A0A5K4FBQ9_SCHMA Loading...

G_PROTEIN_RECEP_F1_2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FBQ9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 322 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
1M34.4Very low34.1Very low237 Ų237168.9 Ų168.9100%1.16786%0.858SS**  074.40-149.9-174.5-147.900108.2
2F31.8Very low33.9Very low216 Ų216164.8 Ų164.895%0.94784%0.839SS**  trans-150.4112.9166.9-84.8-79.1000106.1
3K30.3Very low34.5Very low211 Ų211165 Ų16592%0.91783%0.834SS**  trans-107.8113.8-179.9-123.6177.7-179.3175.60106
4V35.6Very low34.5Very low141 Ų141159.9 Ų159.986%0.85582%0.821SS**PPolyproline II helixtrans-96.9125.8172.3176.60000108
5H33.8Very low34.5Very low173 Ų173164 Ų16480%0.80182%0.822SS**PPolyproline II helixtrans-67.5125.1179.7-95.7-97.6000111.4
6T38Very low34.6Very low124 Ų124163.4 Ų163.476%0.76182%0.823SS**PPolyproline II helixtrans-84.8123.2160.438.20000109.2
7V35.5Very low34.6Very low125 Ų125166.3 Ų166.376%0.75883%0.829SS**  trans-99.1110.2167.3176.80000107
8N30.5Very low34.6Very low149 Ų149166.7 Ų166.780%0.79783%0.828SS**  trans-80.1121.2168.7-79.4-37.7000108.7
9V36.8Very low34.6Very low133 Ų133170.8 Ų170.881%0.80683%0.833SS**  trans-94.8106.9165.71780000107.7
10H31.5Very low34.5Very low167 Ų167171.5 Ų171.577%0.77383%0.834SS**  trans-67127.1169.5-131.1-85000108.6
11Q36.6Very low34.8Very low182 Ų182168 Ų16885%0.8583%0.825SS**  trans-125.8102159-157.21637.900108.4
12D32.3Very low34.9Very low119 Ų119161.6 Ų161.664%0.63680%0.804SS**  trans-77.9124.5176.4-154.9-16.1000108.3
13H41.1Very low35Very low168 Ų168158.3 Ų158.378%0.77880%0.796SS**  trans-142.281.8162.7-123.2-56.6000109.4R15H13-R15 PolarHBondContact O-N 3.17Å
14S34.3Very low35.5Very low93 Ų93154.2 Ų154.265%0.6579%0.789SS**  trans-52.6125.3158.6-820000111.5
15R35.6Very low35.6Very low222 Ų222153.8 Ų153.884%0.83879%0.787SS**  trans-173.6102.5132.9-106.1-173.9-92.9-176-4.8112.1H13H13-R15 PolarHBondContact O-N 3.17Å
16N35.6Very low35.5Very low155 Ų155153.1 Ų153.183%0.82979%0.786SS**  trans32.6113.3134.1-61.5-23.1000119.8
17F34.3Very low35.5Very low212 Ų212155.4 Ų155.493%0.9379%0.793SS**  -162.9116.4116.3-146.4-107.1000111.1
18Q34.9Very low35.4Very low173 Ų173153.6 Ų153.681%0.80879%0.786SS**  trans-72.7140.1170.7-75166.9-75.300110.9
19R34.4Very low35.4Very low245 Ų245156.3 Ų156.393%0.92579%0.787SS**  170.8134.8113.6-92.3176.1-170-178.13.7110.7
20Q32.7Very low35.2Very low184 Ų184160.9 Ų160.986%0.8679%0.79SS**  trans-121.7-173.3178.7-144.1-158.232.300107.6
21P40.1Very low35.3Very low99 Ų99162.5 Ų162.564%0.64379%0.794SS**  -115.4178.6-105.739.7-23000113.8
22S36.7Very low35Very low102 Ų102159.6 Ų159.671%0.71379%0.794SS**  trans174.6130.8142.429.70000114.2
23D34.8Very low35.1Very low148 Ų148158.6 Ų158.679%0.79180%0.796SS**  trans62.3125.5135.3-49-28.9000123.6
24T40.2Very low34.9Very low124 Ų124161.9 Ų161.976%0.76180%0.802SS**  131.8129.9114.9-31.40000115.3
25T37.7Very low34.9Very low133 Ų133166.6 Ų166.682%0.81681%0.811SS**  trans98.1122.4142.26.10000121.4
26M32.5Very low35Very low159 Ų159160.7 Ų160.778%0.78380%0.801SS**  trans-55.7150.3173.4-72-17274.200114.9
27N37.2Very low34.8Very low171 Ų171161 Ų16191%0.91480%0.802SS**  trans-150.8123.6132.1-98.5-26.8000111.1
28S33.3Very low34.7Very low87 Ų87156.7 Ų156.761%0.60879%0.793SS**  trans-76.3136166.8174.80000109
29Y31.7Very low34.6Very low206 Ų206155.5 Ų155.581%0.80879%0.791SS**  trans170.5121.3134.2-101-78.2000111.4
30R31.2Very low34.4Very low230 Ų230146.5 Ų146.587%0.86877%0.769SS**  trans23.4112.4154.4-81.5178.8176.3159.6-0.9118.7
31K34.2Very low34.5Very low201 Ų201146.8 Ų146.887%0.87477%0.771SS**  trans-151.4121.7133.2-122169.4-176.1176.30111.7S33K31-S33 PolarHBondContact O-N 3.3Å
32S29.9Very low34Very low121 Ų121151.1 Ų151.185%0.84678%0.775SS**  trans-16.8108.3156.6169.30000113.2
33S34.6Very low33.6Very low97 Ų97149.9 Ų149.968%0.67877%0.767SS**  trans-122.299.8171.6-159.70000108.2K31 K35K31-S33 PolarHBondContact O-N 3.3Å; S33-K35 VanDerWaalsContact C-N 3.25Å; S33-K35 PolarHBondContact O-N 2.84Å
34R37.8Very low33.8Very low237 Ų237148.5 Ų148.589%0.89476%0.759SS**  trans-53.3102.7152-71.8-178.5-165.5176.84104.6P36R34-P36 VanDerWaalsContact O-CD 3.32Å; R34-P36 WeakPolarHBondContact O-CD 3.49Å; R34-P36 VanDerWaalsContact O-N 3.13Å
35K32.8Very low33.6Very low192 Ų192146.7 Ų146.784%0.83575%0.751SS**  trans-56.9119.2174-70.4179.1179.4179.80106.2S33 L37S33-K35 VanDerWaalsContact C-N 3.25Å; S33-K35 PolarHBondContact O-N 2.84Å; K35-L37 PolarHBondContact O-N 2.75Å
36P37.8Very low33.6Very low99 Ų99147.5 Ų147.564%0.64375%0.751SS**  trans-58.9135.2164.626.3-29.5000106.1R34 V38R34-P36 VanDerWaalsContact O-CD 3.32Å; R34-P36 WeakPolarHBondContact O-CD 3.49Å; R34-P36 VanDerWaalsContact O-N 3.13Å; P36-V38 HydrophobicContact CG-CG2 4.48Å; P36-V38 PolarHBondContact O-N 3.32Å
37L31.4Very low33.8Very low162 Ų162145.6 Ų145.685%0.84874%0.743SS**  trans-56.592.7163.1-114.3152.2000105.5K35 L39K35-L37 PolarHBondContact O-N 2.75Å; L37-L39 PolarHBondContact O-N 3.18Å
38V33.3Very low33.8Very low120 Ų120141.6 Ų141.673%0.72774%0.742SS**  trans-69.788165.9179.70000103.6P36 A40P36-V38 HydrophobicContact CG-CG2 4.48Å; P36-V38 PolarHBondContact O-N 3.32Å; V38-A40 PolarHBondContact O-N 3.33Å
39L32.8Very low34.1Very low148 Ų148140.6 Ų140.678%0.77573%0.729SS**  trans-58.2102.2156.6-132.4103.9000103.1L37 E41L37-L39 PolarHBondContact O-N 3.18Å; L39-E41 VanDerWaalsContact C-N 3.33Å; L39-E41 PolarHBondContact O-N 3.31Å
40A30Very low34.8Very low57 Ų57134.5 Ų134.547%0.47172%0.715SS.*  trans-54.4109.4167.500000105V38 Y42V38-A40 PolarHBondContact O-N 3.33Å; A40-Y42 HydrophobicContact CB-CD2 3.94Å; A40-Y42 HydrophobicContact CB-CE2 3.96Å; A40-Y42 PolarHBondContact O-N 3.07Å
41E33.3Very low35.3Very low189 Ų189131.8 Ų131.888%0.88371%0.714SS**  trans-56.590.6155.3-80.1-170.6129.800104.8L39 S43L39-E41 VanDerWaalsContact C-N 3.33Å; L39-E41 PolarHBondContact O-N 3.31Å; E41-S43 PolarHBondContact O-N 2.81Å
42Y30.3Very low36.1Very low190 Ų190123.6 Ų123.675%0.74568%0.682SS**  trans-64.188.5160.1-88.9-91.2000104.3A40 L44A40-Y42 HydrophobicContact CB-CD2 3.94Å; A40-Y42 HydrophobicContact CB-CE2 3.96Å; A40-Y42 PolarHBondContact O-N 3.07Å; Y42-L44 PolarHBondContact O-N 3.35Å
43S29.4Very low37.5Very low77 Ų77119.1 Ų119.154%0.53865%0.65SS.*  trans-53.4101.3163.2-159.30000104.9E41 S45 N46E41-S43 PolarHBondContact O-N 2.81Å; S43-S45 PolarHBondContact O-N 3.24Å; S43-S45 PolarHBondContact OG-OG 2.88Å; S43-N46 PolarHBondContact O-N 2.99Å; S43-N46 VanDerWaalsContact O-N 3.13Å
44L38.4Very low38.5Very low118 Ų118119.5 Ų119.562%0.61864%0.644SS**THydrogen-bonded Turntrans-55.5-7-175.6-141.386.5000112.4Y42 I49Y42-L44 PolarHBondContact O-N 3.35Å; L44-I49 HydrophobicContact CG-CD1 4.4Å
45S36.9Very low39.8Very low86 Ų86110.6 Ų110.660%0.60162%0.618SS**THydrogen-bonded Turntrans-76.9-14.4177.753.10000115.5S43S43-S45 PolarHBondContact O-N 3.24Å; S43-S45 PolarHBondContact OG-OG 2.88Å
46N35.8Very low41.1Very low151 Ų151102.1 Ų102.181%0.80758%0.582SS**SBendtrans-111-4.2-177-78.2-18000115.3S43S43-N46 PolarHBondContact O-N 2.99Å; S43-N46 VanDerWaalsContact O-N 3.13Å
47L38.3Very low42.6Very low118 Ų118101 Ų10162%0.61857%0.57SS**SBendtrans-79.7126.8160.5-128.170.9000105.5I49L47-I49 HydrophobicContact CB-CD1 4.23Å; L47-I49 HydrophobicContact CB-CG1 3.79Å; L47-I49 WeakPolarHBondContact O-CG1 3.38Å; L47-I49 PolarHBondContact O-N 3.16Å
48G35.8Very low44.4Very low87 Ų8798.5 Ų98.590%0.89756%0.557SS**  trans-67.760.4178.600000112.1P50G48-P50 WeakPolarHBondContact O-CD 3.41Å
49I41.2Very low45.9Very low67 Ų6796.8 Ų96.834%0.34454%0.537SS..  trans-78.4120.2-180-36.1-178000106.7L44 L47 M51 T53L44-I49 HydrophobicContact CG-CD1 4.4Å; L47-I49 HydrophobicContact CB-CD1 4.23Å; L47-I49 HydrophobicContact CB-CG1 3.79Å; L47-I49 WeakPolarHBondContact O-CG1 3.38Å; L47-I49 PolarHBondContact O-N 3.16Å; I49-M51 PolarHBondContact O-N 2.86Å; I49-T53 HydrophobicContact CG2-CG2 3.31Å; I49-T53 WeakPolarHBondContact CG2-OG1 3.24Å
50P44.7Very low47.6Very low77 Ų7794.9 Ų94.950%0.552%0.523SS..  trans-55.7144179.721-31.7000110.1G48 S52 T53G48-P50 WeakPolarHBondContact O-CD 3.41Å; P50-S52 PolarHBondContact O-N 3.36Å; P50-S52 PolarHBondContact O-OG 3.07Å; P50-T53 PolarHBondContact O-N 3.14Å; P50-T53 PolarHBondContact O-OG1 3.04Å
51M41.6Very low49.5Very low174 Ų17498.8 Ų98.886%0.85753%0.529SS*.THydrogen-bonded Turntrans-44.7-17.3-179.6-75.3-99.3-76.300115I49I49-M51 PolarHBondContact O-N 2.86Å
52S52.9Low51.2Low28 Ų2894.2 Ų94.220%0.19651%0.51CS..Hα-helixtrans-65.8-32.1175.858.10000114.5P50 S55 L56P50-S52 PolarHBondContact O-N 3.36Å; P50-S52 PolarHBondContact O-OG 3.07Å; S52-S55 WeakPolarHBondContact O-CB 3.49Å; S52-S55 PolarHBondContact O-N 2.93Å; S52-L56 WeakPolarHBondContact O-CG 3.41Å; S52-L56 PolarHBondContact O-N 2.94Å; S52-L56 VanDerWaalsContact O-N 3.12Å
53T57.6Low52.8Low27 Ų2787.6 Ų87.617%0.16649%0.485CS..Hα-helixtrans-73.5-37.7-174.150.60000114I49 P50 S55 L56 I57I49-T53 HydrophobicContact CG2-CG2 3.31Å; I49-T53 WeakPolarHBondContact CG2-OG1 3.24Å; P50-T53 PolarHBondContact O-N 3.14Å; P50-T53 PolarHBondContact O-OG1 3.04Å; T53-S55 VanDerWaalsContact C-N 3.26Å; T53-S55 PolarHBondContact O-N 3.01Å; T53-L56 PolarHBondContact O-N 3.28Å; T53-L56 VanDerWaalsContact O-N 3.15Å; T53-I57 VanDerWaalsContact O-CG1 3.32Å; T53-I57 WeakPolarHBondContact O-CG1 3.37Å; T53-I57 PolarHBondContact O-N 3.3Å
54N56.1Low54.6Low106 Ų10686.4 Ų86.457%0.56748%0.476SS*.Hα-helixtrans-61.7-37.6173.6-74.3-34.7000111.5I57 L58N54-I57 PolarHBondContact O-N 2.85Å; N54-L58 WeakPolarHBondContact O-CB 3.33Å; N54-L58 PolarHBondContact O-N 2.97Å
55S65.4Low56.1Low49 Ų4990 Ų9034%0.34348%0.482SS..Hα-helixtrans-64.2-41.1174.2-174.80000111.6S52 T53 L58 R59S52-S55 WeakPolarHBondContact O-CB 3.49Å; S52-S55 PolarHBondContact O-N 2.93Å; T53-S55 VanDerWaalsContact C-N 3.26Å; T53-S55 PolarHBondContact O-N 3.01Å; S55-L58 PolarHBondContact O-N 2.92Å; S55-R59 WeakPolarHBondContact O-CB 3.43Å; S55-R59 WeakPolarHBondContact O-CG 3.45Å; S55-R59 PolarHBondContact O-N 3.33Å; S55-R59 PolarHBondContact OG-NE 2.96Å
56L60.8Low57Low15 Ų1590.8 Ų90.88%0.07948%0.477CS..Hα-helixtrans-67.5-43.5175.8-69.1171.7000113.1S52 T53 L58 R59 F60 F253 L282S52-L56 WeakPolarHBondContact O-CG 3.41Å; S52-L56 PolarHBondContact O-N 2.94Å; S52-L56 VanDerWaalsContact O-N 3.12Å; T53-L56 PolarHBondContact O-N 3.28Å; T53-L56 VanDerWaalsContact O-N 3.15Å; L56-L58 VanDerWaalsContact C-N 3.27Å; L56-L58 PolarHBondContact O-N 3.47Å; L56-R59 PolarHBondContact O-N 3.09Å; L56-F60 WeakPolarHBondContact O-CB 3.44Å; L56-F60 PolarHBondContact O-N 3.44Å; L56-F253 HydrophobicContact CD1-CE2 4.29Å; L56-L282 HydrophobicContact CD1-CD1 3.68Å; L56-L282 HydrophobicContact CD1-CD2 3.68Å; L56-L282 HydrophobicContact CD1-CG 4.07Å; L56-L282 HydrophobicContact CD2-CD1 3.44Å; L56-L282 VanDerWaalsContact CD2-CD1 3.44Å; L56-L282 HydrophobicContact CD2-CD2 4.34Å; L56-L282 HydrophobicContact CD2-CG 3.88Å; L56-L282 HydrophobicContact CG-CD1 4.07Å; L56-L282 HydrophobicContact CG-CD2 4.19Å; L56-L282 HydrophobicContact CG-CG 4.29Å
57I67.7Low57.9Low76 Ų7685.7 Ų85.739%0.3945%0.454SS..Hα-helixtrans-61.9-41.4177.4-67.3164.2000109.6T53 N54 F60 K61T53-I57 VanDerWaalsContact O-CG1 3.32Å; T53-I57 WeakPolarHBondContact O-CG1 3.37Å; T53-I57 PolarHBondContact O-N 3.3Å; N54-I57 PolarHBondContact O-N 2.85Å; I57-F60 PolarHBondContact O-N 3.12Å; I57-K61 HydrophobicContact CG2-CD 4.27Å; I57-K61 WeakPolarHBondContact O-CB 3.39Å; I57-K61 VanDerWaalsContact O-CG 3.29Å; I57-K61 WeakPolarHBondContact O-CG 3.35Å; I57-K61 PolarHBondContact O-N 2.84Å
58L69.6Low58.8Low108 Ų10884.9 Ų84.957%0.56545%0.453SS*.Hα-helixtrans-63.3-44.7175.3-173.267.9000111.5N54 S55 L56 K61 L62N54-L58 WeakPolarHBondContact O-CB 3.33Å; N54-L58 PolarHBondContact O-N 2.97Å; S55-L58 PolarHBondContact O-N 2.92Å; L56-L58 VanDerWaalsContact C-N 3.27Å; L56-L58 PolarHBondContact O-N 3.47Å; L58-K61 PolarHBondContact O-N 2.96Å; L58-L62 HydrophobicContact CG-CD1 4.21Å; L58-L62 WeakPolarHBondContact O-CB 3.38Å; L58-L62 WeakPolarHBondContact O-CG 3.47Å; L58-L62 PolarHBondContact O-N 3.46Å
59R66.1Low59.4Low84 Ų8484.5 Ų84.532%0.31744%0.437SS..Hα-helixtrans-63.7-41.2176.5-73.2170.5-171.3-164.6-3.6112.2S55 L56 L62 F63 S286S55-R59 WeakPolarHBondContact O-CB 3.43Å; S55-R59 WeakPolarHBondContact O-CG 3.45Å; S55-R59 PolarHBondContact O-N 3.33Å; S55-R59 PolarHBondContact OG-NE 2.96Å; L56-R59 PolarHBondContact O-N 3.09Å; R59-L62 PolarHBondContact O-N 3.01Å; R59-F63 WeakPolarHBondContact O-CB 3.31Å; R59-F63 PolarHBondContact O-N 2.99Å; R59-S286 PolarHBondContact NH1-OG 2.97Å; R59-S286 PolarHBondContact NH2-OG 2.97Å
60F67.1Low59.7Low108 Ų10885.6 Ų85.647%0.47444%0.444SS..Hα-helixtrans-64.6-44.1175.5-175.5-100.6000111L56 I57 L62 F63 C64 F249L56-F60 WeakPolarHBondContact O-CB 3.44Å; L56-F60 PolarHBondContact O-N 3.44Å; I57-F60 PolarHBondContact O-N 3.12Å; F60-L62 VanDerWaalsContact C-N 3.35Å; F60-L62 PolarHBondContact O-N 3.18Å; F60-F63 PolarHBondContact O-N 3.34Å; F60-C64 VanDerWaalsContact CE1-SG 3.57Å; F60-C64 PolarHBondContact O-N 3.29Å; F60-C64 PolarHBondContact O-SG 2.87Å; F60-C64 VanDerWaalsContact O-SG 3.34Å; F60-F249 HydrophobicContact CD2-CZ 4.2Å
61K71.3Confident59.6Low139 Ų13991.1 Ų91.160%0.60446%0.46SS*.Hα-helixtrans-59.4-43.8173.4-79.2179.9176.3-178.70112.1I57 L58 R65I57-K61 HydrophobicContact CG2-CD 4.27Å; I57-K61 WeakPolarHBondContact O-CB 3.39Å; I57-K61 VanDerWaalsContact O-CG 3.29Å; I57-K61 WeakPolarHBondContact O-CG 3.35Å; I57-K61 PolarHBondContact O-N 2.84Å; L58-K61 PolarHBondContact O-N 2.96Å; K61-R65 WeakPolarHBondContact O-CB 3.12Å; K61-R65 PolarHBondContact O-N 3.22Å
62L68.4Low59.6Low93 Ų9387 Ų8749%0.48745%0.448SS..Hα-helixtrans-61.6-45.8175.3-79.8160.4000111.2L58 R59 F60 R65 M66L58-L62 HydrophobicContact CG-CD1 4.21Å; L58-L62 WeakPolarHBondContact O-CB 3.38Å; L58-L62 WeakPolarHBondContact O-CG 3.47Å; L58-L62 PolarHBondContact O-N 3.46Å; R59-L62 PolarHBondContact O-N 3.01Å; F60-L62 VanDerWaalsContact C-N 3.35Å; F60-L62 PolarHBondContact O-N 3.18Å; L62-R65 PolarHBondContact O-N 2.67Å; L62-M66 WeakPolarHBondContact O-CG 3.27Å; L62-M66 PolarHBondContact O-N 3.06Å
63F64.5Low59Low51 Ų5192.2 Ų92.222%0.22447%0.474CS..Hα-helixtrans-58.9-51176.4179.1-98.5000111.9R59 F60 R65 M66 S67 M242 V245 V246R59-F63 WeakPolarHBondContact O-CB 3.31Å; R59-F63 PolarHBondContact O-N 2.99Å; F60-F63 PolarHBondContact O-N 3.34Å; F63-R65 VanDerWaalsContact C-N 3.26Å; F63-R65 PolarHBondContact O-N 3.05Å; F63-M66 PolarHBondContact O-N 3.28Å; F63-M66 VanDerWaalsContact O-N 3.12Å; F63-S67 PolarHBondContact O-N 3.17Å; F63-S67 PolarHBondContact O-OG 2.87Å; F63-M242 HydrophobicContact CE2-SD 4.4Å; F63-V245 HydrophobicContact CD2-CG1 4.08Å; F63-V245 HydrophobicContact CE2-CB 4.33Å; F63-V245 HydrophobicContact CE2-CG1 3.59Å; F63-V245 HydrophobicContact CZ-CG1 4.46Å; F63-V246 HydrophobicContact CE1-CG2 4.06Å; F63-V246 HydrophobicContact CZ-CG2 3.61Å
64C67.2Low58Low52 Ų5297 Ų9735%0.35150%0.498SS..Hα-helixtrans-59.5-36.9176.5-66.70000112.5F60 T68F60-C64 VanDerWaalsContact CE1-SG 3.57Å; F60-C64 PolarHBondContact O-N 3.29Å; F60-C64 PolarHBondContact O-SG 2.87Å; F60-C64 VanDerWaalsContact O-SG 3.34Å; C64-T68 WeakPolarHBondContact O-CG2 3.33Å; C64-T68 PolarHBondContact O-N 3.42Å; C64-T68 VanDerWaalsContact O-N 3.1Å; C64-T68 PolarHBondContact O-OG1 3.15Å
65R70.1Confident56.9Low195 Ų19597 Ų9774%0.73651%0.507SS*.Hα-helixtrans-68-37.5176.5-166.4-179.1175.1101.60.7112.1K61 L62 F63 T68 S69K61-R65 WeakPolarHBondContact O-CB 3.12Å; K61-R65 PolarHBondContact O-N 3.22Å; L62-R65 PolarHBondContact O-N 2.67Å; F63-R65 VanDerWaalsContact C-N 3.26Å; F63-R65 PolarHBondContact O-N 3.05Å; R65-T68 WeakPolarHBondContact CA-OG1 3.45Å; R65-T68 PolarHBondContact O-OG1 3.02Å; R65-S69 PolarHBondContact O-N 3.49Å
66M55.9Low55.8Low101 Ų101102.1 Ų102.150%0.49853%0.529SS..Hα-helixtrans-68.5-45174.5-67.8-174.2-55.600111.3L62 F63 T68 S69L62-M66 WeakPolarHBondContact O-CG 3.27Å; L62-M66 PolarHBondContact O-N 3.06Å; F63-M66 PolarHBondContact O-N 3.28Å; F63-M66 VanDerWaalsContact O-N 3.12Å; M66-T68 PolarHBondContact O-N 3.46Å; M66-S69 PolarHBondContact O-N 2.89Å; M66-S69 VanDerWaalsContact O-N 3.11Å
67S53.6Low54.7Low45 Ų45108.4 Ų108.432%0.31556%0.562SS.*Hα-helixtrans-65.5-22.8178.6-61.70000114.2F63F63-S67 PolarHBondContact O-N 3.17Å; F63-S67 PolarHBondContact O-OG 2.87Å
68T57.1Low53Low100 Ų100107.6 Ų107.661%0.61357%0.573SS**Hα-helixtrans-84.5-21.3175.545.30000112.8C64 R65 M66C64-T68 WeakPolarHBondContact O-CG2 3.33Å; C64-T68 PolarHBondContact O-N 3.42Å; C64-T68 VanDerWaalsContact O-N 3.1Å; C64-T68 PolarHBondContact O-OG1 3.15Å; R65-T68 WeakPolarHBondContact CA-OG1 3.45Å; R65-T68 PolarHBondContact O-OG1 3.02Å; M66-T68 PolarHBondContact O-N 3.46Å
69S48.6Very low51.2Low79 Ų79107.8 Ų107.855%0.55258%0.583SS**Hα-helixtrans-76-23179.4-161.10000113.6R65 M66 K71R65-S69 PolarHBondContact O-N 3.49Å; M66-S69 PolarHBondContact O-N 2.89Å; M66-S69 VanDerWaalsContact O-N 3.11Å; S69-K71 VanDerWaalsContact C-N 3.32Å; S69-K71 PolarHBondContact O-N 2.95Å
70D47.6Very low49.7Very low90 Ų90109.5 Ų109.548%0.48160%0.598SS.*G310 helixtrans-77-15.7179.5-83.4-22.1000113.4S72D70-S72 PolarHBondContact O-N 3.19Å
71K43.2Very low48Very low194 Ų194114.4 Ų114.484%0.84362%0.619SS**G310 helixtrans-87.72.9-176.7-78.5-169.6176.1-1790115.4S69S69-K71 VanDerWaalsContact C-N 3.32Å; S69-K71 PolarHBondContact O-N 2.95Å
72S41.3Very low46.1Very low88 Ų88116.2 Ų116.262%0.61562%0.624SS**G310 helixtrans-99.7-0.3-178.670.70000115.6D70D70-S72 PolarHBondContact O-N 3.19Å
73N40.3Very low44.4Very low137 Ų137117.9 Ų117.973%0.73364%0.64SS**SBendtrans-120.74.5-171-77-9000116.5
74D35.3Very low43.1Very low126 Ų126121.9 Ų121.967%0.67467%0.668SS**  trans-10977178.7-72.3-29.5000111.8
75S34.3Very low41.4Very low108 Ų108128.1 Ų128.176%0.75569%0.69SS**  trans-170.1140.7154.9-162.60000110.5
76I40.9Very low39.6Very low156 Ų156126 Ų12680%0.869%0.687SS**  trans94.878.6168.7-44.2176.9000115.9
77D37.8Very low38.7Very low146 Ų146128.6 Ų128.678%0.78170%0.696SS**  21.3130.9120.3-16016.2000120.4
78G33.9Very low37.7Very low60 Ų60138 Ų13862%0.61973%0.727SS**  trans74.499.8146.100000119.7
79S30.8Very low36.4Very low111 Ų111138.8 Ų138.878%0.77674%0.736SS**  trans127.6129.6133.8-158.90000116.5
80L34.8Very low35.6Very low121 Ų121139.8 Ų139.863%0.63475%0.749SS**  trans74.395.6158.2-10858.9000120Y82L80-Y82 HydrophobicContact CB-CE2 4.07Å; L80-Y82 HydrophobicContact CD2-CE2 3.77Å; L80-Y82 WeakPolarHBondContact CD2-OH 3.34Å; L80-Y82 HydrophobicContact CG-CE2 4.06Å
81K31.1Very low34.9Very low210 Ų210144.5 Ų144.591%0.91377%0.768SS**  trans-70.3125.8157.1-75.4-178.8175.7-175.60110.1
82Y32.1Very low34.4Very low178 Ų178141.8 Ų141.870%0.69877%0.767SS**  trans-116.9143.4154.1-62.7-81.7000109L80 V84L80-Y82 HydrophobicContact CB-CE2 4.07Å; L80-Y82 HydrophobicContact CD2-CE2 3.77Å; L80-Y82 WeakPolarHBondContact CD2-OH 3.34Å; L80-Y82 HydrophobicContact CG-CE2 4.06Å; Y82-V84 PolarHBondContact O-N 2.88Å
83P32.6Very low33.9Very low128 Ų128142.6 Ų142.683%0.83177%0.773SS**  trans-76.2112.9-173.930.1-31.7000110.6K85P83-K85 PolarHBondContact O-N 3.36Å
84V36.2Very low34Very low135 Ų135142 Ų14282%0.81877%0.774SS**  trans-82.1104.3174-178.70000109Y82Y82-V84 PolarHBondContact O-N 2.88Å
85K32.1Very low34.1Very low183 Ų183144.9 Ų144.980%0.79678%0.783SS**  trans-84.7143.7148.3-82.2-175.9175.61800107.8P83P83-K85 PolarHBondContact O-N 3.36Å
86H33Very low34.6Very low149 Ų149143.6 Ų143.669%0.6977%0.77SS**SBendtrans97.3105.3172.8-57.8-78.2000117.6
87K36.2Very low34.7Very low156 Ų156141.7 Ų141.768%0.67876%0.758SS**  35.5102.5121.2-124.3167.3-177.1163.20114.9S89 C322K87-S89 PolarHBondContact O-N 3.36Å; K87-S89 VanDerWaalsContact O-N 3.1Å; K87-C322 PolarHBondContact NZ-O 2.88Å
88Y32Very low35.5Very low244 Ų244139.1 Ų139.196%0.95775%0.749SS**  trans-8.695.6166.6-58-88000116.2
89S30.6Very low36.5Very low115 Ų115143.6 Ų143.680%0.80475%0.754SS**  trans-147.7120.3149.7-165.90000107.4K87K87-S89 PolarHBondContact O-N 3.36Å; K87-S89 VanDerWaalsContact O-N 3.1Å
90A32.5Very low37.6Very low100 Ų100142.3 Ų142.383%0.82674%0.741SS**  trans-71128.9-173.500000111.1
91Q31.2Very low38.4Very low190 Ų190138.9 Ų138.989%0.88873%0.725SS**  trans-116.8133.6162.3-79.7-150.5-14.100110.6
92V33.4Very low39.4Very low136 Ų136133.8 Ų133.882%0.82471%0.708SS**  trans-89.5124178.9170.60000108.2
93S31.3Very low40.6Very low105 Ų105132 Ų13273%0.73470%0.704SS**  trans-115.3122.8171.4-78.70000110.7
94V41.6Very low41.7Very low126 Ų126128.2 Ų128.276%0.76468%0.68SS**  trans-82.5115.9176.6179.70000108.8V96V94-V96 HydrophobicContact CG1-CG2 4.47Å
95H37Very low42.4Very low185 Ų185128 Ų12886%0.85667%0.668SS**PPolyproline II helixtrans-87.3120.2173.8-105-99.3000110.8
96V46.7Very low43.5Very low81 Ų81125.7 Ų125.749%0.49166%0.66SS.*PPolyproline II helixtrans-100.2135.7174.5179.70000109.3V94 V100 V101V94-V96 HydrophobicContact CG1-CG2 4.47Å; V96-V100 HydrophobicContact CG1-CB 3.94Å; V96-V100 HydrophobicContact CG1-CG1 3.88Å; V96-V101 HydrophobicContact CB-CG2 4.27Å; V96-V101 HydrophobicContact CG1-CG2 4.13Å
97H41.6Very low44.6Very low117 Ų117124.6 Ų124.654%0.54266%0.655SS.*PPolyproline II helixtrans-57.2137.4-175.6-171.2-96.1000112.8Q99 V100 V101H97-Q99 VanDerWaalsContact C-N 3.28Å; H97-Q99 PolarHBondContact ND1-N 2.91Å; H97-Q99 PolarHBondContact O-N 3.44Å; H97-Q99 VanDerWaalsContact O-N 3.15Å; H97-V100 HydrophobicContact CB-CG2 4.11Å; H97-V100 WeakPolarHBondContact O-CA 3.38Å; H97-V100 WeakPolarHBondContact O-CB 3.44Å; H97-V100 PolarHBondContact O-N 2.94Å; H97-V101 PolarHBondContact O-N 3.39Å; H97-V101 VanDerWaalsContact O-N 3.17Å
98P55.2Low45.5Very low91 Ų91121.3 Ų121.359%0.59165%0.648SS**Hα-helixtrans-58.9-33-172.8-2432.1000114.7V100 V101 N102P98-V100 VanDerWaalsContact C-N 3.27Å; P98-V100 PolarHBondContact O-N 3.08Å; P98-V101 PolarHBondContact O-N 3.47Å; P98-N102 PolarHBondContact O-N 3.25Å
99Q54.8Low46.4Very low154 Ų154119.1 Ų119.172%0.7264%0.638SS**Hα-helixtrans-69.7-24.9175.9-64.8-170.5-26.900112.7H97 K103H97-Q99 VanDerWaalsContact C-N 3.28Å; H97-Q99 PolarHBondContact ND1-N 2.91Å; H97-Q99 PolarHBondContact O-N 3.44Å; H97-Q99 VanDerWaalsContact O-N 3.15Å; Q99-K103 WeakPolarHBondContact O-CB 3.29Å; Q99-K103 PolarHBondContact O-N 3.09Å
100V54.3Low47.6Very low84 Ų84119.9 Ų119.951%0.50963%0.629SS.*Hα-helixtrans-80-32.4173.6-176.50000110.5V96 H97 P98 S104V96-V100 HydrophobicContact CG1-CB 3.94Å; V96-V100 HydrophobicContact CG1-CG1 3.88Å; H97-V100 HydrophobicContact CB-CG2 4.11Å; H97-V100 WeakPolarHBondContact O-CA 3.38Å; H97-V100 WeakPolarHBondContact O-CB 3.44Å; H97-V100 PolarHBondContact O-N 2.94Å; P98-V100 VanDerWaalsContact C-N 3.27Å; P98-V100 PolarHBondContact O-N 3.08Å; V100-S104 WeakPolarHBondContact O-CB 3.3Å; V100-S104 PolarHBondContact O-N 2.89Å; V100-S104 PolarHBondContact O-OG 3.18Å
101V50.4Low48.7Very low50 Ų50119 Ų11930%0.30361%0.613SS.*Hα-helixtrans-70.2-38.4176177.90000112.6V96 H97 P98 S104 K105V96-V101 HydrophobicContact CB-CG2 4.27Å; V96-V101 HydrophobicContact CG1-CG2 4.13Å; H97-V101 PolarHBondContact O-N 3.39Å; H97-V101 VanDerWaalsContact O-N 3.17Å; P98-V101 PolarHBondContact O-N 3.47Å; V101-S104 VanDerWaalsContact CA-OG 3.29Å; V101-S104 WeakPolarHBondContact CA-OG 3.48Å; V101-S104 PolarHBondContact O-OG 2.94Å; V101-S104 VanDerWaalsContact O-OG 3.05Å; V101-K105 HydrophobicContact CG1-CD 4.44Å; V101-K105 WeakPolarHBondContact O-CB 3.28Å; V101-K105 WeakPolarHBondContact O-CG 3.11Å; V101-K105 PolarHBondContact O-N 3.46Å
102N53.1Low49.4Very low102 Ų102114.8 Ų114.855%0.54560%0.597SS.*Hα-helixtrans-74.6-38.4176.7-79-8.2000112.2P98 S104 K105 E106P98-N102 PolarHBondContact O-N 3.25Å; N102-S104 VanDerWaalsContact C-N 3.32Å; N102-S104 PolarHBondContact O-N 3.38Å; N102-K105 PolarHBondContact O-N 3.21Å; N102-E106 PolarHBondContact O-N 3.43Å
103K57.5Low50.3Low142 Ų142111.4 Ų111.462%0.61758%0.579SS**Hα-helixtrans-63.9-39.1174.2-155.8174.9-175.3-175.60111.7Q99 E107Q99-K103 WeakPolarHBondContact O-CB 3.29Å; Q99-K103 PolarHBondContact O-N 3.09Å; K103-E107 WeakPolarHBondContact O-CB 3.42Å; K103-E107 WeakPolarHBondContact O-CG 3.29Å; K103-E107 PolarHBondContact O-N 2.88Å
104S54.1Low51.3Low47 Ų47110.8 Ų110.833%0.32957%0.568SS.*Hα-helixtrans-72.1-32.8172.552.20000113.5V100 V101 N102 V108V100-S104 WeakPolarHBondContact O-CB 3.3Å; V100-S104 PolarHBondContact O-N 2.89Å; V100-S104 PolarHBondContact O-OG 3.18Å; V101-S104 VanDerWaalsContact CA-OG 3.29Å; V101-S104 WeakPolarHBondContact CA-OG 3.48Å; V101-S104 PolarHBondContact O-OG 2.94Å; V101-S104 VanDerWaalsContact O-OG 3.05Å; N102-S104 VanDerWaalsContact C-N 3.32Å; N102-S104 PolarHBondContact O-N 3.38Å; S104-V108 VanDerWaalsContact O-CB 3.27Å; S104-V108 WeakPolarHBondContact O-CB 3.35Å; S104-V108 WeakPolarHBondContact O-CG2 3.41Å; S104-V108 PolarHBondContact O-N 3.35Å
105K51.6Low51.6Low131 Ų131108.8 Ų108.857%0.5755%0.552SS**Hα-helixtrans-68.8-33.2172.5-87-179175.91770113.3V101 N102 R109V101-K105 HydrophobicContact CG1-CD 4.44Å; V101-K105 WeakPolarHBondContact O-CB 3.28Å; V101-K105 WeakPolarHBondContact O-CG 3.11Å; V101-K105 PolarHBondContact O-N 3.46Å; N102-K105 PolarHBondContact O-N 3.21Å; K105-R109 WeakPolarHBondContact O-CG 3.29Å; K105-R109 PolarHBondContact O-N 3.19Å; K105-R109 VanDerWaalsContact O-N 3.12Å
106E56.5Low52Low134 Ų134108.4 Ų108.463%0.62655%0.548SS*.Hα-helixtrans-73.9-41.4173.1-79175.1157.600111.6N102 R109 H110N102-E106 PolarHBondContact O-N 3.43Å; E106-R109 PolarHBondContact O-N 2.67Å; E106-H110 PolarHBondContact O-N 3.42Å; E106-H110 VanDerWaalsContact O-N 3.09Å
107E55.2Low52.1Low126 Ų126108.5 Ų108.559%0.58955%0.552SS**Hα-helixtrans-63-42.3172.7-78.2-178.9170.700112K103 R109 H110 V111K103-E107 WeakPolarHBondContact O-CB 3.42Å; K103-E107 WeakPolarHBondContact O-CG 3.29Å; K103-E107 PolarHBondContact O-N 2.88Å; E107-R109 VanDerWaalsContact C-N 3.34Å; E107-R109 PolarHBondContact O-N 2.89Å; E107-H110 PolarHBondContact O-N 2.87Å; E107-V111 WeakPolarHBondContact O-CG2 3.2Å; E107-V111 PolarHBondContact O-N 3.49Å
108V54.4Low52.4Low87 Ų87106.8 Ų106.853%0.52755%0.553SS.*Hα-helixtrans-68.3-30.7177.21720000112S104 N112S104-V108 VanDerWaalsContact O-CB 3.27Å; S104-V108 WeakPolarHBondContact O-CB 3.35Å; S104-V108 WeakPolarHBondContact O-CG2 3.41Å; S104-V108 PolarHBondContact O-N 3.35Å; V108-N112 WeakPolarHBondContact O-CB 3.39Å; V108-N112 PolarHBondContact O-N 3.11Å
109R52.3Low51.6Low198 Ų198107.6 Ų107.675%0.74755%0.553SS**Hα-helixtrans-69.4-38.6173-84-175.7-172.4172.72.9112.3K105 E106 E107 S113K105-R109 WeakPolarHBondContact O-CG 3.29Å; K105-R109 PolarHBondContact O-N 3.19Å; K105-R109 VanDerWaalsContact O-N 3.12Å; E106-R109 PolarHBondContact O-N 2.67Å; E107-R109 VanDerWaalsContact C-N 3.34Å; E107-R109 PolarHBondContact O-N 2.89Å; R109-S113 PolarHBondContact O-N 3.44Å; R109-S113 PolarHBondContact O-OG 3.4Å
110H55.3Low50.9Low131 Ų131104.9 Ų104.961%0.60655%0.551SS**Hα-helixtrans-66.9-41.6174.8-108.1-75.7000111.7E106 E107 S113 D114E106-H110 PolarHBondContact O-N 3.42Å; E106-H110 VanDerWaalsContact O-N 3.09Å; E107-H110 PolarHBondContact O-N 2.87Å; H110-S113 WeakPolarHBondContact CA-OG 3.47Å; H110-S113 PolarHBondContact O-N 2.91Å; H110-S113 PolarHBondContact O-OG 3.4Å; H110-D114 PolarHBondContact O-N 2.84Å
111V54.4Low50.3Low81 Ų81106.9 Ų106.949%0.49156%0.563SS.*Hα-helixtrans-67.2-38.3176.3174.90000111.8E107 D114 L115E107-V111 WeakPolarHBondContact O-CG2 3.2Å; E107-V111 PolarHBondContact O-N 3.49Å; V111-D114 PolarHBondContact O-N 3.36Å; V111-L115 HydrophobicContact CG1-CD1 3.75Å; V111-L115 WeakPolarHBondContact O-CB 3.3Å; V111-L115 WeakPolarHBondContact O-CD1 3.17Å; V111-L115 PolarHBondContact O-N 3.33Å
112N46Very low49.6Very low103 Ų103113.3 Ų113.355%0.55159%0.59SS**Hα-helixtrans-71.8-29.8176-105.6-13.7000113.3V108 D114 K116V108-N112 WeakPolarHBondContact O-CB 3.39Å; V108-N112 PolarHBondContact O-N 3.11Å; N112-D114 VanDerWaalsContact C-N 3.33Å; N112-K116 VanDerWaalsContact O-CB 3.24Å; N112-K116 WeakPolarHBondContact O-CB 3.47Å; N112-K116 PolarHBondContact O-N 2.74Å
113S53Low48.9Very low65 Ų65117.7 Ų117.746%0.45561%0.607SS.*Hα-helixtrans-68.8-36170.752.40000111.6R109 H110 S117R109-S113 PolarHBondContact O-N 3.44Å; R109-S113 PolarHBondContact O-OG 3.4Å; H110-S113 WeakPolarHBondContact CA-OG 3.47Å; H110-S113 PolarHBondContact O-N 2.91Å; H110-S113 PolarHBondContact O-OG 3.4Å; S113-S117 PolarHBondContact O-N 2.95Å
114D53.4Low47.9Very low92 Ų92118.3 Ų118.349%0.49262%0.617SS.*Hα-helixtrans-74.5-39179.8-64.6-19000111.5H110 V111 N112 S117 S118H110-D114 PolarHBondContact O-N 2.84Å; V111-D114 PolarHBondContact O-N 3.36Å; N112-D114 VanDerWaalsContact C-N 3.33Å; D114-S117 PolarHBondContact O-N 2.94Å; D114-S117 PolarHBondContact O-OG 3.12Å; D114-S118 PolarHBondContact O-N 3.46Å; D114-S118 PolarHBondContact O-OG 2.85Å
115L46.3Very low46.9Very low83 Ų83124.2 Ų124.244%0.43564%0.644SS.*Hα-helixtrans-67.5-38.8172.9-10182.9000112.5V111 S117 S118 D119V111-L115 HydrophobicContact CG1-CD1 3.75Å; V111-L115 WeakPolarHBondContact O-CB 3.3Å; V111-L115 WeakPolarHBondContact O-CD1 3.17Å; V111-L115 PolarHBondContact O-N 3.33Å; L115-S117 PolarHBondContact O-N 3.47Å; L115-S118 CarbonylContact O-C 3.52Å; L115-S118 WeakPolarHBondContact O-CA 3.13Å; L115-S118 PolarHBondContact O-N 2.91Å; L115-D119 VanDerWaalsContact O-CG 3.3Å; L115-D119 PolarHBondContact O-N 2.91Å
116K45.6Very low46Very low177 Ų177121.4 Ų121.477%0.7765%0.652SS**Hα-helixtrans-68.5-16.8177.8-146.3172.2-167.3-176.80113.1N112N112-K116 VanDerWaalsContact O-CB 3.24Å; N112-K116 WeakPolarHBondContact O-CB 3.47Å; N112-K116 PolarHBondContact O-N 2.74Å
117S48.6Very low45.3Very low84 Ų84123.8 Ų123.859%0.58766%0.663SS**Hα-helixtrans-85.5-16.1167.679.50000113.7S113 D114 L115S113-S117 PolarHBondContact O-N 2.95Å; D114-S117 PolarHBondContact O-N 2.94Å; D114-S117 PolarHBondContact O-OG 3.12Å; L115-S117 PolarHBondContact O-N 3.47Å
118S47.7Very low44.5Very low80 Ų80125.3 Ų125.356%0.55968%0.675SS**Hα-helixtrans-99.7-23.9-179.9-60.20000113.7D114 L115 S120D114-S118 PolarHBondContact O-N 3.46Å; D114-S118 PolarHBondContact O-OG 2.85Å; L115-S118 CarbonylContact O-C 3.52Å; L115-S118 WeakPolarHBondContact O-CA 3.13Å; L115-S118 PolarHBondContact O-N 2.91Å; S118-S120 PolarHBondContact O-N 3.4Å; S118-S120 VanDerWaalsContact O-N 3.14Å
119D40.2Very low43.4Very low109 Ų109129.6 Ų129.658%0.58369%0.694SS**  trans-79.310.6-178.9-66.9-24.3000114.4L115 V121L115-D119 VanDerWaalsContact O-CG 3.3Å; L115-D119 PolarHBondContact O-N 2.91Å; D119-V121 PolarHBondContact O-N 3.31Å; D119-V121 VanDerWaalsContact O-N 3.07Å
120S40.3Very low42.7Very low96 Ų96128 Ų12867%0.67170%0.699SS**THydrogen-bonded Turntrans-73.610.3174.6-50.90000113.3S118S118-S120 PolarHBondContact O-N 3.4Å; S118-S120 VanDerWaalsContact O-N 3.14Å
121V40.6Very low41.6Very low127 Ų127129.6 Ų129.677%0.7771%0.711SS**THydrogen-bonded Turntrans-129.5-4.6-165.9-176.20000114.2D119D119-V121 PolarHBondContact O-N 3.31Å; D119-V121 VanDerWaalsContact O-N 3.07Å
122E35.8Very low40.6Very low184 Ų184134.5 Ų134.586%0.8673%0.734SS**  trans-116.543.2-177-116-173.9123.100115D124E122-D124 VanDerWaalsContact C-N 3.3Å; E122-D124 PolarHBondContact O-N 3.11Å
123Q38.3Very low39.8Very low194 Ų194136.6 Ų136.691%0.90775%0.745SS**  trans-84.622.8-178.9-152.9172.2-8.400114.8
124D36.6Very low38.9Very low156 Ų156141.7 Ų141.783%0.83476%0.762SS**SBendtrans-132.224-165.8-138.215.3000116.5E122E122-D124 VanDerWaalsContact C-N 3.3Å; E122-D124 PolarHBondContact O-N 3.11Å
125L33.5Very low38.1Very low171 Ų171144.7 Ų144.790%0.89578%0.783SS**  trans-141.843.6174.8-144.473.6000114.4
126G32.7Very low37.3Very low72 Ų72144.8 Ų144.874%0.74280%0.804SS**  trans-98.3101.3160.300000109.4
127E42.3Very low36.6Very low183 Ų183142.8 Ų142.886%0.85580%0.802SS**SBendtrans-169.5-2.7157.6-113.4170.1-174.800117.4
128N36.5Very low36.1Very low158 Ų158147.8 Ų147.885%0.84582%0.816SS**SBendtrans-123.720.7-168.8-79.5-60.8000118.1
129L32.3Very low35.3Very low177 Ų177150.4 Ų150.493%0.92782%0.824SS**SBendtrans-131.943.4174.9-136.574.2000113.7
130I36.6Very low35.2Very low164 Ų164153.7 Ų153.784%0.84184%0.84SS**  trans-126.673.1167.1-53175.8000107.1
131L33.8Very low34.8Very low166 Ų166157.7 Ų157.787%0.86985%0.848SS**  trans-167.244171.5-123.6150.1000113.6
132L31.9Very low34.4Very low183 Ų183161.2 Ų161.296%0.95886%0.856SS**SBendtrans-151.951.9164.1-92.3179.4000109.6
133D29.9Very low34.4Very low148 Ų148160.9 Ų160.979%0.79185%0.854SS**SBendtrans-142.8138.6159.6-17030.2000105.9
134Q35.2Very low34.4Very low172 Ų172156.2 Ų156.280%0.80484%0.841SS**  trans89.288.9-169.3-50.2175.612.400116
135T35.4Very low34.3Very low154 Ų154153.6 Ų153.695%0.94584%0.835SS**  180110.1122.732.70000108.8
136G30.8Very low34.8Very low85 Ų85152.7 Ų152.788%0.87683%0.83SS**  trans170.246.1176.500000112.3
137N29.5Very low35.2Very low136 Ų136156.6 Ų156.673%0.72783%0.829SS**  trans-102106.2175.6-172.230.3000108.4
138E37.8Very low35Very low189 Ų189152.6 Ų152.688%0.88382%0.82SS**  trans-145.5101.8153.1-75.4-159.912700110.1
139N31.4Very low35.4Very low135 Ų135150.3 Ų150.372%0.72281%0.812SS**  trans-6.5118.8154.6-48.1-52.2000118.3
140I37.8Very low36.1Very low177 Ų177148.9 Ų148.991%0.90880%0.8SS**  trans-134.9119.9138.3-60.5-177000107.7
141E32.9Very low36.6Very low180 Ų180147.2 Ų147.284%0.84179%0.789SS**  trans-92.3125.7-172-178.4177.9137.700110.3
142E32Very low36.9Very low201 Ų201143.5 Ų143.594%0.93978%0.776SS**  trans-164103.7143.8-115.9-173.8100.300110.4
143Q35.3Very low37.5Very low177 Ų177139.5 Ų139.583%0.82776%0.755SS**  trans-87.4176.9164.3-104.8-171.7-1400109.2
144P37.8Very low38.5Very low97 Ų97138.8 Ų138.863%0.6375%0.747SS**  cis-141.5167.9-27.234.5-15.7000113
145S34.3Very low39.1Very low101 Ų101135.5 Ų135.571%0.70673%0.734SS**  trans-142.846.6154.962.20000112.5Q147S145-Q147 VanDerWaalsContact C-N 3.25Å; S145-Q147 PolarHBondContact O-N 3.49Å
146L44.1Very low39.5Very low152 Ų152132.9 Ų132.980%0.79672%0.721SS**THydrogen-bonded Turntrans-80.3-2.9172-145.973.8000113.2
147Q42.5Very low40.4Very low154 Ų154134.8 Ų134.872%0.7271%0.707SS**THydrogen-bonded Turntrans-84.5-21.4175.6-100.8168.5-39.300114.1S145 V149S145-Q147 VanDerWaalsContact C-N 3.25Å; S145-Q147 PolarHBondContact O-N 3.49Å; Q147-V149 VanDerWaalsContact C-N 3.33Å; Q147-V149 PolarHBondContact O-N 3.44Å
148C37.2Very low41.2Very low98 Ų98135 Ų13566%0.66271%0.709SS**Hα-helixtrans-74.9-17.3-176.8-104.80000114.5
149V45.1Very low41.4Very low111 Ų111136.8 Ų136.867%0.67371%0.707SS**Hα-helixtrans-87.9-25.8-174.8-177.80000112.2Q147Q147-V149 VanDerWaalsContact C-N 3.33Å; Q147-V149 PolarHBondContact O-N 3.44Å
150Q47.4Very low41.7Very low146 Ų146133.7 Ų133.768%0.68271%0.707SS**Hα-helixtrans-84.9-30.8180-76.7175.4-43.300113.1D153Q150-D153 PolarHBondContact O-N 3.3Å
151E45.7Very low41.6Very low129 Ų129136 Ų13660%0.60370%0.704SS**Hα-helixtrans-73.7-30.7-179.3-127.1165148.900112.8D153 I155E151-D153 VanDerWaalsContact C-N 3.35Å; E151-I155 WeakPolarHBondContact O-CD1 3.23Å; E151-I155 VanDerWaalsContact O-CG1 3.27Å; E151-I155 WeakPolarHBondContact O-CG1 3.25Å; E151-I155 PolarHBondContact O-N 3.45Å
152C40Very low41.6Very low88 Ų88130.6 Ų130.660%0.59570%0.697SS**Hα-helixtrans-71.7-26.5174.7-82.30000113.6C156C152-C156 PolarHBondContact O-N 3.33Å
153D44.4Very low41.8Very low100 Ų100127.7 Ų127.754%0.53569%0.693SS.*Hα-helixtrans-79.9-31-178.5-130.8-1.3000111.8Q150 E151 Q157Q150-D153 PolarHBondContact O-N 3.3Å; E151-D153 VanDerWaalsContact C-N 3.35Å; D153-Q157 WeakPolarHBondContact O-CB 3.4Å; D153-Q157 VanDerWaalsContact O-CG 3.23Å; D153-Q157 WeakPolarHBondContact O-CG 3.37Å; D153-Q157 PolarHBondContact O-N 3.43Å
154Q50.9Low41.6Very low132 Ų132125 Ų12562%0.61769%0.694SS**Hα-helixtrans-73.7-38.7173.9-89.1166.2-13.900112.9C156 Q157 D158Q154-C156 VanDerWaalsContact C-N 3.3Å; Q154-C156 PolarHBondContact O-N 3.49Å; Q154-Q157 PolarHBondContact O-N 2.87Å; Q154-D158 PolarHBondContact O-N 3.26Å; Q154-D158 VanDerWaalsContact O-N 3.13Å
155I49.1Very low41.4Very low103 Ų103129.3 Ų129.353%0.52870%0.702SS.*Hα-helixtrans-69.2-28.6179.9-64.6167.3000112E151E151-I155 WeakPolarHBondContact O-CD1 3.23Å; E151-I155 VanDerWaalsContact O-CG1 3.27Å; E151-I155 WeakPolarHBondContact O-CG1 3.25Å; E151-I155 PolarHBondContact O-N 3.45Å
156C44.5Very low41.4Very low100 Ų100129.1 Ų129.168%0.67670%0.701SS**Hα-helixtrans-82.8-24.6174.1-83.60000113.6C152 Q154C152-C156 PolarHBondContact O-N 3.33Å; Q154-C156 VanDerWaalsContact C-N 3.3Å; Q154-C156 PolarHBondContact O-N 3.49Å
157Q48.2Very low40.8Very low124 Ų124130.3 Ų130.358%0.57970%0.703SS**Hα-helixtrans-80.3-32.8177.2-75.2178.13000113.1D153 Q154 R159 G160D153-Q157 WeakPolarHBondContact O-CB 3.4Å; D153-Q157 VanDerWaalsContact O-CG 3.23Å; D153-Q157 WeakPolarHBondContact O-CG 3.37Å; D153-Q157 PolarHBondContact O-N 3.43Å; Q154-Q157 PolarHBondContact O-N 2.87Å; Q157-R159 VanDerWaalsContact C-N 3.34Å; Q157-R159 PolarHBondContact O-N 3.37Å; Q157-G160 PolarHBondContact O-N 2.96Å
158D45.8Very low40.2Very low142 Ų142132 Ų13276%0.75971%0.708SS**G310 helixtrans-75.4-17.2179.6-94.6-19000114.5Q154 G160Q154-D158 PolarHBondContact O-N 3.26Å; Q154-D158 VanDerWaalsContact O-N 3.13Å; D158-G160 VanDerWaalsContact C-N 3.34Å
159R42.9Very low40Very low226 Ų226133.1 Ų133.185%0.85371%0.712SS**G310 helixtrans-84-6.4173.1-76.6-174.5-179.8169.81.9114.2Q157Q157-R159 VanDerWaalsContact C-N 3.34Å; Q157-R159 PolarHBondContact O-N 3.37Å
160G38.8Very low39.3Very low70 Ų70134.8 Ų134.872%0.72272%0.717SS**G310 helixtrans-106.74.1-176.900000115.4Q157 D158Q157-G160 PolarHBondContact O-N 2.96Å; D158-G160 VanDerWaalsContact C-N 3.34Å
161R33.6Very low38.6Very low225 Ų225133.2 Ų133.285%0.84972%0.717SS**  trans-140.369.1-169.2-162.6177.5-74.5-154.9-0.3112.3
162G34.2Very low38Very low66 Ų66132.8 Ų132.868%0.6872%0.724SS**  trans-137.279.8175.300000112
163T36.2Very low37.6Very low141 Ų141136 Ų13687%0.86574%0.735SS**  trans56.6101148.357.80000120.3
164S30.2Very low37Very low120 Ų120138.8 Ų138.884%0.83975%0.75SS**  trans-64.4120.7145161.90000110.9
165K35.3Very low36.2Very low187 Ų187137 Ų13781%0.81375%0.75SS**  trans-176.8128.4140.5-110.6174.5-179.8178.80110.7
166S32.6Very low35.5Very low97 Ų97140.1 Ų140.168%0.67877%0.768SS**  trans35.4117.5146.258.40000118.6
167E33.3Very low34.8Very low177 Ų177139 Ų13983%0.82777%0.772SS**  171.1137.3102.9-153.4110.4133.200109.1
168F28Very low33.9Very low190 Ų190139.2 Ų139.283%0.83379%0.786SS**  trans-73.8126168.9174.2-89.7000109
169T33.9Very low33.1Very low121 Ų121141.2 Ų141.274%0.74279%0.791SS**  trans175.6122.5138.634.60000112.8
170D31.4Very low32.9Very low147 Ų147136.2 Ų136.279%0.78679%0.788SS**  trans44.7112.2134.7-112.2-6000123.3
171V31.1Very low32.7Very low112 Ų112141.2 Ų141.268%0.67979%0.792SS**  46.1108.4119.9-178.40000119
172T33.8Very low32.5Very low121 Ų121135.8 Ų135.874%0.74279%0.789SS**  169.5130.2110.532.50000112.8
173D32.1Very low32.7Very low155 Ų155139.8 Ų139.883%0.82979%0.793SS**  trans40.3112.3139.9-58.3-30.8000121.6
174N32.4Very low32.7Very low158 Ų158137 Ų13785%0.84578%0.779SS**  -155.7134.1127.4-155.919000110.5
175P33.4Very low32.9Very low95 Ų95137.6 Ų137.662%0.61777%0.769SS**  trans-87.3154.6-176.126.8-12000111.3
176N33.9Very low32.9Very low169 Ų169132.6 Ų132.690%0.90475%0.751SS**  trans130111.5162.2-65.6-32.3000111.8
177G29.7Very low33.4Very low75 Ų75132.5 Ų132.577%0.77375%0.748SS**SBendtrans133.388.9151.900000116.4
178C29.1Very low33.9Very low129 Ų129131.1 Ų131.187%0.87274%0.736SS**  trans59.489.9152.1-59.50000118.1
179E29.2Very low34.6Very low185 Ų185127.4 Ų127.486%0.86473%0.725SS**  trans-57.6129.3157.4-87.2-170.498.200111.2
180P39.7Very low35.1Very low120 Ų120126.4 Ų126.478%0.77972%0.715SS**  trans-79.8117.215610.36.8000108S182P180-S182 PolarHBondContact O-N 3.3Å
181H33.3Very low35.9Very low175 Ų175125.7 Ų125.781%0.8171%0.706SS**  trans-39.8125170.1-85.5-91.6000111.5I183H181-I183 PolarHBondContact O-N 2.96Å
182S30.2Very low36.4Very low112 Ų112126.4 Ų126.478%0.78370%0.701SS**  trans-43.2103.9174.845.20000111.7P180 S184P180-S182 PolarHBondContact O-N 3.3Å; S182-S184 PolarHBondContact O-N 3.18Å
183I37.2Very low36.8Very low149 Ų149129.6 Ų129.676%0.76470%0.699SS**  trans-61.1111.3154.3-62.8174.2000103.5H181 E185H181-I183 PolarHBondContact O-N 2.96Å; I183-E185 PolarHBondContact O-N 2.93Å
184S36.6Very low37.4Very low83 Ų83129.6 Ų129.658%0.5869%0.692SS**  trans-55.987.2167.5167.70000106.7S182 N186S182-S184 PolarHBondContact O-N 3.18Å; S184-N186 PolarHBondContact O-N 3.43Å; S184-N186 VanDerWaalsContact O-N 3.13Å
185E34.2Very low38Very low133 Ų133129.1 Ų129.162%0.62168%0.682SS**  trans-53.4123.6170.7-73.8-171.8143.400106I183 P187I183-E185 PolarHBondContact O-N 2.93Å; E185-P187 WeakPolarHBondContact O-CD 3.44Å
186N36.2Very low38.5Very low81 Ų81128.7 Ų128.743%0.43368%0.675SS.*  trans-59.2126.6179.5-172.64.7000106.8S184 Y188 D189S184-N186 PolarHBondContact O-N 3.43Å; S184-N186 VanDerWaalsContact O-N 3.13Å; N186-Y188 PolarHBondContact O-N 3.42Å; N186-Y188 WeakPolarHBondContact OD1-CD2 3.28Å; N186-D189 PolarHBondContact O-N 3.46Å
187P42.1Very low39.1Very low95 Ų95127.9 Ų127.962%0.61767%0.67SS**THydrogen-bonded Turntrans-55.8-6.2-177.214.3-27.7000115.1E185E185-P187 WeakPolarHBondContact O-CD 3.44Å
188Y44.1Very low39.8Very low149 Ų149128.4 Ų128.458%0.58466%0.662SS**THydrogen-bonded Turntrans-91.9-18.6175.5-53.6-65.4000115.4N186 L190 E191N186-Y188 PolarHBondContact O-N 3.42Å; N186-Y188 WeakPolarHBondContact OD1-CD2 3.28Å; Y188-L190 VanDerWaalsContact C-N 3.28Å; Y188-E191 PolarHBondContact O-N 2.94Å
189D42.9Very low40.7Very low112 Ų112130.9 Ų130.960%0.59966%0.66SS**Hα-helixtrans-72.9-25.4173.4-88.8-33.3000111.8N186 E191 F192 R193N186-D189 PolarHBondContact O-N 3.46Å; D189-E191 VanDerWaalsContact C-N 3.28Å; D189-E191 PolarHBondContact O-N 2.74Å; D189-F192 PolarHBondContact O-N 3.39Å; D189-R193 PolarHBondContact O-N 3.27Å
190L45.1Very low41.6Very low100 Ų100127.4 Ų127.452%0.52465%0.652SS.*Hα-helixtrans-67.9-28.3176.4-133.488.5000112.6Y188 K194Y188-L190 VanDerWaalsContact C-N 3.28Å; L190-K194 PolarHBondContact O-N 3.24Å
191E47Very low41.9Very low131 Ų131128.5 Ų128.561%0.61265%0.651SS**Hα-helixtrans-76.9-34.9-178.2-150.9168.2-165.100111.1Y188 D189 R193 K194 F195Y188-E191 PolarHBondContact O-N 2.94Å; D189-E191 VanDerWaalsContact C-N 3.28Å; D189-E191 PolarHBondContact O-N 2.74Å; E191-R193 VanDerWaalsContact C-N 3.32Å; E191-R193 PolarHBondContact O-N 3.42Å; E191-K194 PolarHBondContact O-N 3.43Å; E191-F195 PolarHBondContact O-N 3.49Å
192F41.7Very low42.6Very low128 Ų128124.6 Ų124.656%0.56165%0.649SS**Hα-helixtrans-69.2-28.9175.2-144.9-94.1000112.9D189 N196D189-F192 PolarHBondContact O-N 3.39Å; F192-N196 PolarHBondContact O-ND2 3.11Å; F192-N196 VanDerWaalsContact O-ND2 3.11Å
193R41.9Very low43.5Very low188 Ų188126.5 Ų126.571%0.70965%0.65SS**Hα-helixtrans-80.2-31.9177.8-153.1172.5-179.9173.7-1.4112.5D189 E191D189-R193 PolarHBondContact O-N 3.27Å; E191-R193 VanDerWaalsContact C-N 3.32Å; E191-R193 PolarHBondContact O-N 3.42Å
194K46.1Very low44.2Very low155 Ų155124.9 Ų124.967%0.67464%0.643SS**Hα-helixtrans-68.8-31.7175.8-80.8-179178.4178.50113.4L190 E191 L197L190-K194 PolarHBondContact O-N 3.24Å; E191-K194 PolarHBondContact O-N 3.43Å; K194-L197 PolarHBondContact O-N 3.13Å
195F44Very low45.1Very low147 Ų147130.7 Ų130.765%0.64566%0.658SS**Hα-helixtrans-76.8-22.7178.7-116.2-87.7000114.3E191 L197 S198 L222E191-F195 PolarHBondContact O-N 3.49Å; F195-L197 VanDerWaalsContact C-N 3.34Å; F195-S198 PolarHBondContact O-OG 3.33Å; F195-L222 HydrophobicContact CD1-CD2 4.27Å; F195-L222 HydrophobicContact CE1-CD2 3.72Å; F195-L222 HydrophobicContact CZ-CD2 3.92Å
196N44.9Very low46.2Very low87 Ų87131.2 Ų131.247%0.46567%0.665SS.*THydrogen-bonded Turntrans-88.3-0.1173.4-70.3-57.3000113.1F192 S198F192-N196 PolarHBondContact O-ND2 3.11Å; F192-N196 VanDerWaalsContact O-ND2 3.11Å; N196-S198 VanDerWaalsContact C-N 3.31Å; N196-S198 PolarHBondContact O-N 3.36Å
197L46.5Very low47.1Very low151 Ų151132.5 Ų132.579%0.79167%0.667SS**SBendtrans-98.234.7177.4-127.281.9000112.6K194 F195K194-L197 PolarHBondContact O-N 3.13Å; F195-L197 VanDerWaalsContact C-N 3.34Å
198S43.8Very low48.2Very low87 Ų87131.5 Ų131.561%0.60866%0.661SS**  trans-133.35016948.80000109.4F195 N196 V200F195-S198 PolarHBondContact O-OG 3.33Å; N196-S198 VanDerWaalsContact C-N 3.31Å; N196-S198 PolarHBondContact O-N 3.36Å; S198-V200 VanDerWaalsContact C-N 3.34Å; S198-V200 PolarHBondContact O-N 3.44Å
199E48.9Very low49.1Very low180 Ų180131.5 Ų131.584%0.84167%0.666SS**  trans-79.894.8160.9-159.2160.2-175.800106.6D201E199-D201 PolarHBondContact O-N 3.24Å
200V47.6Very low50.1Low113 Ų113129.4 Ų129.469%0.68566%0.664SS**  trans-49.6128.4168173.30000108.3S198 A202S198-V200 VanDerWaalsContact C-N 3.34Å; S198-V200 PolarHBondContact O-N 3.44Å; V200-A202 PolarHBondContact O-N 3.1Å
201D45.6Very low50.8Low143 Ų143127.8 Ų127.877%0.76566%0.659SS**  trans-42.4102.3171.6-102.1-46.1000110.8E199 N203E199-D201 PolarHBondContact O-N 3.24Å; D201-N203 PolarHBondContact O-N 3.04Å
202A49Very low51.7Low93 Ų93125 Ų12577%0.76965%0.65SS**THydrogen-bonded Turntrans-79.537.3-176.900000113V200V200-A202 PolarHBondContact O-N 3.1Å
203N49Very low53Low151 Ų151122.6 Ų122.681%0.80764%0.643SS**THydrogen-bonded Turntrans-103.47.5177.7-90.7-28000114.4D201D201-N203 PolarHBondContact O-N 3.04Å
204D50.8Low54.3Low116 Ų116118.6 Ų118.662%0.6263%0.633SS**  trans-100.8118173.2-162.418.6000111.4D206D204-D206 VanDerWaalsContact C-N 3.26Å; D204-D206 PolarHBondContact O-N 3.34Å
205K56.3Low55.5Low204 Ų204116.6 Ų116.689%0.88763%0.629SS**THydrogen-bonded Turntrans-81.92.9-172.7-72.9-171.8177.7179.50114.1
206D57.6Low56.7Low144 Ų144116.6 Ų116.677%0.7763%0.629SS**THydrogen-bonded Turntrans-115.125-179.9-77.5-48.8000113.6D204 P208D204-D206 VanDerWaalsContact C-N 3.26Å; D204-D206 PolarHBondContact O-N 3.34Å; D206-P208 WeakPolarHBondContact O-CD 3.37Å
207F54.1Low58Low108 Ų108120.6 Ų120.647%0.47464%0.637SS.*  trans-72122.8176.6-163.9-101.7000111.5Q209 V211 V212F207-Q209 PolarHBondContact O-N 3.47Å; F207-Q209 VanDerWaalsContact O-N 3.16Å; F207-V211 HydrophobicContact CE1-CB 3.65Å; F207-V211 HydrophobicContact CE1-CG1 3.84Å; F207-V211 HydrophobicContact CE2-CG1 4.28Å; F207-V211 HydrophobicContact CZ-CB 3.66Å; F207-V211 HydrophobicContact CZ-CG1 3.37Å; F207-V212 HydrophobicContact CD1-CG2 3.35Å; F207-V212 HydrophobicContact CE1-CB 4.41Å; F207-V212 HydrophobicContact CE1-CG2 3.38Å
208P65.5Low59.2Low75 Ų75117.6 Ų117.649%0.48762%0.622SS.*  trans-63.6120.6-178.5-18.730000110.9D206 A210 V211D206-P208 WeakPolarHBondContact O-CD 3.37Å; P208-A210 PolarHBondContact O-N 3.23Å; P208-V211 HydrophobicContact CB-CG2 4.15Å; P208-V211 HydrophobicContact CG-CG2 4.36Å; P208-V211 PolarHBondContact O-N 3.17Å
209Q63.8Low60.6Low149 Ų149119.3 Ų119.370%0.69662%0.619SS**Hα-helixtrans-48-34.7177.5-156.398.311.300112.6F207 V211 V212 D213F207-Q209 PolarHBondContact O-N 3.47Å; F207-Q209 VanDerWaalsContact O-N 3.16Å; Q209-V211 VanDerWaalsContact C-N 3.3Å; Q209-V211 PolarHBondContact O-N 3.18Å; Q209-V212 WeakPolarHBondContact O-CB 3.48Å; Q209-V212 PolarHBondContact O-N 2.9Å; Q209-D213 PolarHBondContact O-N 3.29Å
210A62.3Low62Low68 Ų68117.5 Ų117.556%0.56261%0.608SS**Hα-helixtrans-59.1-35.6177.200000113.8P208 E214P208-A210 PolarHBondContact O-N 3.23Å; A210-E214 WeakPolarHBondContact O-CB 3.34Å; A210-E214 PolarHBondContact O-N 3.13Å
211V61.3Low63.5Low66 Ų66116 Ų11640%0.460%0.603SS.*Hα-helixtrans-74.5-34.5178.8-1760000110.5F207 P208 Q209 N215F207-V211 HydrophobicContact CE1-CB 3.65Å; F207-V211 HydrophobicContact CE1-CG1 3.84Å; F207-V211 HydrophobicContact CE2-CG1 4.28Å; F207-V211 HydrophobicContact CZ-CB 3.66Å; F207-V211 HydrophobicContact CZ-CG1 3.37Å; P208-V211 HydrophobicContact CB-CG2 4.15Å; P208-V211 HydrophobicContact CG-CG2 4.36Å; P208-V211 PolarHBondContact O-N 3.17Å; Q209-V211 VanDerWaalsContact C-N 3.3Å; Q209-V211 PolarHBondContact O-N 3.18Å; V211-N215 VanDerWaalsContact O-CB 3.31Å; V211-N215 WeakPolarHBondContact O-CB 3.45Å; V211-N215 PolarHBondContact O-N 3.47Å
212V66.1Low65.2Low71 Ų71112.4 Ų112.443%0.4358%0.583SS.*Hα-helixtrans-64-47.1172.9-173.80000110.2F207 Q209 N215 K216F207-V212 HydrophobicContact CD1-CG2 3.35Å; F207-V212 HydrophobicContact CE1-CB 4.41Å; F207-V212 HydrophobicContact CE1-CG2 3.38Å; Q209-V212 WeakPolarHBondContact O-CB 3.48Å; Q209-V212 PolarHBondContact O-N 2.9Å; V212-N215 PolarHBondContact O-N 3.1Å; V212-K216 VanDerWaalsContact O-CB 3.3Å; V212-K216 WeakPolarHBondContact O-CB 3.47Å; V212-K216 PolarHBondContact O-N 3.38Å
213D67.7Low66.6Low79 Ų79111.3 Ų111.342%0.42257%0.567SS.*Hα-helixtrans-66-38.7-178.9-73.1-30.3000111.9Q209 K216 R217Q209-D213 PolarHBondContact O-N 3.29Å; D213-K216 PolarHBondContact O-N 3.44Å; D213-R217 WeakPolarHBondContact O-CG 3.41Å; D213-R217 PolarHBondContact O-N 3.13Å
214E70.4Confident68.1Low104 Ų104108 Ų10849%0.48655%0.547SS..Hα-helixtrans-64.6-46.7173.7-163.7-175.4146.300111.9A210 K216 R217 N218A210-E214 WeakPolarHBondContact O-CB 3.34Å; A210-E214 PolarHBondContact O-N 3.13Å; E214-K216 VanDerWaalsContact C-N 3.28Å; E214-K216 PolarHBondContact O-N 2.93Å; E214-R217 PolarHBondContact O-N 2.86Å; E214-N218 WeakPolarHBondContact O-CB 3.37Å; E214-N218 VanDerWaalsContact O-CG 3.26Å; E214-N218 PolarHBondContact O-N 2.96Å; E214-N218 PolarHBondContact O-ND2 3.49Å
215N69.7Low69.5Low112 Ų112107.1 Ų107.160%0.59954%0.539SS*.Hα-helixtrans-64.1-35.5178.3-155.18.2000111.6V211 V212 N218 K219V211-N215 VanDerWaalsContact O-CB 3.31Å; V211-N215 WeakPolarHBondContact O-CB 3.45Å; V211-N215 PolarHBondContact O-N 3.47Å; V212-N215 PolarHBondContact O-N 3.1Å; N215-N218 PolarHBondContact O-N 3.22Å; N215-K219 VanDerWaalsContact O-CB 3.28Å; N215-K219 WeakPolarHBondContact O-CB 3.47Å; N215-K219 PolarHBondContact O-N 3.37Å
216K69.4Low70.9Confident148 Ų148100.6 Ų100.664%0.64351%0.513SS*.Hα-helixtrans-66.6-41.5174.3-167.7176.1-179.1179.60112.3V212 D213 E214 F220V212-K216 VanDerWaalsContact O-CB 3.3Å; V212-K216 WeakPolarHBondContact O-CB 3.47Å; V212-K216 PolarHBondContact O-N 3.38Å; D213-K216 PolarHBondContact O-N 3.44Å; E214-K216 VanDerWaalsContact C-N 3.28Å; E214-K216 PolarHBondContact O-N 2.93Å; K216-F220 PolarHBondContact O-N 3.33Å
217R71.9Confident72.1Confident170 Ų170100.6 Ų100.664%0.64250%0.502SS*.Hα-helixtrans-64.7-44.1174.1-74.6-172.9-61.8-152.41.5111.8D213 E214 F220 S221D213-R217 WeakPolarHBondContact O-CG 3.41Å; D213-R217 PolarHBondContact O-N 3.13Å; E214-R217 PolarHBondContact O-N 2.86Å; R217-F220 PolarHBondContact O-N 2.91Å; R217-S221 PolarHBondContact O-N 2.99Å
218N72.2Confident73.3Confident88 Ų88102.4 Ų102.447%0.47151%0.507SS..Hα-helixtrans-64.5-41.1177.6-67.9-16.8000111.4E214 N215 F220 S221 L222E214-N218 WeakPolarHBondContact O-CB 3.37Å; E214-N218 VanDerWaalsContact O-CG 3.26Å; E214-N218 PolarHBondContact O-N 2.96Å; E214-N218 PolarHBondContact O-ND2 3.49Å; N215-N218 PolarHBondContact O-N 3.22Å; N218-F220 VanDerWaalsContact C-N 3.34Å; N218-F220 PolarHBondContact O-N 3.12Å; N218-S221 PolarHBondContact O-N 2.97Å; N218-L222 VanDerWaalsContact O-CB 3.29Å; N218-L222 WeakPolarHBondContact O-CB 3.3Å; N218-L222 PolarHBondContact O-N 3.34Å
219K73.7Confident74.2Confident123 Ų123103 Ų10354%0.53550%0.503SS..Hα-helixtrans-61.5-41.1173.7-173.3172.8-175.2168.90112N215 T223N215-K219 VanDerWaalsContact O-CB 3.28Å; N215-K219 WeakPolarHBondContact O-CB 3.47Å; N215-K219 PolarHBondContact O-N 3.37Å; K219-T223 WeakPolarHBondContact O-CB 3.12Å; K219-T223 PolarHBondContact O-N 3.29Å; K219-T223 PolarHBondContact O-OG1 3.36Å
220F79.1Confident74.9Confident142 Ų14298.3 Ų98.362%0.62349%0.485SS*.Hα-helixtrans-64.3-49.2176.3-172.9-98.8000111.4K216 R217 N218 L222 T223 E224K216-F220 PolarHBondContact O-N 3.33Å; R217-F220 PolarHBondContact O-N 2.91Å; N218-F220 VanDerWaalsContact C-N 3.34Å; N218-F220 PolarHBondContact O-N 3.12Å; F220-L222 VanDerWaalsContact C-N 3.33Å; F220-L222 PolarHBondContact O-N 3.34Å; F220-T223 PolarHBondContact O-N 3.32Å; F220-E224 HydrophobicContact CE1-CG 4.14Å; F220-E224 HydrophobicContact CZ-CG 4.28Å; F220-E224 PolarHBondContact O-N 2.92Å; F220-E224 VanDerWaalsContact O-N 3.08Å
221S78.2Confident75.7Confident81 Ų8197 Ų9757%0.56647%0.47SS*.Hα-helixtrans-60-41.1177.2-170.70000112.6R217 N218 E225R217-S221 PolarHBondContact O-N 2.99Å; N218-S221 PolarHBondContact O-N 2.97Å; S221-E225 PolarHBondContact O-N 3.1Å; S221-E225 VanDerWaalsContact O-N 3.09Å
222L81.9Confident76.8Confident68 Ų6898.5 Ų98.536%0.35647%0.471SS..Hα-helixtrans-67.6-38.3177.1-178.163.6000111.7F195 N218 F220 E224 E225 I226F195-L222 HydrophobicContact CD1-CD2 4.27Å; F195-L222 HydrophobicContact CE1-CD2 3.72Å; F195-L222 HydrophobicContact CZ-CD2 3.92Å; N218-L222 VanDerWaalsContact O-CB 3.29Å; N218-L222 WeakPolarHBondContact O-CB 3.3Å; N218-L222 PolarHBondContact O-N 3.34Å; F220-L222 VanDerWaalsContact C-N 3.33Å; F220-L222 PolarHBondContact O-N 3.34Å; L222-E224 VanDerWaalsContact C-N 3.35Å; L222-E225 PolarHBondContact O-N 2.87Å; L222-I226 HydrophobicContact CD1-CD1 4.12Å; L222-I226 HydrophobicContact CD1-CG1 4.29Å; L222-I226 HydrophobicContact CD2-CD1 4.43Å; L222-I226 HydrophobicContact CG-CD1 3.8Å; L222-I226 HydrophobicContact CG-CG1 4.38Å; L222-I226 WeakPolarHBondContact O-CB 3.34Å; L222-I226 WeakPolarHBondContact O-CG1 3.27Å; L222-I226 PolarHBondContact O-N 3.39Å
223T78.2Confident77.4Confident70 Ų70100 Ų10043%0.42947%0.472SS..Hα-helixtrans-64.1-41.4178.1-580000111.3K219 F220 R227K219-T223 WeakPolarHBondContact O-CB 3.12Å; K219-T223 PolarHBondContact O-N 3.29Å; K219-T223 PolarHBondContact O-OG1 3.36Å; F220-T223 PolarHBondContact O-N 3.32Å; T223-R227 VanDerWaalsContact O-CB 3.29Å; T223-R227 WeakPolarHBondContact O-CB 3.32Å; T223-R227 PolarHBondContact O-N 3.11Å
224E80.3Confident78Confident82 Ų82103 Ų10338%0.38348%0.477SS..Hα-helixtrans-66.2-43.2175.9-72.1-64.1121.600111.9F220 L222 R227 Y228F220-E224 HydrophobicContact CE1-CG 4.14Å; F220-E224 HydrophobicContact CZ-CG 4.28Å; F220-E224 PolarHBondContact O-N 2.92Å; F220-E224 VanDerWaalsContact O-N 3.08Å; L222-E224 VanDerWaalsContact C-N 3.35Å; E224-R227 WeakPolarHBondContact O-CB 3.42Å; E224-R227 PolarHBondContact O-N 3.45Å; E224-R227 IonicContact OE1-NH1 3.96Å; E224-Y228 PolarHBondContact O-N 3.1Å
225E80.3Confident78.5Confident97 Ų97101.9 Ų101.945%0.45347%0.472SS..Hα-helixtrans-62.4-45.2175.5-178.259.4-152.300111.7S221 L222 R227 Y228 Q229S221-E225 PolarHBondContact O-N 3.1Å; S221-E225 VanDerWaalsContact O-N 3.09Å; L222-E225 PolarHBondContact O-N 2.87Å; E225-R227 VanDerWaalsContact C-N 3.3Å; E225-R227 PolarHBondContact O-N 3.15Å; E225-Y228 PolarHBondContact O-N 2.68Å; E225-Q229 WeakPolarHBondContact O-CG 3.46Å; E225-Q229 PolarHBondContact O-N 2.86Å; E225-Q229 PolarHBondContact OE1-NE2 3.25Å; E225-Q229 VanDerWaalsContact OE1-NE2 3.11Å
226I85.5Confident79.3Confident67 Ų67100.6 Ų100.634%0.34447%0.465SS..Hα-helixtrans-60.5-43.2174.2-70167.9000110L222 Q229 T230L222-I226 HydrophobicContact CD1-CD1 4.12Å; L222-I226 HydrophobicContact CD1-CG1 4.29Å; L222-I226 HydrophobicContact CD2-CD1 4.43Å; L222-I226 HydrophobicContact CG-CD1 3.8Å; L222-I226 HydrophobicContact CG-CG1 4.38Å; L222-I226 WeakPolarHBondContact O-CB 3.34Å; L222-I226 WeakPolarHBondContact O-CG1 3.27Å; L222-I226 PolarHBondContact O-N 3.39Å; I226-Q229 PolarHBondContact O-N 2.79Å; I226-T230 HydrophobicContact CG2-CG2 4.16Å; I226-T230 WeakPolarHBondContact O-CG2 3.47Å; I226-T230 PolarHBondContact O-N 3.3Å; I226-T230 PolarHBondContact O-OG1 2.87Å
227R81.9Confident79.9Confident144 Ų14499.2 Ų99.254%0.54346%0.461SS..Hα-helixtrans-60.3-49.5178.7-172.6-179.5-175.4-175-1.8110.7T223 E224 E225 Q229 T230 T231T223-R227 VanDerWaalsContact O-CB 3.29Å; T223-R227 WeakPolarHBondContact O-CB 3.32Å; T223-R227 PolarHBondContact O-N 3.11Å; E224-R227 WeakPolarHBondContact O-CB 3.42Å; E224-R227 PolarHBondContact O-N 3.45Å; E224-R227 IonicContact OE1-NH1 3.96Å; E225-R227 VanDerWaalsContact C-N 3.3Å; E225-R227 PolarHBondContact O-N 3.15Å; R227-Q229 PolarHBondContact O-N 3.38Å; R227-T230 PolarHBondContact O-N 3.08Å; R227-T230 VanDerWaalsContact O-N 3.12Å; R227-T230 PolarHBondContact O-OG1 2.91Å; R227-T231 PolarHBondContact O-N 3.34Å; R227-T231 PolarHBondContact O-OG1 2.86Å
228Y80.6Confident80.5Confident147 Ų14794.3 Ų94.358%0.57645%0.45SS*.Hα-helixtrans-57.8-45.1175.9179-98.9000112.1E224 E225 T230 T231 F232E224-Y228 PolarHBondContact O-N 3.1Å; E225-Y228 PolarHBondContact O-N 2.68Å; Y228-T230 VanDerWaalsContact C-N 3.32Å; Y228-T230 PolarHBondContact O-N 3.03Å; Y228-T231 WeakPolarHBondContact CA-OG1 3.26Å; Y228-T231 PolarHBondContact O-N 3.45Å; Y228-T231 PolarHBondContact O-OG1 3.42Å; Y228-F232 VanDerWaalsContact O-CB 3.3Å; Y228-F232 WeakPolarHBondContact O-CB 3.45Å; Y228-F232 PolarHBondContact O-N 3.46Å
229Q82.9Confident81.3Confident86 Ų8694.1 Ų94.140%0.40245%0.452SS..Hα-helixtrans-64.9-36.3176-71.4-163.525.300112.6E225 I226 R227 K233E225-Q229 WeakPolarHBondContact O-CG 3.46Å; E225-Q229 PolarHBondContact O-N 2.86Å; E225-Q229 PolarHBondContact OE1-NE2 3.25Å; E225-Q229 VanDerWaalsContact OE1-NE2 3.11Å; I226-Q229 PolarHBondContact O-N 2.79Å; R227-Q229 PolarHBondContact O-N 3.38Å; Q229-K233 VanDerWaalsContact O-CB 3.25Å; Q229-K233 WeakPolarHBondContact O-CB 3.35Å; Q229-K233 WeakPolarHBondContact O-CD 3.5Å; Q229-K233 WeakPolarHBondContact O-CG 3.41Å; Q229-K233 PolarHBondContact O-N 3.19Å
230T80.5Confident81.8Confident51 Ų5194.2 Ų94.231%0.31345%0.452SS..Hα-helixtrans-71.2-33.5177.268.30000112.7I226 R227 Y228 R234I226-T230 HydrophobicContact CG2-CG2 4.16Å; I226-T230 WeakPolarHBondContact O-CG2 3.47Å; I226-T230 PolarHBondContact O-N 3.3Å; I226-T230 PolarHBondContact O-OG1 2.87Å; R227-T230 PolarHBondContact O-N 3.08Å; R227-T230 VanDerWaalsContact O-N 3.12Å; R227-T230 PolarHBondContact O-OG1 2.91Å; Y228-T230 VanDerWaalsContact C-N 3.32Å; Y228-T230 PolarHBondContact O-N 3.03Å; T230-R234 VanDerWaalsContact O-CG 3.28Å; T230-R234 WeakPolarHBondContact O-CG 3.29Å; T230-R234 PolarHBondContact O-N 2.76Å; T230-R234 PolarHBondContact O-NE 3.28Å; T230-R234 PolarHBondContact OG1-NH2 2.87Å
231T79.1Confident82.1Confident42 Ų4288.1 Ų88.126%0.25843%0.426SS..Hα-helixtrans-70.2-48.4174.452.40000109.8R227 Y228 K233 R234 E235R227-T231 PolarHBondContact O-N 3.34Å; R227-T231 PolarHBondContact O-OG1 2.86Å; Y228-T231 WeakPolarHBondContact CA-OG1 3.26Å; Y228-T231 PolarHBondContact O-N 3.45Å; Y228-T231 PolarHBondContact O-OG1 3.42Å; T231-K233 VanDerWaalsContact C-N 3.32Å; T231-K233 PolarHBondContact O-N 2.89Å; T231-R234 WeakPolarHBondContact O-CA 3.31Å; T231-R234 WeakPolarHBondContact O-CB 3.44Å; T231-R234 PolarHBondContact O-N 3.24Å; T231-E235 WeakPolarHBondContact O-CG 3.46Å; T231-E235 PolarHBondContact O-N 3.29Å
232F82.4Confident82.5Confident96 Ų9686.6 Ų86.642%0.42141%0.411SS..Hα-helixtrans-58.3-41.7176.4-175.1-108.3000112.5Y228 R234 E235 L236Y228-F232 VanDerWaalsContact O-CB 3.3Å; Y228-F232 WeakPolarHBondContact O-CB 3.45Å; Y228-F232 PolarHBondContact O-N 3.46Å; F232-R234 VanDerWaalsContact C-N 3.32Å; F232-R234 PolarHBondContact O-N 2.82Å; F232-E235 PolarHBondContact O-N 2.93Å; F232-L236 HydrophobicContact CD1-CD1 3.79Å; F232-L236 HydrophobicContact CD1-CG 4.36Å; F232-L236 HydrophobicContact CE1-CD1 3.35Å; F232-L236 HydrophobicContact CE1-CG 4.03Å; F232-L236 HydrophobicContact CE2-CG 4.47Å; F232-L236 HydrophobicContact CZ-CD1 3.82Å; F232-L236 HydrophobicContact CZ-CD2 4.28Å; F232-L236 HydrophobicContact CZ-CG 4.08Å; F232-L236 WeakPolarHBondContact O-CB 3.36Å; F232-L236 WeakPolarHBondContact O-CG 3.35Å; F232-L236 PolarHBondContact O-N 3.34Å
233K79.2Confident82.9Confident103 Ų10387.8 Ų87.845%0.44842%0.421SS..Hα-helixtrans-62.9-36.7174.3-76.7170.6-175.5174.30112.3Q229 T231 Q237Q229-K233 VanDerWaalsContact O-CB 3.25Å; Q229-K233 WeakPolarHBondContact O-CB 3.35Å; Q229-K233 WeakPolarHBondContact O-CD 3.5Å; Q229-K233 WeakPolarHBondContact O-CG 3.41Å; Q229-K233 PolarHBondContact O-N 3.19Å; T231-K233 VanDerWaalsContact C-N 3.32Å; T231-K233 PolarHBondContact O-N 2.89Å; K233-Q237 VanDerWaalsContact O-CG 3.3Å; K233-Q237 WeakPolarHBondContact O-CG 3.34Å; K233-Q237 PolarHBondContact O-N 2.86Å; K233-Q237 VanDerWaalsContact O-N 3.13Å
234R80Confident83.3Confident141 Ų14187.4 Ų87.453%0.53242%0.416SS..Hα-helixtrans-69.7-43.3176.1-78.2177-95.9169.5-11.3111.4T230 T231 F232 L236 Q237 T238T230-R234 VanDerWaalsContact O-CG 3.28Å; T230-R234 WeakPolarHBondContact O-CG 3.29Å; T230-R234 PolarHBondContact O-N 2.76Å; T230-R234 PolarHBondContact O-NE 3.28Å; T230-R234 PolarHBondContact OG1-NH2 2.87Å; T231-R234 WeakPolarHBondContact O-CA 3.31Å; T231-R234 WeakPolarHBondContact O-CB 3.44Å; T231-R234 PolarHBondContact O-N 3.24Å; F232-R234 VanDerWaalsContact C-N 3.32Å; F232-R234 PolarHBondContact O-N 2.82Å; R234-L236 PolarHBondContact O-N 3.14Å; R234-Q237 WeakPolarHBondContact O-CB 3.48Å; R234-Q237 PolarHBondContact O-N 2.95Å; R234-T238 PolarHBondContact O-N 3.49Å; R234-T238 PolarHBondContact O-OG1 2.87Å
235E81.3Confident83.6Confident82 Ų8284 Ų8438%0.38340%0.401SS..Hα-helixtrans-58.8-46.3174.4-69.2163-149.700111.3T231 F232 Q237 T238 V239T231-E235 WeakPolarHBondContact O-CG 3.46Å; T231-E235 PolarHBondContact O-N 3.29Å; F232-E235 PolarHBondContact O-N 2.93Å; E235-Q237 VanDerWaalsContact C-N 3.29Å; E235-Q237 PolarHBondContact O-N 2.87Å; E235-T238 WeakPolarHBondContact O-CB 3.29Å; E235-T238 PolarHBondContact O-N 3.3Å; E235-V239 WeakPolarHBondContact O-CG2 3.35Å; E235-V239 PolarHBondContact O-N 3.44Å
236L87.1Confident83.9Confident85 Ų8582.2 Ų82.245%0.44540%0.396SS..Hα-helixtrans-62.5-33.1176.3-76.3178.6000113.4F232 R234 V239 K240F232-L236 HydrophobicContact CD1-CD1 3.79Å; F232-L236 HydrophobicContact CD1-CG 4.36Å; F232-L236 HydrophobicContact CE1-CD1 3.35Å; F232-L236 HydrophobicContact CE1-CG 4.03Å; F232-L236 HydrophobicContact CE2-CG 4.47Å; F232-L236 HydrophobicContact CZ-CD1 3.82Å; F232-L236 HydrophobicContact CZ-CD2 4.28Å; F232-L236 HydrophobicContact CZ-CG 4.08Å; F232-L236 WeakPolarHBondContact O-CB 3.36Å; F232-L236 WeakPolarHBondContact O-CG 3.35Å; F232-L236 PolarHBondContact O-N 3.34Å; R234-L236 PolarHBondContact O-N 3.14Å; L236-V239 PolarHBondContact O-N 3.08Å; L236-K240 WeakPolarHBondContact O-CB 3.42Å; L236-K240 PolarHBondContact O-N 3.1Å
237Q81.6Confident84.1Confident118 Ų11880.8 Ų80.855%0.55140%0.398SS*.Hα-helixtrans-63.6-43.5174.7-76.3172.9-2.800111.2K233 R234 E235 K240 V241K233-Q237 VanDerWaalsContact O-CG 3.3Å; K233-Q237 WeakPolarHBondContact O-CG 3.34Å; K233-Q237 PolarHBondContact O-N 2.86Å; K233-Q237 VanDerWaalsContact O-N 3.13Å; R234-Q237 WeakPolarHBondContact O-CB 3.48Å; R234-Q237 PolarHBondContact O-N 2.95Å; E235-Q237 VanDerWaalsContact C-N 3.29Å; E235-Q237 PolarHBondContact O-N 2.87Å; Q237-K240 WeakPolarHBondContact O-CB 3.47Å; Q237-K240 PolarHBondContact O-N 2.96Å; Q237-V241 WeakPolarHBondContact O-CG2 3.48Å; Q237-V241 PolarHBondContact O-N 3.12Å; Q237-V241 VanDerWaalsContact O-N 3.08Å
238T84.9Confident84.4Confident67 Ų6775.3 Ų75.341%0.41138%0.382SS..Hα-helixtrans-61.9-46.9175.3-56.10000111R234 E235 K240 V241 M242R234-T238 PolarHBondContact O-N 3.49Å; R234-T238 PolarHBondContact O-OG1 2.87Å; E235-T238 WeakPolarHBondContact O-CB 3.29Å; E235-T238 PolarHBondContact O-N 3.3Å; T238-K240 VanDerWaalsContact C-N 3.29Å; T238-K240 PolarHBondContact O-N 3.42Å; T238-V241 WeakPolarHBondContact O-CB 3.47Å; T238-V241 PolarHBondContact O-N 2.88Å; T238-V241 VanDerWaalsContact O-N 3.1Å; T238-M242 HydrophobicContact CG2-CE 4.17Å; T238-M242 WeakPolarHBondContact O-CG 3.47Å; T238-M242 PolarHBondContact O-N 2.9Å
239V88Confident84.5Confident84 Ų8470.4 Ų70.451%0.50936%0.364SS..Hα-helixtrans-58.4-42.5176.4174.60000111.2E235 L236 V241 M242 T243E235-V239 WeakPolarHBondContact O-CG2 3.35Å; E235-V239 PolarHBondContact O-N 3.44Å; L236-V239 PolarHBondContact O-N 3.08Å; V239-V241 VanDerWaalsContact C-N 3.31Å; V239-V241 PolarHBondContact O-N 2.88Å; V239-M242 WeakPolarHBondContact O-CB 3.29Å; V239-M242 PolarHBondContact O-N 2.97Å; V239-M242 VanDerWaalsContact O-N 3.15Å; V239-T243 PolarHBondContact O-N 3.43Å; V239-T243 PolarHBondContact O-OG1 2.86Å; V239-T243 VanDerWaalsContact O-OG1 3.11Å
240K85.5Confident84.8Confident126 Ų12670.6 Ų70.655%0.54837%0.367SS..Hα-helixtrans-59.1-41.9176.6-179175.5-178.4170.20112L236 Q237 T238 T243 I244L236-K240 WeakPolarHBondContact O-CB 3.42Å; L236-K240 PolarHBondContact O-N 3.1Å; Q237-K240 WeakPolarHBondContact O-CB 3.47Å; Q237-K240 PolarHBondContact O-N 2.96Å; T238-K240 VanDerWaalsContact C-N 3.29Å; T238-K240 PolarHBondContact O-N 3.42Å; K240-T243 PolarHBondContact O-N 3.46Å; K240-I244 HydrophobicContact CG-CD1 4.26Å; K240-I244 VanDerWaalsContact O-CG1 3.31Å; K240-I244 WeakPolarHBondContact O-CG1 3.3Å; K240-I244 PolarHBondContact O-N 3.23Å; K240-I244 VanDerWaalsContact O-N 3.1Å
241V84.9Confident85.2Confident13 Ų1375.4 Ų75.48%0.07938%0.384CS..Hα-helixtrans-62.8-47174.91740000110.2Q237 T238 V239 T243 I244 V245 I292 Y293 R296Q237-V241 WeakPolarHBondContact O-CG2 3.48Å; Q237-V241 PolarHBondContact O-N 3.12Å; Q237-V241 VanDerWaalsContact O-N 3.08Å; T238-V241 WeakPolarHBondContact O-CB 3.47Å; T238-V241 PolarHBondContact O-N 2.88Å; T238-V241 VanDerWaalsContact O-N 3.1Å; V239-V241 VanDerWaalsContact C-N 3.31Å; V239-V241 PolarHBondContact O-N 2.88Å; V241-T243 VanDerWaalsContact C-N 3.31Å; V241-T243 PolarHBondContact O-N 3.44Å; V241-I244 WeakPolarHBondContact O-CB 3.33Å; V241-I244 PolarHBondContact O-N 3.34Å; V241-I244 VanDerWaalsContact O-N 3.08Å; V241-V245 HydrophobicContact CG1-CG2 4.23Å; V241-V245 WeakPolarHBondContact O-CG2 3.33Å; V241-V245 PolarHBondContact O-N 2.77Å; V241-I292 HydrophobicContact CG1-CG2 3.96Å; V241-Y293 HydrophobicContact CG1-CE1 4.31Å; V241-R296 HydrophobicContact CG2-CB 4.03Å
242M87.3Confident85.5Confident49 Ų4973.7 Ų73.724%0.24137%0.373CS..Hα-helixtrans-58.3-43.5177.9-63.8-58.9167.900111.8F63 T238 V239 I244 V245 V246F63-M242 HydrophobicContact CE2-SD 4.4Å; T238-M242 HydrophobicContact CG2-CE 4.17Å; T238-M242 WeakPolarHBondContact O-CG 3.47Å; T238-M242 PolarHBondContact O-N 2.9Å; V239-M242 WeakPolarHBondContact O-CB 3.29Å; V239-M242 PolarHBondContact O-N 2.97Å; V239-M242 VanDerWaalsContact O-N 3.15Å; M242-I244 VanDerWaalsContact C-N 3.31Å; M242-I244 PolarHBondContact O-N 2.74Å; M242-V245 PolarHBondContact O-N 2.8Å; M242-V246 WeakPolarHBondContact O-CB 3.5Å; M242-V246 VanDerWaalsContact O-CG2 3.26Å; M242-V246 WeakPolarHBondContact O-CG2 3.32Å; M242-V246 PolarHBondContact O-N 2.97Å
243T88.9Confident85.5Confident94 Ų9471.8 Ų71.858%0.57737%0.365SS*.Hα-helixtrans-59.7-40.9175.6-59.60000112V239 K240 V241 G247V239-T243 PolarHBondContact O-N 3.43Å; V239-T243 PolarHBondContact O-OG1 2.86Å; V239-T243 VanDerWaalsContact O-OG1 3.11Å; K240-T243 PolarHBondContact O-N 3.46Å; V241-T243 VanDerWaalsContact C-N 3.31Å; V241-T243 PolarHBondContact O-N 3.44Å; T243-G247 PolarHBondContact O-N 3.44Å
244I87.7Confident86Confident61 Ų6171.1 Ų71.131%0.31337%0.366SS..Hα-helixtrans-66.7-45.3176.7-66.8164.9000110.8K240 V241 M242 V246 G247 C248 I292 R296K240-I244 HydrophobicContact CG-CD1 4.26Å; K240-I244 VanDerWaalsContact O-CG1 3.31Å; K240-I244 WeakPolarHBondContact O-CG1 3.3Å; K240-I244 PolarHBondContact O-N 3.23Å; K240-I244 VanDerWaalsContact O-N 3.1Å; V241-I244 WeakPolarHBondContact O-CB 3.33Å; V241-I244 PolarHBondContact O-N 3.34Å; V241-I244 VanDerWaalsContact O-N 3.08Å; M242-I244 VanDerWaalsContact C-N 3.31Å; M242-I244 PolarHBondContact O-N 2.74Å; I244-V246 PolarHBondContact O-N 3.17Å; I244-G247 PolarHBondContact O-N 2.82Å; I244-C248 VanDerWaalsContact O-CB 3.29Å; I244-C248 WeakPolarHBondContact O-CB 2.98Å; I244-C248 PolarHBondContact O-N 2.88Å; I244-I292 HydrophobicContact CG2-CD1 4.25Å; I244-I292 HydrophobicContact CG2-CG1 3.99Å; I244-I292 HydrophobicContact CG2-CG2 4.18Å; I244-R296 HydrophobicContact CD1-CG 3.86Å
245V85.8Confident86.3Confident12 Ų1266.2 Ų66.27%0.07335%0.352CS..Hα-helixtrans-59.5-47.7177.8176.40000110.5F63 V241 M242 C248 F249 I292F63-V245 HydrophobicContact CD2-CG1 4.08Å; F63-V245 HydrophobicContact CE2-CB 4.33Å; F63-V245 HydrophobicContact CE2-CG1 3.59Å; F63-V245 HydrophobicContact CZ-CG1 4.46Å; V241-V245 HydrophobicContact CG1-CG2 4.23Å; V241-V245 WeakPolarHBondContact O-CG2 3.33Å; V241-V245 PolarHBondContact O-N 2.77Å; M242-V245 PolarHBondContact O-N 2.8Å; V245-C248 PolarHBondContact O-N 3.22Å; V245-F249 VanDerWaalsContact O-CB 3.3Å; V245-F249 WeakPolarHBondContact O-CB 3.39Å; V245-F249 PolarHBondContact O-N 2.91Å; V245-I292 HydrophobicContact CB-CD1 4.4Å; V245-I292 HydrophobicContact CG2-CD1 3.87Å; V245-I292 HydrophobicContact CG2-CG2 3.86Å
246V87.9Confident86.4Confident58 Ų5864 Ų6435%0.35234%0.341SS..Hα-helixtrans-63.8-45.4177.9173.50000111.1F63 M242 I244 C248 F249 L250F63-V246 HydrophobicContact CE1-CG2 4.06Å; F63-V246 HydrophobicContact CZ-CG2 3.61Å; M242-V246 WeakPolarHBondContact O-CB 3.5Å; M242-V246 VanDerWaalsContact O-CG2 3.26Å; M242-V246 WeakPolarHBondContact O-CG2 3.32Å; M242-V246 PolarHBondContact O-N 2.97Å; I244-V246 PolarHBondContact O-N 3.17Å; V246-C248 VanDerWaalsContact C-N 3.34Å; V246-C248 PolarHBondContact O-N 3.15Å; V246-F249 WeakPolarHBondContact O-CB 3.33Å; V246-F249 PolarHBondContact O-N 3.25Å; V246-L250 HydrophobicContact CG1-CD1 4.02Å; V246-L250 HydrophobicContact CG1-CG 4.34Å; V246-L250 WeakPolarHBondContact O-CB 3Å; V246-L250 VanDerWaalsContact O-CG 3.29Å; V246-L250 WeakPolarHBondContact O-CG 3.47Å; V246-L250 PolarHBondContact O-N 3.2Å
247G89Confident86.3Confident38 Ų3863.3 Ų63.339%0.39234%0.338SS..Hα-helixtrans-61.2-42178.200000112.6T243 I244 L250 F251T243-G247 PolarHBondContact O-N 3.44Å; I244-G247 PolarHBondContact O-N 2.82Å; G247-L250 PolarHBondContact O-N 3.35Å; G247-F251 WeakPolarHBondContact O-CB 3.17Å; G247-F251 PolarHBondContact O-N 2.79Å
248C87.1Confident86.7Confident29 Ų2962.7 Ų62.720%0.19634%0.338CS..Hα-helixtrans-66.5-44.3175.8-176.70000111.8I244 V245 V246 L250 F251 C252 C288 I292I244-C248 VanDerWaalsContact O-CB 3.29Å; I244-C248 WeakPolarHBondContact O-CB 2.98Å; I244-C248 PolarHBondContact O-N 2.88Å; V245-C248 PolarHBondContact O-N 3.22Å; V246-C248 VanDerWaalsContact C-N 3.34Å; V246-C248 PolarHBondContact O-N 3.15Å; C248-L250 VanDerWaalsContact C-N 3.33Å; C248-L250 PolarHBondContact O-N 3.49Å; C248-F251 PolarHBondContact O-N 3.25Å; C248-C252 WeakPolarHBondContact O-CB 3.42Å; C248-C252 PolarHBondContact O-N 2.85Å; C248-C252 PolarHBondContact O-SG 3.49Å; C248-C252 VanDerWaalsContact O-SG 3.41Å; C248-C288 WeakPolarHBondContact SG-CB 3.25Å; C248-C288 PolarHBondContact SG-SG 3.42Å; C248-I292 HydrophobicContact CB-CD1 4.31Å
249F84Confident86.8Confident44 Ų4460.7 Ų60.719%0.19333%0.325CS..Hα-helixtrans-55.7-48.8174178.1-89000111.1F60 V245 V246 C252 F253 N285F60-F249 HydrophobicContact CD2-CZ 4.2Å; V245-F249 VanDerWaalsContact O-CB 3.3Å; V245-F249 WeakPolarHBondContact O-CB 3.39Å; V245-F249 PolarHBondContact O-N 2.91Å; V246-F249 WeakPolarHBondContact O-CB 3.33Å; V246-F249 PolarHBondContact O-N 3.25Å; F249-C252 PolarHBondContact O-N 2.82Å; F249-F253 HydrophobicContact CE1-CB 4.36Å; F249-F253 HydrophobicContact CE1-CG 4.37Å; F249-F253 WeakPolarHBondContact O-CB 3.48Å; F249-F253 PolarHBondContact O-N 3.18Å; F249-N285 VanDerWaalsContact CD2-ND2 3.25Å; F249-N285 WeakPolarHBondContact CD2-ND2 3.46Å
250L88.5Confident86.7Confident89 Ų8961.3 Ų61.347%0.46632%0.322SS..Hα-helixtrans-63.7-44.1177.7-69.6175.9000111.7V246 G247 C248 C252 F253 L254V246-L250 HydrophobicContact CG1-CD1 4.02Å; V246-L250 HydrophobicContact CG1-CG 4.34Å; V246-L250 WeakPolarHBondContact O-CB 3Å; V246-L250 VanDerWaalsContact O-CG 3.29Å; V246-L250 WeakPolarHBondContact O-CG 3.47Å; V246-L250 PolarHBondContact O-N 3.2Å; G247-L250 PolarHBondContact O-N 3.35Å; C248-L250 VanDerWaalsContact C-N 3.33Å; C248-L250 PolarHBondContact O-N 3.49Å; L250-C252 VanDerWaalsContact C-N 3.33Å; L250-C252 PolarHBondContact O-N 3.32Å; L250-F253 PolarHBondContact O-N 2.92Å; L250-L254 WeakPolarHBondContact O-CA 3.08Å; L250-L254 WeakPolarHBondContact O-CB 3.21Å; L250-L254 PolarHBondContact O-N 3.37Å
251F88.2Confident86.9Confident153 Ų15358.8 Ų58.867%0.67132%0.315SS*.Hα-helixtrans-61.6-40178.7-179.7-96.9000112.7G247 C248 P255G247-F251 WeakPolarHBondContact O-CB 3.17Å; G247-F251 PolarHBondContact O-N 2.79Å; C248-F251 PolarHBondContact O-N 3.25Å; F251-P255 WeakPolarHBondContact O-CD 3.5Å; F251-P255 WeakPolarHBondContact O-CG 3.15Å
252C85.3Confident87.1Confident6 Ų659.1 Ų59.14%0.04132%0.32CS..Hα-helixtrans-75-29.9176.5-680000112.8C248 F249 L250 L281 N285C248-C252 WeakPolarHBondContact O-CB 3.42Å; C248-C252 PolarHBondContact O-N 2.85Å; C248-C252 PolarHBondContact O-SG 3.49Å; C248-C252 VanDerWaalsContact O-SG 3.41Å; F249-C252 PolarHBondContact O-N 2.82Å; L250-C252 VanDerWaalsContact C-N 3.33Å; L250-C252 PolarHBondContact O-N 3.32Å; C252-L281 WeakPolarHBondContact CB-O 3.47Å; C252-N285 HydrophobicContact CB-CB 4.38Å
253F84.4Confident87.1Confident55 Ų5558.3 Ų58.324%0.24132%0.316CS..Hα-helixtrans-90.1-39.8-174.8-175.8-104.9000113.8L56 F249 L250 F256 L257 L282L56-F253 HydrophobicContact CD1-CE2 4.29Å; F249-F253 HydrophobicContact CE1-CB 4.36Å; F249-F253 HydrophobicContact CE1-CG 4.37Å; F249-F253 WeakPolarHBondContact O-CB 3.48Å; F249-F253 PolarHBondContact O-N 3.18Å; L250-F253 PolarHBondContact O-N 2.92Å; F253-F256 WeakPolarHBondContact O-CB 3.22Å; F253-F256 PolarHBondContact O-N 2.93Å; F253-L257 HydrophobicContact CD1-CB 4.37Å; F253-L257 HydrophobicContact CE1-CB 4.11Å; F253-L257 HydrophobicContact CE1-CD1 4.28Å; F253-L257 HydrophobicContact CE1-CD2 4.09Å; F253-L257 HydrophobicContact CE1-CG 4.39Å; F253-L257 HydrophobicContact CZ-CD1 4.47Å; F253-L257 PolarHBondContact O-N 3.43Å; F253-L282 HydrophobicContact CD2-CD1 4.43Å
254L88.3Confident87.1Confident89 Ų8958.9 Ų58.947%0.46632%0.315SS..Hα-helixtrans-55.8-46-175.6-170.9156.7000113.6L250 F256 L257 L258L250-L254 WeakPolarHBondContact O-CA 3.08Å; L250-L254 WeakPolarHBondContact O-CB 3.21Å; L250-L254 PolarHBondContact O-N 3.37Å; L254-F256 VanDerWaalsContact C-N 3.3Å; L254-F256 PolarHBondContact O-N 2.76Å; L254-L257 WeakPolarHBondContact O-CB 3.46Å; L254-L257 PolarHBondContact O-N 2.95Å; L254-L258 HydrophobicContact CD2-CD1 3.43Å; L254-L258 VanDerWaalsContact CD2-CD1 3.43Å; L254-L258 HydrophobicContact CD2-CG 3.83Å; L254-L258 WeakPolarHBondContact O-CG 3.41Å; L254-L258 PolarHBondContact O-N 3.41Å
255P86.7Confident87.2Confident38 Ų3862.8 Ų62.825%0.24734%0.335CS..Hα-helixtrans-68.3-32-178.828.7-35.4000111.9F251 V259 L278 L281F251-P255 WeakPolarHBondContact O-CD 3.5Å; F251-P255 WeakPolarHBondContact O-CG 3.15Å; P255-V259 PolarHBondContact O-N 3.35Å; P255-L278 HydrophobicContact CB-CD2 3.56Å; P255-L278 HydrophobicContact CG-CD2 4.01Å; P255-L281 HydrophobicContact CG-CD1 4.11Å
256F82.6Confident87.4Confident35 Ų3564.7 Ų64.715%0.15435%0.348CS..Hα-helixtrans-66.5-44171.2-178-97.7000111.4F253 L254 L258 V259 H260 L278F253-F256 WeakPolarHBondContact O-CB 3.22Å; F253-F256 PolarHBondContact O-N 2.93Å; L254-F256 VanDerWaalsContact C-N 3.3Å; L254-F256 PolarHBondContact O-N 2.76Å; F256-L258 PolarHBondContact O-N 3.42Å; F256-V259 PolarHBondContact O-N 3.44Å; F256-H260 PolarHBondContact O-N 2.91Å; F256-H260 VanDerWaalsContact O-N 3.07Å; F256-L278 HydrophobicContact CD2-CB 4.24Å
257L86.4Confident87.1Confident71 Ų7168.2 Ų68.237%0.37237%0.369SS..Hα-helixtrans-60.3-43.9176.8-177.567.6000111.9F253 L254 H260 L261F253-L257 HydrophobicContact CD1-CB 4.37Å; F253-L257 HydrophobicContact CE1-CB 4.11Å; F253-L257 HydrophobicContact CE1-CD1 4.28Å; F253-L257 HydrophobicContact CE1-CD2 4.09Å; F253-L257 HydrophobicContact CE1-CG 4.39Å; F253-L257 HydrophobicContact CZ-CD1 4.47Å; F253-L257 PolarHBondContact O-N 3.43Å; L254-L257 WeakPolarHBondContact O-CB 3.46Å; L254-L257 PolarHBondContact O-N 2.95Å; L257-H260 PolarHBondContact O-N 3.25Å; L257-L261 HydrophobicContact CD1-CD1 4.19Å; L257-L261 HydrophobicContact CD1-CG 4.23Å; L257-L261 HydrophobicContact CD2-CD1 4.39Å; L257-L261 HydrophobicContact CG-CD1 3.85Å; L257-L261 HydrophobicContact CG-CG 4.29Å; L257-L261 WeakPolarHBondContact O-CB 3.27Å; L257-L261 VanDerWaalsContact O-CG 3.26Å; L257-L261 WeakPolarHBondContact O-CG 3.07Å; L257-L261 PolarHBondContact O-N 2.78Å
258L90.2Very high87Confident106 Ų10669.7 Ų69.756%0.55537%0.373SS*.Hα-helixtrans-64.3-42.2-179.8-73.6-177.8000112.7L254 F256 G262L254-L258 HydrophobicContact CD2-CD1 3.43Å; L254-L258 VanDerWaalsContact CD2-CD1 3.43Å; L254-L258 HydrophobicContact CD2-CG 3.83Å; L254-L258 WeakPolarHBondContact O-CG 3.41Å; L254-L258 PolarHBondContact O-N 3.41Å; F256-L258 PolarHBondContact O-N 3.42Å; L258-G262 PolarHBondContact O-N 3.38Å
259V87.2Confident86.9Confident25 Ų2575.8 Ų75.815%0.15240%0.402CS..Hα-helixtrans-64.6-45.9177169.60000110.3P255 F256 L261 G262 E263 F270 L278P255-V259 PolarHBondContact O-N 3.35Å; F256-V259 PolarHBondContact O-N 3.44Å; V259-L261 PolarHBondContact O-N 3.05Å; V259-G262 WeakPolarHBondContact O-CA 3.49Å; V259-G262 PolarHBondContact O-N 3.13Å; V259-G262 VanDerWaalsContact O-N 3.14Å; V259-E263 WeakPolarHBondContact O-CG 3.02Å; V259-E263 PolarHBondContact O-N 2.79Å; V259-F270 HydrophobicContact CG1-CB 4.38Å; V259-F270 HydrophobicContact CG1-CD2 3.64Å; V259-F270 HydrophobicContact CG1-CE2 4.38Å; V259-F270 HydrophobicContact CG1-CG 4.38Å; V259-F270 WeakPolarHBondContact O-CE2 3.29Å; V259-L278 HydrophobicContact CB-CD1 3.78Å; V259-L278 HydrophobicContact CG1-CD1 4.08Å; V259-L278 HydrophobicContact CG2-CD1 3.42Å; V259-L278 VanDerWaalsContact CG2-CD1 3.42Å
260H84.3Confident86.9Confident96 Ų9677 Ų7744%0.44441%0.407SS..Hα-helixtrans-65.8-41.2179.4-164.458.4000112.8F256 L257 G262 E263 I264F256-H260 PolarHBondContact O-N 2.91Å; F256-H260 VanDerWaalsContact O-N 3.07Å; L257-H260 PolarHBondContact O-N 3.25Å; H260-G262 VanDerWaalsContact C-N 3.29Å; H260-G262 PolarHBondContact O-N 2.98Å; H260-E263 IonicContact ND1-OE2 3.89Å; H260-E263 PolarHBondContact O-N 2.88Å; H260-I264 VanDerWaalsContact O-CG1 3.32Å; H260-I264 WeakPolarHBondContact O-CG1 3.36Å; H260-I264 PolarHBondContact O-N 2.82Å; H260-I264 VanDerWaalsContact O-N 3.14Å
261L89.8Confident86.8Confident74 Ų7476.4 Ų76.439%0.38741%0.409SS..Hα-helixtrans-61.9-39.5172-75174.6000111.4L257 V259 I264 I265L257-L261 HydrophobicContact CD1-CD1 4.19Å; L257-L261 HydrophobicContact CD1-CG 4.23Å; L257-L261 HydrophobicContact CD2-CD1 4.39Å; L257-L261 HydrophobicContact CG-CD1 3.85Å; L257-L261 HydrophobicContact CG-CG 4.29Å; L257-L261 WeakPolarHBondContact O-CB 3.27Å; L257-L261 VanDerWaalsContact O-CG 3.26Å; L257-L261 WeakPolarHBondContact O-CG 3.07Å; L257-L261 PolarHBondContact O-N 2.78Å; V259-L261 PolarHBondContact O-N 3.05Å; L261-I264 PolarHBondContact O-N 3.12Å; L261-I265 WeakPolarHBondContact O-CB 2.95Å; L261-I265 WeakPolarHBondContact O-CD1 3.44Å; L261-I265 WeakPolarHBondContact O-CG1 3.46Å; L261-I265 PolarHBondContact O-N 3.42Å
262G89.2Confident86.5Confident19 Ų1976.5 Ų76.520%0.19641%0.412CS..Hα-helixtrans-57.3-50.3174.600000111.7L258 V259 H260 I264 I265 C266L258-G262 PolarHBondContact O-N 3.38Å; V259-G262 WeakPolarHBondContact O-CA 3.49Å; V259-G262 PolarHBondContact O-N 3.13Å; V259-G262 VanDerWaalsContact O-N 3.14Å; H260-G262 VanDerWaalsContact C-N 3.29Å; H260-G262 PolarHBondContact O-N 2.98Å; G262-I264 VanDerWaalsContact C-N 3.3Å; G262-I264 PolarHBondContact O-N 2.88Å; G262-I265 PolarHBondContact O-N 2.92Å; G262-I265 VanDerWaalsContact O-N 3.17Å; G262-C266 PolarHBondContact O-N 2.52Å; G262-C266 PolarHBondContact O-SG 3.14Å
263E88Confident86.5Confident32 Ų3282.7 Ų82.715%0.1544%0.443CS..Hα-helixtrans-59.5-39.6178.6-66-177.5148.800112.5V259 H260 T267 C268 F270 H275V259-E263 WeakPolarHBondContact O-CG 3.02Å; V259-E263 PolarHBondContact O-N 2.79Å; H260-E263 IonicContact ND1-OE2 3.89Å; H260-E263 PolarHBondContact O-N 2.88Å; E263-T267 VanDerWaalsContact O-CA 3.25Å; E263-T267 WeakPolarHBondContact O-CA 3.34Å; E263-T267 PolarHBondContact O-N 3.38Å; E263-C268 WeakPolarHBondContact CA-O 3.48Å; E263-C268 VanDerWaalsContact CB-O 3.27Å; E263-C268 WeakPolarHBondContact CB-O 3.14Å; E263-C268 WeakPolarHBondContact CG-O 3.5Å; E263-C268 PolarHBondContact O-N 3.39Å; E263-F270 HydrophobicContact CG-CD2 3.34Å; E263-F270 HydrophobicContact CG-CE2 3.82Å; E263-F270 HydrophobicContact CG-CG 4.22Å; E263-F270 PolarHBondContact OE1-N 3.48Å; E263-H275 IonicContact OE1-CE1 3.31Å; E263-H275 PolarHBondContact OE1-CE1 3.02Å; E263-H275 VanDerWaalsContact OE1-CE1 3.31Å; E263-H275 IonicContact OE1-NE2 2.8Å; E263-H275 PolarHBondContact OE1-NE2 3.15Å; E263-H275 IonicContact OE2-CE1 3.65Å; E263-H275 IonicContact OE2-NE2 3.93Å
264I88.1Confident86.4Confident107 Ų10783.7 Ų83.755%0.54945%0.45SS..Hα-helixtrans-65.9-44.1176.6-64.9164.4000110.8H260 L261 G262H260-I264 VanDerWaalsContact O-CG1 3.32Å; H260-I264 WeakPolarHBondContact O-CG1 3.36Å; H260-I264 PolarHBondContact O-N 2.82Å; H260-I264 VanDerWaalsContact O-N 3.14Å; L261-I264 PolarHBondContact O-N 3.12Å; G262-I264 VanDerWaalsContact C-N 3.3Å; G262-I264 PolarHBondContact O-N 2.88Å
265I90.9Very high86.1Confident143 Ų14381.9 Ų81.973%0.73344%0.439SS*.Hα-helixtrans-71.8-44.3-176.5-67.9164.8000111.4L261 G262L261-I265 WeakPolarHBondContact O-CB 2.95Å; L261-I265 WeakPolarHBondContact O-CD1 3.44Å; L261-I265 WeakPolarHBondContact O-CG1 3.46Å; L261-I265 PolarHBondContact O-N 3.42Å; G262-I265 PolarHBondContact O-N 2.92Å; G262-I265 VanDerWaalsContact O-N 3.17Å
266C89.4Confident85.9Confident51 Ų5183.2 Ų83.235%0.34545%0.447SS..Hα-helixtrans-86.4-11.5-177.269.30000113.3G262 C268G262-C266 PolarHBondContact O-N 2.52Å; G262-C266 PolarHBondContact O-SG 3.14Å; C266-C268 HydrophobicContact CB-CB 4.39Å; C266-C268 PolarHBondContact O-N 3.49Å; C266-C268 PolarHBondContact O-SG 3.15Å; C266-C268 WeakPolarHBondContact SG-CB 3.19Å; C266-C268 PolarHBondContact SG-N 3.17Å; C266-C268 VanDerWaalsContact SG-SG 3.62Å
267T82.3Confident86.1Confident132 Ų13284.7 Ų84.781%0.8146%0.46SS*.THydrogen-bonded Turntrans53.530.6-17059.40000112.9E263E263-T267 VanDerWaalsContact O-CA 3.25Å; E263-T267 WeakPolarHBondContact O-CA 3.34Å; E263-T267 PolarHBondContact O-N 3.38Å
268C86.7Confident86Confident69 Ų6982.1 Ų82.147%0.46645%0.446SS..  trans-112.7160.9176.7-49.70000110E263 C266E263-C268 WeakPolarHBondContact CA-O 3.48Å; E263-C268 VanDerWaalsContact CB-O 3.27Å; E263-C268 WeakPolarHBondContact CB-O 3.14Å; E263-C268 WeakPolarHBondContact CG-O 3.5Å; E263-C268 PolarHBondContact O-N 3.39Å; C266-C268 HydrophobicContact CB-CB 4.39Å; C266-C268 PolarHBondContact O-N 3.49Å; C266-C268 PolarHBondContact O-SG 3.15Å; C266-C268 WeakPolarHBondContact SG-CB 3.19Å; C266-C268 PolarHBondContact SG-N 3.17Å; C266-C268 VanDerWaalsContact SG-SG 3.62Å
269I84.4Confident85.6Confident157 Ų15779.2 Ų79.281%0.80544%0.435SS*.  trans-105.3122171.8-60.7172.5000107.2
270F84.9Confident85.4Confident70 Ų7086.1 Ų86.131%0.30746%0.458SS..  trans-73150175.6-74.7-57.7000110.8V259 E263 L274V259-F270 HydrophobicContact CG1-CB 4.38Å; V259-F270 HydrophobicContact CG1-CD2 3.64Å; V259-F270 HydrophobicContact CG1-CE2 4.38Å; V259-F270 HydrophobicContact CG1-CG 4.38Å; V259-F270 WeakPolarHBondContact O-CE2 3.29Å; E263-F270 HydrophobicContact CG-CD2 3.34Å; E263-F270 HydrophobicContact CG-CE2 3.82Å; E263-F270 HydrophobicContact CG-CG 4.22Å; E263-F270 PolarHBondContact OE1-N 3.48Å; F270-L274 HydrophobicContact CB-CD1 4.04Å; F270-L274 HydrophobicContact CD1-CD1 4.28Å; F270-L274 HydrophobicContact CG-CD1 4.26Å
271P85.7Confident85.5Confident77 Ų7784 Ų8450%0.545%0.45SS..  trans-60.9147.4-178.225.8-35.9000111.7I273 L274P271-I273 HydrophobicContact CB-CG2 4.03Å; P271-I273 HydrophobicContact CG-CG2 4Å; P271-I273 PolarHBondContact O-N 3.4Å; P271-L274 HydrophobicContact CG-CD1 4.17Å; P271-L274 HydrophobicContact CG-CG 4.3Å; P271-L274 PolarHBondContact O-N 3.24Å
272E82.4Confident85.1Confident155 Ų15580.8 Ų80.872%0.72443%0.433SS*.Hα-helixtrans-54.9-27.6-177.8-169177.1-177.700113L274 H275 V276E272-L274 PolarHBondContact O-N 3.03Å; E272-L274 VanDerWaalsContact O-N 3.15Å; E272-H275 PolarHBondContact O-N 2.89Å; E272-V276 HydrophobicContact CG-CG2 4.13Å; E272-V276 WeakPolarHBondContact O-CG2 3.49Å; E272-V276 PolarHBondContact O-N 3.47Å
273I83.7Confident84.6Confident136 Ų13686.7 Ų86.770%0.69745%0.45SS*.Hα-helixtrans-60.3-23.2176-159.2157.6000113.8P271 P277P271-I273 HydrophobicContact CB-CG2 4.03Å; P271-I273 HydrophobicContact CG-CG2 4Å; P271-I273 PolarHBondContact O-N 3.4Å; I273-P277 WeakPolarHBondContact O-CD 3.26Å; I273-P277 WeakPolarHBondContact O-CG 3.32Å
274L83.8Confident84.5Confident75 Ų7589.1 Ų89.139%0.39346%0.464SS..Hα-helixtrans-84.8-38.1172-66.4177.4000111.3F270 P271 E272 P277 L278F270-L274 HydrophobicContact CB-CD1 4.04Å; F270-L274 HydrophobicContact CD1-CD1 4.28Å; F270-L274 HydrophobicContact CG-CD1 4.26Å; P271-L274 HydrophobicContact CG-CD1 4.17Å; P271-L274 HydrophobicContact CG-CG 4.3Å; P271-L274 PolarHBondContact O-N 3.24Å; E272-L274 PolarHBondContact O-N 3.03Å; E272-L274 VanDerWaalsContact O-N 3.15Å; L274-P277 WeakPolarHBondContact O-CD 3.4Å; L274-P277 WeakPolarHBondContact O-CG 3.43Å; L274-L278 WeakPolarHBondContact O-CD1 3.33Å; L274-L278 WeakPolarHBondContact O-CG 3.01Å
275H80.8Confident84.2Confident51 Ų5184.7 Ų84.724%0.23644%0.441CS..Hα-helixtrans-68.7-38.1-177.9-76.4-77.9000113.5E263 E272 L278 S279E263-H275 IonicContact OE1-CE1 3.31Å; E263-H275 PolarHBondContact OE1-CE1 3.02Å; E263-H275 VanDerWaalsContact OE1-CE1 3.31Å; E263-H275 IonicContact OE1-NE2 2.8Å; E263-H275 PolarHBondContact OE1-NE2 3.15Å; E263-H275 IonicContact OE2-CE1 3.65Å; E263-H275 IonicContact OE2-NE2 3.93Å; E272-H275 PolarHBondContact O-N 2.89Å; H275-L278 PolarHBondContact O-N 2.88Å; H275-S279 WeakPolarHBondContact O-CB 3.33Å; H275-S279 PolarHBondContact O-N 3.36Å; H275-S279 PolarHBondContact O-OG 3.42Å
276V83.2Confident83.7Confident67 Ų6780 Ų8041%0.40642%0.422SS..Hα-helixtrans-57.5-61.9-179.9173.90000111.8E272 L278 S279 W280E272-V276 HydrophobicContact CG-CG2 4.13Å; E272-V276 WeakPolarHBondContact O-CG2 3.49Å; E272-V276 PolarHBondContact O-N 3.47Å; V276-L278 VanDerWaalsContact C-N 3.29Å; V276-L278 PolarHBondContact O-N 3.43Å; V276-S279 WeakPolarHBondContact O-CB 3.32Å; V276-S279 PolarHBondContact O-N 3.19Å; V276-S279 VanDerWaalsContact O-N 3.14Å; V276-W280 PolarHBondContact O-N 3.04Å; V276-W280 VanDerWaalsContact O-N 3.11Å
277P86.1Confident83.2Confident66 Ų6680.5 Ų80.543%0.42942%0.424SS..Hα-helixtrans-63-33.2-177.825.2-34.8000113.1I273 L274 S279 W280 L281I273-P277 WeakPolarHBondContact O-CD 3.26Å; I273-P277 WeakPolarHBondContact O-CG 3.32Å; L274-P277 WeakPolarHBondContact O-CD 3.4Å; L274-P277 WeakPolarHBondContact O-CG 3.43Å; P277-S279 VanDerWaalsContact C-N 3.33Å; P277-W280 WeakPolarHBondContact O-CB 3.29Å; P277-W280 PolarHBondContact O-N 3.14Å; P277-L281 PolarHBondContact O-N 3.5Å
278L85.4Confident83.1Confident17 Ų1775.5 Ų75.59%0.08940%0.395CS..Hα-helixtrans-65.8-38.3176.1-66.4173.7000112.1P255 F256 V259 L274 H275 V276 W280 L281 L282P255-L278 HydrophobicContact CB-CD2 3.56Å; P255-L278 HydrophobicContact CG-CD2 4.01Å; F256-L278 HydrophobicContact CD2-CB 4.24Å; V259-L278 HydrophobicContact CB-CD1 3.78Å; V259-L278 HydrophobicContact CG1-CD1 4.08Å; V259-L278 HydrophobicContact CG2-CD1 3.42Å; V259-L278 VanDerWaalsContact CG2-CD1 3.42Å; L274-L278 WeakPolarHBondContact O-CD1 3.33Å; L274-L278 WeakPolarHBondContact O-CG 3.01Å; H275-L278 PolarHBondContact O-N 2.88Å; V276-L278 VanDerWaalsContact C-N 3.29Å; V276-L278 PolarHBondContact O-N 3.43Å; L278-W280 VanDerWaalsContact C-N 3.33Å; L278-L281 HydrophobicContact CD2-CD1 4.26Å; L278-L281 PolarHBondContact O-N 2.86Å; L278-L282 PolarHBondContact O-N 3.34Å; L278-L282 VanDerWaalsContact O-N 3.11Å
279S80.3Confident82.6Confident44 Ų4475 Ų7531%0.30839%0.387SS..Hα-helixtrans-63.5-41.2173.4-59.70000111H275 V276 P277 L282 Y283H275-S279 WeakPolarHBondContact O-CB 3.33Å; H275-S279 PolarHBondContact O-N 3.36Å; H275-S279 PolarHBondContact O-OG 3.42Å; V276-S279 WeakPolarHBondContact O-CB 3.32Å; V276-S279 PolarHBondContact O-N 3.19Å; V276-S279 VanDerWaalsContact O-N 3.14Å; P277-S279 VanDerWaalsContact C-N 3.33Å; S279-L282 WeakPolarHBondContact O-CB 3.47Å; S279-L282 PolarHBondContact O-N 2.78Å; S279-Y283 WeakPolarHBondContact O-CD2 3.26Å; S279-Y283 PolarHBondContact O-N 3.41Å; S279-Y283 VanDerWaalsContact O-N 3.07Å
280W85Confident82.3Confident170 Ų17070.8 Ų70.864%0.64437%0.37SS*.Hα-helixtrans-60.9-44.8173.7-73.8101.8000112.6V276 P277 L278 L282 Y283 L284V276-W280 PolarHBondContact O-N 3.04Å; V276-W280 VanDerWaalsContact O-N 3.11Å; P277-W280 WeakPolarHBondContact O-CB 3.29Å; P277-W280 PolarHBondContact O-N 3.14Å; L278-W280 VanDerWaalsContact C-N 3.33Å; W280-L282 PolarHBondContact O-N 3.46Å; W280-Y283 WeakPolarHBondContact O-CB 3.44Å; W280-Y283 PolarHBondContact O-N 3.18Å; W280-L284 WeakPolarHBondContact O-CG 3.32Å; W280-L284 PolarHBondContact O-N 2.93Å
281L85.2Confident81.9Confident51 Ų5173.5 Ų73.527%0.26738%0.382SS..Hα-helixtrans-57.5-36.8175.6-75.7170.4000112.2C252 P255 P277 L278 L284 N285C252-L281 WeakPolarHBondContact CB-O 3.47Å; P255-L281 HydrophobicContact CG-CD1 4.11Å; P277-L281 PolarHBondContact O-N 3.5Å; L278-L281 HydrophobicContact CD2-CD1 4.26Å; L278-L281 PolarHBondContact O-N 2.86Å; L281-L284 HydrophobicContact CD2-CD1 4.27Å; L281-L284 PolarHBondContact O-N 3.07Å; L281-N285 PolarHBondContact O-N 3.39Å
282L81.8Confident81.7Confident8 Ų870.5 Ų70.54%0.04236%0.362CS..Hα-helixtrans-67.8-39176.1-164.864.6000112.6L56 F253 L278 S279 W280 N285L56-L282 HydrophobicContact CD1-CD1 3.68Å; L56-L282 HydrophobicContact CD1-CD2 3.68Å; L56-L282 HydrophobicContact CD1-CG 4.07Å; L56-L282 HydrophobicContact CD2-CD1 3.44Å; L56-L282 VanDerWaalsContact CD2-CD1 3.44Å; L56-L282 HydrophobicContact CD2-CD2 4.34Å; L56-L282 HydrophobicContact CD2-CG 3.88Å; L56-L282 HydrophobicContact CG-CD1 4.07Å; L56-L282 HydrophobicContact CG-CD2 4.19Å; L56-L282 HydrophobicContact CG-CG 4.29Å; F253-L282 HydrophobicContact CD2-CD1 4.43Å; L278-L282 PolarHBondContact O-N 3.34Å; L278-L282 VanDerWaalsContact O-N 3.11Å; S279-L282 WeakPolarHBondContact O-CB 3.47Å; S279-L282 PolarHBondContact O-N 2.78Å; W280-L282 PolarHBondContact O-N 3.46Å; L282-N285 VanDerWaalsContact O-CB 3.29Å; L282-N285 WeakPolarHBondContact O-CB 3.5Å; L282-N285 PolarHBondContact O-N 3.14Å
283Y79.3Confident81.2Confident143 Ų14367.2 Ų67.256%0.56134%0.343SS*.Hα-helixtrans-66.6-38.3172.8-69.5-61.9000112S279 W280 N285 S286S279-Y283 WeakPolarHBondContact O-CD2 3.26Å; S279-Y283 PolarHBondContact O-N 3.41Å; S279-Y283 VanDerWaalsContact O-N 3.07Å; W280-Y283 WeakPolarHBondContact O-CB 3.44Å; W280-Y283 PolarHBondContact O-N 3.18Å; Y283-N285 PolarHBondContact O-N 3.22Å; Y283-N285 VanDerWaalsContact O-N 3.17Å; Y283-S286 PolarHBondContact O-N 3.41Å; Y283-S286 VanDerWaalsContact O-N 3.14Å
284L84.6Confident80.7Confident83 Ų8361.4 Ų61.444%0.43532%0.316SS..Hα-helixtrans-60.8-24.3178.9-74.1172.6000113.3W280 L281 S286 C287 C288W280-L284 WeakPolarHBondContact O-CG 3.32Å; W280-L284 PolarHBondContact O-N 2.93Å; L281-L284 HydrophobicContact CD2-CD1 4.27Å; L281-L284 PolarHBondContact O-N 3.07Å; L284-S286 PolarHBondContact O-N 3.17Å; L284-S286 VanDerWaalsContact O-N 3.15Å; L284-C287 HydrophobicContact CD2-CB 4.49Å; L284-C287 WeakPolarHBondContact O-CA 3.21Å; L284-C287 WeakPolarHBondContact O-CB 3.48Å; L284-C287 PolarHBondContact O-N 3.43Å; L284-C288 PolarHBondContact O-N 3.46Å; L284-C288 PolarHBondContact O-SG 3.19Å
285N81.8Confident80.2Confident14 Ų1464.2 Ų64.28%0.07533%0.325CS..Hα-helixtrans-53.4-35174.3-168.8-10000112.5F249 C252 L281 L282 Y283F249-N285 VanDerWaalsContact CD2-ND2 3.25Å; F249-N285 WeakPolarHBondContact CD2-ND2 3.46Å; C252-N285 HydrophobicContact CB-CB 4.38Å; L281-N285 PolarHBondContact O-N 3.39Å; L282-N285 VanDerWaalsContact O-CB 3.29Å; L282-N285 WeakPolarHBondContact O-CB 3.5Å; L282-N285 PolarHBondContact O-N 3.14Å; Y283-N285 PolarHBondContact O-N 3.22Å; Y283-N285 VanDerWaalsContact O-N 3.17Å
286S81.2Confident79.6Confident45 Ų4568 Ų6832%0.31534%0.337SS..Hα-helixtrans-69.8-38173.4-84.50000113.4R59 Y283 L284 C288 N289 P290R59-S286 PolarHBondContact NH1-OG 2.97Å; R59-S286 PolarHBondContact NH2-OG 2.97Å; Y283-S286 PolarHBondContact O-N 3.41Å; Y283-S286 VanDerWaalsContact O-N 3.14Å; L284-S286 PolarHBondContact O-N 3.17Å; L284-S286 VanDerWaalsContact O-N 3.15Å; S286-C288 VanDerWaalsContact C-N 3.27Å; S286-C288 PolarHBondContact O-N 2.85Å; S286-N289 PolarHBondContact O-N 2.88Å; S286-P290 WeakPolarHBondContact O-CD 3.36Å
287C78.9Confident78.8Confident60 Ų6066.9 Ų66.941%0.40533%0.329SS..Hα-helixtrans-65.4-36.1178.7-59.60000110.4L284 N289 P290 F291L284-C287 HydrophobicContact CD2-CB 4.49Å; L284-C287 WeakPolarHBondContact O-CA 3.21Å; L284-C287 WeakPolarHBondContact O-CB 3.48Å; L284-C287 PolarHBondContact O-N 3.43Å; C287-N289 PolarHBondContact O-N 2.68Å; C287-P290 VanDerWaalsContact O-CD 3.26Å; C287-P290 WeakPolarHBondContact O-CD 3.32Å; C287-F291 HydrophobicContact CB-CE2 4.35Å; C287-F291 WeakPolarHBondContact O-CD2 3.4Å
288C80.4Confident78.1Confident28 Ų2870.3 Ų70.319%0.18934%0.337CS..Hα-helixtrans-60.1-28.5-179.2-64.70000113.7C248 L284 S286 F291 I292C248-C288 WeakPolarHBondContact SG-CB 3.25Å; C248-C288 PolarHBondContact SG-SG 3.42Å; L284-C288 PolarHBondContact O-N 3.46Å; L284-C288 PolarHBondContact O-SG 3.19Å; S286-C288 VanDerWaalsContact C-N 3.27Å; S286-C288 PolarHBondContact O-N 2.85Å; C288-F291 PolarHBondContact O-N 3.14Å; C288-I292 HydrophobicContact CB-CD1 4.27Å; C288-I292 WeakPolarHBondContact O-CB 3.01Å; C288-I292 WeakPolarHBondContact O-CD1 3.38Å; C288-I292 WeakPolarHBondContact O-CG1 3.46Å; C288-I292 PolarHBondContact O-N 3.23Å
289N76Confident77.3Confident58 Ų5874.1 Ų74.131%0.3136%0.363SS..Hα-helixtrans-60.7-57.7-179-66.2-37000112.3S286 C287 F291 I292 Y293S286-N289 PolarHBondContact O-N 2.88Å; C287-N289 PolarHBondContact O-N 2.68Å; N289-F291 VanDerWaalsContact C-N 3.27Å; N289-F291 PolarHBondContact O-N 2.79Å; N289-I292 PolarHBondContact O-N 3.48Å; N289-Y293 HydrophobicContact CB-CE2 4.38Å; N289-Y293 WeakPolarHBondContact O-CD2 3.49Å; N289-Y293 PolarHBondContact O-N 3.02Å; N289-Y293 VanDerWaalsContact O-N 3.15Å
290P76.9Confident76.8Confident69 Ų6978.5 Ų78.545%0.44837%0.374SS..Hα-helixtrans-49.9-43.2171.2-28.930.5000114.1S286 C287 A294S286-P290 WeakPolarHBondContact O-CD 3.36Å; C287-P290 VanDerWaalsContact O-CD 3.26Å; C287-P290 WeakPolarHBondContact O-CD 3.32Å; P290-A294 WeakPolarHBondContact O-CB 3.44Å; P290-A294 PolarHBondContact O-N 2.87Å
291F77.5Confident76.2Confident126 Ų12671.3 Ų71.355%0.55335%0.351SS*.Hα-helixtrans-65.6-42.9179.3-70.3-73.1000112.2C287 C288 N289 Y293 A294 F295C287-F291 HydrophobicContact CB-CE2 4.35Å; C287-F291 WeakPolarHBondContact O-CD2 3.4Å; C288-F291 PolarHBondContact O-N 3.14Å; N289-F291 VanDerWaalsContact C-N 3.27Å; N289-F291 PolarHBondContact O-N 2.79Å; F291-Y293 VanDerWaalsContact C-N 3.34Å; F291-Y293 PolarHBondContact O-N 3.49Å; F291-A294 PolarHBondContact O-N 2.98Å; F291-F295 HydrophobicContact CB-CD2 4.41Å; F291-F295 HydrophobicContact CD1-CD2 4.25Å; F291-F295 AromaticContact CD1-CE2 3.69Å; F291-F295 HydrophobicContact CD1-CE2 3.69Å; F291-F295 HydrophobicContact CE1-CE2 4.42Å; F291-F295 WeakPolarHBondContact O-CB 2.97Å; F291-F295 WeakPolarHBondContact O-CD2 3.48Å; F291-F295 PolarHBondContact O-N 3.07Å
292I80.4Confident75.6Confident15 Ų1572.8 Ų72.88%0.07736%0.359CS..Hα-helixtrans-63-45.4-179.4-67.6163.8000110.1V241 I244 V245 C248 C288 N289 R296V241-I292 HydrophobicContact CG1-CG2 3.96Å; I244-I292 HydrophobicContact CG2-CD1 4.25Å; I244-I292 HydrophobicContact CG2-CG1 3.99Å; I244-I292 HydrophobicContact CG2-CG2 4.18Å; V245-I292 HydrophobicContact CB-CD1 4.4Å; V245-I292 HydrophobicContact CG2-CD1 3.87Å; V245-I292 HydrophobicContact CG2-CG2 3.86Å; C248-I292 HydrophobicContact CB-CD1 4.31Å; C288-I292 HydrophobicContact CB-CD1 4.27Å; C288-I292 WeakPolarHBondContact O-CB 3.01Å; C288-I292 WeakPolarHBondContact O-CD1 3.38Å; C288-I292 WeakPolarHBondContact O-CG1 3.46Å; C288-I292 PolarHBondContact O-N 3.23Å; N289-I292 PolarHBondContact O-N 3.48Å; I292-R296 WeakPolarHBondContact O-CB 3.25Å; I292-R296 WeakPolarHBondContact O-CG 3.44Å; I292-R296 PolarHBondContact O-N 3.05Å; I292-R296 VanDerWaalsContact O-N 3.1Å
293Y72.4Confident75.3Confident85 Ų8574.6 Ų74.633%0.33338%0.375SS..Hα-helixtrans-71-42.1179.9-64.9-63.2000112.8V241 N289 F291 F295 N297V241-Y293 HydrophobicContact CG1-CE1 4.31Å; N289-Y293 HydrophobicContact CB-CE2 4.38Å; N289-Y293 WeakPolarHBondContact O-CD2 3.49Å; N289-Y293 PolarHBondContact O-N 3.02Å; N289-Y293 VanDerWaalsContact O-N 3.15Å; F291-Y293 VanDerWaalsContact C-N 3.34Å; F291-Y293 PolarHBondContact O-N 3.49Å; Y293-F295 VanDerWaalsContact C-N 3.31Å; Y293-F295 PolarHBondContact O-N 2.74Å; Y293-N297 PolarHBondContact O-N 3.43Å
294A73.5Confident75Confident15 Ų1571.4 Ų71.412%0.12436%0.364CS..Hα-helixtrans-64.7-34.9179.100000112.1P290 F291 A301 F304P290-A294 WeakPolarHBondContact O-CB 3.44Å; P290-A294 PolarHBondContact O-N 2.87Å; F291-A294 PolarHBondContact O-N 2.98Å; A294-A301 WeakPolarHBondContact O-CA 3.34Å; A294-A301 WeakPolarHBondContact O-CB 3.35Å; A294-F304 HydrophobicContact CB-CB 4.36Å; A294-F304 HydrophobicContact CB-CD2 3.56Å; A294-F304 HydrophobicContact CB-CE2 3.95Å; A294-F304 HydrophobicContact CB-CG 3.94Å
295F72.6Confident74.3Confident133 Ų13375.1 Ų75.158%0.58337%0.372SS*.Hα-helixtrans-94.1-23.5-174.5-76.1-96.6000114.1F291 Y293F291-F295 HydrophobicContact CB-CD2 4.41Å; F291-F295 HydrophobicContact CD1-CD2 4.25Å; F291-F295 AromaticContact CD1-CE2 3.69Å; F291-F295 HydrophobicContact CD1-CE2 3.69Å; F291-F295 HydrophobicContact CE1-CE2 4.42Å; F291-F295 WeakPolarHBondContact O-CB 2.97Å; F291-F295 WeakPolarHBondContact O-CD2 3.48Å; F291-F295 PolarHBondContact O-N 3.07Å; Y293-F295 VanDerWaalsContact C-N 3.31Å; Y293-F295 PolarHBondContact O-N 2.74Å
296R69Low73.9Confident131 Ų13183.2 Ų83.249%0.49440%0.402SS..Hα-helixtrans-97-24.6-174.7-65.2-59.374.8178.8-8.5115.4V241 I244 I292V241-R296 HydrophobicContact CG2-CB 4.03Å; I244-R296 HydrophobicContact CD1-CG 3.86Å; I292-R296 WeakPolarHBondContact O-CB 3.25Å; I292-R296 WeakPolarHBondContact O-CG 3.44Å; I292-R296 PolarHBondContact O-N 3.05Å; I292-R296 VanDerWaalsContact O-N 3.1Å
297N67.3Low73.5Confident44 Ų4486.3 Ų86.324%0.23541%0.414CS..  trans-107107.6173.4-62.8-47.1000109.4Y293 P299 Y300 A301Y293-N297 PolarHBondContact O-N 3.43Å; N297-P299 VanDerWaalsContact C-CD 3.43Å; N297-P299 VanDerWaalsContact C-N 3.32Å; N297-P299 HydrophobicContact CB-CG 4.48Å; N297-Y300 HydrophobicContact CB-CD2 3.35Å; N297-Y300 HydrophobicContact CB-CE2 4.16Å; N297-Y300 HydrophobicContact CB-CG 4.11Å; N297-Y300 CarbonylContact O-C 3.59Å; N297-Y300 WeakPolarHBondContact O-CA 3.27Å; N297-Y300 PolarHBondContact O-N 3.35Å; N297-A301 PolarHBondContact O-N 3.35Å
298K69.6Low73.1Confident138 Ų13889.5 Ų89.560%0.643%0.427SS*.Hα-helixtrans-46.4-45.7174-74.7-160.2176.6179.90114.1Y300 A301 D302K298-Y300 VanDerWaalsContact C-N 3.27Å; K298-Y300 PolarHBondContact O-N 3.49Å; K298-A301 WeakPolarHBondContact O-CB 3.37Å; K298-A301 PolarHBondContact O-N 3.49Å; K298-A301 VanDerWaalsContact O-N 3.14Å; K298-D302 VanDerWaalsContact O-CG 3.26Å; K298-D302 PolarHBondContact O-N 3.23Å
299P69.3Low72.4Confident96 Ų9694.1 Ų94.162%0.62345%0.45SS*.Hα-helixtrans-62.9-32.3178.122.4-33.6000113.4N297 A303N297-P299 VanDerWaalsContact C-CD 3.43Å; N297-P299 VanDerWaalsContact C-N 3.32Å; N297-P299 HydrophobicContact CB-CG 4.48Å; P299-A303 PolarHBondContact O-N 2.86Å
300Y69.1Low71.6Confident137 Ų13794.2 Ų94.254%0.53745%0.452SS..Hα-helixtrans-76.8-39.2174.1-70.4-93.3000111.2N297 K298 D302 A303 F304N297-Y300 HydrophobicContact CB-CD2 3.35Å; N297-Y300 HydrophobicContact CB-CE2 4.16Å; N297-Y300 HydrophobicContact CB-CG 4.11Å; N297-Y300 CarbonylContact O-C 3.59Å; N297-Y300 WeakPolarHBondContact O-CA 3.27Å; N297-Y300 PolarHBondContact O-N 3.35Å; K298-Y300 VanDerWaalsContact C-N 3.27Å; K298-Y300 PolarHBondContact O-N 3.49Å; Y300-D302 VanDerWaalsContact C-N 3.25Å; Y300-D302 PolarHBondContact O-N 3.32Å; Y300-A303 PolarHBondContact O-N 3.35Å; Y300-F304 WeakPolarHBondContact O-CD2 3.39Å; Y300-F304 PolarHBondContact O-N 3.37Å
301A72.5Confident70.5Confident19 Ų1999.5 Ų99.516%0.15747%0.471CS..Hα-helixtrans-54.9-44.4174.400000111.2A294 N297 K298 F304 R305A294-A301 WeakPolarHBondContact O-CA 3.34Å; A294-A301 WeakPolarHBondContact O-CB 3.35Å; N297-A301 PolarHBondContact O-N 3.35Å; K298-A301 WeakPolarHBondContact O-CB 3.37Å; K298-A301 PolarHBondContact O-N 3.49Å; K298-A301 VanDerWaalsContact O-N 3.14Å; A301-F304 PolarHBondContact O-N 3.49Å; A301-R305 WeakPolarHBondContact O-CB 3.45Å; A301-R305 VanDerWaalsContact O-CG 3.27Å; A301-R305 WeakPolarHBondContact O-CG 3.35Å; A301-R305 PolarHBondContact O-N 3.3Å
302D72.5Confident69.3Low81 Ų81101 Ų10143%0.43349%0.485SS..Hα-helixtrans-68.9-37.9-179.9-64.2-20.7000111.4K298 Y300 R305 R306K298-D302 VanDerWaalsContact O-CG 3.26Å; K298-D302 PolarHBondContact O-N 3.23Å; Y300-D302 VanDerWaalsContact C-N 3.25Å; Y300-D302 PolarHBondContact O-N 3.32Å; D302-R305 PolarHBondContact O-N 3.27Å; D302-R306 WeakPolarHBondContact O-CB 3.48Å; D302-R306 VanDerWaalsContact O-CG 3.22Å; D302-R306 WeakPolarHBondContact O-CG 3.22Å; D302-R306 PolarHBondContact O-N 2.94Å
303A75.9Confident68.1Low47 Ų47103.7 Ų103.739%0.38850%0.504SS..Hα-helixtrans-64.3-43.1171.900000112P299 Y300 R306 L307P299-A303 PolarHBondContact O-N 2.86Å; Y300-A303 PolarHBondContact O-N 3.35Å; A303-R306 WeakPolarHBondContact O-CB 3.11Å; A303-R306 PolarHBondContact O-N 2.96Å; A303-L307 VanDerWaalsContact O-CG 3.29Å; A303-L307 WeakPolarHBondContact O-CG 3.46Å; A303-L307 PolarHBondContact O-N 3.14Å
304F72.8Confident67.4Low75 Ų75106.7 Ų106.733%0.32954%0.536SS..Hα-helixtrans-65.6-41.2175.7-86.8-73000112.3A294 Y300 A301 L307 L308A294-F304 HydrophobicContact CB-CB 4.36Å; A294-F304 HydrophobicContact CB-CD2 3.56Å; A294-F304 HydrophobicContact CB-CE2 3.95Å; A294-F304 HydrophobicContact CB-CG 3.94Å; Y300-F304 WeakPolarHBondContact O-CD2 3.39Å; Y300-F304 PolarHBondContact O-N 3.37Å; A301-F304 PolarHBondContact O-N 3.49Å; F304-L307 WeakPolarHBondContact O-CB 3.42Å; F304-L307 PolarHBondContact O-N 2.96Å; F304-L308 WeakPolarHBondContact O-CG 3.33Å; F304-L308 PolarHBondContact O-N 3.24Å
305R71.2Confident66.5Low161 Ų161109.2 Ų109.261%0.60856%0.564SS**Hα-helixtrans-59.5-47.4173.2-76.9173.3-174.5-83.7-0.9110.6A301 D302 L307 L308 D309A301-R305 WeakPolarHBondContact O-CB 3.45Å; A301-R305 VanDerWaalsContact O-CG 3.27Å; A301-R305 WeakPolarHBondContact O-CG 3.35Å; A301-R305 PolarHBondContact O-N 3.3Å; D302-R305 PolarHBondContact O-N 3.27Å; R305-L307 VanDerWaalsContact C-N 3.3Å; R305-L307 PolarHBondContact O-N 3.23Å; R305-L308 PolarHBondContact O-N 2.98Å; R305-L308 VanDerWaalsContact O-N 3.14Å; R305-D309 WeakPolarHBondContact O-CB 3.4Å; R305-D309 VanDerWaalsContact O-CG 3.23Å; R305-D309 PolarHBondContact O-N 3.11Å
306R72.4Confident65.3Low184 Ų184111.8 Ų111.869%0.69457%0.574SS**Hα-helixtrans-56.1-46.7173.7-72.5171.5-172.8-1642.6111D302 A303 L308 D309 T310D302-R306 WeakPolarHBondContact O-CB 3.48Å; D302-R306 VanDerWaalsContact O-CG 3.22Å; D302-R306 WeakPolarHBondContact O-CG 3.22Å; D302-R306 PolarHBondContact O-N 2.94Å; A303-R306 WeakPolarHBondContact O-CB 3.11Å; A303-R306 PolarHBondContact O-N 2.96Å; R306-L308 VanDerWaalsContact C-N 3.35Å; R306-L308 PolarHBondContact O-N 3.34Å; R306-D309 PolarHBondContact O-N 2.8Å; R306-T310 WeakPolarHBondContact O-CB 3.42Å; R306-T310 PolarHBondContact O-N 3.33Å; R306-T310 PolarHBondContact O-OG1 2.8Å
307L72.8Confident64.5Low111 Ų111113.9 Ų113.958%0.58159%0.592SS**Hα-helixtrans-61.5-39.3178-71.2168.3000112.9A303 F304 R305 T310A303-L307 VanDerWaalsContact O-CG 3.29Å; A303-L307 WeakPolarHBondContact O-CG 3.46Å; A303-L307 PolarHBondContact O-N 3.14Å; F304-L307 WeakPolarHBondContact O-CB 3.42Å; F304-L307 PolarHBondContact O-N 2.96Å; R305-L307 VanDerWaalsContact C-N 3.3Å; R305-L307 PolarHBondContact O-N 3.23Å; L307-T310 WeakPolarHBondContact O-CB 3.04Å; L307-T310 PolarHBondContact O-N 3.22Å
308L70.6Confident63.5Low126 Ų126122.5 Ų122.566%0.6662%0.621SS**Hα-helixtrans-76.4-35.4178.8-67.5171000112.7F304 R305 R306 T310 E311F304-L308 WeakPolarHBondContact O-CG 3.33Å; F304-L308 PolarHBondContact O-N 3.24Å; R305-L308 PolarHBondContact O-N 2.98Å; R305-L308 VanDerWaalsContact O-N 3.14Å; R306-L308 VanDerWaalsContact C-N 3.35Å; R306-L308 PolarHBondContact O-N 3.34Å; L308-T310 PolarHBondContact O-N 2.88Å; L308-E311 PolarHBondContact O-N 2.96Å
309D66.4Low62.3Low126 Ų126122.8 Ų122.867%0.67463%0.628SS**Hα-helixtrans-71.6-13.8173.3-67.1-26.1000111.7R305 R306 E311R305-D309 WeakPolarHBondContact O-CB 3.4Å; R305-D309 VanDerWaalsContact O-CG 3.23Å; R305-D309 PolarHBondContact O-N 3.11Å; R306-D309 PolarHBondContact O-N 2.8Å; D309-E311 PolarHBondContact O-N 3.31Å
310T58Low61.4Low59 Ų59124.4 Ų124.436%0.36264%0.636SS.*G310 helixtrans-80.46.4178.1-56.90000112.7R306 L307 L308 N312 C313R306-T310 WeakPolarHBondContact O-CB 3.42Å; R306-T310 PolarHBondContact O-N 3.33Å; R306-T310 PolarHBondContact O-OG1 2.8Å; L307-T310 WeakPolarHBondContact O-CB 3.04Å; L307-T310 PolarHBondContact O-N 3.22Å; L308-T310 PolarHBondContact O-N 2.88Å; T310-N312 PolarHBondContact O-N 2.95Å; T310-C313 HydrophobicContact CG2-CB 3.3Å; T310-C313 PolarHBondContact O-N 2.99Å
311E55.6Low60.4Low180 Ų180123 Ų12384%0.84164%0.642SS**G310 helixtrans-63.1-4.9166.7-66.1-147.2159.100113.1L308 D309L308-E311 PolarHBondContact O-N 2.96Å; D309-E311 PolarHBondContact O-N 3.31Å
312N52.3Low58.7Low157 Ų157128.8 Ų128.884%0.8468%0.68SS**G310 helixtrans-110.816.9165.9-74.2-26.9000115.2T310T310-N312 PolarHBondContact O-N 2.95Å
313C54.9Low58Low72 Ų72131.2 Ų131.249%0.48669%0.692SS.*  trans-127.652.7-175.2-91.40000113.7T310 G315T310-C313 HydrophobicContact CG2-CB 3.3Å; T310-C313 PolarHBondContact O-N 2.99Å; C313-G315 PolarHBondContact O-N 3.11Å
314C57.6Low57.1Low149 Ų149135.6 Ų135.6100%1.00771%0.708SS**THydrogen-bonded Turntrans-6633.1168.9-157.10000114.1
315G54.2Low56.2Low68 Ų68138.9 Ų138.970%0.70173%0.729SS**THydrogen-bonded Turntrans-158.60.5-171.100000119C313C313-G315 PolarHBondContact O-N 3.11Å
316K48.3Very low55.3Low186 Ų186137.6 Ų137.681%0.80974%0.736SS**  trans-139.849.8-177.7-81.6-176.9-179.4166.90113.9R318K316-R318 VanDerWaalsContact C-N 3.29Å; K316-R318 PolarHBondContact O-N 3.01Å
317M51.5Low54.3Low176 Ų176134.8 Ų134.887%0.86774%0.739SS**  trans-92.274155.3-139.7179-68.700107.5L319M317-L319 PolarHBondContact O-N 2.92Å
318R46.7Very low53Low225 Ų225136.3 Ų136.385%0.84975%0.749SS**  trans-73.5101.8173.5-160.3-177.9-81.2-178.8-5.6106.3K316 V320K316-R318 VanDerWaalsContact C-N 3.29Å; K316-R318 PolarHBondContact O-N 3.01Å; R318-V320 PolarHBondContact O-N 3Å
319L44.9Very low51.8Low143 Ų143137.1 Ų137.175%0.74976%0.756SS**  trans-47.2107.4167.1-110.8120.1000108M317 T321M317-L319 PolarHBondContact O-N 2.92Å; L319-T321 HydrophobicContact CB-CG2 4.44Å; L319-T321 HydrophobicContact CD2-CG2 3.48Å; L319-T321 VanDerWaalsContact CD2-CG2 3.48Å; L319-T321 PolarHBondContact O-N 3.15Å; L319-T321 VanDerWaalsContact O-N 3.12Å
320V49Very low50.7Low130 Ų130137.9 Ų137.979%0.78876%0.762SS**  trans-80.283.5160.3-179.30000105R318 C322R318-V320 PolarHBondContact O-N 3Å; V320-C322 PolarHBondContact O-N 3.45Å
321T48.5Very low50Low109 Ų109144.5 Ų144.567%0.66980%0.795SS**  trans-71108.1163.938.60000107.7L319L319-T321 HydrophobicContact CB-CG2 4.44Å; L319-T321 HydrophobicContact CD2-CG2 3.48Å; L319-T321 VanDerWaalsContact CD2-CG2 3.48Å; L319-T321 PolarHBondContact O-N 3.15Å; L319-T321 VanDerWaalsContact O-N 3.12Å
322C37.3Very low49.5Very low139 Ų139141.3 Ų141.394%0.93979%0.791SS**  trans-73.60160.5-640000111.7K87 V320K87-C322 PolarHBondContact NZ-O 2.88Å; V320-C322 PolarHBondContact O-N 3.45Å

Retrieved 322 of 322 residues in 268.5 ms (Link to these results)