128 IonicContact OE1-CZ 3.59Å; E124-R128 IonicContact OE1-NE 3.83Å; E124-R128 IonicContact OE1-NH2 3.59Å; E124-R128 PolarHBondContact OE1-NH2 3.13Å
125K79Confident71.8Confident151 Ų151132 Ų13266%0.65764%0.643SS**Hα-helixtrans-62.7-42.8172.1-77.2-177.2178.9-169.90112.7K121 K122 R128 N129K121-K125 WeakPolarHBondContact O-CG 3.37Å; K121-K125 PolarHBondContact O-N 2.69Å; K121-K125 VanDerWaalsContact O-N 3.08Å; K122-K125 PolarHBondContact O-N 3.26Å; K125-R128 PolarHBondContact O-N 2.79Å; K125-N129 WeakPolarHBondContact O-CB 3.12Å; K125-N129 PolarHBondContact O-N 3.17Å
126T78.3Confident71.8Confident87 Ų87130.3 Ų130.353%0.53464%0.64SS.*Hα-helixtrans-64.4-42.6177.7-57.80000111.3K122 R123 N129 S130K122-T126 PolarHBondContact O-N 2.84Å; K122-T126 PolarHBondContact O-OG1 2.79Å; R123-T126 PolarHBondContact O-N 2.91Å; T126-N129 PolarHBondContact O-N 2.8Å; T126-S130 PolarHBondContact O-N 3.44Å; T126-S130 PolarHBondContact O-OG 2.84Å
127M73.5Confident72.2Confident123 Ų123128.1 Ų128.161%0.60664%0.64SS**Hα-helixtrans-64.7-40.8176.3-76.2-159.5176.400112.5R123 E124 N129 S130 M131R123-M127 WeakPolarHBondContact O-CB 3.36Å; R123-M127 WeakPolarHBondContact O-CG 3.16Å; R123-M127 PolarHBondContact O-N 3.08Å; E124-M127 PolarHBondContact O-N 3.03Å; M127-N129 VanDerWaalsContact C-N 3.34Å; M127-N129 PolarHBondContact O-N 2.84Å; M127-S130 WeakPolarHBondContact CA-OG 3.49Å; M127-S130 PolarHBondContact O-N 2.74Å; M127-S130 PolarHBondContact O-OG 3.07Å; M127-M131 WeakPolarHBondContact O-CG 3.49Å; M127-M131 PolarHBondContact O-N 2.78Å
128R76Confident72.4Confident162 Ų162132.6 Ų132.661%0.61166%0.655SS**Hα-helixtrans-62.7-40.6173.9-72.4-177.8-166.9-152.15.5111.9E124 K125 M131E124-R128 WeakPolarHBondContact O-CG 3.35Å; E124-R128 PolarHBondContact O-N 3.38Å; E124-R128 IonicContact OE1-CZ 3.59Å; E124-R128 IonicContact OE1-NE 3.83Å; E124-R128 IonicContact OE1-NH2 3.59Å; E124-R128 PolarHBondContact OE1-NH2 3.13Å; K125-R128 PolarHBondContact O-N 2.79Å; R128-M131 PolarHBondContact O-N 2.88Å
129N72.8Confident72.2Confident120 Ų120131.9 Ų131.964%0.64266%0.658SS**Hα-helixtrans-72.9-28.6178.2-76.78.6000113.3K125 T126 M127 M131K125-N129 WeakPolarHBondContact O-CB 3.12Å; K125-N129 PolarHBondContact O-N 3.17Å; T126-N129 PolarHBondContact O-N 2.8Å; M127-N129 VanDerWaalsContact C-N 3.34Å; M127-N129 PolarHBondContact O-N 2.84Å; N129-M131 VanDerWaalsContact C-N 3.31Å
130S73.2Confident72Confident89 Ų89136.5 Ų136.562%0.62267%0.671SS**Hα-helixtrans-81.5-7.6175.361.40000114T126 M127T126-S130 PolarHBondContact O-N 3.44Å; T126-S130 PolarHBondContact O-OG 2.84Å; M127-S130 WeakPolarHBondContact CA-OG 3.49Å; M127-S130 PolarHBondContact O-N 2.74Å; M127-S130 PolarHBondContact O-OG 3.07Å
131M59.8Low71.9Confident163 Ų163137.1 Ų137.180%0.80368%0.676SS**THydrogen-bonded Turntrans-99.21.9175.9-76.5-172.7163.500113.2M127 R128 N129M127-M131 WeakPolarHBondContact O-CG 3.49Å; M127-M131 PolarHBondContact O-N 2.78Å; R128-M131 PolarHBondContact O-N 2.88Å; N129-M131 VanDerWaalsContact C-N 3.31Å
132L59.1Low71.5Confident124 Ų124137.3 Ų137.365%0.64968%0.684SS**  trans-92.9131.3170-78152.6000108.7
133P54.3Low70.7Confident198 Ų198135.9 Ų135.9100%1.28669%0.686SS**  trans-660-179.929-35.1000113.3

Retrieved 133 of 133 residues in 18.5 ms (Link to these results)