A0A077Z2R6_TRITR Loading...

Homeobox protein otx5

AlphaFold DB , UniProt , Accession A0A077Z2R6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 297 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
1M47.5Very low57.6Low240 Ų240124.4 Ų124.4100%1.18275%0.754SS**  0165.60-71.863.2172.900108.4
2A53.1Low57.9Low103 Ų103121.1 Ų121.185%0.85176%0.764SS**  trans-113-164-153.600000117.5
3Y56.8Low57.5Low171 Ų171117.4 Ų117.467%0.67176%0.763SS**  trans-123.7143.5-150.8-79.2-119.4000118
4A59.1Low57.4Low51 Ų51126.4 Ų126.442%0.42178%0.777SS.*  51.6111.9123.600000129.5
5H61.6Low57.1Low95 Ų95129.3 Ų129.344%0.4478%0.784SS.*  92.60100.6-91.2-100000127.6Q150 K151 E152H5-Q150 VanDerWaalsContact CG-O 3.3Å; H5-Q150 PolarHBondContact ND1-O 3.28Å; H5-Q150 VanDerWaalsContact ND1-O 3.1Å; H5-K151 WeakPolarHBondContact CE1-CA 3.4Å; H5-K151 PolarHBondContact CE1-N 3.45Å; H5-K151 PolarHBondContact CE1-O 3.18Å; H5-K151 PolarHBondContact ND1-N 3.46Å; H5-K151 VanDerWaalsContact ND1-N 3.15Å; H5-K151 WeakPolarHBondContact NE2-CA 2.99Å; H5-K151 PolarHBondContact NE2-N 3.21Å; H5-E152 PolarHBondContact CE1-N 3.25Å; H5-E152 WeakPolarHBondContact NE2-CA 3.44Å; H5-E152 PolarHBondContact NE2-N 3.47Å
6P55.7Low57.1Low82 Ų82132.3 Ų132.353%0.53279%0.793SS.*  0-167.9047.1-24.9000122.4
7H61.9Low56.3Low190 Ų190134.2 Ų134.288%0.8879%0.792SS**  trans80.2166.7164.5-54.3-36.2000121.3
8G57.8Low55.7Low79 Ų79139.1 Ų139.181%0.81479%0.794SS**  cis142.8152.5-13.400000115.3
9A58.1Low55.2Low99 Ų99138 Ų13882%0.81879%0.793SS**  cis-174.7168.3-24.600000114.4
10T62.6Low54.6Low143 Ų143137.1 Ų137.188%0.87780%0.796SS**  trans83.5159.5160.4-119.80000121.1
11S59.5Low54.8Low115 Ų115136.4 Ų136.480%0.80480%0.795SS**  cis-166178.7-14.768.50000114.9
12G61.6Low54.7Low85 Ų85130.9 Ų130.988%0.87678%0.78SS**  trans153169.8171.100000116.4
13G52.2Low54.4Low73 Ų73130.8 Ų130.875%0.75378%0.78SS**  cis172.7142.3-14.900000117.9
14Y56Low54.3Low244 Ų244128.7 Ų128.796%0.95779%0.787SS**  trans62.7170.2163.5-57.2-63000125.5
15L53.4Low53.6Low170 Ų170134.6 Ų134.689%0.8980%0.8SS**  trans-140.2158.3-153.4-74.8170.3000118.8
16L57Low53Low176 Ų176139.7 Ų139.792%0.92182%0.821SS**  trans-171-167.9149.3-108.1161.4000116.8
17Q43.9Very low52.5Low166 Ų166140.3 Ų140.378%0.77682%0.824SS**  trans-136.6165.4-139.3177.667.8-23.800118.9
18R44.6Very low52.2Low221 Ų221138 Ų13883%0.83482%0.823SS**  trans94.6168.8164.8-53.4-170.5102.4-145.56.4119.1
19P45.7Very low51.7Low119 Ų119141.6 Ų141.677%0.77382%0.823SS**  cis-129.6-156.5-44.537.3-17.7000114.6
20S44.1Very low51.5Low120 Ų120144.7 Ų144.784%0.83983%0.826SS**  trans-126.3163.4-168.9-153.50000115.2
21P59.8Low51.2Low122 Ų122141.3 Ų141.379%0.79282%0.819SS**  trans-122177.3-160.344.3-34000118.5
22S43.8Very low50.7Low124 Ų124145 Ų14587%0.86782%0.824SS**  trans-159.2138.8168.654.50000115.4
23A48Very low50.6Low102 Ų102149.5 Ų149.584%0.84382%0.824SS**  trans-178.3154.9159.600000112.4
24P53.3Low50.4Low127 Ų127151.7 Ų151.783%0.82583%0.828SS**  trans-126.4158.1-165.540.2-25.2000120.4
25Y45.8Very low50.5Low174 Ų174148.1 Ų148.168%0.68282%0.82SS**  trans5.7149.5153.6-163-101.6000125.4T27Y25-T27 WeakPolarHBondContact OH-CG2 3.41Å
26F47.7Very low50.2Low203 Ų203147.4 Ų147.489%0.8982%0.817SS**  trans-163.3152.5141.2-92.9-61.8000113.5
27T45.6Very low50Low95 Ų95146.1 Ų146.158%0.58381%0.81SS**  trans-159.2149.5171.5-140.40000113.3Y25Y25-T27 WeakPolarHBondContact OH-CG2 3.41Å
28V56.6Low50.5Low142 Ų142143.8 Ų143.886%0.86181%0.812SS**  trans-151.7155.7170.3-178.80000110.4
29N46.9Very low50.8Low153 Ų153139.3 Ų139.382%0.81881%0.812SS**  trans-144.9159.2176.4-174.529.9000110.8
30N53Low51.2Low164 Ų164137.2 Ų137.288%0.87781%0.812SS**  trans-155.5160.3174.1-147.41.1000114.6
31G57.7Low51.8Low72 Ų72138.4 Ų138.474%0.74281%0.814SS**  trans-105.7-174.3-164.500000118.8
32Q48.1Very low51.6Low194 Ų194140.6 Ų140.691%0.90782%0.817SS**  trans-120.2144.5-169.3-102.1-166.2-20.800115.4
33M58.7Low52.4Low178 Ų178141 Ų14188%0.87782%0.815SS**  trans-178.5155.6152.252.2-173.974.200108.5
34S49Very low52.9Low119 Ų119143.9 Ų143.983%0.83281%0.81SS**  cis-161.6175.6-21.8-89.70000108
35H58.3Low52.6Low169 Ų169142.9 Ų142.978%0.78280%0.804SS**  trans-140.3161.4-177.957.9-107.7000115
36N47.4Very low53.2Low155 Ų155142.5 Ų142.583%0.82981%0.812SS**  trans-153.2169.1162.5-121-87.6000111.2
37L52Low53.5Low149 Ų149141.7 Ų141.778%0.7881%0.809SS**  trans-116.8151.2-153.6-47.190.4000115.1
38S53.9Low54.1Low117 Ų117144.9 Ų144.982%0.81882%0.817SS**  -174.2133.4125.7-167.20000111.4
39P51.3Low54.1Low127 Ų127142.9 Ų142.983%0.82581%0.807SS**  trans-104.1143179.236.9-30.6000113.9
40G53.7Low54.3Low76 Ų76140.5 Ų140.578%0.78479%0.794SS**  trans168.180.3168.700000117.7
41V57.4Low54.3Low145 Ų145138.1 Ų138.188%0.87978%0.781SS**  trans-157.3148.2152.7-102.40000109.7
42I54.8Low53.9Low168 Ų168138.9 Ų138.986%0.86278%0.775SS**  trans-102.5111.7-176.9-60.1169.6000109.7
43T62Low54.2Low132 Ų132138.6 Ų138.681%0.8177%0.767SS**  trans-143.3127.1166.5-52.80000110.2
44Q57Low54.3Low162 Ų162137.1 Ų137.176%0.75776%0.761SS**  trans-112.5169.7173-66.5-8218.900108.8
45P47.3Very low54.6Low107 Ų107136.5 Ų136.570%0.69575%0.753SS**  cis-129.9135.4-48.433.6-19.4000110.9
46I58.7Low54.3Low165 Ų165132.4 Ų132.485%0.84676%0.756SS**  trans-127.9133.5177.6-65.8180000111.8Q48I46-Q48 PolarHBondContact O-N 3.15Å
47F53.5Low55Low187 Ų187130.7 Ų130.782%0.8275%0.752SS**  trans-54.4122.8172.2-96.9-125.5000111.9P49F47-P49 HydrophobicContact CD1-CG 4.24Å
48Q58.3Low55.6Low161 Ų161127.7 Ų127.775%0.75275%0.749SS**  trans-133.376.9151.3-71.9-157.812.800110.8I46 N50I46-Q48 PolarHBondContact O-N 3.15Å; Q48-N50 PolarHBondContact O-N 3.1Å
49P56Low56.1Low100 Ų100128 Ų12865%0.64975%0.747SS**  trans-65.4129164.229.2-32.8000109.7F47F47-P49 HydrophobicContact CD1-CG 4.24Å
50N51.9Low56.7Low103 Ų103133 Ų13355%0.55175%0.75SS**  trans67.365.2151.7-166.925000118.4Q48 Y53Q48-N50 PolarHBondContact O-N 3.1Å; N50-Y53 WeakPolarHBondContact ND2-CE2 3.35Å; N50-Y53 WeakPolarHBondContact OD1-CD2 3.17Å; N50-Y53 WeakPolarHBondContact OD1-CE2 3.47Å
51L53.3Low57.8Low114 Ų114139 Ų13960%0.59776%0.755SS**  trans-103.39.7168-155.764.1000114.3Y53 L54L51-Y53 VanDerWaalsContact C-N 3.29Å; L51-Y53 PolarHBondContact O-N 3.14Å; L51-L54 HydrophobicContact CD1-CD1 3.94Å
52S49.3Very low58.9Low88 Ų88139.4 Ų139.462%0.61575%0.747SS**THydrogen-bonded Turntrans-77.3-8.2-178.649.20000114.6
53Y55.2Low60.3Low188 Ų188141.1 Ų141.174%0.73774%0.742SS**THydrogen-bonded Turntrans-89.6-6.7179.1-65.7-58.5000115.3N50 L51N50-Y53 WeakPolarHBondContact ND2-CE2 3.35Å; N50-Y53 WeakPolarHBondContact OD1-CD2 3.17Å; N50-Y53 WeakPolarHBondContact OD1-CE2 3.47Å; L51-Y53 VanDerWaalsContact C-N 3.29Å; L51-Y53 PolarHBondContact O-N 3.14Å
54L59.1Low61.4Low147 Ų147145 Ų14577%0.7774%0.742SS**SBendtrans-105.4-0.6-174.5-62.4-175.5000115.2L51L51-L54 HydrophobicContact CD1-CD1 3.94Å
55T56.7Low63Low106 Ų106143.3 Ų143.365%0.6573%0.734SS**SBendtrans-109.688.3178-174.90000113.1T57T55-T57 VanDerWaalsContact C-N 3.3Å; T55-T57 PolarHBondContact O-N 3.38Å
56G52.4Low65.1Low83 Ų83148.5 Ų148.586%0.85674%0.74SS**SBendtrans62.4-38.814500000122.2
57T61.5Low66.8Low120 Ų120142 Ų14274%0.73671%0.708SS**  trans-136.546.8-156.952.20000114.1T55 P59T55-T57 VanDerWaalsContact C-N 3.3Å; T55-T57 PolarHBondContact O-N 3.38Å; T57-P59 WeakPolarHBondContact O-CD 3.42Å; T57-P59 VanDerWaalsContact O-N 3.13Å
58A63.9Low68.9Low86 Ų86138.9 Ų138.971%0.71171%0.705SS**  trans-50.5121.7167.100000110.2R60A58-R60 PolarHBondContact O-N 2.85Å
59P64.1Low70.7Confident122 Ų122133.8 Ų133.879%0.79268%0.679SS**  trans-67.4100.6-170.124-33.2000110.5T57 K61T57-P59 WeakPolarHBondContact O-CD 3.42Å; T57-P59 VanDerWaalsContact O-N 3.13Å; P59-K61 PolarHBondContact O-N 3.25Å; P59-K61 VanDerWaalsContact O-N 3.1Å
60R65Low72.7Confident232 Ų232132 Ų13288%0.87567%0.668SS**  trans-53.8117.6174.5-64-172.8-68.5-176.1-3.4107.6A58 Q62A58-R60 PolarHBondContact O-N 2.85Å; R60-Q62 PolarHBondContact O-N 2.77Å
61K76.1Confident74.9Confident204 Ų204135.3 Ų135.389%0.88767%0.674SS**  trans-44.9111.3-173.9-81.785.1171.4-178.50109.9P59 R63P59-K61 PolarHBondContact O-N 3.25Å; P59-K61 VanDerWaalsContact O-N 3.1Å; K61-R63 PolarHBondContact O-N 3.4Å; K61-R63 VanDerWaalsContact O-N 3.1Å
62Q81.4Confident77.1Confident153 Ų153132.5 Ų132.572%0.71567%0.667SS**PPolyproline II helixtrans-56.7120.9-173.7177.159.711.900109.5R60 R64 E65R60-Q62 PolarHBondContact O-N 2.77Å; Q62-R64 PolarHBondContact O-N 3.32Å; Q62-E65 PolarHBondContact NE2-OE1 3.48Å
63R84.1Confident79.4Confident204 Ų204130 Ų13077%0.7765%0.645SS**PPolyproline II helixtrans-66.7120.8-178.3-176.8-174.9-177.8-161.75.5108.3K61 E65K61-R63 PolarHBondContact O-N 3.4Å; K61-R63 VanDerWaalsContact O-N 3.1Å; R63-E65 PolarHBondContact O-N 2.97Å
64R84.2Confident81.5Confident214 Ų214123.8 Ų123.881%0.80862%0.624SS**PPolyproline II helixtrans-57.8127.4-178-159.7178.1-158176.57.3111Q62Q62-R64 PolarHBondContact O-N 3.32Å
65E90.2Very high83.3Confident126 Ų126119.8 Ų119.859%0.58960%0.604SS**PPolyproline II helixtrans-57.5138.5-169.9-58.1-49.514200113.7Q62 R63 R105Q62-E65 PolarHBondContact NE2-OE1 3.48Å; R63-E65 PolarHBondContact O-N 2.97Å; E65-R105 PolarHBondContact O-NH1 3.09Å; E65-R105 PolarHBondContact O-NH2 2.87Å; E65-R105 VanDerWaalsContact O-NH2 3.07Å
66R92.3Very high85.3Confident215 Ų215118.2 Ų118.281%0.81159%0.59SS**PPolyproline II helixtrans-86.5129.5-177.2-177.3-178.6-179.2-176.81.9110.4
67T94.3Very high87.5Confident29 Ų29114.3 Ų114.318%0.17855%0.549CS..PPolyproline II helixtrans-78.8127.8169.7-56.40000110.2Y69 L101 R105T67-Y69 HydrophobicContact CG2-CD1 4.38Å; T67-Y69 HydrophobicContact CG2-CD2 4.44Å; T67-Y69 HydrophobicContact CG2-CE1 4.02Å; T67-Y69 HydrophobicContact CG2-CE2 4.07Å; T67-L101 HydrophobicContact CG2-CD1 3.96Å; T67-L101 HydrophobicContact CG2-CD2 3.68Å; T67-R105 WeakPolarHBondContact OG1-CD 3.32Å; T67-R105 PolarHBondContact OG1-NH1 2.82Å
68T96.6Very high89.3Confident122 Ų122112.1 Ų112.175%0.74853%0.531SS*.PPolyproline II helixtrans-99.3144161.4-60.10000107.9
69Y97.1Very high90.9Very high53 Ų53110.7 Ų110.721%0.20852%0.519CS..  trans-111.6137.4-179.1-56.5-97.7000109.2T67 L74 L77 L101 R105 W109T67-Y69 HydrophobicContact CG2-CD1 4.38Å; T67-Y69 HydrophobicContact CG2-CD2 4.44Å; T67-Y69 HydrophobicContact CG2-CE1 4.02Å; T67-Y69 HydrophobicContact CG2-CE2 4.07Å; Y69-L74 HydrophobicContact CD2-CD2 4.46Å; Y69-L74 HydrophobicContact CG-CD2 4.02Å; Y69-L77 HydrophobicContact CD1-CD1 3.92Å; Y69-L77 HydrophobicContact CE1-CD1 3.99Å; Y69-L101 HydrophobicContact CD1-CD1 3.57Å; Y69-L101 HydrophobicContact CE1-CD1 3.42Å; Y69-L101 VanDerWaalsContact CE1-CD1 3.42Å; Y69-R105 PolarHBondContact OH-O 2.87Å; Y69-W109 AromaticContact CE1-CD1 3.96Å; Y69-W109 AromaticContact CZ-CD1 3.81Å
70S98.2Very high92.5Very high62 Ų62105.9 Ų105.943%0.43449%0.487SS..  trans-75165.3168.684.30000110.9A72 Q73 L74S70-A72 PolarHBondContact O-N 2.78Å; S70-Q73 PolarHBondContact O-N 2.86Å; S70-Q73 WeakPolarHBondContact OG-CG 3.42Å; S70-Q73 PolarHBondContact OG-N 3.5Å; S70-L74 PolarHBondContact O-N 3Å; S70-L74 VanDerWaalsContact O-N 3.07Å
71R98.2Very high94.1Very high174 Ų17495.5 Ų95.566%0.65745%0.448SS*.Hα-helixtrans-56.8-52.1-180-177.364.4-143.3-1547.4111.7Q73 L74 D75R71-Q73 VanDerWaalsContact C-N 3.3Å; R71-Q73 PolarHBondContact O-N 3.33Å; R71-L74 WeakPolarHBondContact O-CA 3.41Å; R71-L74 WeakPolarHBondContact O-CB 3.32Å; R71-L74 PolarHBondContact O-N 2.87Å; R71-D75 WeakPolarHBondContact CG-OD2 3.45Å; R71-D75 IonicContact CZ-OD1 3.2Å; R71-D75 IonicContact NE-OD1 2.93Å; R71-D75 PolarHBondContact NE-OD1 3.18Å; R71-D75 IonicContact NE-OD2 3.16Å; R71-D75 PolarHBondContact NE-OD2 3.41Å; R71-D75 VanDerWaalsContact NE-OD2 3.16Å; R71-D75 IonicContact NH2-OD1 2.66Å; R71-D75 PolarHBondContact NH2-OD1 3.06Å; R71-D75 VanDerWaalsContact O-CG 3.32Å; R71-D75 PolarHBondContact O-N 3Å
72A98.2Very high95.2Very high55 Ų5589.8 Ų89.846%0.45544%0.439SS..Hα-helixtrans-60.3-34.4178.800000113.8S70 D75 M76S70-A72 PolarHBondContact O-N 2.78Å; A72-D75 PolarHBondContact O-N 3.17Å; A72-M76 HydrophobicContact CB-CE 4.45Å; A72-M76 WeakPolarHBondContact O-CE 3.48Å; A72-M76 WeakPolarHBondContact O-CG 3.45Å; A72-M76 PolarHBondContact O-N 3.35Å
73Q98.5Very high96Very high36 Ų3691.3 Ų91.317%0.16844%0.443CS..Hα-helixtrans-66.2-39.7173.4-65.5175.9-39.600111.5S70 R71 L77 I99S70-Q73 PolarHBondContact O-N 2.86Å; S70-Q73 WeakPolarHBondContact OG-CG 3.42Å; S70-Q73 PolarHBondContact OG-N 3.5Å; R71-Q73 VanDerWaalsContact C-N 3.3Å; R71-Q73 PolarHBondContact O-N 3.33Å; Q73-L77 WeakPolarHBondContact O-CB 3.49Å; Q73-L77 WeakPolarHBondContact O-CD1 3.32Å; Q73-L77 VanDerWaalsContact O-CG 3.25Å; Q73-L77 WeakPolarHBondContact O-CG 3.44Å; Q73-L77 PolarHBondContact O-N 2.86Å; Q73-L77 VanDerWaalsContact O-N 3.1Å; Q73-I99 HydrophobicContact CB-CB 4.36Å; Q73-I99 HydrophobicContact CG-CB 4.04Å; Q73-I99 PolarHBondContact NE2-O 3.19Å
74L98.5Very high96.6Very high56 Ų5683.6 Ų83.629%0.29342%0.418SS..Hα-helixtrans-66.1-44.4174.3-67.6173.1000111.3Y69 S70 R71 M76 L77 E78Y69-L74 HydrophobicContact CD2-CD2 4.46Å; Y69-L74 HydrophobicContact CG-CD2 4.02Å; S70-L74 PolarHBondContact O-N 3Å; S70-L74 VanDerWaalsContact O-N 3.07Å; R71-L74 WeakPolarHBondContact O-CA 3.41Å; R71-L74 WeakPolarHBondContact O-CB 3.32Å; R71-L74 PolarHBondContact O-N 2.87Å; L74-M76 VanDerWaalsContact C-N 3.33Å; L74-M76 PolarHBondContact O-N 3.33Å; L74-L77 CarbonylContact O-C 3.59Å; L74-L77 PolarHBondContact O-N 3.32Å; L74-L77 VanDerWaalsContact O-N 3.12Å; L74-E78 WeakPolarHBondContact O-CG 3.5Å; L74-E78 PolarHBondContact O-N 2.84Å
75D98.4Very high97.3Very high63 Ų6378.9 Ų78.934%0.33740%0.401SS..Hα-helixtrans-60.1-42.6179.1-62.3-44.7000111.8R71 A72 E78 A79R71-D75 WeakPolarHBondContact CG-OD2 3.45Å; R71-D75 IonicContact CZ-OD1 3.2Å; R71-D75 IonicContact NE-OD1 2.93Å; R71-D75 PolarHBondContact NE-OD1 3.18Å; R71-D75 IonicContact NE-OD2 3.16Å; R71-D75 PolarHBondContact NE-OD2 3.41Å; R71-D75 VanDerWaalsContact NE-OD2 3.16Å; R71-D75 IonicContact NH2-OD1 2.66Å; R71-D75 PolarHBondContact NH2-OD1 3.06Å; R71-D75 VanDerWaalsContact O-CG 3.32Å; R71-D75 PolarHBondContact O-N 3Å; A72-D75 PolarHBondContact O-N 3.17Å; D75-E78 PolarHBondContact O-N 3.37Å; D75-A79 VanDerWaalsContact O-CB 3.28Å; D75-A79 WeakPolarHBondContact O-CB 3.39Å; D75-A79 PolarHBondContact O-N 3.14Å
76M98.2Very high97.6Very high74 Ų7480.7 Ų80.737%0.36540%0.403SS..Hα-helixtrans-62.3-41.9172.8-78.7-173.6-90.100113A72 L74 L80 I95 I99A72-M76 HydrophobicContact CB-CE 4.45Å; A72-M76 WeakPolarHBondContact O-CE 3.48Å; A72-M76 WeakPolarHBondContact O-CG 3.45Å; A72-M76 PolarHBondContact O-N 3.35Å; L74-M76 VanDerWaalsContact C-N 3.33Å; L74-M76 PolarHBondContact O-N 3.33Å; M76-L80 PolarHBondContact O-N 3.32Å; M76-L80 VanDerWaalsContact O-N 3.1Å; M76-I95 HydrophobicContact CB-CD1 4.21Å; M76-I99 HydrophobicContact CB-CG2 4.04Å; M76-I99 HydrophobicContact CE-CG2 3.97Å; M76-I99 HydrophobicContact SD-CG2 3.96Å
77L98.7Very high97.9Very high0 Ų070.8 Ų70.80%037%0.367CS..Hα-helixtrans-69.1-37.2177.2-73.9166.8000112.5Y69 Q73 L74 F81 I95 I99 V106 W109 F110Y69-L77 HydrophobicContact CD1-CD1 3.92Å; Y69-L77 HydrophobicContact CE1-CD1 3.99Å; Q73-L77 WeakPolarHBondContact O-CB 3.49Å; Q73-L77 WeakPolarHBondContact O-CD1 3.32Å; Q73-L77 VanDerWaalsContact O-CG 3.25Å; Q73-L77 WeakPolarHBondContact O-CG 3.44Å; Q73-L77 PolarHBondContact O-N 2.86Å; Q73-L77 VanDerWaalsContact O-N 3.1Å; L74-L77 CarbonylContact O-C 3.59Å; L74-L77 PolarHBondContact O-N 3.32Å; L74-L77 VanDerWaalsContact O-N 3.12Å; L77-F81 WeakPolarHBondContact O-CB 3.4Å; L77-F81 PolarHBondContact O-N 3.49Å; L77-I95 HydrophobicContact CD2-CG1 4.35Å; L77-I95 HydrophobicContact CD2-CG2 4.38Å; L77-I99 HydrophobicContact CD1-CD1 3.86Å; L77-I99 HydrophobicContact CD2-CD1 3.84Å; L77-I99 HydrophobicContact CG-CD1 3.88Å; L77-V106 HydrophobicContact CD2-CG1 4.1Å; L77-V106 HydrophobicContact CD2-CG2 4.35Å; L77-W109 HydrophobicContact CB-CD2 4.07Å; L77-W109 HydrophobicContact CB-CE3 4.05Å; L77-W109 HydrophobicContact CB-CH2 3.71Å; L77-W109 HydrophobicContact CB-CZ2 3.68Å; L77-W109 HydrophobicContact CB-CZ3 3.89Å; L77-W109 HydrophobicContact CD1-CD2 3.94Å; L77-W109 HydrophobicContact CD1-CG 3.94Å; L77-W109 HydrophobicContact CD2-CD2 4.43Å; L77-W109 HydrophobicContact CD2-CE3 4.24Å; L77-W109 HydrophobicContact CG-CD2 4.39Å; L77-W109 WeakPolarHBondContact O-CH2 3.41Å; L77-F110 HydrophobicContact CD2-CE2 3.88Å
78E98.5Very high98.1Very high74 Ų7473.9 Ų73.935%0.34638%0.382SS..Hα-helixtrans-73.6-35.7176.6-62.9-145.5136.100112.2L74 D75 F81 A82 W109 R113L74-E78 WeakPolarHBondContact O-CG 3.5Å; L74-E78 PolarHBondContact O-N 2.84Å; D75-E78 PolarHBondContact O-N 3.37Å; E78-F81 PolarHBondContact O-N 3.07Å; E78-A82 PolarHBondContact O-N 3.15Å; E78-W109 HydrophobicContact CG-CH2 3.94Å; E78-W109 HydrophobicContact CG-CZ2 3.83Å; E78-R113 IonicContact OE1-CZ 2.62Å; E78-R113 IonicContact OE1-NE 2.73Å; E78-R113 PolarHBondContact OE1-NE 2.99Å; E78-R113 IonicContact OE1-NH2 2.71Å; E78-R113 PolarHBondContact OE1-NH2 3.01Å; E78-R113 IonicContact OE2-NH2 3.12Å
79A98.3Very high98.2Very high56 Ų5670.7 Ų70.746%0.46336%0.36SS..Hα-helixtrans-62.1-41.8171.100000112D75 A82 K83D75-A79 VanDerWaalsContact O-CB 3.28Å; D75-A79 WeakPolarHBondContact O-CB 3.39Å; D75-A79 PolarHBondContact O-N 3.14Å; A79-A82 PolarHBondContact O-N 3.15Å; A79-K83 PolarHBondContact O-N 3.22Å
80L98.2Very high98.2Very high22 Ų2275 Ų7512%0.11538%0.38CS..Hα-helixtrans-67.8-39.1172.3-177.461.3000111.8M76 A82 K83 T84 P87 I95 F110M76-L80 PolarHBondContact O-N 3.32Å; M76-L80 VanDerWaalsContact O-N 3.1Å; L80-A82 VanDerWaalsContact C-N 3.28Å; L80-A82 PolarHBondContact O-N 2.62Å; L80-K83 PolarHBondContact O-N 3.37Å; L80-K83 VanDerWaalsContact O-N 3.14Å; L80-T84 HydrophobicContact CD1-CG2 4.29Å; L80-T84 PolarHBondContact O-N 3.05Å; L80-P87 HydrophobicContact CD2-CB 4.31Å; L80-I95 HydrophobicContact CD2-CB 3.86Å; L80-I95 HydrophobicContact CD2-CG1 4.06Å; L80-I95 HydrophobicContact CD2-CG2 3.76Å; L80-F110 HydrophobicContact CB-CZ 4.12Å; L80-F110 HydrophobicContact CD2-CE2 4.16Å; L80-F110 HydrophobicContact CD2-CZ 3.85Å; L80-F110 HydrophobicContact CG-CZ 3.86Å
81F98.5Very high98.2Very high13 Ų1375.1 Ų75.16%0.05738%0.375CS..Hα-helixtrans-63.2-31.4176.3-173.2-93.6000113.4L77 E78 T84 R85 W109 F110 R113 R114L77-F81 WeakPolarHBondContact O-CB 3.4Å; L77-F81 PolarHBondContact O-N 3.49Å; E78-F81 PolarHBondContact O-N 3.07Å; F81-T84 WeakPolarHBondContact CA-O 3.48Å; F81-T84 CarbonylContact O-C 3.43Å; F81-R85 HydrophobicContact CD1-CG 4.43Å; F81-R85 HydrophobicContact CD2-CB 4.42Å; F81-R85 HydrophobicContact CD2-CG 4.44Å; F81-R85 HydrophobicContact CE1-CG 3.99Å; F81-R85 HydrophobicContact CE2-CB 3.94Å; F81-R85 HydrophobicContact CE2-CG 4Å; F81-R85 HydrophobicContact CZ-CB 4.15Å; F81-R85 HydrophobicContact CZ-CG 3.76Å; F81-W109 HydrophobicContact CB-CH2 4.14Å; F81-W109 HydrophobicContact CB-CZ3 4.11Å; F81-W109 HydrophobicContact CD2-CZ3 4.28Å; F81-W109 HydrophobicContact CG-CZ3 4.48Å; F81-F110 HydrophobicContact CB-CE1 3.94Å; F81-F110 HydrophobicContact CB-CZ 4.34Å; F81-F110 AromaticContact CD2-CD1 3.81Å; F81-F110 HydrophobicContact CD2-CD1 3.81Å; F81-F110 AromaticContact CD2-CE1 3.74Å; F81-F110 HydrophobicContact CD2-CE1 3.74Å; F81-F110 HydrophobicContact CG-CE1 4.34Å; F81-R113 HydrophobicContact CD1-CG 4.1Å; F81-R113 HydrophobicContact CD2-CB 4.12Å; F81-R113 HydrophobicContact CD2-CG 3.73Å; F81-R113 HydrophobicContact CE1-CG 4.01Å; F81-R113 HydrophobicContact CE2-CB 3.91Å; F81-R113 HydrophobicContact CE2-CG 3.64Å; F81-R113 HydrophobicContact CG-CG 3.97Å; F81-R113 HydrophobicContact CZ-CB 4.42Å; F81-R113 HydrophobicContact CZ-CG 3.79Å; F81-R114 HydrophobicContact CE2-CG 3.94Å
82A98.1Very high98.3Very high84 Ų8468.7 Ų68.769%0.69435%0.351SS*.Hα-helixtrans-68.3-38.117300000112.2E78 A79 L80E78-A82 PolarHBondContact O-N 3.15Å; A79-A82 PolarHBondContact O-N 3.15Å; L80-A82 VanDerWaalsContact C-N 3.28Å; L80-A82 PolarHBondContact O-N 2.62Å
83K97.8Very high98.3Very high186 Ų18670 Ų7081%0.80935%0.348SS*.Hα-helixtrans-71-48.5173.6-66-178.8179.1-172.20112.2A79 L80A79-K83 PolarHBondContact O-N 3.22Å; L80-K83 PolarHBondContact O-N 3.37Å; L80-K83 VanDerWaalsContact O-N 3.14Å
84T97.9Very high98.3Very high41 Ų4172.8 Ų72.825%0.25236%0.361SS..  trans-146.9129.5174.1176.60000112.3L80 F81 Y86 P87 L91L80-T84 HydrophobicContact CD1-CG2 4.29Å; L80-T84 PolarHBondContact O-N 3.05Å; F81-T84 WeakPolarHBondContact CA-O 3.48Å; F81-T84 CarbonylContact O-C 3.43Å; T84-Y86 PolarHBondContact O-N 2.94Å; T84-Y86 VanDerWaalsContact OG1-C 3.24Å; T84-Y86 PolarHBondContact OG1-N 3.45Å; T84-Y86 PolarHBondContact OG1-O 3.3Å; T84-P87 HydrophobicContact CG2-CB 4.02Å; T84-L91 HydrophobicContact CG2-CD1 4.26Å
85R97.6Very high98.3Very high116 Ų11670.9 Ų70.944%0.43835%0.351SS..SBendtrans-75.4-12.9173-58.2-177.2-178.691.9-7.3112.4F81 R114F81-R85 HydrophobicContact CD1-CG 4.43Å; F81-R85 HydrophobicContact CD2-CB 4.42Å; F81-R85 HydrophobicContact CD2-CG 4.44Å; F81-R85 HydrophobicContact CE1-CG 3.99Å; F81-R85 HydrophobicContact CE2-CB 3.94Å; F81-R85 HydrophobicContact CE2-CG 4Å; F81-R85 HydrophobicContact CZ-CB 4.15Å; F81-R85 HydrophobicContact CZ-CG 3.76Å; R85-R114 WeakPolarHBondContact O-CD 3.48Å; R85-R114 PolarHBondContact O-NH1 2.86Å
86Y98.5Very high98.3Very high164 Ų16468.1 Ų68.164%0.64334%0.337SS*.SBendtrans-133.372.9-178.2-63.6-88.5000110T84 R114T84-Y86 PolarHBondContact O-N 2.94Å; T84-Y86 VanDerWaalsContact OG1-C 3.24Å; T84-Y86 PolarHBondContact OG1-N 3.45Å; T84-Y86 PolarHBondContact OG1-O 3.3Å; Y86-R114 VanDerWaalsContact CE1-NE 3.27Å
87P97.9Very high98.3Very high6 Ų671.8 Ų71.84%0.03936%0.355CS..  trans-67.4134.4174.228.5-35.6000111.1L80 T84 L91 R92 F110L80-P87 HydrophobicContact CD2-CB 4.31Å; T84-P87 HydrophobicContact CG2-CB 4.02Å; P87-L91 HydrophobicContact CB-CB 3.81Å; P87-L91 HydrophobicContact CB-CD1 4.39Å; P87-R92 HydrophobicContact CB-CG 3.86Å; P87-R92 HydrophobicContact CG-CG 3.67Å; P87-R92 PolarHBondContact O-NH1 3.42Å; P87-F110 VanDerWaalsContact CD-CE1 3.48Å; P87-F110 HydrophobicContact CG-CD1 3.63Å; P87-F110 HydrophobicContact CG-CD2 4Å; P87-F110 HydrophobicContact CG-CE1 3.56Å; P87-F110 HydrophobicContact CG-CE2 3.95Å; P87-F110 HydrophobicContact CG-CG 3.87Å; P87-F110 HydrophobicContact CG-CZ 3.75Å
88D98.4Very high98.3Very high94 Ų9477.6 Ų77.650%0.50338%0.38SS..  trans-68.4169.6172-173.335.1000112.1F90 L91 R92D88-F90 VanDerWaalsContact C-N 3.35Å; D88-F90 PolarHBondContact O-N 3.37Å; D88-L91 PolarHBondContact O-N 2.82Å; D88-L91 VanDerWaalsContact O-N 3.17Å; D88-R92 WeakPolarHBondContact O-CG 3.48Å; D88-R92 PolarHBondContact O-N 3.46Å; D88-R92 PolarHBondContact O-NH1 2.73Å
89I98.2Very high98.2Very high55 Ų5574.2 Ų74.228%0.28236%0.364SS..Hα-helixtrans-50-51.5-176.2-17660.7000112.1L91 R92 E93 E103I89-L91 VanDerWaalsContact C-N 3.35Å; I89-L91 PolarHBondContact O-N 3.17Å; I89-R92 CarbonylContact O-C 3.58Å; I89-R92 WeakPolarHBondContact O-CA 3.37Å; I89-R92 PolarHBondContact O-N 2.96Å; I89-E93 HydrophobicContact CD1-CG 4.11Å; I89-E93 HydrophobicContact CG1-CG 4.36Å; I89-E93 WeakPolarHBondContact O-CG 3.44Å; I89-E93 PolarHBondContact O-N 3.32Å; I89-E103 HydrophobicContact CD1-CG 3.98Å
90F98.2Very high98.2Very high145 Ų14578.5 Ų78.564%0.63638%0.379SS*.Hα-helixtrans-59.9-41.7-179-56.8-68.6000112.7D88 R92 E93 E94D88-F90 VanDerWaalsContact C-N 3.35Å; D88-F90 PolarHBondContact O-N 3.37Å; F90-R92 VanDerWaalsContact C-N 3.32Å; F90-R92 PolarHBondContact O-N 3.08Å; F90-E93 PolarHBondContact O-N 3.01Å; F90-E94 WeakPolarHBondContact O-CB 3.4Å; F90-E94 PolarHBondContact O-N 3.3Å
91L98.1Very high98.1Very high64 Ų6478.9 Ų78.934%0.33538%0.381SS..Hα-helixtrans-67.9-30.5176-71.6172.4000112.5T84 P87 D88 I89 I95T84-L91 HydrophobicContact CG2-CD1 4.26Å; P87-L91 HydrophobicContact CB-CB 3.81Å; P87-L91 HydrophobicContact CB-CD1 4.39Å; D88-L91 PolarHBondContact O-N 2.82Å; D88-L91 VanDerWaalsContact O-N 3.17Å; I89-L91 VanDerWaalsContact C-N 3.35Å; I89-L91 PolarHBondContact O-N 3.17Å; L91-I95 WeakPolarHBondContact O-CG2 3.33Å; L91-I95 PolarHBondContact O-N 3.14Å
92R98.6Very high98.1Very high38 Ų3882 Ų8214%0.14340%0.403CS..Hα-helixtrans-76.2-33.6174.7-64.5-167.5-45.7-81.8-3.8112P87 D88 I89 F90 I95 A96 E103 V106P87-R92 HydrophobicContact CB-CG 3.86Å; P87-R92 HydrophobicContact CG-CG 3.67Å; P87-R92 PolarHBondContact O-NH1 3.42Å; D88-R92 WeakPolarHBondContact O-CG 3.48Å; D88-R92 PolarHBondContact O-N 3.46Å; D88-R92 PolarHBondContact O-NH1 2.73Å; I89-R92 CarbonylContact O-C 3.58Å; I89-R92 WeakPolarHBondContact O-CA 3.37Å; I89-R92 PolarHBondContact O-N 2.96Å; F90-R92 VanDerWaalsContact C-N 3.32Å; F90-R92 PolarHBondContact O-N 3.08Å; R92-I95 WeakPolarHBondContact O-CG2 3.35Å; R92-A96 WeakPolarHBondContact O-CB 3.41Å; R92-A96 PolarHBondContact O-N 3.3Å; R92-E103 HydrophobicContact CB-CG 4.15Å; R92-E103 IonicContact CZ-OE1 3.2Å; R92-E103 IonicContact NE-OE1 2.7Å; R92-E103 PolarHBondContact NE-OE1 3.1Å; R92-E103 IonicContact NH2-OE1 2.78Å; R92-E103 PolarHBondContact NH2-OE1 2.77Å; R92-V106 HydrophobicContact CB-CG1 4.05Å; R92-V106 HydrophobicContact CG-CG1 4.13Å
93E98.6Very high98.1Very high84 Ų8480 Ų8039%0.39338%0.379SS..Hα-helixtrans-71.8-46174.7-70.8173.4155.200111.5I89 F90 I95 A96 M97 E103I89-E93 HydrophobicContact CD1-CG 4.11Å; I89-E93 HydrophobicContact CG1-CG 4.36Å; I89-E93 WeakPolarHBondContact O-CG 3.44Å; I89-E93 PolarHBondContact O-N 3.32Å; F90-E93 PolarHBondContact O-N 3.01Å; E93-I95 PolarHBondContact O-N 3.4Å; E93-A96 WeakPolarHBondContact O-CB 3Å; E93-A96 PolarHBondContact O-N 3.45Å; E93-M97 WeakPolarHBondContact O-CG 3.28Å; E93-M97 PolarHBondContact O-N 3.4Å; E93-E103 HydrophobicContact CG-CB 4.45Å; E93-E103 HydrophobicContact CG-CG 4.14Å
94E98.5Very high98.1Very high93 Ų9373.7 Ų73.744%0.43536%0.358SS..Hα-helixtrans-55.9-48.3176.1-170.6-154.1143.200111.7F90 K98F90-E94 WeakPolarHBondContact O-CB 3.4Å; F90-E94 PolarHBondContact O-N 3.3Å; E94-K98 HydrophobicContact CG-CD 4.45Å; E94-K98 WeakPolarHBondContact O-CG 3.47Å; E94-K98 PolarHBondContact O-N 2.97Å; E94-K98 VanDerWaalsContact O-N 3.13Å; E94-K98 WeakPolarHBondContact OE1-CE 3.49Å; E94-K98 IonicContact OE1-NZ 3.8Å; E94-K98 PolarHBondContact OE1-NZ 3.42Å
95I98.4Very high98.1Very high17 Ų1774.3 Ų74.39%0.08736%0.356CS..Hα-helixtrans-73.2-33.9178.7-157.163.9000112M76 L77 L80 L91 R92 E93 K98 I99 V106M76-I95 HydrophobicContact CB-CD1 4.21Å; L77-I95 HydrophobicContact CD2-CG1 4.35Å; L77-I95 HydrophobicContact CD2-CG2 4.38Å; L80-I95 HydrophobicContact CD2-CB 3.86Å; L80-I95 HydrophobicContact CD2-CG1 4.06Å; L80-I95 HydrophobicContact CD2-CG2 3.76Å; L91-I95 WeakPolarHBondContact O-CG2 3.33Å; L91-I95 PolarHBondContact O-N 3.14Å; R92-I95 WeakPolarHBondContact O-CG2 3.35Å; E93-I95 PolarHBondContact O-N 3.4Å; I95-K98 PolarHBondContact O-N 3.18Å; I95-I99 HydrophobicContact CG1-CG2 4.39Å; I95-I99 VanDerWaalsContact O-CG1 3.26Å; I95-I99 WeakPolarHBondContact O-CG1 3.38Å; I95-I99 WeakPolarHBondContact O-CG2 3.37Å; I95-I99 PolarHBondContact O-N 3.45Å; I95-V106 HydrophobicContact CG2-CB 4.46Å; I95-V106 HydrophobicContact CG2-CG1 3.58Å; I95-V106 HydrophobicContact CG2-CG2 4.05Å
96A98.5Very high98.1Very high5 Ų568.8 Ų68.84%0.04134%0.335CS..Hα-helixtrans-59.5-46.117500000111.7R92 E93 I99 N100 L101 V106R92-A96 WeakPolarHBondContact O-CB 3.41Å; R92-A96 PolarHBondContact O-N 3.3Å; E93-A96 WeakPolarHBondContact O-CB 3Å; E93-A96 PolarHBondContact O-N 3.45Å; A96-I99 PolarHBondContact O-N 2.95Å; A96-N100 PolarHBondContact O-N 3.13Å; A96-L101 CarbonylContact C-O 3.55Å; A96-L101 VanDerWaalsContact CB-O 3.24Å; A96-L101 WeakPolarHBondContact CB-O 3.48Å; A96-L101 PolarHBondContact O-N 3.39Å; A96-L101 VanDerWaalsContact O-O 3.1Å; A96-V106 HydrophobicContact CB-CG2 3.8Å
97M98.2Very high98.1Very high150 Ų15065.5 Ų65.574%0.73933%0.326SS*.Hα-helixtrans-60.1-51.8172.9-68.4173.471.100111.1E93 I99 N100E93-M97 WeakPolarHBondContact O-CG 3.28Å; E93-M97 PolarHBondContact O-N 3.4Å; M97-I99 VanDerWaalsContact C-N 3.27Å; M97-I99 PolarHBondContact O-N 2.91Å; M97-N100 PolarHBondContact O-N 3.31Å; M97-N100 VanDerWaalsContact O-N 3.1Å
98K98.2Very high98.1Very high122 Ų12268.2 Ų68.253%0.5334%0.342SS..Hα-helixtrans-58.1-35.2-179.1-74.9172.7176.8-179.30113.8E94 I95E94-K98 HydrophobicContact CG-CD 4.45Å; E94-K98 WeakPolarHBondContact O-CG 3.47Å; E94-K98 PolarHBondContact O-N 2.97Å; E94-K98 VanDerWaalsContact O-N 3.13Å; E94-K98 WeakPolarHBondContact OE1-CE 3.49Å; E94-K98 IonicContact OE1-NZ 3.8Å; E94-K98 PolarHBondContact OE1-NZ 3.42Å; I95-K98 PolarHBondContact O-N 3.18Å
99I97.7Very high98.1Very high4 Ų464.9 Ų64.92%0.02132%0.323CS..Hα-helixtrans-96.62.4179.976.3-171.6000114Q73 M76 L77 I95 A96 M97 L101 V106Q73-I99 HydrophobicContact CB-CB 4.36Å; Q73-I99 HydrophobicContact CG-CB 4.04Å; Q73-I99 PolarHBondContact NE2-O 3.19Å; M76-I99 HydrophobicContact CB-CG2 4.04Å; M76-I99 HydrophobicContact CE-CG2 3.97Å; M76-I99 HydrophobicContact SD-CG2 3.96Å; L77-I99 HydrophobicContact CD1-CD1 3.86Å; L77-I99 HydrophobicContact CD2-CD1 3.84Å; L77-I99 HydrophobicContact CG-CD1 3.88Å; I95-I99 HydrophobicContact CG1-CG2 4.39Å; I95-I99 VanDerWaalsContact O-CG1 3.26Å; I95-I99 WeakPolarHBondContact O-CG1 3.38Å; I95-I99 WeakPolarHBondContact O-CG2 3.37Å; I95-I99 PolarHBondContact O-N 3.45Å; A96-I99 PolarHBondContact O-N 2.95Å; M97-I99 VanDerWaalsContact C-N 3.27Å; M97-I99 PolarHBondContact O-N 2.91Å; I99-L101 HydrophobicContact CD1-CB 4.36Å; I99-L101 HydrophobicContact CD1-CD1 3.88Å; I99-L101 HydrophobicContact CD1-CG 4.42Å; I99-L101 HydrophobicContact CG1-CB 3.97Å; I99-L101 HydrophobicContact CG1-CD1 4.02Å; I99-L101 HydrophobicContact CG1-CG 4.03Å; I99-V106 HydrophobicContact CD1-CG2 3.95Å
100N98Very high98.1Very high145 Ų14562.3 Ų62.378%0.77531%0.309SS*.THydrogen-bonded Turntrans54.449.1-176.5-66-84.7000113.9A96 M97A96-N100 PolarHBondContact O-N 3.13Å; M97-N100 PolarHBondContact O-N 3.31Å; M97-N100 VanDerWaalsContact O-N 3.1Å
101L96.7Very high98.1Very high30 Ų3061.5 Ų61.516%0.15731%0.305CS..SBendtrans-132154.9174.4-68.1177.4000111.1T67 Y69 A96 I99T67-L101 HydrophobicContact CG2-CD1 3.96Å; T67-L101 HydrophobicContact CG2-CD2 3.68Å; Y69-L101 HydrophobicContact CD1-CD1 3.57Å; Y69-L101 HydrophobicContact CE1-CD1 3.42Å; Y69-L101 VanDerWaalsContact CE1-CD1 3.42Å; A96-L101 CarbonylContact C-O 3.55Å; A96-L101 VanDerWaalsContact CB-O 3.24Å; A96-L101 WeakPolarHBondContact CB-O 3.48Å; A96-L101 PolarHBondContact O-N 3.39Å; A96-L101 VanDerWaalsContact O-O 3.1Å; I99-L101 HydrophobicContact CD1-CB 4.36Å; I99-L101 HydrophobicContact CD1-CD1 3.88Å; I99-L101 HydrophobicContact CD1-CG 4.42Å; I99-L101 HydrophobicContact CG1-CB 3.97Å; I99-L101 HydrophobicContact CG1-CD1 4.02Å; I99-L101 HydrophobicContact CG1-CG 4.03Å
102P97.6Very high98.2Very high78 Ų7862.8 Ų62.851%0.50631%0.313SS..  trans-64.3145.4172-20.932.6000112.4S104 R105 V106P102-S104 PolarHBondContact O-N 2.89Å; P102-S104 VanDerWaalsContact O-N 3.08Å; P102-R105 HydrophobicContact CB-CG 4.36Å; P102-R105 HydrophobicContact CG-CG 4.31Å; P102-R105 WeakPolarHBondContact O-CB 3.44Å; P102-R105 PolarHBondContact O-N 3.13Å; P102-V106 PolarHBondContact O-N 3.01Å
103E98.3Very high98.1Very high44 Ų4463.1 Ų63.121%0.20631%0.314CS..Hα-helixtrans-44.1-45.6172.9-176.9-76.216100111.6I89 R92 E93 R105 V106 Q107I89-E103 HydrophobicContact CD1-CG 3.98Å; R92-E103 HydrophobicContact CB-CG 4.15Å; R92-E103 IonicContact CZ-OE1 3.2Å; R92-E103 IonicContact NE-OE1 2.7Å; R92-E103 PolarHBondContact NE-OE1 3.1Å; R92-E103 IonicContact NH2-OE1 2.78Å; R92-E103 PolarHBondContact NH2-OE1 2.77Å; E93-E103 HydrophobicContact CG-CB 4.45Å; E93-E103 HydrophobicContact CG-CG 4.14Å; E103-R105 PolarHBondContact O-N 2.88Å; E103-V106 CarbonylContact O-C 3.6Å; E103-V106 WeakPolarHBondContact O-CA 3.31Å; E103-V106 WeakPolarHBondContact O-CB 3.23Å; E103-V106 PolarHBondContact O-N 2.92Å; E103-Q107 PolarHBondContact O-N 3.22Å; E103-Q107 PolarHBondContact OE2-NE2 3.07Å
104S97.7Very high98.1Very high52 Ų5261.8 Ų61.836%0.36431%0.305SS..Hα-helixtrans-59.4-25-177.363.10000113.6P102 V108P102-S104 PolarHBondContact O-N 2.89Å; P102-S104 VanDerWaalsContact O-N 3.08Å; S104-V108 WeakPolarHBondContact O-CB 3.42Å; S104-V108 VanDerWaalsContact O-CG2 3.23Å; S104-V108 WeakPolarHBondContact O-CG2 3.46Å; S104-V108 PolarHBondContact O-N 3.47Å; S104-V108 VanDerWaalsContact O-N 3.08Å
105R97.9Very high98.1Very high54 Ų5458.7 Ų58.720%0.20430%0.296CS..Hα-helixtrans-81.1-38.1175.2-56.7-57.6173.3122.1-11.9111.4E65 T67 Y69 P102 E103 V108 W109E65-R105 PolarHBondContact O-NH1 3.09Å; E65-R105 PolarHBondContact O-NH2 2.87Å; E65-R105 VanDerWaalsContact O-NH2 3.07Å; T67-R105 WeakPolarHBondContact OG1-CD 3.32Å; T67-R105 PolarHBondContact OG1-NH1 2.82Å; Y69-R105 PolarHBondContact OH-O 2.87Å; P102-R105 HydrophobicContact CB-CG 4.36Å; P102-R105 HydrophobicContact CG-CG 4.31Å; P102-R105 WeakPolarHBondContact O-CB 3.44Å; P102-R105 PolarHBondContact O-N 3.13Å; E103-R105 PolarHBondContact O-N 2.88Å; R105-V108 PolarHBondContact O-N 3.28Å; R105-W109 WeakPolarHBondContact O-CB 3.45Å; R105-W109 PolarHBondContact O-N 3.15Å
106V98.3Very high98Very high0 Ų063.3 Ų63.30%032%0.315CS..Hα-helixtrans-59.5-50.1167.8178.10000110.3L77 R92 I95 A96 I99 P102 E103 V108 W109 F110L77-V106 HydrophobicContact CD2-CG1 4.1Å; L77-V106 HydrophobicContact CD2-CG2 4.35Å; R92-V106 HydrophobicContact CB-CG1 4.05Å; R92-V106 HydrophobicContact CG-CG1 4.13Å; I95-V106 HydrophobicContact CG2-CB 4.46Å; I95-V106 HydrophobicContact CG2-CG1 3.58Å; I95-V106 HydrophobicContact CG2-CG2 4.05Å; A96-V106 HydrophobicContact CB-CG2 3.8Å; I99-V106 HydrophobicContact CD1-CG2 3.95Å; P102-V106 PolarHBondContact O-N 3.01Å; E103-V106 CarbonylContact O-C 3.6Å; E103-V106 WeakPolarHBondContact O-CA 3.31Å; E103-V106 WeakPolarHBondContact O-CB 3.23Å; E103-V106 PolarHBondContact O-N 2.92Å; V106-V108 PolarHBondContact O-N 3.36Å; V106-W109 WeakPolarHBondContact O-CB 3.49Å; V106-W109 PolarHBondContact O-N 2.98Å; V106-W109 VanDerWaalsContact O-N 3.13Å; V106-F110 HydrophobicContact CG1-CD2 3.67Å; V106-F110 HydrophobicContact CG1-CE2 3.81Å; V106-F110 WeakPolarHBondContact O-CD2 3.32Å; V106-F110 PolarHBondContact O-N 3.33Å
107Q98.2Very high97.9Very high96 Ų9664.2 Ų64.245%0.44932%0.321SS..Hα-helixtrans-57.5-44.5177.5177.3169.3-143.600112.7E103 K111E103-Q107 PolarHBondContact O-N 3.22Å; E103-Q107 PolarHBondContact OE2-NE2 3.07Å; Q107-K111 WeakPolarHBondContact O-CB 3.35Å; Q107-K111 PolarHBondContact O-N 3.39Å
108V98.1Very high97.8Very high63 Ų6364.1 Ų64.138%0.38231%0.313SS..Hα-helixtrans-66.7-40.11751680000111.8S104 R105 V106 K111 N112S104-V108 WeakPolarHBondContact O-CB 3.42Å; S104-V108 VanDerWaalsContact O-CG2 3.23Å; S104-V108 WeakPolarHBondContact O-CG2 3.46Å; S104-V108 PolarHBondContact O-N 3.47Å; S104-V108 VanDerWaalsContact O-N 3.08Å; R105-V108 PolarHBondContact O-N 3.28Å; V106-V108 PolarHBondContact O-N 3.36Å; V108-K111 PolarHBondContact O-N 3.08Å; V108-N112 WeakPolarHBondContact O-CB 3.47Å; V108-N112 PolarHBondContact O-N 3.38Å; V108-N112 PolarHBondContact O-OD1 3.02Å
109W98.5Very high97.6Very high24 Ų2463.6 Ų63.69%0.09131%0.312CS..Hα-helixtrans-60.1-49.3175-175.4102.1000111.2Y69 L77 E78 F81 R105 V106 K111 N112 R113Y69-W109 AromaticContact CE1-CD1 3.96Å; Y69-W109 AromaticContact CZ-CD1 3.81Å; L77-W109 HydrophobicContact CB-CD2 4.07Å; L77-W109 HydrophobicContact CB-CE3 4.05Å; L77-W109 HydrophobicContact CB-CH2 3.71Å; L77-W109 HydrophobicContact CB-CZ2 3.68Å; L77-W109 HydrophobicContact CB-CZ3 3.89Å; L77-W109 HydrophobicContact CD1-CD2 3.94Å; L77-W109 HydrophobicContact CD1-CG 3.94Å; L77-W109 HydrophobicContact CD2-CD2 4.43Å; L77-W109 HydrophobicContact CD2-CE3 4.24Å; L77-W109 HydrophobicContact CG-CD2 4.39Å; L77-W109 WeakPolarHBondContact O-CH2 3.41Å; E78-W109 HydrophobicContact CG-CH2 3.94Å; E78-W109 HydrophobicContact CG-CZ2 3.83Å; F81-W109 HydrophobicContact CB-CH2 4.14Å; F81-W109 HydrophobicContact CB-CZ3 4.11Å; F81-W109 HydrophobicContact CD2-CZ3 4.28Å; F81-W109 HydrophobicContact CG-CZ3 4.48Å; R105-W109 WeakPolarHBondContact O-CB 3.45Å; R105-W109 PolarHBondContact O-N 3.15Å; V106-W109 WeakPolarHBondContact O-CB 3.49Å; V106-W109 PolarHBondContact O-N 2.98Å; V106-W109 VanDerWaalsContact O-N 3.13Å; W109-K111 PolarHBondContact O-N 3.13Å; W109-N112 CarbonylContact O-C 3.41Å; W109-N112 PolarHBondContact O-N 3.44Å; W109-N112 VanDerWaalsContact O-N 3.12Å; W109-R113 HydrophobicContact CE3-CB 4.17Å; W109-R113 HydrophobicContact CH2-CB 4.04Å; W109-R113 HydrophobicContact CH2-CG 3.72Å; W109-R113 HydrophobicContact CZ2-CB 4.46Å; W109-R113 HydrophobicContact CZ2-CG 4.24Å; W109-R113 HydrophobicContact CZ3-CB 3.89Å; W109-R113 HydrophobicContact CZ3-CG 4Å; W109-R113 PolarHBondContact O-N 3.42Å
110F98.7Very high97.3Very high1 Ų166.7 Ų66.70%0.00433%0.327CS..Hα-helixtrans-62.4-40.5178.6-91.5-88.8000112.2L77 L80 F81 P87 V106 N112 R113 R114L77-F110 HydrophobicContact CD2-CE2 3.88Å; L80-F110 HydrophobicContact CB-CZ 4.12Å; L80-F110 HydrophobicContact CD2-CE2 4.16Å; L80-F110 HydrophobicContact CD2-CZ 3.85Å; L80-F110 HydrophobicContact CG-CZ 3.86Å; F81-F110 HydrophobicContact CB-CE1 3.94Å; F81-F110 HydrophobicContact CB-CZ 4.34Å; F81-F110 AromaticContact CD2-CD1 3.81Å; F81-F110 HydrophobicContact CD2-CD1 3.81Å; F81-F110 AromaticContact CD2-CE1 3.74Å; F81-F110 HydrophobicContact CD2-CE1 3.74Å; F81-F110 HydrophobicContact CG-CE1 4.34Å; P87-F110 VanDerWaalsContact CD-CE1 3.48Å; P87-F110 HydrophobicContact CG-CD1 3.63Å; P87-F110 HydrophobicContact CG-CD2 4Å; P87-F110 HydrophobicContact CG-CE1 3.56Å; P87-F110 HydrophobicContact CG-CE2 3.95Å; P87-F110 HydrophobicContact CG-CG 3.87Å; P87-F110 HydrophobicContact CG-CZ 3.75Å; V106-F110 HydrophobicContact CG1-CD2 3.67Å; V106-F110 HydrophobicContact CG1-CE2 3.81Å; V106-F110 WeakPolarHBondContact O-CD2 3.32Å; V106-F110 PolarHBondContact O-N 3.33Å; F110-N112 VanDerWaalsContact C-N 3.33Å; F110-N112 PolarHBondContact O-N 3.04Å; F110-R113 PolarHBondContact O-N 2.86Å; F110-R114 WeakPolarHBondContact O-CB 3.42Å; F110-R114 WeakPolarHBondContact O-CG 3.47Å; F110-R114 PolarHBondContact O-N 3.08Å
111K98.3Very high97Very high127 Ų12762.2 Ų62.255%0.55231%0.309SS*.Hα-helixtrans-58.5-45.2172.9-173.7176.667.9176.20111.5Q107 V108 W109 A115Q107-K111 WeakPolarHBondContact O-CB 3.35Å; Q107-K111 PolarHBondContact O-N 3.39Å; V108-K111 PolarHBondContact O-N 3.08Å; W109-K111 PolarHBondContact O-N 3.13Å; K111-A115 PolarHBondContact O-N 2.85Å
112N98.3Very high96.7Very high92 Ų9265.8 Ų65.849%0.49233%0.325SS..Hα-helixtrans-70.6-38.3-179.9-66.3-6.1000112.1V108 W109 F110 A115 K116V108-N112 WeakPolarHBondContact O-CB 3.47Å; V108-N112 PolarHBondContact O-N 3.38Å; V108-N112 PolarHBondContact O-OD1 3.02Å; W109-N112 CarbonylContact O-C 3.41Å; W109-N112 PolarHBondContact O-N 3.44Å; W109-N112 VanDerWaalsContact O-N 3.12Å; F110-N112 VanDerWaalsContact C-N 3.33Å; F110-N112 PolarHBondContact O-N 3.04Å; N112-A115 WeakPolarHBondContact O-CB 3.26Å; N112-A115 PolarHBondContact O-N 2.8Å; N112-K116 PolarHBondContact O-N 3Å
113R98.4Very high96.2Very high44 Ų4469.5 Ų69.517%0.16634%0.336CS..Hα-helixtrans-65-40.6176-164.765.1172.191.6-11.1111.6E78 F81 W109 F110 C117E78-R113 IonicContact OE1-CZ 2.62Å; E78-R113 IonicContact OE1-NE 2.73Å; E78-R113 PolarHBondContact OE1-NE 2.99Å; E78-R113 IonicContact OE1-NH2 2.71Å; E78-R113 PolarHBondContact OE1-NH2 3.01Å; E78-R113 IonicContact OE2-NH2 3.12Å; F81-R113 HydrophobicContact CD1-CG 4.1Å; F81-R113 HydrophobicContact CD2-CB 4.12Å; F81-R113 HydrophobicContact CD2-CG 3.73Å; F81-R113 HydrophobicContact CE1-CG 4.01Å; F81-R113 HydrophobicContact CE2-CB 3.91Å; F81-R113 HydrophobicContact CE2-CG 3.64Å; F81-R113 HydrophobicContact CG-CG 3.97Å; F81-R113 HydrophobicContact CZ-CB 4.42Å; F81-R113 HydrophobicContact CZ-CG 3.79Å; W109-R113 HydrophobicContact CE3-CB 4.17Å; W109-R113 HydrophobicContact CH2-CB 4.04Å; W109-R113 HydrophobicContact CH2-CG 3.72Å; W109-R113 HydrophobicContact CZ2-CB 4.46Å; W109-R113 HydrophobicContact CZ2-CG 4.24Å; W109-R113 HydrophobicContact CZ3-CB 3.89Å; W109-R113 HydrophobicContact CZ3-CG 4Å; W109-R113 PolarHBondContact O-N 3.42Å; F110-R113 PolarHBondContact O-N 2.86Å; R113-C117 WeakPolarHBondContact O-CB 3.46Å; R113-C117 PolarHBondContact O-N 3.12Å
114R98.3Very high95.5Very high56 Ų5674.6 Ų74.621%0.21135%0.353CS..Hα-helixtrans-63.4-38.6170.4-72.2-164.8-65.1-94.18.1112.7F81 R85 Y86 F110 C117 R118F81-R114 HydrophobicContact CE2-CG 3.94Å; R85-R114 WeakPolarHBondContact O-CD 3.48Å; R85-R114 PolarHBondContact O-NH1 2.86Å; Y86-R114 VanDerWaalsContact CE1-NE 3.27Å; F110-R114 WeakPolarHBondContact O-CB 3.42Å; F110-R114 WeakPolarHBondContact O-CG 3.47Å; F110-R114 PolarHBondContact O-N 3.08Å; R114-C117 WeakPolarHBondContact O-CB 3.24Å; R114-C117 PolarHBondContact O-N 3.41Å; R114-R118 PolarHBondContact O-N 3.41Å; R114-R118 VanDerWaalsContact O-N 3.14Å
115A98Very high94.5Very high29 Ų2976.6 Ų76.624%0.2436%0.363CS..Hα-helixtrans-64.1-48.9176.100000111.8K111 N112 C117 R118 Q119K111-A115 PolarHBondContact O-N 2.85Å; N112-A115 WeakPolarHBondContact O-CB 3.26Å; N112-A115 PolarHBondContact O-N 2.8Å; A115-C117 VanDerWaalsContact C-N 3.29Å; A115-C117 PolarHBondContact O-N 2.94Å; A115-R118 PolarHBondContact O-N 3.19Å; A115-R118 VanDerWaalsContact O-N 3.15Å; A115-Q119 WeakPolarHBondContact O-CG 3.48Å; A115-Q119 PolarHBondContact O-N 2.7Å
116K97.3Very high93Very high113 Ų11377.2 Ų77.249%0.49139%0.387SS..Hα-helixtrans-57.5-41.8174.5-171.8179.2179.3-178.60111.6N112 R118 Q119 Q120N112-K116 PolarHBondContact O-N 3Å; K116-R118 VanDerWaalsContact C-N 3.35Å; K116-R118 PolarHBondContact O-N 2.95Å; K116-Q119 PolarHBondContact O-N 2.99Å; K116-Q120 HydrophobicContact CG-CG 4.41Å; K116-Q120 WeakPolarHBondContact O-CB 3.44Å; K116-Q120 VanDerWaalsContact O-CG 3.32Å; K116-Q120 WeakPolarHBondContact O-CG 3.25Å; K116-Q120 PolarHBondContact O-N 2.93Å
117C95.3Very high91.3Very high25 Ų2582.2 Ų82.217%0.16942%0.418CS..Hα-helixtrans-59.4-40.4176.9-169.70000113R113 R114 A115 A121 C170R113-C117 WeakPolarHBondContact O-CB 3.46Å; R113-C117 PolarHBondContact O-N 3.12Å; R114-C117 WeakPolarHBondContact O-CB 3.24Å; R114-C117 PolarHBondContact O-N 3.41Å; A115-C117 VanDerWaalsContact C-N 3.29Å; A115-C117 PolarHBondContact O-N 2.94Å; C117-A121 PolarHBondContact O-N 2.81Å; C117-C170 VanDerWaalsContact SG-SG 3.68Å
118R96Very high89.5Confident147 Ų14781.7 Ų81.756%0.55543%0.429SS*.Hα-helixtrans-70.9-40.4176-67.9-164.8-53.8-85.21.4112.4R114 A115 K116 Q120 A121 Q122R114-R118 PolarHBondContact O-N 3.41Å; R114-R118 VanDerWaalsContact O-N 3.14Å; A115-R118 PolarHBondContact O-N 3.19Å; A115-R118 VanDerWaalsContact O-N 3.15Å; K116-R118 VanDerWaalsContact C-N 3.35Å; K116-R118 PolarHBondContact O-N 2.95Å; R118-Q120 VanDerWaalsContact C-N 3.33Å; R118-Q120 PolarHBondContact O-N 3.44Å; R118-A121 WeakPolarHBondContact O-CB 3.33Å; R118-A121 PolarHBondContact O-N 3.33Å; R118-A121 VanDerWaalsContact O-N 3.17Å; R118-Q122 WeakPolarHBondContact O-CG 3.32Å; R118-Q122 PolarHBondContact O-N 2.71Å
119Q93.9Very high87.6Confident111 Ų11183.5 Ų83.552%0.51944%0.443SS..Hα-helixtrans-60.1-43.4175.4-69.4167-24.700111.4A115 K116 A121 Q122 Q123A115-Q119 WeakPolarHBondContact O-CG 3.48Å; A115-Q119 PolarHBondContact O-N 2.7Å; K116-Q119 PolarHBondContact O-N 2.99Å; Q119-A121 VanDerWaalsContact C-N 3.31Å; Q119-A121 PolarHBondContact O-N 3.05Å; Q119-Q122 PolarHBondContact O-N 2.8Å; Q119-Q123 VanDerWaalsContact O-CG 3.31Å; Q119-Q123 WeakPolarHBondContact O-CG 3.38Å; Q119-Q123 PolarHBondContact O-N 3.43Å
120Q92.7Very high85.6Confident70 Ų7087.3 Ų87.333%0.32748%0.479SS..Hα-helixtrans-65.2-31175.9-71.4176.3-58.600113K116 R118 R124K116-Q120 HydrophobicContact CG-CG 4.41Å; K116-Q120 WeakPolarHBondContact O-CB 3.44Å; K116-Q120 VanDerWaalsContact O-CG 3.32Å; K116-Q120 WeakPolarHBondContact O-CG 3.25Å; K116-Q120 PolarHBondContact O-N 2.93Å; R118-Q120 VanDerWaalsContact C-N 3.33Å; R118-Q120 PolarHBondContact O-N 3.44Å; Q120-R124 WeakPolarHBondContact O-CG 3.45Å
121A91.5Very high83.5Confident50 Ų5092.6 Ų92.641%0.41352%0.523SS..Hα-helixtrans-71.1-46.2172.600000111.8C117 R118 Q119 Q123 R124 T125C117-A121 PolarHBondContact O-N 2.81Å; R118-A121 WeakPolarHBondContact O-CB 3.33Å; R118-A121 PolarHBondContact O-N 3.33Å; R118-A121 VanDerWaalsContact O-N 3.17Å; Q119-A121 VanDerWaalsContact C-N 3.31Å; Q119-A121 PolarHBondContact O-N 3.05Å; A121-Q123 VanDerWaalsContact C-N 3.3Å; A121-Q123 PolarHBondContact O-N 3.5Å; A121-R124 WeakPolarHBondContact O-CB 3.41Å; A121-R124 PolarHBondContact O-N 2.96Å; A121-T125 PolarHBondContact O-N 3.31Å
122Q89.3Confident81.2Confident105 Ų10590 Ų9049%0.49153%0.533SS..Hα-helixtrans-61.7-36.4178-70.6170.9-42.600112.6R118 Q119 R124 T125R118-Q122 WeakPolarHBondContact O-CG 3.32Å; R118-Q122 PolarHBondContact O-N 2.71Å; Q119-Q122 PolarHBondContact O-N 2.8Å; Q122-R124 PolarHBondContact O-N 3.12Å; Q122-T125 PolarHBondContact O-N 3.1Å; Q122-T125 PolarHBondContact O-OG1 3.4Å; Q122-T125 VanDerWaalsContact O-OG1 3.08Å
123Q86.8Confident78.8Confident156 Ų15690.5 Ų90.573%0.72955%0.549SS*.Hα-helixtrans-64.6-24.7173.8-75170.9-18.400113.3Q119 A121Q119-Q123 VanDerWaalsContact O-CG 3.31Å; Q119-Q123 WeakPolarHBondContact O-CG 3.38Å; Q119-Q123 PolarHBondContact O-N 3.43Å; A121-Q123 VanDerWaalsContact C-N 3.3Å; A121-Q123 PolarHBondContact O-N 3.5Å
124R83.2Confident76.4Confident152 Ų15298.1 Ų98.157%0.57458%0.584SS**Hα-helixtrans-84.6-22.7176.9-71.7174.5171.4-147.7-12.6113.4Q120 A121 Q122 G126 S169Q120-R124 WeakPolarHBondContact O-CG 3.45Å; A121-R124 WeakPolarHBondContact O-CB 3.41Å; A121-R124 PolarHBondContact O-N 2.96Å; Q122-R124 PolarHBondContact O-N 3.12Å; R124-G126 VanDerWaalsContact C-N 3.33Å; R124-S169 PolarHBondContact NH1-O 3.27Å; R124-S169 VanDerWaalsContact NH1-O 3.13Å; R124-S169 PolarHBondContact NH1-OG 3.47Å
125T77.9Confident74Confident93 Ų93105 Ų10557%0.57162%0.615SS**SBendtrans-87.54.3-178.454.90000114.1A121 Q122 T127A121-T125 PolarHBondContact O-N 3.31Å; Q122-T125 PolarHBondContact O-N 3.1Å; Q122-T125 PolarHBondContact O-OG1 3.4Å; Q122-T125 VanDerWaalsContact O-OG1 3.08Å; T125-T127 PolarHBondContact O-N 3.24Å; T125-T127 PolarHBondContact O-OG1 3.1Å; T125-T127 PolarHBondContact OG1-OG1 3.06Å
126G65.4Low71.3Confident68 Ų68109.4 Ų109.470%0.70164%0.635SS**SBendtrans70.6-25.1174.800000115.7R124 A128R124-G126 VanDerWaalsContact C-N 3.33Å; G126-A128 VanDerWaalsContact C-N 3.26Å; G126-A128 PolarHBondContact O-N 3.07Å
127T63.7Low68.6Low105 Ų105107.6 Ų107.664%0.64465%0.648SS**  trans-72.972.9176.544.50000111.9T125 P129T125-T127 PolarHBondContact O-N 3.24Å; T125-T127 PolarHBondContact O-OG1 3.1Å; T125-T127 PolarHBondContact OG1-OG1 3.06Å; T127-P129 WeakPolarHBondContact O-CD 3.41Å
128A59.8Low65.9Low84 Ų84112.8 Ų112.869%0.69467%0.674SS**  trans-54.2121.9167.400000109.3G126 A130G126-A128 VanDerWaalsContact C-N 3.26Å; G126-A128 PolarHBondContact O-N 3.07Å; A128-A130 PolarHBondContact O-N 3.07Å; A128-A130 VanDerWaalsContact O-N 3.09Å
129P59.1Low63.3Low102 Ų102109.4 Ų109.466%0.66269%0.685SS**  trans-66.8115-179.826-32.7000108.9T127 A131T127-P129 WeakPolarHBondContact O-CD 3.41Å; P129-A131 VanDerWaalsContact C-N 3.33Å; P129-A131 PolarHBondContact O-N 2.78Å
130A55.1Low61.1Low103 Ų103111.8 Ų111.885%0.85170%0.696SS**  trans-65.688.5-177.600000111A128 G132A128-A130 PolarHBondContact O-N 3.07Å; A128-A130 VanDerWaalsContact O-N 3.09Å; A130-G132 VanDerWaalsContact C-N 3.26Å; A130-G132 PolarHBondContact O-N 2.99Å
131A56.1Low58.8Low112 Ų112113.6 Ų113.693%0.92672%0.717SS**  trans-77.968.6-173.100000112.6P129P129-A131 VanDerWaalsContact C-N 3.33Å; P129-A131 PolarHBondContact O-N 2.78Å
132G48.2Very low56.8Low74 Ų74118.9 Ų118.976%0.76373%0.733SS**  trans132.387.3162.100000116.1A130A130-G132 VanDerWaalsContact C-N 3.26Å; A130-G132 PolarHBondContact O-N 2.99Å
133A47.8Very low54.4Low102 Ų102122.1 Ų122.184%0.84375%0.745SS**  trans-147.7108.2156.700000109.7
134K48.7Very low52.5Low203 Ų203123.6 Ų123.688%0.88375%0.752SS**  trans-106.9107.1176.5-77-168.1174.1-1670111.2
135K48.8Very low50.4Low200 Ų200123.3 Ų123.387%0.8776%0.762SS**  trans-160.3108.4156.6-102.2179.5178-176.60105.6
136N40.9Very low49Very low123 Ų123125.4 Ų125.466%0.65877%0.774SS**  66.3108.557.3-156.30.3000112.5L297N136-L297 HydrophobicContact CB-CD1 3.52Å; N136-L297 HydrophobicContact CB-CD2 4.28Å; N136-L297 VanDerWaalsContact CG-CD1 3.5Å
137G40.1Very low47.9Very low75 Ų75129.6 Ų129.677%0.77378%0.776SS**  trans160.256.8-174.900000113.9
138N39Very low46.9Very low133 Ų133128 Ų12871%0.71178%0.78SS**  trans-81.1144.8175.4-178.428.9000111.5
139G41Very low46.3Very low76 Ų76127.7 Ų127.778%0.78477%0.77SS**  trans-168.598.2176.800000112.3
140Q48Very low46.2Very low162 Ų162127.9 Ų127.976%0.75776%0.762SS**  trans-97.6142.7-176.3-57.6165.3-89.500111.8
141S44Very low46.2Very low108 Ų108128.9 Ų128.976%0.75575%0.747SS**  trans-176.2114.9134.4-85.50000116
142Q49Very low45.9Very low160 Ų160128.9 Ų128.975%0.74873%0.728SS**  trans53.5132.1131.4-55.3-166.538.300124.3
143K40.6Very low46.3Very low174 Ų174133 Ų13376%0.75773%0.727SS**  trans67.3112.5140.2-74.3178.5174.3-177.60120.8
144Q46.7Very low46.3Very low186 Ų186133.4 Ų133.487%0.86972%0.72SS**  -175-179.490.3-114164.9-14.700111.8
145D38Very low46Very low147 Ų147130.4 Ų130.479%0.78671%0.713SS**  trans-109.4168-152.8-46.2-94.2000116.3
146V49.5Very low45.7Very low137 Ų137129.4 Ų129.483%0.8371%0.711SS**  trans149.5110.3140.4167.10000115.2
147E41.7Very low45.8Very low155 Ų155131.7 Ų131.772%0.72472%0.718SS**  trans42.7139.5144.3-155.1159.3-174.600124.9
148G43.9Very low45.7Very low72 Ų72136.8 Ų136.874%0.74272%0.719SS**  trans-172.3-8.1-178.600000126.4
149T46.9Very low45.8Very low78 Ų78138.2 Ų138.248%0.47972%0.719SS.*  trans69.5116.9158.3-69.90000124.6
150Q56.5Low45.6Very low105 Ų105142.6 Ų142.649%0.49172%0.717SS.*  trans57.4162.7142.6-68-177.668.300122H5H5-Q150 VanDerWaalsContact CG-O 3.3Å; H5-Q150 PolarHBondContact ND1-O 3.28Å; H5-Q150 VanDerWaalsContact ND1-O 3.1Å
151K55.2Low45.1Very low125 Ų125143.5 Ų143.554%0.54372%0.718SS.*  cis-155155.9-14.8-113.3-169.7-173.9-64.90107.8H5H5-K151 WeakPolarHBondContact CE1-CA 3.4Å; H5-K151 PolarHBondContact CE1-N 3.45Å; H5-K151 PolarHBondContact CE1-O 3.18Å; H5-K151 PolarHBondContact ND1-N 3.46Å; H5-K151 VanDerWaalsContact ND1-N 3.15Å; H5-K151 WeakPolarHBondContact NE2-CA 2.99Å; H5-K151 PolarHBondContact NE2-N 3.21Å
152E48.8Very low44.8Very low111 Ų111145.7 Ų145.752%0.51972%0.717SS.*  cis-165.2167.6-17.7-142.6154.8-125.200112.7H5H5-E152 PolarHBondContact CE1-N 3.25Å; H5-E152 WeakPolarHBondContact NE2-CA 3.44Å; H5-E152 PolarHBondContact NE2-N 3.47Å
153Q58Low44.1Very low160 Ų160147.1 Ų147.175%0.74872%0.723SS**  trans26.8151.4147-81170.3-19.400125.3
154T46.7Very low43.9Very low112 Ų112143.9 Ų143.969%0.68772%0.723SS**  cis-153.4-129.1-24.113.70000109.6
155D42.1Very low43.6Very low140 Ų140141.5 Ų141.575%0.74971%0.714SS**  cis-165179.9-1.7-135.8-61.1000113
156E43.4Very low43.7Very low178 Ų178140 Ų14083%0.83272%0.716SS**  trans-111.9-178.3-178.8-54.1-172103.200112.4
157E42.1Very low43.3Very low171 Ų171139.7 Ų139.780%0.79971%0.708SS**  cis-161-163.811.1-152.3-148.6-178.600110.6
158K38.2Very low43.5Very low182 Ų182139.4 Ų139.479%0.79171%0.711SS**  trans93.289.4149.1-155.6172.1-175.21740122.4
159F42Very low43.8Very low164 Ų164139.4 Ų139.472%0.71970%0.7SS**  70.9109.6119.8-145.5-101.8000122.4
160K36.8Very low44Very low167 Ų167137.8 Ų137.873%0.72669%0.691SS**  trans48.393.4147.7-57.8-172.1-170.2176.50119.9
161K37.5Very low43.5Very low181 Ų181141.3 Ų141.379%0.78771%0.708SS**  trans-139.3128.4131.6-89.1-158.2167.9-1750108.2
162E36.7Very low43.1Very low155 Ų155139.7 Ų139.772%0.72471%0.712SS**  65.8106.380.7-65.1177.2157.100113
163E34Very low42.8Very low190 Ų190141 Ų14189%0.88873%0.727SS**  trans53.759.9143.8-151.1160.4-17500119.7
164S37.9Very low42.1Very low106 Ų106138.1 Ų138.174%0.74173%0.731SS**  trans-135.7118.1150.649.80000108.9
165I40.5Very low41.6Very low135 Ų135140.9 Ų140.969%0.69274%0.742SS**  56.275.965.2-49.4-177.8000111.6I167I165-I167 HydrophobicContact CG2-CD1 4.39Å; I165-I167 HydrophobicContact CG2-CG1 4Å
166S39.9Very low41.7Very low117 Ų117137.5 Ų137.582%0.81874%0.74SS**  trans-13472.2151.3-88.90000109.5N168S166-N168 PolarHBondContact O-N 3.47Å
167I41.3Very low41.7Very low130 Ų130135.7 Ų135.767%0.66774%0.741SS**  trans-50.2123.7153.99172000108.3I165I165-I167 HydrophobicContact CG2-CD1 4.39Å; I165-I167 HydrophobicContact CG2-CG1 4Å
168N45.5Very low41.9Very low149 Ų149131.7 Ų131.780%0.79774%0.738SS**  trans178.7169.8147.4-94.4-35.6000112.5S166 C170S166-N168 PolarHBondContact O-N 3.47Å; N168-C170 PolarHBondContact O-N 2.89Å
169S50.4Low42.2Very low71 Ų71131 Ų13150%0.49774%0.737SS.*SBendtrans80.6-19.5172.1-151.60000119.4R124R124-S169 PolarHBondContact NH1-O 3.27Å; R124-S169 VanDerWaalsContact NH1-O 3.13Å; R124-S169 PolarHBondContact NH1-OG 3.47Å
170C49.5Very low42.5Very low45 Ų45131.6 Ų131.630%0.30474%0.739SS.*SBendtrans-100.1-10.5-172.7-590000116.7C117 N168C117-C170 VanDerWaalsContact SG-SG 3.68Å; N168-C170 PolarHBondContact O-N 2.89Å
171Q46.2Very low43.1Very low178 Ų178127.9 Ų127.983%0.83273%0.734SS**  trans-103.4117.6-178.7-68.1177.8-3.300110.3
172S46.4Very low43.6Very low91 Ų91126.1 Ų126.164%0.63673%0.734SS**  trans-168.6154.8164-158.20000111.4
173V43.1Very low44Very low138 Ų138122.6 Ų122.684%0.83673%0.731SS**  trans54.6100.9172.6-61.70000118.8
174A44.8Very low44.8Very low101 Ų101121.9 Ų121.984%0.83573%0.73SS**  trans-151.452.9154.700000110.7
175N35.6Very low45.4Very low169 Ų169122.8 Ų122.890%0.90473%0.73SS**  trans-108.3139.8176.8-77.219.3000111.1
176G43.5Very low45.7Very low70 Ų70122.1 Ų122.172%0.72273%0.733SS**  trans130.3134.8-176.900000110
177T44Very low46.1Very low139 Ų139121.2 Ų121.285%0.85373%0.727SS**  cis-156.9159.15.844.40000110.4
178A46.5Very low46.6Very low87 Ų87120.8 Ų120.872%0.71974%0.735SS**  trans69.115016900000116.3
179E44.8Very low46.6Very low167 Ų167122.9 Ų122.978%0.7874%0.74SS**  cis-158.1164.5-10.6-119.4175.9122.800110.9
180K47.2Very low46.6Very low177 Ų177123.5 Ų123.577%0.7775%0.75SS**  trans30.1111.1163.1-85.1173.7169.5169.10120.2
181S50.7Low46.7Very low89 Ų89126.9 Ų126.962%0.62277%0.771SS**  8514782.788.60000112.7
182D46.6Very low46.4Very low145 Ų145123.2 Ų123.278%0.77577%0.765SS**  cis-145.3174.210.9-79-73.5000111.5
183A46.3Very low46.3Very low80 Ų80125.9 Ų125.966%0.66177%0.77SS**  trans57.7120.2163.100000118.8
184M50.3Low46.4Very low176 Ų176127.1 Ų127.187%0.86777%0.771SS**  67.1132.250.6101.3-169.2160.600113.7
185V50Low46.2Very low124 Ų124130 Ų13075%0.75277%0.773SS**  cis-161.4163.22.973.20000111
186T46.5Very low46.2Very low122 Ų122126.6 Ų126.675%0.74876%0.762SS**  trans68.3149.4162.1-630000117.5
187S50Low46.4Very low98 Ų98128.7 Ų128.769%0.68577%0.766SS**  cis172.6144.7-42.9-94.30000107.6
188S51Low46.2Very low120 Ų120132.9 Ų132.984%0.83977%0.768SS**  trans66.8151.6179-520000114.5
189Q44.4Very low45.9Very low194 Ų194132.5 Ų132.591%0.90777%0.773SS**  cis-140.3171.19.4-156.6166.546.300110.5
190A50.6Low45.9Very low84 Ų84135.5 Ų135.569%0.69478%0.778SS**  trans-142.2177.3-169.900000110.8
191P51.5Low45.6Very low116 Ų116132.7 Ų132.775%0.75378%0.781SS**  cis-133-153.6-5039-22.6000111.4
192S40.5Very low45.7Very low101 Ų101134.3 Ų134.371%0.70679%0.79SS**  trans76.1152.1179.980.60000114.1
193I44Very low45.5Very low146 Ų146133.2 Ų133.275%0.74979%0.793SS**  cis-126.4165.522.84.1-78.6000115.1
194L46.7Very low45.4Very low164 Ų164137.2 Ų137.286%0.85980%0.802SS**  trans-9.3137.5157.7-62.9160.2000118.9
195N39.1Very low45.4Very low163 Ų163134 Ų13487%0.87280%0.797SS**  -162.9166.6100.4-158.812000112.3
196S37.2Very low45Very low97 Ų97132.2 Ų132.268%0.67880%0.795SS**  trans-132.5133.8173-177.30000110.9
197S47Very low44.7Very low114 Ų114131.5 Ų131.580%0.79779%0.794SS**  trans-162.3164.4156.4-159.80000111.6
198Y38.7Very low44.4Very low226 Ų226135.2 Ų135.289%0.88680%0.8SS**  trans-96.8150.6-175.6-67-104.6000112
199G41.8Very low44Very low80 Ų80135.4 Ų135.483%0.82580%0.796SS**  trans-166.4129.4172.700000113.3
200Y43.2Very low44Very low229 Ų229132.9 Ų132.990%0.89879%0.794SS**  trans-97.3139.4178.7-111.5-104.3000111
201S41.6Very low43.6Very low118 Ų118135 Ų13583%0.82580%0.798SS**  170.8140.4128.7-78.60000113.4
202P53.4Low43.3Very low124 Ų124137 Ų13781%0.80580%0.803SS**  trans-101.1166170.138.8-33.2000113.4
203S42.6Very low43.8Very low122 Ų122137.1 Ų137.185%0.85380%0.799SS**  trans-151.9174.6165-163.80000112.1
204I43.7Very low44.2Very low163 Ų163138 Ų13884%0.83681%0.806SS**  trans-137.7137.5-149-32174.3000114
205S49Very low44.3Very low110 Ų110134.8 Ų134.877%0.76980%0.802SS**  trans-170.1135154.3-124.10000108.2
206A43.6Very low44.7Very low86 Ų86130.7 Ų130.771%0.71180%0.799SS**  cis77.5135.841.300000113.6
207C38.3Very low45.1Very low107 Ų107134.3 Ų134.372%0.72381%0.807SS**  cis-170.8170.3-9.652.20000112.5
208Q45.1Very low45.1Very low175 Ų175135.5 Ų135.582%0.81880%0.804SS**  trans130.3126.2161.4-72.2159.6106.600112.5
209T41Very low45.6Very low124 Ų124132.5 Ų132.576%0.76180%0.8SS**  cis83.7116.448.8-54.40000111.1
210V46.4Very low46Very low142 Ų142135.1 Ų135.186%0.86180%0.8SS**  -148.5-164.677.3-75.50000114
211V42Very low46.1Very low129 Ų129129.5 Ų129.578%0.78279%0.792SS**  trans-128.6165-151.2-60.60000116
212N44.1Very low45.9Very low158 Ų158135.7 Ų135.785%0.84580%0.797SS**  trans-148.6158.1140.6-162.75.4000110.2
213T51.1Low45.1Very low103 Ų103132.8 Ų132.863%0.63279%0.789SS**  trans-130.4137-160.350.50000115.2
214N51.7Low44.9Very low165 Ų165134.3 Ų134.388%0.88279%0.787SS**  trans-145.699.1142.5-85.9-51.8000105.9
215A50.3Low44.7Very low96 Ų96134.8 Ų134.879%0.79379%0.786SS**  68.19678.400000111.8
216G46.2Very low44.1Very low77 Ų77135.2 Ų135.279%0.79479%0.788SS**  trans169.855.5-174.400000116.9
217M46.3Very low43.8Very low172 Ų172134.2 Ų134.285%0.84779%0.786SS**  trans39.2112.8150.3-71.8-61.6-168.700121.4
218L46.8Very low44Very low139 Ų139134.1 Ų134.173%0.72879%0.787SS**  84.2141.7124.6-128.668.8000121.8
219M50.4Low43.8Very low164 Ų164131.5 Ų131.581%0.80879%0.787SS**  trans82.2138.9162.8-58-52.5-179.800120.7
220T48.6Very low44.1Very low135 Ų135132 Ų13283%0.82878%0.782SS**  trans-112.2178.4-161.2140000111.5
221P46.7Very low44Very low111 Ų111132 Ų13272%0.72178%0.776SS**  trans-101.3-171.5-14241.5-41000116.1
222R37.4Very low43.9Very low248 Ų248130.7 Ų130.794%0.93677%0.769SS**  trans100.1157.2177.3-56.7169.177.2153.34.8113.5
223G35.5Very low44Very low62 Ų62129 Ų12964%0.63976%0.764SS**  trans92.9121.5-171.400000110.4
224L39.3Very low43.3Very low154 Ų154130.8 Ų130.881%0.80677%0.77SS**  cis61.1133.844.9-78.792.3000115.4
225Q38.6Very low42.4Very low174 Ų174127.6 Ų127.681%0.81376%0.761SS**  trans70.9125.1165.3-65.5164.667.400114.3
226S37.3Very low41.9Very low118 Ų118128.1 Ų128.183%0.82576%0.758SS**  cis90.8126.443.9-173.60000111.4
227G37.7Very low41.7Very low65 Ų65129.3 Ų129.367%0.6776%0.755SS**  trans78.4162.2-166.400000112.5
228S42.4Very low41.5Very low106 Ų106126.6 Ų126.674%0.74175%0.753SS**  cis-156.8138.9-7.5-80.10000110
229C39.7Very low41.5Very low120 Ų120124.2 Ų124.281%0.81175%0.748SS**  -177.6143.9123.6540000110.6
230M46.9Very low41.6Very low135 Ų135125.6 Ų125.667%0.66575%0.752SS**  cis-156.8137.8-23-98.4-44.3178.200107
231L44.3Very low41.4Very low141 Ų141122.9 Ų122.974%0.73875%0.751SS**  trans59.7153.8134.8-53.3178.9000120
232T40.7Very low41.4Very low101 Ų101121.3 Ų121.362%0.6276%0.755SS**  cis-166148.8-6.119.70000111.4
233T46.7Very low41.7Very low123 Ų123114.4 Ų114.476%0.75575%0.751SS**  trans55.9153.2140.859.70000122.8
234N35.7Very low41.9Very low141 Ų141121.4 Ų121.475%0.75476%0.759SS**  cis-166.2166.9-30.9-157.218.7000110.1
235S33.2Very low42.4Very low98 Ų98121.9 Ų121.969%0.68576%0.761SS**  trans2.2117.8157.4-57.30000121.6
236S40.4Very low42.6Very low106 Ų106117.4 Ų117.474%0.74175%0.747SS**  -179.8108.9122.549.30000108.7
237S40.7Very low43Very low103 Ų103116.8 Ų116.872%0.7274%0.74SS**  95.612953.766.90000112.8
238S42.9Very low43.1Very low115 Ų115122.4 Ų122.480%0.80475%0.749SS**  trans67.5149.9177.979.30000116.3
239S47.1Very low43.2Very low89 Ų89127.2 Ų127.262%0.62275%0.752SS**  cis-162.8156.2-19.5-100.60000110.3
240H52.8Low43.9Very low192 Ų192126.5 Ų126.589%0.88974%0.744SS**  trans64.1154.6177.5-42.2-71000114.9
241G44Very low43.8Very low79 Ų79125.9 Ų125.981%0.81475%0.75SS**  cis140.9124.5-6.100000111.2
242G45.6Very low43.8Very low78 Ų78125.4 Ų125.480%0.80476%0.757SS**  trans134.8117.4170.200000117
243A44.7Very low44.2Very low102 Ų102125.6 Ų125.684%0.84376%0.762SS**  trans33.1113.9143.900000122.1
244Y39Very low44.2Very low209 Ų209126.6 Ų126.682%0.8276%0.763SS**  trans-63.8127.1158.6-178.2-82000113.8P246Y244-P246 HydrophobicContact CD1-CG 4.44Å; Y244-P246 VanDerWaalsContact CE1-CD 3.5Å; Y244-P246 HydrophobicContact CE1-CG 3.85Å
245I50.8Low44.9Very low165 Ų165125.2 Ų125.285%0.84676%0.759SS**  trans-145.7122.1154.5-56.8-176.2000111.4
246P42Very low45.6Very low79 Ų79125.8 Ų125.851%0.51376%0.761SS.*  trans-116.8-176.9162.141.6-32.2000111.5Y244Y244-P246 HydrophobicContact CD1-CG 4.44Å; Y244-P246 VanDerWaalsContact CE1-CD 3.5Å; Y244-P246 HydrophobicContact CE1-CG 3.85Å
247P45.5Very low45.5Very low105 Ų105129.3 Ų129.368%0.68276%0.759SS**  -128137.7-54.735.9-22000112.3
248Q40.6Very low45.6Very low184 Ų184134 Ų13486%0.8676%0.763SS**  trans-144.3165153.5-61.9-58.5-20.500105.5
249Y43.9Very low45.6Very low207 Ų207135.4 Ų135.481%0.81277%0.767SS**  cis-154.3-178.928.6-174.5-113.5000110.7
250V53.7Low45.6Very low105 Ų105134.8 Ų134.864%0.63677%0.767SS**  trans-69.1152-177.4-85.10000114.1
251P46Very low45.2Very low122 Ų122133.7 Ų133.779%0.79276%0.762SS**  trans-85.4143.6-176.834.4-34.7000112.7
252C43.4Very low45.2Very low130 Ų130135.6 Ų135.688%0.87876%0.763SS**  trans-131.7152.4163.6-96.40000111.9
253S49.3Very low45.5Very low105 Ų105137.6 Ų137.673%0.73476%0.762SS**  trans-44.7126.617544.70000115.4
254N47.3Very low45.6Very low144 Ų144143.2 Ų143.277%0.7776%0.762SS**  5.7134.6126.5-152.110.8000117.6
255V50Low46.1Very low112 Ų112140.4 Ų140.468%0.67976%0.761SS**  trans59.5153.6173.2-78.30000117.3
256P47.4Very low46.1Very low111 Ų111136.5 Ų136.572%0.72175%0.753SS**  cis-131.314117.738.4-20000118.9
257Y38.5Very low46.6Very low180 Ų180138.1 Ų138.171%0.70677%0.767SS**  trans61.6149.8132.5-82.7-77.6000125.4
258Y42.3Very low47Very low202 Ų202141.2 Ų141.279%0.79277%0.774SS**  trans52.8104.3155-66.6-57.5000120.5
259T44.5Very low47.8Very low144 Ų144137.6 Ų137.688%0.88377%0.766SS**  trans-114129.7140.651.50000109.1
260A46.2Very low48.5Very low76 Ų76134.3 Ų134.363%0.62877%0.768SS**  trans148.7136.6166.300000110.9
261E44.3Very low48Very low168 Ų168136.9 Ų136.979%0.78578%0.778SS**  trans35.992166.77.7-60.9159.300119.5
262S45.1Very low48.4Very low119 Ų119136.3 Ų136.383%0.83278%0.775SS**  -176.3124.8118.4-81.10000111.9
263P52.1Low48.5Very low120 Ų120139.3 Ų139.378%0.77977%0.773SS**  trans-92.9127.8178.334-30.4000111.9
264Y45.4Very low48.7Very low220 Ų220140.2 Ų140.286%0.86377%0.774SS**  trans-151.6148.2150.3-109.6-78.5000112.3
265L50.3Low48.6Very low151 Ų151136.1 Ų136.179%0.79177%0.766SS**  trans-28.8154.4167.3-55.2176.3000116.4
266A49.8Very low48.5Very low83 Ų83137.2 Ų137.269%0.68677%0.773SS**  cis-178.3179.2-10.700000109.3
267S52.2Low48.5Very low113 Ų113137.6 Ų137.679%0.7978%0.779SS**  trans73142.6152.5-156.60000117.4
268M54.7Low48.9Very low169 Ų169132.8 Ų132.883%0.83378%0.783SS**  cis-157.6154.7-19.4-105.8-70.2177.600106.8
269P57Low49.2Very low108 Ų108127.7 Ų127.770%0.70178%0.783SS**  trans-102.9150.6-179.537.5-30.7000113.9
270T58.7Low49.7Very low139 Ų139129 Ų12985%0.85378%0.781SS**  trans-153.7140.2156.342.20000111.6
271N44.8Very low49.7Very low159 Ų159135.5 Ų135.585%0.8579%0.791SS**  trans-161.1100.2166.1-175.526.3000111.7
272P53.9Low50.3Low110 Ų110134.9 Ų134.971%0.71479%0.788SS**  trans-143.491.518037.5-16.6000116.3
273F44.5Very low50.8Low192 Ų192134.5 Ų134.584%0.84278%0.782SS**  trans-163.1112.8150.9-136.5-116.6000107.7
274V54.2Low51Low124 Ų124137.9 Ų137.975%0.75278%0.78SS**  61.8118.661.1-175.20000112.3
275G45.3Very low51.5Low59 Ų59132.6 Ų132.661%0.60877%0.771SS**  trans129.879.5153.500000120.2
276T47.6Very low51.7Low134 Ų134132 Ų13282%0.82277%0.773SS**  trans74.6148.2137.6-7.30000121.9
277S48Very low52.2Low120 Ų120132.2 Ų132.284%0.83977%0.769SS**  trans75.6102.9152.3-570000120.5
278G46.6Very low52.5Low78 Ų78131 Ų13180%0.80475%0.754SS**  trans163.3133155.700000117.3
279A47.9Very low52.2Low96 Ų96132 Ų13279%0.79375%0.75SS**  trans53.6112.6158.100000120.6
280M55.4Low52.3Low171 Ų171132.3 Ų132.384%0.84275%0.745SS**  trans-70.4140.7161-66.7177.6172.100111.7
281Y45.5Very low52.3Low213 Ų213131.2 Ų131.284%0.83573%0.734SS**  trans-91.4108.6165.9-97.3-103.3000111
282H57.9Low53.4Low154 Ų154132.5 Ų132.571%0.71373%0.727SS**  trans-72.1151.7171-84-100.2000112.1R284H282-R284 PolarHBondContact O-N 3.16Å
283P55.8Low54Low111 Ų111133.3 Ų133.372%0.72172%0.719SS**  trans-65.2127.1177.626.9-34.6000111.4T285P283-T285 PolarHBondContact O-N 2.66Å; P283-T285 VanDerWaalsContact O-N 3.14Å
284R54.7Low55.2Low191 Ų191132.1 Ų132.172%0.72171%0.71SS**  trans-73.1105.4177.1-72.1-166.8-176.3-128.90.6110.9H282 N288H282-R284 PolarHBondContact O-N 3.16Å; R284-N288 PolarHBondContact NH1-OD1 2.96Å
285T57.8Low56Low110 Ų110130.8 Ų130.868%0.67570%0.704SS**  trans-72.1171.9167.4560000111.8P283 S287 N288P283-T285 PolarHBondContact O-N 2.66Å; P283-T285 VanDerWaalsContact O-N 3.14Å; T285-S287 PolarHBondContact O-N 3.23Å; T285-N288 PolarHBondContact O-ND2 2.81Å
286V54.5Low56.6Low138 Ų138136.6 Ų136.684%0.83672%0.718SS**G310 helixtrans-62.7-3.2-157.3-152.10000116.4N288V286-N288 VanDerWaalsContact C-N 3.32Å; V286-N288 PolarHBondContact O-N 2.93Å
287S58.9Low56.4Low87 Ų87138.2 Ų138.261%0.60872%0.721SS**G310 helixtrans-68-23.3-169.3-149.10000115.4T285 Y289 L290T285-S287 PolarHBondContact O-N 3.23Å; S287-Y289 PolarHBondContact O-N 3.1Å; S287-L290 PolarHBondContact O-N 2.77Å
288N58.3Low56.9Low88 Ų88139.2 Ų139.247%0.47172%0.715SS.*G310 helixtrans-66.5-7.3-168.8-74-103.9000115.1R284 T285 V286R284-N288 PolarHBondContact NH1-OD1 2.96Å; T285-N288 PolarHBondContact O-ND2 2.81Å; V286-N288 VanDerWaalsContact C-N 3.32Å; V286-N288 PolarHBondContact O-N 2.93Å
289Y48.6Very low57.4Low191 Ų191142.4 Ų142.475%0.74971%0.71SS**G310 helixtrans-97-6.6-178.4-133.3-91.2000115.1S287 W292S287-Y289 PolarHBondContact O-N 3.1Å; Y289-W292 PolarHBondContact O-NE1 3.1Å
290L59.1Low57.9Low113 Ų113144.9 Ų144.959%0.59271%0.705SS**THydrogen-bonded Turntrans-99.9-24.7176.4-70.5101000113.7S287 W292 K293 Y294S287-L290 PolarHBondContact O-N 2.77Å; L290-W292 PolarHBondContact O-N 3.41Å; L290-K293 WeakPolarHBondContact O-CA 3.47Å; L290-K293 WeakPolarHBondContact O-CB 3.15Å; L290-K293 PolarHBondContact O-N 2.85Å; L290-Y294 PolarHBondContact O-N 3.38Å
291D59.7Low58.1Low117 Ų117143.4 Ų143.463%0.62670%0.697SS**THydrogen-bonded Turntrans-59.5-43.8-169.8-16653.8000113.5K293 Y294 P295D291-K293 PolarHBondContact O-N 2.89Å; D291-K293 VanDerWaalsContact O-N 3.07Å; D291-Y294 PolarHBondContact O-N 3.27Å; D291-P295 WeakPolarHBondContact O-CD 3.01Å
292W68.2Low58.9Low185 Ų185139.1 Ų139.170%0.70169%0.689SS**THydrogen-bonded Turntrans-64.1-15.3175.874.7-89.4000114.3Y289 L290Y289-W292 PolarHBondContact O-NE1 3.1Å; L290-W292 PolarHBondContact O-N 3.41Å
293K66Low58.9Low128 Ų128138.1 Ų138.156%0.55769%0.687SS**THydrogen-bonded Turntrans-107.4-25.8-172.6-160.2171.4-178.5178.30113L290 D291L290-K293 WeakPolarHBondContact O-CA 3.47Å; L290-K293 WeakPolarHBondContact O-CB 3.15Å; L290-K293 PolarHBondContact O-N 2.85Å; D291-K293 PolarHBondContact O-N 2.89Å; D291-K293 VanDerWaalsContact O-N 3.07Å
294Y68.4Low59.1Low166 Ų166140 Ų14065%0.65169%0.685SS**  trans-145.372.3176.6-65.5-77.7000111.9L290 D291 M296L290-Y294 PolarHBondContact O-N 3.38Å; D291-Y294 PolarHBondContact O-N 3.27Å; Y294-M296 PolarHBondContact O-N 2.73Å; Y294-M296 VanDerWaalsContact O-N 3.15Å
295P71.2Confident59.5Low97 Ų97136.1 Ų136.163%0.6368%0.682SS**  trans-63115.6165.327.1-33000108.7D291 L297D291-P295 WeakPolarHBondContact O-CD 3.01Å; P295-L297 PolarHBondContact O-N 3.38Å; P295-L297 VanDerWaalsContact O-N 3.15Å
296M59.5Low59.6Low180 Ų180138.3 Ų138.389%0.88768%0.683SS**  trans-66.1104-159.6-73.6-91.8-75.400114.8Y294Y294-M296 PolarHBondContact O-N 2.73Å; Y294-M296 VanDerWaalsContact O-N 3.15Å
297L43.1Very low60.1Low169 Ų169138.3 Ų138.389%0.88567%0.669SS**  trans-151.60159.6-74179.2000109.9N136 P295N136-L297 HydrophobicContact CB-CD1 3.52Å; N136-L297 HydrophobicContact CB-CD2 4.28Å; N136-L297 VanDerWaalsContact CG-CD1 3.5Å; P295-L297 PolarHBondContact O-N 3.38Å; P295-L297 VanDerWaalsContact O-N 3.15Å

Retrieved 297 of 297 residues in 317.6 ms (Link to these results)