A0A096MDA2_POEFO Loading...

Family with sequence similarity 131 member B

AlphaFold DB , UniProt , Accession A0A096MDA2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 451 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
1M36.5Very low38.7Very low254 Ų254150.8 Ų150.8100%1.25185%0.848SS**  0144.10-66.5178165.200106.9
2G33.5Very low38.2Very low64 Ų64153 Ų15366%0.6686%0.856SS**  cis120.572.222.700000107.8
3C39Very low37.7Very low123 Ų123146.8 Ų146.883%0.83185%0.848SS**  109.2172.587.2-84.50000110.1
4I40.3Very low37.5Very low182 Ų182146.6 Ų146.693%0.93385%0.85SS**  trans88.2122.2-177.2-52162.1000113.6
5G36.1Very low38.5Very low63 Ų63144.4 Ų144.465%0.64984%0.842SS**  cis168.2158.1-11.100000115.6
6S38.9Very low38.3Very low123 Ų123143.3 Ų143.386%0.8684%0.838SS**  trans63.8142.4167-65.40000117.3
7R43.1Very low38.2Very low239 Ų239143.8 Ų143.890%0.90283%0.83SS**  cis-132.5151.621.9-60169.1-169.1-100.3-3.1112
8R40.5Very low38.8Very low231 Ų231147.3 Ų147.387%0.87283%0.834SS**  trans-88.4163.7152.3-52.9177.6-172.2170.61.5106.4
9L40.5Very low38.4Very low159 Ų159146.1 Ų146.183%0.83283%0.825SS**  cis-154.1178.841.7-63.9156.9000106.9
10T36.7Very low38.3Very low135 Ų135141.8 Ų141.883%0.82882%0.815SS**  cis-130.8172.810.944.10000111
11A40.4Very low38.2Very low86 Ų86144.2 Ų144.271%0.71182%0.819SS**  trans-123154.1169.200000110
12D32.5Very low38.2Very low177 Ų177140.3 Ų140.395%0.94780%0.797SS**  trans179.4154.3142.3-88.8-26.7000109
13G32.6Very low38.5Very low73 Ų73145.3 Ų145.375%0.75381%0.808SS**  trans114.428.5163.500000121.3
14V34.4Very low38.5Very low144 Ų144143.3 Ų143.387%0.87380%0.796SS**  trans-19.6141.3152.31660000117.2
15P53.2Low38.7Very low113 Ų113142.4 Ų142.473%0.73479%0.79SS**  -128.7175.7-60.441.3-23000113.2
16V34.8Very low39.6Very low127 Ų127145.2 Ų145.277%0.7779%0.786SS**  trans-160.8113.1153.3122.10000106.9
17Q36.9Very low40Very low152 Ų152146.2 Ų146.271%0.7178%0.782SS**  76.7128.590.4-161.6171-43.700112.6D19Q17-D19 PolarHBondContact NE2-OD2 3.15Å; Q17-D19 PolarHBondContact O-N 2.68Å
18K49.2Very low40.2Very low207 Ų207140 Ų14090%0.977%0.77SS**  trans-104.761.5-157-166.7-161.5173.8-173.50111.5
19D31.4Very low40.9Very low123 Ų123134.5 Ų134.566%0.65876%0.763SS**  trans-98.8120.9174.8-47-45.8000105.9Q17Q17-D19 PolarHBondContact NE2-OD2 3.15Å; Q17-D19 PolarHBondContact O-N 2.68Å
20G36.4Very low41.2Very low60 Ų60131.5 Ų131.562%0.61976%0.755SS**  cis10475.92900000106.7Q22G20-Q22 PolarHBondContact O-N 3.36Å
21E36.3Very low42Very low193 Ų193131.9 Ų131.990%0.90275%0.75SS**  trans-69.772.4-170.4-65.2-179.2134.400112.1L23E21-L23 PolarHBondContact O-N 3.34Å
22Q35.8Very low42.4Very low172 Ų172134.1 Ų134.180%0.80475%0.75SS**  trans-66.3107.7156.5-72.6-173.8-26.300107.5G20 S24G20-Q22 PolarHBondContact O-N 3.36Å; Q22-S24 PolarHBondContact O-N 3.19Å
23L39.2Very low43Very low170 Ų170131.3 Ų131.389%0.8974%0.741SS**  trans-69.379.4164.1-65.6176.1000108.2E21E21-L23 PolarHBondContact O-N 3.34Å
24S38.7Very low43.8Very low81 Ų81140 Ų14057%0.56675%0.751SS**  trans-70.3139.7-175.8-149.10000110.2Q22 E26Q22-S24 PolarHBondContact O-N 3.19Å; S24-E26 VanDerWaalsContact C-N 3.34Å; S24-E26 WeakPolarHBondContact CB-OE2 3.32Å; S24-E26 PolarHBondContact O-N 3.04Å; S24-E26 PolarHBondContact OG-OE2 3.5Å
25M45.4Very low44.3Very low163 Ų163141 Ų14180%0.80375%0.75SS**SBendtrans-87.99.5-159.8-64.6-172.965.200115.2
26E54.8Low43.9Very low121 Ų121144 Ų14457%0.56575%0.752SS**  trans-85.5-20.9-159.7-71.864.8-132.600116S24 T28S24-E26 VanDerWaalsContact C-N 3.34Å; S24-E26 WeakPolarHBondContact CB-OE2 3.32Å; S24-E26 PolarHBondContact O-N 3.04Å; S24-E26 PolarHBondContact OG-OE2 3.5Å; E26-T28 VanDerWaalsContact C-N 3.33Å; E26-T28 PolarHBondContact O-N 3.25Å
27D46.5Very low44.8Very low145 Ų145149.6 Ų149.678%0.77576%0.759SS**G310 helixtrans-86.715.3-165.1-104-16.4000116.5T29 S30D27-T29 VanDerWaalsContact C-N 3.27Å; D27-T29 PolarHBondContact O-N 2.75Å; D27-S30 PolarHBondContact O-OG 2.88Å
28T47.6Very low45.5Very low108 Ų108149 Ų14966%0.66376%0.761SS**G310 helixtrans-76.7-8.7175.652.70000114.2E26 S30E26-T28 VanDerWaalsContact C-N 3.33Å; E26-T28 PolarHBondContact O-N 3.25Å; T28-S30 VanDerWaalsContact C-N 3.26Å; T28-S30 PolarHBondContact O-N 2.81Å
29T56Low45.6Very low116 Ų116144.7 Ų144.771%0.71276%0.757SS**G310 helixtrans-75.6-7-174.764.60000115.1D27D27-T29 VanDerWaalsContact C-N 3.27Å; D27-T29 PolarHBondContact O-N 2.75Å
30S45.8Very low46.3Very low96 Ų96146 Ų14667%0.67176%0.764SS**G310 helixtrans-81-20.3-175.156.50000114.9D27 T28D27-S30 PolarHBondContact O-OG 2.88Å; T28-S30 VanDerWaalsContact C-N 3.26Å; T28-S30 PolarHBondContact O-N 2.81Å
31I54.6Low47Very low142 Ų142148 Ų14873%0.72878%0.775SS**SBendtrans-86.6-20.8-169.8-61.1172.8000112.6
32L47.7Very low47.8Very low134 Ų134149.2 Ų149.270%0.70277%0.773SS**SBendtrans-89.9136.6-175.7-63.2178.3000112.4R34L32-R34 PolarHBondContact O-N 2.89Å
33P45.4Very low48.5Very low117 Ų117143.1 Ų143.176%0.7676%0.756SS**  trans-53.4134.8170.8-26.335000111.5L35P33-L35 VanDerWaalsContact C-N 3.32Å; P33-L35 PolarHBondContact O-N 3.01Å
34R50.6Low49.1Very low255 Ų255142.1 Ų142.196%0.96275%0.75SS**  trans-66.481.8-174.1-77.7-178.9162.2-175.9-4.5112.7L32 K36L32-R34 PolarHBondContact O-N 2.89Å; R34-K36 PolarHBondContact O-N 3.19Å
35L43.9Very low49.7Very low165 Ų165141 Ų14186%0.86475%0.751SS**  trans-64.1122.7174.3-17061.8000110.1P33 R37P33-L35 VanDerWaalsContact C-N 3.32Å; P33-L35 PolarHBondContact O-N 3.01Å; L35-R37 PolarHBondContact O-N 3.45Å
36K44.8Very low49.9Very low178 Ų178135.6 Ų135.677%0.77473%0.732SS**  trans-63.8119.4-176.4-174.4-177.4179.7-1750109.9R34 N38R34-K36 PolarHBondContact O-N 3.19Å; K36-N38 PolarHBondContact O-N 2.99Å; K36-N38 VanDerWaalsContact O-N 3.16Å; K36-N38 PolarHBondContact O-OD1 3.36Å
37R54.5Low49.6Very low244 Ų244135.5 Ų135.592%0.92174%0.735SS**  trans-67108.6-176.8-50.9-176.4-152.997-2.1111.7L35L35-R37 PolarHBondContact O-N 3.45Å
38N51.1Low49.6Very low138 Ų138133 Ų13374%0.73873%0.734SS**  trans-159.339.5163.966.5-37.8000115.5K36K36-N38 PolarHBondContact O-N 2.99Å; K36-N38 VanDerWaalsContact O-N 3.16Å; K36-N38 PolarHBondContact O-OD1 3.36Å
39S50.3Low49.5Very low118 Ų118136.6 Ų136.683%0.82574%0.741SS**SBendtrans-148.1163.8163.658.70000111.7
40N46.8Very low48.9Very low151 Ų151134.5 Ų134.581%0.80773%0.73SS**  trans-70.8154.2-163.9-69.4-56.1000114.5Y42N40-Y42 VanDerWaalsContact C-N 3.28Å; N40-Y42 PolarHBondContact O-N 3.37Å
41A51.4Low49.1Very low101 Ų101135.2 Ų135.284%0.83574%0.735SS**SBendtrans-77.551.3-161.700000116.5G43A41-G43 VanDerWaalsContact C-N 3.25Å; A41-G43 PolarHBondContact O-N 3.02Å
42Y53.7Low48.8Very low219 Ų219135.2 Ų135.286%0.85974%0.736SS**  trans-89.958.6165-70.6-82.5000110.8N40N40-Y42 VanDerWaalsContact C-N 3.28Å; N40-Y42 PolarHBondContact O-N 3.37Å
43G50.4Low49Very low44 Ų44134.4 Ų134.445%0.45474%0.742SS.*  trans-73.3148.7174.600000112A41 G45 A46A41-G43 VanDerWaalsContact C-N 3.25Å; A41-G43 PolarHBondContact O-N 3.02Å; G43-G45 PolarHBondContact O-N 3.41Å; G43-A46 VanDerWaalsContact O-CB 3.31Å; G43-A46 WeakPolarHBondContact O-CB 3.3Å; G43-A46 PolarHBondContact O-N 3.46Å
44I50.5Low49.1Very low149 Ų149132.3 Ų132.376%0.76474%0.741SS**G310 helixtrans-53.9-31.5-172.3-64.4169.2000113.2A46 L47I44-A46 PolarHBondContact O-N 3.34Å; I44-A46 VanDerWaalsContact O-N 3.14Å; I44-L47 PolarHBondContact O-N 2.83Å; I44-L47 VanDerWaalsContact O-N 3.12Å
45G51.4Low48.7Very low57 Ų57126.7 Ų126.759%0.58874%0.735SS**G310 helixtrans-62.2-15.3174.700000115.6G43G43-G45 PolarHBondContact O-N 3.41Å
46A50.3Low49.2Very low50 Ų50124.9 Ų124.941%0.41374%0.737SS.*G310 helixtrans-73.3-39.6172.100000112.1G43 I44 A48 K49 S50G43-A46 VanDerWaalsContact O-CB 3.31Å; G43-A46 WeakPolarHBondContact O-CB 3.3Å; G43-A46 PolarHBondContact O-N 3.46Å; I44-A46 PolarHBondContact O-N 3.34Å; I44-A46 VanDerWaalsContact O-N 3.14Å; A46-A48 VanDerWaalsContact C-N 3.3Å; A46-A48 PolarHBondContact O-N 2.95Å; A46-K49 PolarHBondContact O-N 3.15Å; A46-S50 PolarHBondContact O-N 3.46Å; A46-S50 VanDerWaalsContact O-N 3.11Å
47L47.8Very low49.4Very low119 Ų119119.5 Ų119.562%0.62373%0.732SS**Hα-helixtrans-64.4-36.6-178.9-62.1174.7000111.7I44 K49 S50I44-L47 PolarHBondContact O-N 2.83Å; I44-L47 VanDerWaalsContact O-N 3.12Å; L47-K49 PolarHBondContact O-N 2.8Å; L47-K49 VanDerWaalsContact O-N 3.12Å; L47-S50 PolarHBondContact O-N 3.1Å; L47-S50 PolarHBondContact O-OG 3.15Å
48A46.6Very low49.3Very low91 Ų91112.8 Ų112.875%0.75272%0.717SS**Hα-helixtrans-62.9-13.6173.600000114A46A46-A48 VanDerWaalsContact C-N 3.3Å; A46-A48 PolarHBondContact O-N 2.95Å
49K46.5Very low49.3Very low185 Ų185110.3 Ų110.380%0.80471%0.707SS**Hα-helixtrans-112.7-14.4178-66.9-171.566.9175.80114.5A46 L47A46-K49 PolarHBondContact O-N 3.15Å; L47-K49 PolarHBondContact O-N 2.8Å; L47-K49 VanDerWaalsContact O-N 3.12Å
50S42.6Very low49.3Very low71 Ų71112.9 Ų112.950%0.49770%0.699SS.*Hα-helixtrans-85.4-23.7178.357.20000113.7A46 L47 L52A46-S50 PolarHBondContact O-N 3.46Å; A46-S50 VanDerWaalsContact O-N 3.11Å; L47-S50 PolarHBondContact O-N 3.1Å; L47-S50 PolarHBondContact O-OG 3.15Å; S50-L52 PolarHBondContact O-N 3.44Å
51S49.4Very low49.5Very low111 Ų111110 Ų11078%0.77669%0.687SS**THydrogen-bonded Turntrans-80.740.6-173.1-148.60000115.4
52L49.4Very low49.4Very low142 Ų142111.6 Ų111.674%0.74368%0.679SS**THydrogen-bonded Turntrans-144.1-2.9171.4-151.372.4000114.7S50 T59S50-L52 PolarHBondContact O-N 3.44Å; L52-T59 HydrophobicContact CD1-CG2 4.02Å; L52-T59 HydrophobicContact CG-CG2 4.39Å
53S51.5Low49.5Very low117 Ų117109.9 Ų109.982%0.81868%0.676SS**SBendtrans-15172.9-179.5-179.40000110.8
54G47.5Very low49.6Very low73 Ų73113.8 Ų113.875%0.75368%0.682SS**SBendtrans170.722.3-177.800000119.3
55V42.1Very low49.8Very low137 Ų137111.8 Ų111.883%0.8367%0.665SS**SBendtrans-159.9145.2157.7134.90000108
56S53.6Low50Low128 Ų128113.1 Ų113.190%0.89566%0.661SS**SBendtrans-73.6135.7-178.2-1670000111.8
57G50.4Low50.3Low65 Ų65112.4 Ų112.467%0.6765%0.652SS**SBendtrans154.2-51.5167.800000116.9
58V52.1Low50.7Low102 Ų102115.6 Ų115.662%0.61866%0.661SS**SBendtrans-108.5-22.1-154.9176.80000115.6
59T51.5Low51.1Low86 Ų86115.1 Ų115.153%0.52865%0.65SS.*THydrogen-bonded Turntrans-92.2-1.8-153.5470000118.4L52L52-T59 HydrophobicContact CD1-CG2 4.02Å; L52-T59 HydrophobicContact CG-CG2 4.39Å
60R50.1Low51.5Low173 Ų173109.2 Ų109.265%0.65363%0.63SS**THydrogen-bonded Turntrans-95.8-48.6174.4-162.5-171.5175.6-67.4-5.4113.6E64R60-E64 IonicContact CZ-OE1 2.75Å; R60-E64 IonicContact CZ-OE2 3.74Å; R60-E64 IonicContact NH1-OE1 3.41Å; R60-E64 PolarHBondContact NH1-OE1 3.24Å; R60-E64 IonicContact NH1-OE2 2.96Å; R60-E64 PolarHBondContact NH1-OE2 3.12Å; R60-E64 IonicContact NH2-OE1 3.37Å; R60-E64 PolarHBondContact NH2-OE1 3.32Å
61T51.6Low52.1Low90 Ų90110 Ų11055%0.55264%0.64SS**THydrogen-bonded Turntrans-74.1-41.1-167.246.80000113.7K63 E64 R65T61-K63 VanDerWaalsContact C-N 3.34Å; T61-K63 PolarHBondContact O-N 2.75Å; T61-E64 PolarHBondContact O-N 3.21Å; T61-R65 WeakPolarHBondContact O-CG 3.42Å
62M48.9Very low52.4Low135 Ų135109 Ų10967%0.66563%0.625SS**G310 helixtrans-70.9-29.6-173.5-159.6167.7-174.700112.9E64 R65M62-E64 VanDerWaalsContact C-N 3.32Å; M62-E64 PolarHBondContact O-N 2.87Å; M62-R65 PolarHBondContact O-N 2.9Å
63K55.3Low52.6Low183 Ų183106.6 Ų106.680%0.79663%0.625SS**G310 helixtrans-71.6-25.2176.2-174.2176.6176.6-176.90113.1T61 R65T61-K63 VanDerWaalsContact C-N 3.34Å; T61-K63 PolarHBondContact O-N 2.75Å; K63-R65 VanDerWaalsContact C-N 3.34Å
64E53.3Low53Low125 Ų125108.9 Ų108.958%0.58462%0.622SS**G310 helixtrans-85.9-8.3-179.3-157.9167-139.400112.2R60 T61 M62R60-E64 IonicContact CZ-OE1 2.75Å; R60-E64 IonicContact CZ-OE2 3.74Å; R60-E64 IonicContact NH1-OE1 3.41Å; R60-E64 PolarHBondContact NH1-OE1 3.24Å; R60-E64 IonicContact NH1-OE2 2.96Å; R60-E64 PolarHBondContact NH1-OE2 3.12Å; R60-E64 IonicContact NH2-OE1 3.37Å; R60-E64 PolarHBondContact NH2-OE1 3.32Å; T61-E64 PolarHBondContact O-N 3.21Å; M62-E64 VanDerWaalsContact C-N 3.32Å; M62-E64 PolarHBondContact O-N 2.87Å
65R54.4Low53.4Low107 Ų107108.8 Ų108.840%0.40462%0.621SS.*SBendtrans-115.23.2-175.7-65.4-68-163.9160.55.9114.9T61 M62 K63 T67 E82 N85T61-R65 WeakPolarHBondContact O-CG 3.42Å; M62-R65 PolarHBondContact O-N 2.9Å; K63-R65 VanDerWaalsContact C-N 3.34Å; R65-T67 PolarHBondContact O-N 3.01Å; R65-E82 WeakPolarHBondContact O-CG 3.46Å; R65-N85 PolarHBondContact NH1-ND2 3.29Å; R65-N85 VanDerWaalsContact NH1-ND2 3.15Å; R65-N85 VanDerWaalsContact NH2-CG 3.29Å
66V54.3Low54.6Low85 Ų85109.4 Ų109.452%0.51561%0.609SS.*BIsolated β-bridgetrans-85.2107.9168.7176.10000107
67T57.7Low55Low35 Ų35107.5 Ų107.522%0.21559%0.592CS.*  trans-60.8151.2177.974.30000110R65 M80 E82R65-T67 PolarHBondContact O-N 3.01Å; T67-M80 VanDerWaalsContact OG1-CB 3.26Å; T67-M80 WeakPolarHBondContact OG1-CB 3.24Å; T67-M80 PolarHBondContact OG1-O 3.07Å; T67-E82 HydrophobicContact CG2-CB 4.3Å; T67-E82 HydrophobicContact CG2-CG 3.95Å
68K56Low55.5Low187 Ų187106.1 Ų106.181%0.81357%0.574SS**  trans-52.6142.7175-65.6177.6-177.21740109.8T70K68-T70 PolarHBondContact O-N 2.93Å; K68-T70 VanDerWaalsContact O-N 3.07Å
69P55.3Low55.9Low80 Ų80107.1 Ų107.152%0.51957%0.572SS.*  trans-58.3115.2-174.821.4-32.8000111.3A71 V77P69-A71 PolarHBondContact O-N 2.77Å; P69-V77 HydrophobicContact CB-CG1 3.59Å
70T54.5Low56Low62 Ų62108.4 Ų108.438%0.3857%0.573SS.*EExtended strand (participates in β ladder)trans-74.696.6177.5-57.60000108.2K68 M72 A78K68-T70 PolarHBondContact O-N 2.93Å; K68-T70 VanDerWaalsContact O-N 3.07Å; T70-M72 PolarHBondContact O-N 3.37Å; T70-A78 PolarHBondContact N-O 3.28Å
71A55.9Low56.5Low86 Ų86104.9 Ų104.971%0.71157%0.566SS**EExtended strand (participates in β ladder)trans-69.8100.3179.600000110.3P69P69-A71 PolarHBondContact O-N 2.77Å
72M54.9Low56.7Low92 Ų92104.1 Ų104.145%0.45356%0.556SS.*  trans-76.2143.9170.6-59.6-174.7-65.100109.9T70 G75 R76 A78T70-M72 PolarHBondContact O-N 3.37Å; M72-G75 PolarHBondContact O-N 2.91Å; M72-R76 WeakPolarHBondContact CB-O 3.45Å; M72-R76 HydrophobicContact CE-CB 3.96Å; M72-R76 WeakPolarHBondContact CE-O 3.48Å; M72-R76 PolarHBondContact N-O 3.39Å; M72-A78 HydrophobicContact CE-CB 3.75Å; M72-A78 HydrophobicContact SD-CB 4.4Å
73A54Low56.9Low90 Ų90106.1 Ų106.174%0.74456%0.557SS**THydrogen-bonded Turntrans-54.9148.7170.700000110.6
74Q59.1Low56.7Low165 Ų165104.8 Ų104.877%0.77155%0.553SS**THydrogen-bonded Turntrans74.215.6-165-47.8177.6-22.700115.5R76Q74-R76 VanDerWaalsContact C-N 3.29Å; Q74-R76 PolarHBondContact O-N 2.72Å
75G56.5Low56.5Low71 Ų71103.8 Ų103.873%0.73255%0.552SS**SBendtrans768.2163.900000116M72 V77M72-G75 PolarHBondContact O-N 2.91Å; G75-V77 PolarHBondContact O-N 2.97Å
76R66.3Low56.1Low150 Ų150106.4 Ų106.457%0.56656%0.562SS**  trans-80.5106.1170.8-72.2-177.2-67.7-111.3-12109.3M72 Q74 A78M72-R76 WeakPolarHBondContact CB-O 3.45Å; M72-R76 HydrophobicContact CE-CB 3.96Å; M72-R76 WeakPolarHBondContact CE-O 3.48Å; M72-R76 PolarHBondContact N-O 3.39Å; Q74-R76 VanDerWaalsContact C-N 3.29Å; Q74-R76 PolarHBondContact O-N 2.72Å; R76-A78 PolarHBondContact O-N 3.04Å
77V63Low56Low88 Ų88106 Ų10653%0.53358%0.576SS.*EExtended strand (participates in β ladder)trans-75115.4169.8176.70000108.6P69 G75P69-V77 HydrophobicContact CB-CG1 3.59Å; G75-V77 PolarHBondContact O-N 2.97Å
78A61.2Low55.5Low37 Ų37111.3 Ų111.331%0.30660%0.599SS.*EExtended strand (participates in β ladder)trans-98.7132.516600000109.5T70 M72 R76T70-A78 PolarHBondContact N-O 3.28Å; M72-A78 HydrophobicContact CE-CB 3.75Å; M72-A78 HydrophobicContact SD-CB 4.4Å; R76-A78 PolarHBondContact O-N 3.04Å
79H60.3Low55Low123 Ų123109 Ų10957%0.56959%0.592SS**  trans-88.3108.1168-71.6-86.2000108.6I81H79-I81 PolarHBondContact O-N 3.36Å; H79-I81 VanDerWaalsContact O-N 3.13Å
80M53.5Low54.6Low112 Ų112108.5 Ų108.555%0.55259%0.587SS**  trans-71103.3166.1-96.9169.856.700108.5T67 E82T67-M80 VanDerWaalsContact OG1-CB 3.26Å; T67-M80 WeakPolarHBondContact OG1-CB 3.24Å; T67-M80 PolarHBondContact OG1-O 3.07Å; M80-E82 PolarHBondContact O-N 2.93Å
81I61.2Low54Low99 Ų99110.3 Ų110.351%0.50860%0.598SS.*BIsolated β-bridgetrans-80111.6162.5-61.2176.5000105.9H79 W83H79-I81 PolarHBondContact O-N 3.36Å; H79-I81 VanDerWaalsContact O-N 3.13Å; I81-W83 PolarHBondContact O-N 3.4Å; I81-W83 VanDerWaalsContact O-N 3.16Å
82E56Low53.6Low74 Ų74107.7 Ų107.735%0.34658%0.58SS.*  trans-71.7105.4172.546.6177.9164.900109.4R65 T67 M80 Q84R65-E82 WeakPolarHBondContact O-CG 3.46Å; T67-E82 HydrophobicContact CG2-CB 4.3Å; T67-E82 HydrophobicContact CG2-CG 3.95Å; M80-E82 PolarHBondContact O-N 2.93Å; E82-Q84 PolarHBondContact O-N 3.31Å
83W52.9Low53Low177 Ų177109.1 Ų109.167%0.6761%0.606SS**  trans-69-16-179.8-71.187000113.4I81 N85 W86I81-W83 PolarHBondContact O-N 3.4Å; I81-W83 VanDerWaalsContact O-N 3.16Å; W83-N85 PolarHBondContact O-N 3.05Å; W83-W86 HydrophobicContact CE3-CD2 4.16Å; W83-W86 AromaticContact CE3-CE2 3.79Å; W83-W86 HydrophobicContact CE3-CH2 4.28Å; W83-W86 AromaticContact CE3-CZ2 3.87Å; W83-W86 HydrophobicContact CE3-CZ2 3.87Å; W83-W86 AromaticContact CH2-CH2 3.82Å; W83-W86 HydrophobicContact CH2-CH2 3.82Å; W83-W86 AromaticContact CH2-CZ2 3.79Å; W83-W86 HydrophobicContact CH2-CZ2 3.79Å; W83-W86 HydrophobicContact CZ3-CD2 4.17Å; W83-W86 AromaticContact CZ3-CE2 3.74Å; W83-W86 HydrophobicContact CZ3-CE3 4.18Å; W83-W86 AromaticContact CZ3-CH2 3.4Å; W83-W86 HydrophobicContact CZ3-CH2 3.4Å; W83-W86 VanDerWaalsContact CZ3-CH2 3.4Å; W83-W86 AromaticContact CZ3-CZ2 3.36Å; W83-W86 HydrophobicContact CZ3-CZ2 3.36Å; W83-W86 AromaticContact CZ3-CZ3 3.82Å; W83-W86 HydrophobicContact CZ3-CZ3 3.82Å
84Q50.6Low52.7Low156 Ų156108.6 Ų108.673%0.72961%0.609SS**THydrogen-bonded Turntrans-65.7124.9170.9-67.5-167.25.800110E82E82-Q84 PolarHBondContact O-N 3.31Å
85N49.2Very low52Low104 Ų104103.2 Ų103.256%0.55660%0.598SS**THydrogen-bonded Turntrans76.133.8-179.1-41.4-93.2000116R65 W83R65-N85 PolarHBondContact NH1-ND2 3.29Å; R65-N85 VanDerWaalsContact NH1-ND2 3.15Å; R65-N85 VanDerWaalsContact NH2-CG 3.29Å; W83-N85 PolarHBondContact O-N 3.05Å
86W46Very low51.2Low161 Ų161106.3 Ų106.361%0.6160%0.597SS**SBendtrans-57.6138.4138.8-76.632.4000107.9W83 M88W83-W86 HydrophobicContact CE3-CD2 4.16Å; W83-W86 AromaticContact CE3-CE2 3.79Å; W83-W86 HydrophobicContact CE3-CH2 4.28Å; W83-W86 AromaticContact CE3-CZ2 3.87Å; W83-W86 HydrophobicContact CE3-CZ2 3.87Å; W83-W86 AromaticContact CH2-CH2 3.82Å; W83-W86 HydrophobicContact CH2-CH2 3.82Å; W83-W86 AromaticContact CH2-CZ2 3.79Å; W83-W86 HydrophobicContact CH2-CZ2 3.79Å; W83-W86 HydrophobicContact CZ3-CD2 4.17Å; W83-W86 AromaticContact CZ3-CE2 3.74Å; W83-W86 HydrophobicContact CZ3-CE3 4.18Å; W83-W86 AromaticContact CZ3-CH2 3.4Å; W83-W86 HydrophobicContact CZ3-CH2 3.4Å; W83-W86 VanDerWaalsContact CZ3-CH2 3.4Å; W83-W86 AromaticContact CZ3-CZ2 3.36Å; W83-W86 HydrophobicContact CZ3-CZ2 3.36Å; W83-W86 AromaticContact CZ3-CZ3 3.82Å; W83-W86 HydrophobicContact CZ3-CZ3 3.82Å; W86-M88 VanDerWaalsContact C-N 3.29Å; W86-M88 PolarHBondContact O-N 2.88Å
87G52.2Low50.2Low78 Ų78103.8 Ų103.880%0.80460%0.6SS**  trans-73.765.2-158.100000116Q89G87-Q89 PolarHBondContact O-N 3.28Å
88M46.5Very low49.6Very low145 Ų145104.6 Ų104.671%0.71460%0.598SS**  trans-65.185.3163.2-66.3-176.877.800109.5W86 T90W86-M88 VanDerWaalsContact C-N 3.29Å; W86-M88 PolarHBondContact O-N 2.88Å; M88-T90 VanDerWaalsContact C-N 3.27Å; M88-T90 PolarHBondContact O-N 3.34Å; M88-T90 VanDerWaalsContact O-N 3.11Å
89Q46.3Very low49.2Very low140 Ų140107.9 Ų107.965%0.65462%0.619SS**  trans-67.198.1149.4-65.6-164.395.600105.7G87 V91G87-Q89 PolarHBondContact O-N 3.28Å; Q89-V91 PolarHBondContact O-N 3.3Å
90T47.3Very low48.8Very low69 Ų69113.4 Ų113.442%0.42364%0.635SS.*  trans-64.2100.3173.5-4.80000107.3M88 G92M88-T90 VanDerWaalsContact C-N 3.27Å; M88-T90 PolarHBondContact O-N 3.34Å; M88-T90 VanDerWaalsContact O-N 3.11Å; T90-G92 PolarHBondContact O-N 3.22Å; T90-G92 VanDerWaalsContact O-N 3.07Å
91V41.8Very low49.2Very low99 Ų99109.7 Ų109.760%0.662%0.617SS**BIsolated β-bridgetrans-65105.9164.6-89.40000107.1Q89Q89-V91 PolarHBondContact O-N 3.3Å
92G47.3Very low49.2Very low32 Ų32107.7 Ų107.733%0.3361%0.611SS.*  trans-62.6167.917100000111T90 G94 G95T90-G92 PolarHBondContact O-N 3.22Å; T90-G92 VanDerWaalsContact O-N 3.07Å; G92-G94 PolarHBondContact O-N 3.38Å; G92-G95 PolarHBondContact O-N 2.66Å
93A41.8Very low49.7Very low121 Ų121110.1 Ų110.1100%163%0.631SS**THydrogen-bonded Turntrans-54.5116.2173.200000109.8
94G48.7Very low50.3Low79 Ų79109.3 Ų109.381%0.81464%0.635SS**THydrogen-bonded Turntrans113.7-7.6-170.600000115.3G92 L96G92-G94 PolarHBondContact O-N 3.38Å; G94-L96 VanDerWaalsContact C-N 3.3Å; G94-L96 PolarHBondContact O-N 2.8Å
95G44.5Very low51.1Low52 Ų52107.1 Ų107.154%0.53663%0.625SS.*  trans75.48.9167.200000116.3G92G92-G95 PolarHBondContact O-N 2.66Å
96L39.3Very low52.1Low137 Ų137107.9 Ų107.972%0.71762%0.62SS**  trans-75.8141.9176.1-68.9171.2000111.4G94 Q98G94-L96 VanDerWaalsContact C-N 3.3Å; G94-L96 PolarHBondContact O-N 2.8Å; L96-Q98 PolarHBondContact O-N 3.28Å; L96-Q98 VanDerWaalsContact O-N 3.13Å
97P45.9Very low53.3Low97 Ų97103.1 Ų103.163%0.6360%0.604SS**BIsolated β-bridgetrans-74.1103.1176.129.7-33.3000110.4
98Q48.7Very low54.2Low104 Ų104106.8 Ų106.849%0.48660%0.598SS.*  trans-73.3139.1-179.4-162.2146.6-55.700111.4L96L96-Q98 PolarHBondContact O-N 3.28Å; L96-Q98 VanDerWaalsContact O-N 3.13Å
99S53.2Low55.3Low106 Ų106103.8 Ų103.874%0.74158%0.582SS**  trans-62.6167.2179.3-168.30000112.1I101S99-I101 VanDerWaalsContact C-N 3.32Å; S99-I101 PolarHBondContact O-N 3.49Å
100R51.1Low56.5Low240 Ų240102.4 Ų102.491%0.90657%0.571SS**  trans-69.187.3178.8-78.1-173.9-73-159.9-4.4111.5S102R100-S102 PolarHBondContact O-N 3.42Å
101I62.9Low57.7Low34 Ų34105.3 Ų105.317%0.17458%0.575CS.*  trans-41.1131.2164.3-56.1176.9000109.2S99 E105 R106S99-I101 VanDerWaalsContact C-N 3.32Å; S99-I101 PolarHBondContact O-N 3.49Å; I101-E105 HydrophobicContact CG2-CB 3.73Å; I101-E105 HydrophobicContact CG2-CG 3.65Å; I101-R106 HydrophobicContact CG2-CB 4.08Å
102S62.3Low59.1Low56 Ų56103.4 Ų103.439%0.39257%0.569SS.*  trans-61.1151.2179.3174.10000111.1R100 Q104 E105 R106R100-S102 PolarHBondContact O-N 3.42Å; S102-Q104 PolarHBondContact O-N 3.32Å; S102-Q104 PolarHBondContact OG-N 3.46Å; S102-E105 PolarHBondContact N-OE2 3.44Å; S102-E105 CarbonylContact O-C 3.58Å; S102-E105 WeakPolarHBondContact O-CA 3.38Å; S102-E105 WeakPolarHBondContact O-CB 3.49Å; S102-E105 PolarHBondContact O-N 3.25Å; S102-R106 PolarHBondContact O-N 3.16Å
103T65.1Low60.3Low126 Ų126107.9 Ų107.977%0.77358%0.581SS**Hα-helixtrans-58.9-34.3174.345.30000112.2E105 E107T103-E105 VanDerWaalsContact C-N 3.33Å; T103-E107 WeakPolarHBondContact O-CB 3.34Å; T103-E107 PolarHBondContact O-N 3.45Å; T103-E107 VanDerWaalsContact O-N 3.15Å
104Q65.3Low62Low160 Ų160105.9 Ų105.975%0.74855%0.554SS**Hα-helixtrans-67.2-33.8172.9-178.6-179.7-0.500112.6S102 K108S102-Q104 PolarHBondContact O-N 3.32Å; S102-Q104 PolarHBondContact OG-N 3.46Å; Q104-K108 WeakPolarHBondContact O-CB 3.37Å; Q104-K108 PolarHBondContact O-N 2.84Å
105E67.6Low63.4Low110 Ų110106.1 Ų106.151%0.51454%0.537SS..Hα-helixtrans-81.9-41.6-175.8-174.1-179.7-150.300111.1I101 S102 T103 E107 K108 E109I101-E105 HydrophobicContact CG2-CB 3.73Å; I101-E105 HydrophobicContact CG2-CG 3.65Å; S102-E105 PolarHBondContact N-OE2 3.44Å; S102-E105 CarbonylContact O-C 3.58Å; S102-E105 WeakPolarHBondContact O-CA 3.38Å; S102-E105 WeakPolarHBondContact O-CB 3.49Å; S102-E105 PolarHBondContact O-N 3.25Å; T103-E105 VanDerWaalsContact C-N 3.33Å; E105-E107 VanDerWaalsContact C-N 3.32Å; E105-E107 PolarHBondContact O-N 2.91Å; E105-K108 CarbonylContact O-C 3.6Å; E105-K108 WeakPolarHBondContact O-CA 3.3Å; E105-K108 WeakPolarHBondContact O-CB 3.3Å; E105-K108 PolarHBondContact O-N 3.13Å; E105-K108 VanDerWaalsContact O-N 3.1Å; E105-E109 WeakPolarHBondContact O-CB 3.5Å; E105-E109 PolarHBondContact O-N 2.93Å
106R70.6Confident65Low120 Ų120106.4 Ų106.445%0.45353%0.534SS..Hα-helixtrans-59.5-39.9168.6173.7177.6-73.9-121.4-4.1112I101 S102 K108 E109 R110I101-R106 HydrophobicContact CG2-CB 4.08Å; S102-R106 PolarHBondContact O-N 3.16Å; R106-K108 VanDerWaalsContact C-N 3.32Å; R106-E109 PolarHBondContact O-N 3.5Å; R106-R110 VanDerWaalsContact O-CB 3.3Å; R106-R110 WeakPolarHBondContact O-CB 3.26Å; R106-R110 PolarHBondContact O-N 3.29Å
107E70.6Confident67Low60 Ų60104.8 Ų104.828%0.2852%0.519SS..Hα-helixtrans-77.4-19176.7175.657.6-164.100112.4T103 E105 R110 R111T103-E107 WeakPolarHBondContact O-CB 3.34Å; T103-E107 PolarHBondContact O-N 3.45Å; T103-E107 VanDerWaalsContact O-N 3.15Å; E105-E107 VanDerWaalsContact C-N 3.32Å; E105-E107 PolarHBondContact O-N 2.91Å; E107-R110 IonicContact OE1-CZ 3.36Å; E107-R110 IonicContact OE1-NE 2.81Å; E107-R110 IonicContact OE1-NH2 3.8Å; E107-R110 PolarHBondContact OE1-NH2 2.9Å; E107-R110 IonicContact OE2-CZ 3.73Å; E107-R110 IonicContact OE2-NE 3.21Å; E107-R110 PolarHBondContact OE2-NE 2.73Å; E107-R110 IonicContact OE2-NH2 2.66Å; E107-R110 PolarHBondContact OE2-NH2 3.19Å; E107-R111 WeakPolarHBondContact O-CD 3.44Å; E107-R111 VanDerWaalsContact O-CG 3.24Å; E107-R111 WeakPolarHBondContact O-CG 3.43Å; E107-R111 PolarHBondContact O-N 3.13Å; E107-R111 IonicContact OE1-CZ 3.15Å; E107-R111 IonicContact OE1-NE 2.88Å; E107-R111 PolarHBondContact OE1-NE 2.76Å; E107-R111 IonicContact OE1-NH2 2.75Å; E107-R111 PolarHBondContact OE1-NH2 2.53Å
108K71.8Confident68.8Low155 Ų155103.1 Ų103.167%0.67451%0.51SS*.Hα-helixtrans-75.2-43.9166.4-177.8-168.4173.1-166.30111Q104 E105 R106 R111 A112Q104-K108 WeakPolarHBondContact O-CB 3.37Å; Q104-K108 PolarHBondContact O-N 2.84Å; E105-K108 CarbonylContact O-C 3.6Å; E105-K108 WeakPolarHBondContact O-CA 3.3Å; E105-K108 WeakPolarHBondContact O-CB 3.3Å; E105-K108 PolarHBondContact O-N 3.13Å; E105-K108 VanDerWaalsContact O-N 3.1Å; R106-K108 VanDerWaalsContact C-N 3.32Å; K108-R111 PolarHBondContact O-N 2.9Å; K108-A112 PolarHBondContact O-N 2.69Å
109E69.4Low70.8Confident82 Ų82105.2 Ų105.238%0.38352%0.524SS..Hα-helixtrans-57.3-55173.8179.9176.4-128.900110.4E105 R106 R111 A112 E113E105-E109 WeakPolarHBondContact O-CB 3.5Å; E105-E109 PolarHBondContact O-N 2.93Å; R106-E109 PolarHBondContact O-N 3.5Å; E109-R111 PolarHBondContact O-N 3.11Å; E109-R111 VanDerWaalsContact O-N 3.12Å; E109-A112 CarbonylContact O-C 3.59Å; E109-A112 WeakPolarHBondContact O-CB 3.47Å; E109-A112 PolarHBondContact O-N 2.97Å; E109-E113 WeakPolarHBondContact O-CG 3.43Å; E109-E113 PolarHBondContact O-N 2.98Å
110R72.1Confident72.6Confident111 Ų111101.4 Ų101.442%0.41950%0.495SS..Hα-helixtrans-61-22.4176.3-162.1-151.558.868.10.4114.2R106 E107 N114R106-R110 VanDerWaalsContact O-CB 3.3Å; R106-R110 WeakPolarHBondContact O-CB 3.26Å; R106-R110 PolarHBondContact O-N 3.29Å; E107-R110 IonicContact OE1-CZ 3.36Å; E107-R110 IonicContact OE1-NE 2.81Å; E107-R110 IonicContact OE1-NH2 3.8Å; E107-R110 PolarHBondContact OE1-NH2 2.9Å; E107-R110 IonicContact OE2-CZ 3.73Å; E107-R110 IonicContact OE2-NE 3.21Å; E107-R110 PolarHBondContact OE2-NE 2.73Å; E107-R110 IonicContact OE2-NH2 2.66Å; E107-R110 PolarHBondContact OE2-NH2 3.19Å; R110-N114 VanDerWaalsContact O-CB 3.3Å; R110-N114 WeakPolarHBondContact O-CB 3.42Å; R110-N114 PolarHBondContact O-N 3.35Å
111R72.1Confident74.5Confident131 Ų13193 Ų9349%0.49447%0.473SS..Hα-helixtrans-78.3-50168.8-76.8172.9-159.91523.7111E107 K108 E109 E113 N114 D115E107-R111 WeakPolarHBondContact O-CD 3.44Å; E107-R111 VanDerWaalsContact O-CG 3.24Å; E107-R111 WeakPolarHBondContact O-CG 3.43Å; E107-R111 PolarHBondContact O-N 3.13Å; E107-R111 IonicContact OE1-CZ 3.15Å; E107-R111 IonicContact OE1-NE 2.88Å; E107-R111 PolarHBondContact OE1-NE 2.76Å; E107-R111 IonicContact OE1-NH2 2.75Å; E107-R111 PolarHBondContact OE1-NH2 2.53Å; K108-R111 PolarHBondContact O-N 2.9Å; E109-R111 PolarHBondContact O-N 3.11Å; E109-R111 VanDerWaalsContact O-N 3.12Å; R111-E113 VanDerWaalsContact C-N 3.25Å; R111-E113 PolarHBondContact O-N 3.4Å; R111-N114 CarbonylContact O-C 3.56Å; R111-N114 WeakPolarHBondContact O-CA 3.5Å; R111-N114 WeakPolarHBondContact O-CB 3.49Å; R111-N114 PolarHBondContact O-N 2.84Å; R111-D115 WeakPolarHBondContact O-CB 3.38Å; R111-D115 PolarHBondContact O-N 3.03Å
112A71Confident75.9Confident59 Ų5997.3 Ų97.349%0.48850%0.497SS..Hα-helixtrans-56.4-38.1176.100000112.7K108 E109 A116K108-A112 PolarHBondContact O-N 2.69Å; E109-A112 CarbonylContact O-C 3.59Å; E109-A112 WeakPolarHBondContact O-CB 3.47Å; E109-A112 PolarHBondContact O-N 2.97Å; A112-A116 WeakPolarHBondContact O-CB 3.31Å; A112-A116 PolarHBondContact O-N 3.43Å
113E73.5Confident77.3Confident125 Ų12596.8 Ų96.858%0.58450%0.5SS*.Hα-helixtrans-63.8-43.2171.8-69.9178.3146.300112.7E109 R111 Y117E109-E113 WeakPolarHBondContact O-CG 3.43Å; E109-E113 PolarHBondContact O-N 2.98Å; R111-E113 VanDerWaalsContact C-N 3.25Å; R111-E113 PolarHBondContact O-N 3.4Å; E113-Y117 WeakPolarHBondContact O-CB 3.35Å; E113-Y117 PolarHBondContact O-N 3.26Å
114N75.8Confident78.5Confident80 Ų8094.8 Ų94.843%0.42848%0.482SS..Hα-helixtrans-69.6-38.6178.9173.585.9000112.4R110 R111 Y117 S118R110-N114 VanDerWaalsContact O-CB 3.3Å; R110-N114 WeakPolarHBondContact O-CB 3.42Å; R110-N114 PolarHBondContact O-N 3.35Å; R111-N114 CarbonylContact O-C 3.56Å; R111-N114 WeakPolarHBondContact O-CA 3.5Å; R111-N114 WeakPolarHBondContact O-CB 3.49Å; R111-N114 PolarHBondContact O-N 2.84Å; N114-Y117 PolarHBondContact O-N 3.21Å; N114-S118 WeakPolarHBondContact O-CB 3.41Å; N114-S118 PolarHBondContact O-N 2.82Å; N114-S118 PolarHBondContact O-OG 3.5Å
115D79.3Confident79.9Confident84 Ų8489.4 Ų89.445%0.44946%0.456SS..Hα-helixtrans-69.2-46.9177.6-57.5-19.2000108.8R111 Y117 S118 D119R111-D115 WeakPolarHBondContact O-CB 3.38Å; R111-D115 PolarHBondContact O-N 3.03Å; D115-Y117 VanDerWaalsContact C-N 3.27Å; D115-Y117 PolarHBondContact O-N 3.31Å; D115-S118 WeakPolarHBondContact O-CA 3.43Å; D115-S118 VanDerWaalsContact O-CB 3.31Å; D115-S118 WeakPolarHBondContact O-CB 3.13Å; D115-S118 PolarHBondContact O-N 3.02Å; D115-D119 PolarHBondContact O-N 3.49Å
116A78.3Confident81.1Confident58 Ų5890.9 Ų90.948%0.47946%0.463SS..Hα-helixtrans-63.6-26.5172.900000114.1A112 L120A112-A116 WeakPolarHBondContact O-CB 3.31Å; A112-A116 PolarHBondContact O-N 3.43Å; A116-L120 WeakPolarHBondContact O-CG 3.46Å
117Y80.8Confident82.2Confident102 Ų10288 Ų8840%0.447%0.465SS..Hα-helixtrans-77.9-29.1169.5-169.2-91.7000112.2E113 N114 D115 L120 K125 R128E113-Y117 WeakPolarHBondContact O-CB 3.35Å; E113-Y117 PolarHBondContact O-N 3.26Å; N114-Y117 PolarHBondContact O-N 3.21Å; D115-Y117 VanDerWaalsContact C-N 3.27Å; D115-Y117 PolarHBondContact O-N 3.31Å; Y117-L120 HydrophobicContact CD2-CD1 3.69Å; Y117-L120 HydrophobicContact CE2-CD1 4.07Å; Y117-L120 HydrophobicContact CG-CD1 4.15Å; Y117-K125 HydrophobicContact CD1-CG 4.47Å; Y117-K125 HydrophobicContact CE1-CB 4.38Å; Y117-K125 HydrophobicContact CE1-CD 4.38Å; Y117-K125 HydrophobicContact CE1-CG 3.85Å; Y117-K125 WeakPolarHBondContact O-CE 3.4Å; Y117-K125 PolarHBondContact OH-O 3.26Å; Y117-R128 HydrophobicContact CE2-CB 4.35Å
118S83.9Confident83.2Confident63 Ų6390.9 Ų90.944%0.44147%0.473SS..Hα-helixtrans-70.3-39.5178.5-610000111.7N114 D115 L120 K125N114-S118 WeakPolarHBondContact O-CB 3.41Å; N114-S118 PolarHBondContact O-N 2.82Å; N114-S118 PolarHBondContact O-OG 3.5Å; D115-S118 WeakPolarHBondContact O-CA 3.43Å; D115-S118 VanDerWaalsContact O-CB 3.31Å; D115-S118 WeakPolarHBondContact O-CB 3.13Å; D115-S118 PolarHBondContact O-N 3.02Å; S118-L120 PolarHBondContact O-N 2.64Å; S118-K125 PolarHBondContact O-NZ 3.03Å
119D89.9Confident84.2Confident147 Ų14790.1 Ų90.179%0.78647%0.47SS*.SBendtrans-66-16.3178.6-71.7-21.7000114.5D115D115-D119 PolarHBondContact O-N 3.49Å
120L90.4Very high85.5Confident26 Ų2688.4 Ų88.414%0.13647%0.47CS..SBendtrans-66.5150177.4-59.5173.7000112.1A116 Y117 S118 E124 K125 R128A116-L120 WeakPolarHBondContact O-CG 3.46Å; Y117-L120 HydrophobicContact CD2-CD1 3.69Å; Y117-L120 HydrophobicContact CE2-CD1 4.07Å; Y117-L120 HydrophobicContact CG-CD1 4.15Å; S118-L120 PolarHBondContact O-N 2.64Å; L120-E124 HydrophobicContact CB-CB 4.09Å; L120-E124 HydrophobicContact CD2-CB 4.49Å; L120-K125 HydrophobicContact CB-CD 4.49Å; L120-K125 HydrophobicContact CB-CG 3.93Å; L120-K125 HydrophobicContact CD1-CG 4.34Å; L120-K125 VanDerWaalsContact O-CE 3.24Å; L120-K125 WeakPolarHBondContact O-CE 3.38Å; L120-K125 PolarHBondContact O-NZ 3.07Å; L120-R128 VanDerWaalsContact CD1-CZ 3.42Å
121S91.3Very high86.5Confident63 Ų6385.7 Ų85.744%0.44147%0.472SS..  trans-68.4158.9166.666.90000112.1G123 E124 K125S121-G123 VanDerWaalsContact C-N 3.28Å; S121-G123 PolarHBondContact O-N 2.83Å; S121-E124 WeakPolarHBondContact CB-OE2 2.98Å; S121-E124 PolarHBondContact N-OE2 3.31Å; S121-E124 WeakPolarHBondContact O-CB 3.24Å; S121-E124 PolarHBondContact O-N 3.26Å; S121-E124 VanDerWaalsContact OG-CG 3.3Å; S121-E124 WeakPolarHBondContact OG-CG 3.34Å; S121-E124 PolarHBondContact OG-OE2 2.91Å; S121-K125 WeakPolarHBondContact O-CG 3.45Å; S121-K125 PolarHBondContact O-N 3.28Å
122D92.6Very high87.4Confident125 Ų12580.8 Ų80.867%0.66846%0.462SS*.Hα-helixtrans-64.4-31.9-177.2-63.4-34.3000112.8E124 K125 E126D122-E124 VanDerWaalsContact C-N 3.34Å; D122-E124 PolarHBondContact O-N 3.05Å; D122-K125 WeakPolarHBondContact O-CB 3.13Å; D122-K125 PolarHBondContact O-N 2.92Å; D122-K125 IonicContact OD1-NZ 3.88Å; D122-E126 WeakPolarHBondContact O-CB 3.32Å; D122-E126 PolarHBondContact O-N 3.32Å
123G93.1Very high88.5Confident45 Ų4581.9 Ų81.946%0.46446%0.458SS..Hα-helixtrans-67.7-31171.900000113.5S121 A127S121-G123 VanDerWaalsContact C-N 3.28Å; S121-G123 PolarHBondContact O-N 2.83Å; G123-A127 VanDerWaalsContact O-CB 3.27Å; G123-A127 WeakPolarHBondContact O-CB 3.4Å; G123-A127 PolarHBondContact O-N 3.01Å
124E90.3Very high89.4Confident84 Ų8481.6 Ų81.639%0.39346%0.461SS..Hα-helixtrans-76.8-27174-75.7174.394.400113.3L120 S121 D122 R128L120-E124 HydrophobicContact CB-CB 4.09Å; L120-E124 HydrophobicContact CD2-CB 4.49Å; S121-E124 WeakPolarHBondContact CB-OE2 2.98Å; S121-E124 PolarHBondContact N-OE2 3.31Å; S121-E124 WeakPolarHBondContact O-CB 3.24Å; S121-E124 PolarHBondContact O-N 3.26Å; S121-E124 VanDerWaalsContact OG-CG 3.3Å; S121-E124 WeakPolarHBondContact OG-CG 3.34Å; S121-E124 PolarHBondContact OG-OE2 2.91Å; D122-E124 VanDerWaalsContact C-N 3.34Å; D122-E124 PolarHBondContact O-N 3.05Å; E124-R128 WeakPolarHBondContact O-CG 3.49Å; E124-R128 PolarHBondContact O-N 2.85Å; E124-R128 PolarHBondContact O-NH1 3.37Å
125K93.4Very high90.2Very high47 Ų4784 Ų8420%0.20447%0.469CS..Hα-helixtrans-72.3-45.5169.7-68.8163.2172.6144.20110.1Y117 S118 L120 S121 D122 R128 F129Y117-K125 HydrophobicContact CD1-CG 4.47Å; Y117-K125 HydrophobicContact CE1-CB 4.38Å; Y117-K125 HydrophobicContact CE1-CD 4.38Å; Y117-K125 HydrophobicContact CE1-CG 3.85Å; Y117-K125 WeakPolarHBondContact O-CE 3.4Å; Y117-K125 PolarHBondContact OH-O 3.26Å; S118-K125 PolarHBondContact O-NZ 3.03Å; L120-K125 HydrophobicContact CB-CD 4.49Å; L120-K125 HydrophobicContact CB-CG 3.93Å; L120-K125 HydrophobicContact CD1-CG 4.34Å; L120-K125 VanDerWaalsContact O-CE 3.24Å; L120-K125 WeakPolarHBondContact O-CE 3.38Å; L120-K125 PolarHBondContact O-NZ 3.07Å; S121-K125 WeakPolarHBondContact O-CG 3.45Å; S121-K125 PolarHBondContact O-N 3.28Å; D122-K125 WeakPolarHBondContact O-CB 3.13Å; D122-K125 PolarHBondContact O-N 2.92Å; D122-K125 IonicContact OD1-NZ 3.88Å; K125-R128 PolarHBondContact O-N 3.36Å; K125-F129 PolarHBondContact O-N 2.93Å
126E93.3Very high90.9Very high141 Ų14186.3 Ų86.366%0.65948%0.477SS*.Hα-helixtrans-61.6-44.3174.5-175.4171.7-150.200112D122 R128 F129 A130D122-E126 WeakPolarHBondContact O-CB 3.32Å; D122-E126 PolarHBondContact O-N 3.32Å; E126-R128 VanDerWaalsContact C-N 3.34Å; E126-R128 PolarHBondContact O-N 3.4Å; E126-F129 WeakPolarHBondContact O-CB 3.41Å; E126-F129 PolarHBondContact O-N 3.29Å; E126-A130 WeakPolarHBondContact O-CB 3.3Å; E126-A130 PolarHBondContact O-N 3.49Å
127A92.4Very high91.6Very high60 Ų6088.8 Ų88.850%0.49648%0.477SS..Hα-helixtrans-61-40.3175.700000112.7G123 A131G123-A127 VanDerWaalsContact O-CB 3.27Å; G123-A127 WeakPolarHBondContact O-CB 3.4Å; G123-A127 PolarHBondContact O-N 3.01Å; A127-A131 WeakPolarHBondContact O-CB 3.2Å; A127-A131 PolarHBondContact O-N 3.06Å
128R92.1Very high92Very high121 Ų12186.4 Ų86.446%0.45748%0.479SS..Hα-helixtrans-67.3-39.7174.2-77.6173.8178.478.4-9.6112.2Y117 L120 E124 K125 E126 A131 G132Y117-R128 HydrophobicContact CE2-CB 4.35Å; L120-R128 VanDerWaalsContact CD1-CZ 3.42Å; E124-R128 WeakPolarHBondContact O-CG 3.49Å; E124-R128 PolarHBondContact O-N 2.85Å; E124-R128 PolarHBondContact O-NH1 3.37Å; K125-R128 PolarHBondContact O-N 3.36Å; E126-R128 VanDerWaalsContact C-N 3.34Å; E126-R128 PolarHBondContact O-N 3.4Å; R128-A131 PolarHBondContact O-N 3.03Å; R128-G132 PolarHBondContact O-N 3.32Å
129F94Very high92Very high138 Ų13888 Ų8861%0.60548%0.482SS*.Hα-helixtrans-61.6-50.4173.7173.3-101.9000111.4K125 E126 A131 G132 I133K125-F129 PolarHBondContact O-N 2.93Å; E126-F129 WeakPolarHBondContact O-CB 3.41Å; E126-F129 PolarHBondContact O-N 3.29Å; F129-A131 VanDerWaalsContact C-N 3.34Å; F129-A131 PolarHBondContact O-N 3.43Å; F129-G132 PolarHBondContact O-N 2.96Å; F129-G132 VanDerWaalsContact O-N 3.1Å; F129-I133 HydrophobicContact CD1-CG1 4.44Å; F129-I133 HydrophobicContact CD2-CG1 4.45Å; F129-I133 HydrophobicContact CE1-CG1 3.99Å; F129-I133 HydrophobicContact CE2-CD1 4.03Å; F129-I133 HydrophobicContact CE2-CG1 4.01Å; F129-I133 HydrophobicContact CZ-CD1 3.96Å; F129-I133 HydrophobicContact CZ-CG1 3.76Å; F129-I133 WeakPolarHBondContact O-CG1 3.43Å; F129-I133 PolarHBondContact O-N 3.3Å
130A95.8Very high91.9Very high46 Ų4683.6 Ų83.638%0.3846%0.462SS..Hα-helixtrans-59.3-42.4177.500000112.1E126 G132 I133 L134E126-A130 WeakPolarHBondContact O-CB 3.3Å; E126-A130 PolarHBondContact O-N 3.49Å; A130-G132 PolarHBondContact O-N 2.99Å; A130-I133 PolarHBondContact O-N 2.94Å; A130-L134 WeakPolarHBondContact O-CB 3.44Å; A130-L134 WeakPolarHBondContact O-CG 3.33Å; A130-L134 PolarHBondContact O-N 2.84Å
131A92.2Very high91.8Very high55 Ų5586.9 Ų86.946%0.45548%0.477SS..Hα-helixtrans-61.5-40.5173.900000112.5A127 R128 F129 L134 Q135A127-A131 WeakPolarHBondContact O-CB 3.2Å; A127-A131 PolarHBondContact O-N 3.06Å; R128-A131 PolarHBondContact O-N 3.03Å; F129-A131 VanDerWaalsContact C-N 3.34Å; F129-A131 PolarHBondContact O-N 3.43Å; A131-L134 PolarHBondContact O-N 2.85Å; A131-Q135 WeakPolarHBondContact O-CB 3.47Å; A131-Q135 PolarHBondContact O-N 3.07Å
132G92.6Very high91.5Very high28 Ų2886.7 Ų86.729%0.28948%0.479SS..Hα-helixtrans-64.4-41.2175.200000113.4R128 F129 A130 Q135 Q136R128-G132 PolarHBondContact O-N 3.32Å; F129-G132 PolarHBondContact O-N 2.96Å; F129-G132 VanDerWaalsContact O-N 3.1Å; A130-G132 PolarHBondContact O-N 2.99Å; G132-Q135 PolarHBondContact O-N 2.82Å; G132-Q136 WeakPolarHBondContact O-CG 3.5Å; G132-Q136 PolarHBondContact O-N 3.49Å
133I94Very high91.3Very high81 Ų8183.7 Ų83.742%0.41547%0.465SS..Hα-helixtrans-65.3-43.1174.5-63.7-61.9000111F129 A130 Q135 Q136 F137F129-I133 HydrophobicContact CD1-CG1 4.44Å; F129-I133 HydrophobicContact CD2-CG1 4.45Å; F129-I133 HydrophobicContact CE1-CG1 3.99Å; F129-I133 HydrophobicContact CE2-CD1 4.03Å; F129-I133 HydrophobicContact CE2-CG1 4.01Å; F129-I133 HydrophobicContact CZ-CD1 3.96Å; F129-I133 HydrophobicContact CZ-CG1 3.76Å; F129-I133 WeakPolarHBondContact O-CG1 3.43Å; F129-I133 PolarHBondContact O-N 3.3Å; A130-I133 PolarHBondContact O-N 2.94Å; I133-Q135 VanDerWaalsContact C-N 3.33Å; I133-Q135 PolarHBondContact O-N 2.98Å; I133-Q136 PolarHBondContact O-N 3.42Å; I133-F137 PolarHBondContact O-N 3.31Å
134L92.4Very high90.7Very high120 Ų12087.4 Ų87.463%0.62847%0.474SS*.Hα-helixtrans-63.2-37.6174.9-72.6169.1000112.3A130 A131 F137 A138A130-L134 WeakPolarHBondContact O-CB 3.44Å; A130-L134 WeakPolarHBondContact O-CG 3.33Å; A130-L134 PolarHBondContact O-N 2.84Å; A131-L134 PolarHBondContact O-N 2.85Å; L134-F137 PolarHBondContact O-N 2.96Å; L134-A138 WeakPolarHBondContact O-CB 3.33Å; L134-A138 PolarHBondContact O-N 2.83Å
135Q91.6Very high90.1Very high129 Ų12988.2 Ų88.260%0.60348%0.48SS*.Hα-helixtrans-64.2-42.9174-173.4-179.29.900111.6A131 G132 I133 A138 I139A131-Q135 WeakPolarHBondContact O-CB 3.47Å; A131-Q135 PolarHBondContact O-N 3.07Å; G132-Q135 PolarHBondContact O-N 2.82Å; I133-Q135 VanDerWaalsContact C-N 3.33Å; I133-Q135 PolarHBondContact O-N 2.98Å; Q135-A138 PolarHBondContact O-N 3.48Å; Q135-I139 HydrophobicContact CG-CD1 4.02Å; Q135-I139 VanDerWaalsContact O-CG1 3.27Å; Q135-I139 WeakPolarHBondContact O-CG1 3.22Å; Q135-I139 PolarHBondContact O-N 3.1Å
136Q95.4Very high89.3Confident134 Ų13488.8 Ų88.863%0.62649%0.494SS*.Hα-helixtrans-62.6-41.5174.3-74.1-177-14.300112G132 I133 I139 S140G132-Q136 WeakPolarHBondContact O-CG 3.5Å; G132-Q136 PolarHBondContact O-N 3.49Å; I133-Q136 PolarHBondContact O-N 3.42Å; Q136-I139 PolarHBondContact O-N 2.96Å; Q136-S140 WeakPolarHBondContact O-CB 3.27Å; Q136-S140 PolarHBondContact O-N 3.35Å; Q136-S140 PolarHBondContact O-OG 3.03Å
137F91.1Very high88.5Confident109 Ų10991.1 Ų91.148%0.47850%0.497SS..Hα-helixtrans-59.6-52.2174.8-174.6-90.1000111.2I133 L134 I139 S140 E141I133-F137 PolarHBondContact O-N 3.31Å; L134-F137 PolarHBondContact O-N 2.96Å; F137-I139 VanDerWaalsContact C-N 3.32Å; F137-I139 PolarHBondContact O-N 3.21Å; F137-S140 CarbonylContact O-C 3.58Å; F137-S140 WeakPolarHBondContact O-CA 3.32Å; F137-S140 PolarHBondContact O-N 2.94Å; F137-S140 PolarHBondContact O-OG 3.26Å; F137-E141 HydrophobicContact CE1-CB 4.46Å; F137-E141 WeakPolarHBondContact CE1-OE2 3.45Å; F137-E141 PolarHBondContact O-N 3.11Å
138A90Very high87.1Confident53 Ų5392 Ų9244%0.43850%0.5SS..Hα-helixtrans-60.3-37.8179.600000113.2L134 Q135 A142L134-A138 WeakPolarHBondContact O-CB 3.33Å; L134-A138 PolarHBondContact O-N 2.83Å; Q135-A138 PolarHBondContact O-N 3.48Å; A138-A142 VanDerWaalsContact O-CB 3.32Å; A138-A142 WeakPolarHBondContact O-CB 3.34Å; A138-A142 PolarHBondContact O-N 3.4Å
139I84.8Confident85.7Confident97 Ų9791.1 Ų91.150%0.49751%0.512SS..Hα-helixtrans-64.9-42.2172.8-69.2165.7000110.7Q135 Q136 F137 T143Q135-I139 HydrophobicContact CG-CD1 4.02Å; Q135-I139 VanDerWaalsContact O-CG1 3.27Å; Q135-I139 WeakPolarHBondContact O-CG1 3.22Å; Q135-I139 PolarHBondContact O-N 3.1Å; Q136-I139 PolarHBondContact O-N 2.96Å; F137-I139 VanDerWaalsContact C-N 3.32Å; F137-I139 PolarHBondContact O-N 3.21Å; I139-T143 WeakPolarHBondContact O-CB 3.35Å; I139-T143 PolarHBondContact O-N 2.88Å; I139-T143 PolarHBondContact O-OG1 2.98Å
140S86.4Confident83.9Confident53 Ų5392 Ų9237%0.37152%0.519SS..Hα-helixtrans-67.3-39178.275.50000112.7Q136 F137 T143 L144Q136-S140 WeakPolarHBondContact O-CB 3.27Å; Q136-S140 PolarHBondContact O-N 3.35Å; Q136-S140 PolarHBondContact O-OG 3.03Å; F137-S140 CarbonylContact O-C 3.58Å; F137-S140 WeakPolarHBondContact O-CA 3.32Å; F137-S140 PolarHBondContact O-N 2.94Å; F137-S140 PolarHBondContact O-OG 3.26Å; S140-T143 PolarHBondContact O-N 3Å; S140-L144 WeakPolarHBondContact O-CB 3.45Å; S140-L144 VanDerWaalsContact O-CG 3.32Å; S140-L144 WeakPolarHBondContact O-CG 3.49Å; S140-L144 PolarHBondContact O-N 2.92Å
141E89Confident82Confident96 Ų9696.2 Ų96.245%0.44954%0.536SS..Hα-helixtrans-64.2-51.1175.5-174.3-176.8173.700110.7F137 T143 L144 L145F137-E141 HydrophobicContact CE1-CB 4.46Å; F137-E141 WeakPolarHBondContact CE1-OE2 3.45Å; F137-E141 PolarHBondContact O-N 3.11Å; E141-T143 VanDerWaalsContact C-N 3.25Å; E141-T143 PolarHBondContact O-N 3.12Å; E141-L144 PolarHBondContact O-N 3.21Å; E141-L145 HydrophobicContact CG-CD1 4.04Å; E141-L145 WeakPolarHBondContact O-CB 3.27Å; E141-L145 VanDerWaalsContact O-CG 3.28Å; E141-L145 WeakPolarHBondContact O-CG 3.43Å; E141-L145 PolarHBondContact O-N 3.44Å
142A85.6Confident80.3Confident59 Ų5996.9 Ų96.949%0.48855%0.548SS..Hα-helixtrans-59.4-35.8175.200000112.6A138 A146A138-A142 VanDerWaalsContact O-CB 3.32Å; A138-A142 WeakPolarHBondContact O-CB 3.34Å; A138-A142 PolarHBondContact O-N 3.4Å; A142-A146 VanDerWaalsContact O-CB 3.31Å; A142-A146 WeakPolarHBondContact O-CB 3.42Å; A142-A146 PolarHBondContact O-N 3.34Å
143T87.4Confident78.2Confident62 Ų62104 Ų10438%0.3857%0.574SS.*Hα-helixtrans-67.9-47.3175.2-56.70000111.3I139 S140 E141 L145 A146 W147I139-T143 WeakPolarHBondContact O-CB 3.35Å; I139-T143 PolarHBondContact O-N 2.88Å; I139-T143 PolarHBondContact O-OG1 2.98Å; S140-T143 PolarHBondContact O-N 3Å; E141-T143 VanDerWaalsContact C-N 3.25Å; E141-T143 PolarHBondContact O-N 3.12Å; T143-L145 PolarHBondContact O-N 3.4Å; T143-A146 PolarHBondContact O-N 3.22Å; T143-W147 PolarHBondContact O-N 2.95Å
144L79.9Confident75.7Confident122 Ų122104.8 Ų104.864%0.63959%0.586SS**Hα-helixtrans-63.9-39.7178.6-73.9168.6000112S140 E141 W147 S148S140-L144 WeakPolarHBondContact O-CB 3.45Å; S140-L144 VanDerWaalsContact O-CG 3.32Å; S140-L144 WeakPolarHBondContact O-CG 3.49Å; S140-L144 PolarHBondContact O-N 2.92Å; E141-L144 PolarHBondContact O-N 3.21Å; L144-W147 PolarHBondContact O-N 3.47Å; L144-S148 PolarHBondContact O-N 2.78Å; L144-S148 PolarHBondContact O-OG 3.02Å
145L79.5Confident73.7Confident102 Ų102104.8 Ų104.853%0.53459%0.593SS.*Hα-helixtrans-64.6-39.5173.6-70.3170.8000112.3E141 T143 W147 S148 S149E141-L145 HydrophobicContact CG-CD1 4.04Å; E141-L145 WeakPolarHBondContact O-CB 3.27Å; E141-L145 VanDerWaalsContact O-CG 3.28Å; E141-L145 WeakPolarHBondContact O-CG 3.43Å; E141-L145 PolarHBondContact O-N 3.44Å; T143-L145 PolarHBondContact O-N 3.4Å; L145-W147 VanDerWaalsContact C-N 3.29Å; L145-W147 PolarHBondContact O-N 3.39Å; L145-S148 PolarHBondContact O-OG 3.45Å; L145-S149 WeakPolarHBondContact O-CB 3.48Å; L145-S149 PolarHBondContact O-N 3.13Å
146A75.1Confident71.5Confident59 Ų59110 Ų11049%0.48861%0.607SS.*Hα-helixtrans-67.1-30.1174.700000112.7A142 T143A142-A146 VanDerWaalsContact O-CB 3.31Å; A142-A146 WeakPolarHBondContact O-CB 3.42Å; A142-A146 PolarHBondContact O-N 3.34Å; T143-A146 PolarHBondContact O-N 3.22Å
147W77.4Confident69.4Low190 Ų190109.6 Ų109.672%0.7262%0.619SS**Hα-helixtrans-79.8-43.3177.2-74.641.3000111.7T143 L144 L145 S149 M150T143-W147 PolarHBondContact O-N 2.95Å; L144-W147 PolarHBondContact O-N 3.47Å; L145-W147 VanDerWaalsContact C-N 3.29Å; L145-W147 PolarHBondContact O-N 3.39Å; W147-S149 VanDerWaalsContact C-N 3.33Å; W147-S149 PolarHBondContact O-N 3.45Å; W147-M150 PolarHBondContact O-N 2.94Å; W147-M150 VanDerWaalsContact O-N 3.14Å
148S63.6Low66.7Low79 Ų79107.3 Ų107.355%0.55263%0.627SS**Hα-helixtrans-67.3-33.4175.864.40000112.5L144 L145 M150 D151L144-S148 PolarHBondContact O-N 2.78Å; L144-S148 PolarHBondContact O-OG 3.02Å; L145-S148 PolarHBondContact O-OG 3.45Å; S148-M150 PolarHBondContact O-N 3.46Å; S148-M150 VanDerWaalsContact O-N 3.08Å; S148-D151 PolarHBondContact O-N 2.98Å
149S61.6Low64.7Low102 Ų102109.8 Ų109.871%0.71364%0.641SS**THydrogen-bonded Turntrans-63.9-8.9172.4-174.90000114.3L145 W147L145-S149 WeakPolarHBondContact O-CB 3.48Å; L145-S149 PolarHBondContact O-N 3.13Å; W147-S149 VanDerWaalsContact C-N 3.33Å; W147-S149 PolarHBondContact O-N 3.45Å
150M57.6Low62.7Low155 Ų155112.6 Ų112.676%0.76466%0.657SS**THydrogen-bonded Turntrans-106.9-6179.5-168.7155.850.700113.3W147 S148 G152W147-M150 PolarHBondContact O-N 2.94Å; W147-M150 VanDerWaalsContact O-N 3.14Å; S148-M150 PolarHBondContact O-N 3.46Å; S148-M150 VanDerWaalsContact O-N 3.08Å; M150-G152 PolarHBondContact O-N 3.01Å; M150-G152 VanDerWaalsContact O-N 3.16Å
151D55.6Low60.8Low136 Ų136119 Ų11973%0.72768%0.681SS**SBendtrans-82.991.2170.8-149.4-11.3000109.3S148 E153S148-D151 PolarHBondContact O-N 2.98Å; D151-E153 VanDerWaalsContact C-N 3.29Å; D151-E153 PolarHBondContact O-N 3.25Å
152G55.6Low58.2Low68 Ų68117.9 Ų117.970%0.70170%0.696SS**  trans-77.453.2-15900000116.6M150 S154M150-G152 PolarHBondContact O-N 3.01Å; M150-G152 VanDerWaalsContact O-N 3.16Å; G152-S154 PolarHBondContact O-N 2.74Å
153E48.8Very low55.9Low179 Ų179120.7 Ų120.784%0.83671%0.712SS**  trans-73.776.7172.256.6-177.5161.500112.9D151D151-E153 VanDerWaalsContact C-N 3.29Å; D151-E153 PolarHBondContact O-N 3.25Å
154S42.3Very low54.1Low96 Ų96124 Ų12467%0.67173%0.731SS**  trans-48.6127.8172.11790000111.5G152 R156G152-S154 PolarHBondContact O-N 2.74Å; S154-R156 VanDerWaalsContact C-N 3.35Å; S154-R156 PolarHBondContact O-N 3.3Å
155P50.5Low52Low120 Ų120122.2 Ų122.278%0.77973%0.734SS**  trans-69.589.6-178.428.3-34.9000110.6S157P155-S157 PolarHBondContact O-N 3.03Å
156R44.8Very low50.4Low238 Ų238125.4 Ų125.490%0.89875%0.746SS**  trans-55.3125.6170.3-93.7-173.5166.9-172.4-2.4109.4S154 G158S154-R156 VanDerWaalsContact C-N 3.35Å; S154-R156 PolarHBondContact O-N 3.3Å; R156-G158 VanDerWaalsContact C-N 3.34Å; R156-G158 PolarHBondContact O-N 3.39Å
157S50Low48.7Very low126 Ų126130.4 Ų130.488%0.88176%0.764SS**  trans-6082.3-172.4-50.20000114.4P155 S159P155-S157 PolarHBondContact O-N 3.03Å; S157-S159 PolarHBondContact O-N 3.36Å
158G36.3Very low47.1Very low62 Ų62125.2 Ų125.264%0.63976%0.757SS**  trans-85.445.717100000112.9R156 N160R156-G158 VanDerWaalsContact C-N 3.34Å; R156-G158 PolarHBondContact O-N 3.39Å; G158-N160 PolarHBondContact O-N 3Å
159S46.1Very low46.2Very low105 Ų105130.1 Ų130.173%0.73477%0.771SS**  trans-67.694.6-174.2-170.50000112S157S157-S159 PolarHBondContact O-N 3.36Å
160N43.9Very low45.4Very low156 Ų156131.2 Ų131.283%0.83477%0.773SS**  trans-125.612.7173.4-74.7-60.9000113G158 G162G158-N160 PolarHBondContact O-N 3Å; N160-G162 PolarHBondContact O-N 3.26Å
161Q45.3Very low44.4Very low187 Ų187129.1 Ų129.187%0.87477%0.765SS**SBendtrans-80.9110.8162.9-67.7-157.114.300108.6
162G36.2Very low43.7Very low73 Ų73130.1 Ų130.175%0.75377%0.765SS**  trans-64.4153.5-174.200000113.7N160N160-G162 PolarHBondContact O-N 3.26Å
163S35.9Very low43.1Very low118 Ų118135.1 Ų135.183%0.82577%0.77SS**  trans-52.6141.4-176.8-1780000114A165S163-A165 PolarHBondContact O-N 3.43Å
164V49.2Very low42.8Very low131 Ų131130.6 Ų130.679%0.79476%0.758SS**  trans-35.2127.7171.2-176.60000113.6
165A37.8Very low43Very low85 Ų85132.8 Ų132.870%0.70276%0.761SS**  trans-138.246.8171.100000112.9S163 L167S163-A165 PolarHBondContact O-N 3.43Å; A165-L167 PolarHBondContact O-N 2.99Å; A165-L167 VanDerWaalsContact O-N 3.14Å
166H44.1Very low42.8Very low168 Ų168133.1 Ų133.178%0.77876%0.761SS**  trans27.373.7146.5-162.6-68.8000117.9
167L41Very low42.8Very low165 Ų165126.4 Ų126.486%0.86475%0.75SS**  trans-117.379.9169.5-75.3-179000112.5A165A165-L167 PolarHBondContact O-N 2.99Å; A165-L167 VanDerWaalsContact O-N 3.14Å
168S42.7Very low42.5Very low81 Ų81131 Ų13157%0.56675%0.749SS**  trans49.7116.4143.1-54.60000120.2V170S168-V170 PolarHBondContact O-N 3.36Å
169E44.8Very low42.6Very low182 Ų182135 Ų13585%0.8576%0.755SS**SBendtrans-5310.4165.8-160.6167.7-162.800116.1
170V44.9Very low42.6Very low125 Ų125138.8 Ų138.876%0.75876%0.761SS**THydrogen-bonded Turntrans-103.114.5-167.3-172.20000112.4S168S168-V170 PolarHBondContact O-N 3.36Å
171N37.6Very low42.6Very low111 Ų111139 Ų13959%0.59476%0.761SS**THydrogen-bonded Turntrans-12919.7176.8-162.925.1000113.2E173N171-E173 VanDerWaalsContact C-N 3.29Å; N171-E173 PolarHBondContact O-N 3.46Å
172Q39.8Very low42.5Very low156 Ų156137.4 Ų137.473%0.72976%0.757SS**THydrogen-bonded Turntrans-75.6-15.4-175.1-154.178.19700113.4
173E43.9Very low42.4Very low174 Ų174142.9 Ų142.981%0.81376%0.763SS**THydrogen-bonded Turntrans-102.82.6-171.364.7-175.6161.600115.7N171N171-E173 VanDerWaalsContact C-N 3.29Å; N171-E173 PolarHBondContact O-N 3.46Å
174S41Very low42.3Very low84 Ų84146 Ų14659%0.58776%0.764SS**SBendtrans-104.4-7.5-169.6-154.90000115.9
175I46.3Very low41.5Very low141 Ų141145.5 Ų145.572%0.72377%0.767SS**SBendtrans-111.826.1-175.645.4174000114.2
176T46.5Very low41.8Very low128 Ų128147 Ų14779%0.78577%0.772SS**SBendtrans-104.424.117357.50000113.5
177S46.5Very low41.5Very low96 Ų96141.9 Ų141.967%0.67176%0.759SS**SBendtrans-148.4142.7167.476.40000111.6
178R42.7Very low41.3Very low224 Ų224142.7 Ų142.785%0.84576%0.758SS**SBendtrans58.782.1166.3-163-177.3-147.9108.46.7114.3
179D38.5Very low41.1Very low145 Ų145145 Ų14578%0.77577%0.769SS**  -156.9118.551.5-75.9-39.4000111.5
180Q45.5Very low40.7Very low185 Ų185146.9 Ų146.986%0.86477%0.768SS**  trans-89.6165.2163.5-71180-13.700109.6
181I44.4Very low40.7Very low160 Ų160144.8 Ų144.882%0.82176%0.757SS**SBendtrans80.7139.2-175.3-48.7158.5000111.6
182L42.9Very low41Very low153 Ų153146.1 Ų146.180%0.80176%0.759SS**SBendtrans61.769.5-177.4-69.2153.3000115.5
183H33.8Very low41.2Very low188 Ų188144 Ų14487%0.8776%0.757SS**  -174.898.1114.2-97.8-69.2000110.2
184Q33.5Very low41.1Very low184 Ų184144.3 Ų144.386%0.8675%0.752SS**  trans-77.2124.5164.1-66174.133.900107.7
185S33.6Very low41.2Very low121 Ų121146.6 Ų146.685%0.84676%0.762SS**  trans-92.798.3169.1-171.10000108.2A187S185-A187 PolarHBondContact O-N 2.89Å
186S44.9Very low41.1Very low115 Ų115144.8 Ų144.880%0.80476%0.762SS**  trans-71.8105.2-175.8-550000111.7
187A35.8Very low40.9Very low61 Ų61144.9 Ų144.950%0.50475%0.754SS.*  trans-142.7129.1165.300000109.6S185 V189S185-A187 PolarHBondContact O-N 2.89Å; A187-V189 PolarHBondContact O-N 3.41Å
188E38.3Very low40.6Very low182 Ų182143.8 Ų143.885%0.8576%0.757SS**SBendtrans25.755.7166.9-5885.4-99.900120.1
189V38.7Very low40.4Very low130 Ų130139.9 Ų139.979%0.78875%0.749SS**  trans-120.4102.1160.1174.80000110.5A187A187-V189 PolarHBondContact O-N 3.41Å
190W35.9Very low40.8Very low222 Ų222144 Ų14484%0.84176%0.755SS**  trans-69.8142.6164.3-7988.5000110.1H192W190-H192 VanDerWaalsContact C-N 3.33Å; W190-H192 PolarHBondContact O-N 3.36Å
191P43.9Very low40.5Very low80 Ų80141.1 Ų141.152%0.51975%0.754SS.*  trans-82.764.4-16334.2-38.4000114.1T193 Y194P191-T193 PolarHBondContact O-N 2.94Å; P191-Y194 PolarHBondContact O-N 2.93Å
192H45.2Very low40.4Very low139 Ų139142 Ų14264%0.64476%0.759SS**Hα-helixtrans-52.6-27.8173.3-90.2-70.5000113.7W190 Y194W190-H192 VanDerWaalsContact C-N 3.33Å; W190-H192 PolarHBondContact O-N 3.36Å; H192-Y194 VanDerWaalsContact C-N 3.3Å; H192-Y194 PolarHBondContact O-N 3.35Å
193T44.3Very low40Very low113 Ų113140.1 Ų140.169%0.69376%0.759SS**Hα-helixtrans-63.3-31.5177.8-35.60000113.2P191P191-T193 PolarHBondContact O-N 2.94Å
194Y40.9Very low40Very low180 Ų180136.6 Ų136.671%0.70676%0.755SS**Hα-helixtrans-80-25.1-170.3-136-84.9000113.5P191 H192 S196P191-Y194 PolarHBondContact O-N 2.93Å; H192-Y194 VanDerWaalsContact C-N 3.3Å; H192-Y194 PolarHBondContact O-N 3.35Å; Y194-S196 VanDerWaalsContact C-N 3.3Å
195V43.7Very low40.7Very low131 Ų131132.9 Ų132.979%0.79475%0.75SS**Hα-helixtrans-75.6-21.6177.3-176.90000111.7Q197V195-Q197 VanDerWaalsContact C-N 3.34Å; V195-Q197 PolarHBondContact O-N 3.19Å
196S44.2Very low41.2Very low103 Ų103135 Ų13572%0.7275%0.752SS**THydrogen-bonded Turntrans-83.1-3.5-175.4-61.30000114.7Y194Y194-S196 VanDerWaalsContact C-N 3.3Å
197Q42.5Very low41.2Very low130 Ų130133.9 Ų133.961%0.60775%0.749SS**SBendtrans-132.1105.1175.8-63.9-177.911.300108.3V195 H199V195-Q197 VanDerWaalsContact C-N 3.34Å; V195-Q197 PolarHBondContact O-N 3.19Å; Q197-H199 VanDerWaalsContact C-N 3.28Å; Q197-H199 PolarHBondContact O-N 2.88Å
198G39.1Very low41.3Very low73 Ų73143 Ų14375%0.75377%0.771SS**  trans-70.267.5-16500000115.9
199H38.7Very low41.3Very low142 Ų142143 Ų14366%0.65777%0.77SS**  trans-105.284.6177.9-70.7-64.3000111.7Q197Q197-H199 VanDerWaalsContact C-N 3.28Å; Q197-H199 PolarHBondContact O-N 2.88Å
200Y46.8Very low41.2Very low231 Ų231142.9 Ų142.991%0.90677%0.773SS**  trans-81.3114.3164.7-67.6-75.6000110.5
201C38.9Very low41Very low125 Ų125139.1 Ų139.185%0.84577%0.774SS**  trans-128.8122.3163.3-79.80000108.9
202L43.6Very low40.4Very low179 Ų179142.6 Ų142.694%0.93779%0.788SS**  trans-72.8127.1179.3-61.6165.4000110.6
203S33.5Very low40.2Very low114 Ų114140.7 Ų140.780%0.79779%0.791SS**  trans-165.8154.8148-142.50000113.6
204S34Very low39.7Very low113 Ų113142.8 Ų142.879%0.7980%0.798SS**  trans59.2103.7165.3-58.40000119.1
205S47.2Very low39.9Very low106 Ų106140 Ų14074%0.74180%0.802SS**  trans-62.5-174.9138.8-63.50000111.1
206D45.3Very low39.5Very low167 Ų167139.4 Ų139.489%0.89380%0.803SS**  trans79.763.2171.7-50.2-20.5000115.4
207A44.6Very low39.6Very low90 Ų90138.2 Ų138.274%0.74481%0.808SS**  trans-145.935.116500000113
208W38.6Very low39.4Very low253 Ų253138.8 Ų138.896%0.95882%0.82SS**  trans-131.954.8177.7-74.9102.2000112.1
209E36.8Very low39.1Very low181 Ų181140.1 Ų140.185%0.84682%0.824SS**  trans-83.7122.9160.5-68.7-167.8131.400109.2T211E209-T211 PolarHBondContact O-N 3.14Å; E209-T211 VanDerWaalsContact O-N 3.12Å
210P37.8Very low38.8Very low128 Ų128138.7 Ų138.783%0.83183%0.83SS**  trans-67.5110.5170.7-15.530.1000108.8N212P210-N212 PolarHBondContact O-N 3.02Å
211T32.4Very low38.3Very low143 Ų143133.2 Ų133.288%0.87782%0.822SS**PPolyproline II helixtrans-62.2124.7177.539.90000110E209E209-T211 PolarHBondContact O-N 3.14Å; E209-T211 VanDerWaalsContact O-N 3.12Å
212N31.3Very low38.1Very low153 Ų153133.4 Ų133.482%0.81882%0.822SS**PPolyproline II helixtrans-64.7155.3-166.1-163.413000112.6P210P210-N212 PolarHBondContact O-N 3.02Å
213S39.7Very low37.6Very low100 Ų100129.8 Ų129.870%0.69982%0.818SS**PPolyproline II helixtrans-69130.3-177.557.80000113.1
214D34Very low37.5Very low156 Ų156127.5 Ų127.583%0.83481%0.813SS**  trans-155.4145.9144.3-115.7-24.7000111.2S216D214-S216 PolarHBondContact O-N 3.27Å
215P46.1Very low37.4Very low122 Ų122127.8 Ų127.879%0.79282%0.815SS**  trans-92.8102.6-171.234.2-31.6000112.9
216S34.2Very low36.9Very low118 Ų118132.4 Ų132.483%0.82582%0.817SS**  trans-86.4124.616860.40000111.1D214D214-S216 PolarHBondContact O-N 3.27Å
217G46.8Very low36.5Very low79 Ų79131.6 Ų131.681%0.81481%0.812SS**  trans-86.4123.2-168.900000114.5
218V37.8Very low36.4Very low141 Ų141134.9 Ų134.986%0.85581%0.813SS**  trans-112.7110.8157.6-73.90000109.2S220V218-S220 PolarHBondContact O-N 3.12Å
219A32.2Very low36.1Very low102 Ų102125.6 Ų125.684%0.84380%0.797SS**  trans-84.5110.7-175.400000111.3
220S33Very low36.4Very low112 Ų112122.5 Ų122.578%0.78379%0.79SS**PPolyproline II helixtrans-67.9135.3166-63.50000110.3V218V218-S220 PolarHBondContact O-N 3.12Å
221P36.3Very low36.4Very low115 Ų115123.7 Ų123.775%0.74779%0.789SS**PPolyproline II helixtrans-68.7144.3177.228.9-34.4000110.8A223P221-A223 PolarHBondContact O-N 3.27Å
222P34.6Very low36.7Very low129 Ų129120.9 Ų120.984%0.83879%0.789SS**PPolyproline II helixtrans-68119.7176.827.7-33.4000110.4G224P222-G224 PolarHBondContact O-N 2.99Å
223A33.4Very low37.1Very low104 Ų104124.8 Ų124.886%0.8679%0.794SS**PPolyproline II helixtrans-61.7119.3172.300000109.7P221P221-A223 PolarHBondContact O-N 3.27Å
224G31.1Very low37.3Very low66 Ų66126 Ų12668%0.6879%0.792SS**PPolyproline II helixtrans-68.3144.7-170.100000113.8P222 Y226P222-G224 PolarHBondContact O-N 2.99Å; G224-Y226 PolarHBondContact O-N 2.98Å
225S32.1Very low38.2Very low119 Ų119120.9 Ų120.983%0.83278%0.777SS**PPolyproline II helixtrans-57.6125.9167.3179.20000110.5
226Y37.1Very low38.4Very low203 Ų203121.7 Ų121.780%0.79677%0.77SS**PPolyproline II helixtrans-103.3133.2163.862.7-89.4000109.4G224G224-Y226 PolarHBondContact O-N 2.98Å
227I37.3Very low39.1Very low150 Ų150119.1 Ų119.177%0.76976%0.756SS**PPolyproline II helixtrans-70.3135.9176.2-64.1-63.8000109G229I227-G229 PolarHBondContact O-N 3.06Å
228M41.3Very low39Very low158 Ų158118.2 Ų118.278%0.77874%0.741SS**  trans-66.697.6170.6-170.774.8-158.700109.5T230M228-T230 PolarHBondContact O-N 2.96Å
229G33.1Very low39.5Very low59 Ų59114.5 Ų114.561%0.60873%0.725SS**  trans-69.2123.6163.100000109.3I227I227-G229 PolarHBondContact O-N 3.06Å
230T43.6Very low40.3Very low115 Ų115116.3 Ų116.371%0.70672%0.715SS**  trans-74.3154.816257.50000109.5M228M228-T230 PolarHBondContact O-N 2.96Å
231D37.1Very low41Very low154 Ų154118.7 Ų118.782%0.82471%0.712SS**  trans149.4144.4134.3-73.1-1.1000111.1
232G38.4Very low41.7Very low84 Ų84119.8 Ų119.887%0.86671%0.711SS**  trans71.280.8165.700000117.3
233Y39.1Very low42.4Very low234 Ų234118.9 Ų118.992%0.91870%0.699SS**  trans-93.3115.5165-153.5-89.4000109.3
234D45.6Very low43.3Very low125 Ų125117.7 Ų117.767%0.66868%0.681SS**  trans-118.9135176.4-167.214.6000111.3Q236D234-Q236 PolarHBondContact O-N 3.24Å
235G52.1Low44.4Very low50 Ų50116.2 Ų116.252%0.51567%0.666SS.*THydrogen-bonded Turntrans-77.8-24.2-160.900000115A237G235-A237 PolarHBondContact O-N 3.08Å
236Q50.5Low45.4Very low139 Ų139113.7 Ų113.765%0.6565%0.648SS**Hα-helixtrans-71.6-27.6-169.8-90.270.7-14.500113.3D234 A238 A239D234-Q236 PolarHBondContact O-N 3.24Å; Q236-A238 PolarHBondContact O-N 2.88Å; Q236-A239 PolarHBondContact O-N 3.22Å
237A47.8Very low46.2Very low63 Ų63111.5 Ų111.552%0.52164%0.64SS.*Hα-helixtrans-64.8-40-175.400000112.9G235 A239 H240 F241G235-A237 PolarHBondContact O-N 3.08Å; A237-A239 VanDerWaalsContact C-N 3.29Å; A237-A239 PolarHBondContact O-N 2.98Å; A237-H240 PolarHBondContact O-N 2.94Å; A237-F241 WeakPolarHBondContact O-CD2 3.33Å
238A46.4Very low47.2Very low61 Ų61111.5 Ų111.550%0.50463%0.634SS.*Hα-helixtrans-65.1-30.4-175.900000113.4Q236 L242Q236-A238 PolarHBondContact O-N 2.88Å; A238-L242 PolarHBondContact O-N 3.02Å
239A48.3Very low47.8Very low62 Ų62111 Ų11151%0.51263%0.631SS.*Hα-helixtrans-66.5-41.6-178.700000112.6Q236 A237 F241 L242 D243Q236-A239 PolarHBondContact O-N 3.22Å; A237-A239 VanDerWaalsContact C-N 3.29Å; A237-A239 PolarHBondContact O-N 2.98Å; A239-F241 VanDerWaalsContact C-N 3.34Å; A239-F241 PolarHBondContact O-N 3.29Å; A239-L242 PolarHBondContact O-N 3.27Å; A239-D243 PolarHBondContact O-N 2.68Å
240H47.3Very low49Very low140 Ų140114.7 Ų114.765%0.64863%0.632SS**Hα-helixtrans-69.6-27.8-179.3-82.6-71000113.8A237 T244A237-H240 PolarHBondContact O-N 2.94Å; H240-T244 PolarHBondContact O-N 2.98Å; H240-T244 PolarHBondContact O-OG1 2.83Å
241F48.8Very low49.8Very low162 Ų162113 Ų11371%0.71162%0.618SS**Hα-helixtrans-73.4-32.7175.5-82.2-74.2000113.1A237 A239 T244 G245A237-F241 WeakPolarHBondContact O-CD2 3.33Å; A239-F241 VanDerWaalsContact C-N 3.34Å; A239-F241 PolarHBondContact O-N 3.29Å; F241-T244 PolarHBondContact O-OG1 2.7Å; F241-G245 PolarHBondContact O-N 3.49Å
242L51.2Low50.7Low138 Ų138111.6 Ų111.672%0.72361%0.606SS**Hα-helixtrans-69.4-41.4176.1-67.9170.7000111.9A238 A239 G245 S246A238-L242 PolarHBondContact O-N 3.02Å; A239-L242 PolarHBondContact O-N 3.27Å; L242-G245 PolarHBondContact O-N 3.33Å; L242-S246 PolarHBondContact O-N 3.44Å
243D48.6Very low51.4Low110 Ų110115.4 Ų115.459%0.58860%0.596SS**Hα-helixtrans-63.3-50.8178.3-168.648.3000111.4A239 G245 S246 Y247A239-D243 PolarHBondContact O-N 2.68Å; D243-G245 VanDerWaalsContact C-N 3.33Å; D243-G245 PolarHBondContact O-N 2.87Å; D243-S246 PolarHBondContact O-N 2.94Å; D243-S246 PolarHBondContact O-OG 3.22Å; D243-Y247 PolarHBondContact O-N 3.12Å
244T51.7Low52.1Low79 Ų79105.9 Ų105.949%0.48556%0.563SS.*Hα-helixtrans-65.5-30.9176.642.40000113.9H240 F241 F248H240-T244 PolarHBondContact O-N 2.98Å; H240-T244 PolarHBondContact O-OG1 2.83Å; F241-T244 PolarHBondContact O-OG1 2.7Å; T244-F248 PolarHBondContact O-N 3.49Å
245G54.8Low52.5Low36 Ų36102.3 Ų102.337%0.37155%0.548SS..Hα-helixtrans-61-49.2172.700000112.4F241 L242 D243 Y247 F248 E249F241-G245 PolarHBondContact O-N 3.49Å; L242-G245 PolarHBondContact O-N 3.33Å; D243-G245 VanDerWaalsContact C-N 3.33Å; D243-G245 PolarHBondContact O-N 2.87Å; G245-Y247 VanDerWaalsContact C-N 3.3Å; G245-Y247 PolarHBondContact O-N 2.76Å; G245-F248 PolarHBondContact O-N 3.01Å; G245-F248 VanDerWaalsContact O-N 3.14Å; G245-E249 PolarHBondContact O-N 2.95Å
246S52.9Low52.5Low65 Ų65103.1 Ų103.146%0.45555%0.545SS..Hα-helixtrans-60.3-38.1-178.574.80000113.1L242 D243 E249 Q250L242-S246 PolarHBondContact O-N 3.44Å; D243-S246 PolarHBondContact O-N 2.94Å; D243-S246 PolarHBondContact O-OG 3.22Å; S246-E249 PolarHBondContact O-N 3.45Å; S246-Q250 PolarHBondContact O-N 2.76Å; S246-Q250 VanDerWaalsContact O-N 3.08Å
247Y54.7Low52.6Low157 Ų157100 Ų10062%0.61653%0.533SS*.Hα-helixtrans-69.4-37.2178.1-154.8-88.1000111.9D243 G245 I251D243-Y247 PolarHBondContact O-N 3.12Å; G245-Y247 VanDerWaalsContact C-N 3.3Å; G245-Y247 PolarHBondContact O-N 2.76Å; Y247-I251 HydrophobicContact CD1-CG1 4.12Å; Y247-I251 HydrophobicContact CE1-CD1 4.38Å; Y247-I251 HydrophobicContact CE1-CG1 4.12Å; Y247-I251 VanDerWaalsContact O-CG1 3.27Å; Y247-I251 WeakPolarHBondContact O-CG1 3.49Å; Y247-I251 PolarHBondContact O-N 2.87Å; Y247-I251 VanDerWaalsContact O-N 3.09Å
248F57.3Low52.8Low150 Ų150105 Ų10566%0.65854%0.538SS*.Hα-helixtrans-67.6-41.3175.5-114.2-84.2000112.2T244 G245 I251 Q252T244-F248 PolarHBondContact O-N 3.49Å; G245-F248 PolarHBondContact O-N 3.01Å; G245-F248 VanDerWaalsContact O-N 3.14Å; F248-I251 PolarHBondContact O-N 3.24Å; F248-Q252 WeakPolarHBondContact O-CG 3.48Å; F248-Q252 PolarHBondContact O-N 2.98Å
249E54.2Low53Low149 Ų149106.2 Ų106.270%0.69654%0.539SS*.Hα-helixtrans-63.9-42.1178-167.2171.7-166.600111.5G245 S246 Q252 Y253G245-E249 PolarHBondContact O-N 2.95Å; S246-E249 PolarHBondContact O-N 3.45Å; E249-Q252 PolarHBondContact O-N 2.84Å; E249-Y253 WeakPolarHBondContact O-CB 3.39Å; E249-Y253 PolarHBondContact O-N 3.45Å
250Q59Low53.3Low135 Ų135107.1 Ų107.163%0.63154%0.539SS*.Hα-helixtrans-63.9-40.4173.6-17117712.600112.7S246 S254S246-Q250 PolarHBondContact O-N 2.76Å; S246-Q250 VanDerWaalsContact O-N 3.08Å; Q250-S254 WeakPolarHBondContact O-CB 3.48Å; Q250-S254 PolarHBondContact O-N 3.29Å; Q250-S254 PolarHBondContact O-OG 2.9Å
251I59.3Low53.5Low81 Ų81105 Ų10542%0.41553%0.532SS..Hα-helixtrans-65.6-43.5176.3-70.7-69.9000111Y247 F248 S254 S255Y247-I251 HydrophobicContact CD1-CG1 4.12Å; Y247-I251 HydrophobicContact CE1-CD1 4.38Å; Y247-I251 HydrophobicContact CE1-CG1 4.12Å; Y247-I251 VanDerWaalsContact O-CG1 3.27Å; Y247-I251 WeakPolarHBondContact O-CG1 3.49Å; Y247-I251 PolarHBondContact O-N 2.87Å; Y247-I251 VanDerWaalsContact O-N 3.09Å; F248-I251 PolarHBondContact O-N 3.24Å; I251-S254 PolarHBondContact O-N 2.98Å; I251-S254 PolarHBondContact O-OG 3.47Å; I251-S254 VanDerWaalsContact O-OG 3.08Å; I251-S255 WeakPolarHBondContact O-CB 3.31Å; I251-S255 PolarHBondContact O-N 2.91Å; I251-S255 PolarHBondContact O-OG 3.11Å
252Q56.1Low53.8Low124 Ų124100.8 Ų100.858%0.57952%0.517SS*.Hα-helixtrans-58.9-52.4175.2-77-74.927.200111.7F248 E249 S254 S255 S256F248-Q252 WeakPolarHBondContact O-CG 3.48Å; F248-Q252 PolarHBondContact O-N 2.98Å; E249-Q252 PolarHBondContact O-N 2.84Å; Q252-S254 VanDerWaalsContact C-N 3.34Å; Q252-S254 PolarHBondContact O-N 3.39Å; Q252-S255 WeakPolarHBondContact O-CB 3.27Å; Q252-S255 PolarHBondContact O-N 2.98Å; Q252-S256 PolarHBondContact O-N 3.42Å
253Y53.2Low54.2Low164 Ų164100.1 Ų100.164%0.64351%0.512SS*.Hα-helixtrans-57.8-45.5177.8-172.7-103.8000111.8E249 S255 S256 L257E249-Y253 WeakPolarHBondContact O-CB 3.39Å; E249-Y253 PolarHBondContact O-N 3.45Å; Y253-S255 PolarHBondContact O-N 3.24Å; Y253-S256 PolarHBondContact O-N 3.27Å; Y253-L257 HydrophobicContact CD1-CD1 3.95Å; Y253-L257 HydrophobicContact CD2-CD1 4.17Å; Y253-L257 HydrophobicContact CE1-CD1 3.64Å; Y253-L257 HydrophobicContact CE2-CD1 3.87Å; Y253-L257 HydrophobicContact CG-CD1 4.21Å; Y253-L257 VanDerWaalsContact O-CD1 3.28Å; Y253-L257 WeakPolarHBondContact O-CD1 3.36Å; Y253-L257 PolarHBondContact O-N 3.46Å; Y253-L257 VanDerWaalsContact O-N 3.12Å
254S53.3Low54.7Low34 Ų3498.2 Ų98.224%0.23851%0.507CS..Hα-helixtrans-69.5-16.3177.984.90000114.4Q250 I251 Q252 R258Q250-S254 WeakPolarHBondContact O-CB 3.48Å; Q250-S254 PolarHBondContact O-N 3.29Å; Q250-S254 PolarHBondContact O-OG 2.9Å; I251-S254 PolarHBondContact O-N 2.98Å; I251-S254 PolarHBondContact O-OG 3.47Å; I251-S254 VanDerWaalsContact O-OG 3.08Å; Q252-S254 VanDerWaalsContact C-N 3.34Å; Q252-S254 PolarHBondContact O-N 3.39Å; S254-R258 WeakPolarHBondContact O-CD 3.33Å; S254-R258 VanDerWaalsContact O-CG 3.32Å; S254-R258 WeakPolarHBondContact O-CG 3.44Å; S254-R258 PolarHBondContact O-NE 3.29Å
255S54.5Low55.5Low50 Ų50100.1 Ų100.135%0.3551%0.514SS..Hα-helixtrans-88-40.3174.2-57.50000110.8I251 Q252 Y253 R258 T259I251-S255 WeakPolarHBondContact O-CB 3.31Å; I251-S255 PolarHBondContact O-N 2.91Å; I251-S255 PolarHBondContact O-OG 3.11Å; Q252-S255 WeakPolarHBondContact O-CB 3.27Å; Q252-S255 PolarHBondContact O-N 2.98Å; Y253-S255 PolarHBondContact O-N 3.24Å; S255-R258 PolarHBondContact O-N 3.48Å; S255-T259 PolarHBondContact O-N 3.34Å; S255-T259 VanDerWaalsContact O-N 3.08Å; S255-T259 PolarHBondContact O-OG1 2.96Å
256S53.1Low56.1Low66 Ų66104 Ų10446%0.46252%0.52SS..Hα-helixtrans-59.6-44.9175.6179.40000112.4Q252 Y253 R258 T259 T260Q252-S256 PolarHBondContact O-N 3.42Å; Y253-S256 PolarHBondContact O-N 3.27Å; S256-R258 VanDerWaalsContact C-N 3.34Å; S256-R258 PolarHBondContact O-N 2.68Å; S256-T259 PolarHBondContact O-N 3.17Å; S256-T259 PolarHBondContact O-OG1 3.01Å; S256-T260 PolarHBondContact O-N 3.39Å; S256-T260 PolarHBondContact O-OG1 2.87Å
257L52.6Low56.9Low73 Ų73107.8 Ų107.838%0.38253%0.529SS..Hα-helixtrans-59.3-44.3174.9-90.979.7000111.9Y253 T259 T260 D261Y253-L257 HydrophobicContact CD1-CD1 3.95Å; Y253-L257 HydrophobicContact CD2-CD1 4.17Å; Y253-L257 HydrophobicContact CE1-CD1 3.64Å; Y253-L257 HydrophobicContact CE2-CD1 3.87Å; Y253-L257 HydrophobicContact CG-CD1 4.21Å; Y253-L257 VanDerWaalsContact O-CD1 3.28Å; Y253-L257 WeakPolarHBondContact O-CD1 3.36Å; Y253-L257 PolarHBondContact O-N 3.46Å; Y253-L257 VanDerWaalsContact O-N 3.12Å; L257-T259 VanDerWaalsContact C-N 3.34Å; L257-T259 PolarHBondContact O-N 3.27Å; L257-T260 WeakPolarHBondContact CA-OG1 3.32Å; L257-T260 PolarHBondContact O-N 2.99Å; L257-T260 PolarHBondContact O-OG1 3.25Å; L257-D261 WeakPolarHBondContact O-CB 3.49Å; L257-D261 VanDerWaalsContact O-CG 3.25Å; L257-D261 PolarHBondContact O-N 3.24Å
258R51.9Low57.6Low170 Ų170106.3 Ų106.364%0.64253%0.527SS*.Hα-helixtrans-64.4-36.3-179.2-66.9174.4-142.8-109.64.8112.6S254 S255 S256 D262S254-R258 WeakPolarHBondContact O-CD 3.33Å; S254-R258 VanDerWaalsContact O-CG 3.32Å; S254-R258 WeakPolarHBondContact O-CG 3.44Å; S254-R258 PolarHBondContact O-NE 3.29Å; S255-R258 PolarHBondContact O-N 3.48Å; S256-R258 VanDerWaalsContact C-N 3.34Å; S256-R258 PolarHBondContact O-N 2.68Å; R258-D262 VanDerWaalsContact O-CB 3.25Å; R258-D262 WeakPolarHBondContact O-CB 3.48Å; R258-D262 PolarHBondContact O-N 3.38Å
259T51.2Low58.4Low85 Ų85102.1 Ų102.152%0.52152%0.52SS..Hα-helixtrans-74.1-33.2176.151.10000112.1S255 S256 L257 M263S255-T259 PolarHBondContact O-N 3.34Å; S255-T259 VanDerWaalsContact O-N 3.08Å; S255-T259 PolarHBondContact O-OG1 2.96Å; S256-T259 PolarHBondContact O-N 3.17Å; S256-T259 PolarHBondContact O-OG1 3.01Å; L257-T259 VanDerWaalsContact C-N 3.34Å; L257-T259 PolarHBondContact O-N 3.27Å; T259-M263 VanDerWaalsContact O-CB 3.3Å; T259-M263 WeakPolarHBondContact O-CB 3.35Å; T259-M263 VanDerWaalsContact O-CG 3.26Å; T259-M263 WeakPolarHBondContact O-CG 3.47Å; T259-M263 PolarHBondContact O-N 3.03Å
260T53.4Low59.5Low81 Ų81100.4 Ų100.450%0.49751%0.511SS..Hα-helixtrans-67-39.9169.746.70000112.8S256 L257 S264S256-T260 PolarHBondContact O-N 3.39Å; S256-T260 PolarHBondContact O-OG1 2.87Å; L257-T260 WeakPolarHBondContact CA-OG1 3.32Å; L257-T260 PolarHBondContact O-N 2.99Å; L257-T260 PolarHBondContact O-OG1 3.25Å; T260-S264 VanDerWaalsContact O-CB 3.28Å; T260-S264 WeakPolarHBondContact O-CB 3.28Å; T260-S264 PolarHBondContact O-N 2.99Å
261D51.7Low60.3Low97 Ų9797.4 Ų97.452%0.51950%0.498SS..Hα-helixtrans-66.2-45.4178.1-69.7-28.7000111.7L257 S264 L265L257-D261 WeakPolarHBondContact O-CB 3.49Å; L257-D261 VanDerWaalsContact O-CG 3.25Å; L257-D261 PolarHBondContact O-N 3.24Å; D261-S264 WeakPolarHBondContact O-CB 3.45Å; D261-S264 PolarHBondContact O-N 2.88Å; D261-L265 PolarHBondContact O-N 3.19Å
262D54.7Low61.1Low73 Ų7396.9 Ų96.939%0.3950%0.502SS..Hα-helixtrans-63.6-41.6176.3172.256.9000112.2R258 L265 K266R258-D262 VanDerWaalsContact O-CB 3.25Å; R258-D262 WeakPolarHBondContact O-CB 3.48Å; R258-D262 PolarHBondContact O-N 3.38Å; D262-L265 PolarHBondContact O-N 2.78Å; D262-K266 WeakPolarHBondContact O-CB 3.32Å; D262-K266 WeakPolarHBondContact O-CD 3.47Å; D262-K266 VanDerWaalsContact O-CG 3.26Å; D262-K266 WeakPolarHBondContact O-CG 3.44Å; D262-K266 PolarHBondContact O-N 3.16Å; D262-K266 WeakPolarHBondContact OD1-CE 3.47Å; D262-K266 IonicContact OD1-NZ 2.65Å; D262-K266 PolarHBondContact OD1-NZ 2.86Å; D262-K266 IonicContact OD2-NZ 3.76Å; D262-K266 PolarHBondContact OD2-NZ 3.22Å
263M59.1Low62.3Low124 Ų12493.9 Ų93.961%0.61150%0.495SS*.Hα-helixtrans-65.1-39.5173.1-77.3-65.1-68.300112.4T259 K266 F267T259-M263 VanDerWaalsContact O-CB 3.3Å; T259-M263 WeakPolarHBondContact O-CB 3.35Å; T259-M263 VanDerWaalsContact O-CG 3.26Å; T259-M263 WeakPolarHBondContact O-CG 3.47Å; T259-M263 PolarHBondContact O-N 3.03Å; M263-K266 PolarHBondContact O-N 3.4Å; M263-F267 WeakPolarHBondContact O-CB 3.35Å; M263-F267 PolarHBondContact O-N 2.87Å
264S59.7Low63.2Low70 Ų7091.1 Ų91.149%0.4948%0.484SS..Hα-helixtrans-62.6-47.3175.3-172.20000111.5T260 D261 K266 F267 Q268T260-S264 VanDerWaalsContact O-CB 3.28Å; T260-S264 WeakPolarHBondContact O-CB 3.28Å; T260-S264 PolarHBondContact O-N 2.99Å; D261-S264 WeakPolarHBondContact O-CB 3.45Å; D261-S264 PolarHBondContact O-N 2.88Å; S264-K266 PolarHBondContact O-N 3.16Å; S264-F267 PolarHBondContact O-N 3.3Å; S264-Q268 WeakPolarHBondContact O-CB 3.29Å; S264-Q268 PolarHBondContact O-N 3.28Å
265L69.3Low64.4Low119 Ų11995 Ų9562%0.62350%0.501SS*.Hα-helixtrans-60-44.2174.9-11472.8000112.1D261 D262 Q268 A269D261-L265 PolarHBondContact O-N 3.19Å; D262-L265 PolarHBondContact O-N 2.78Å; L265-Q268 PolarHBondContact O-N 3.12Å; L265-A269 VanDerWaalsContact O-CB 3.29Å; L265-A269 WeakPolarHBondContact O-CB 3.34Å; L265-A269 PolarHBondContact O-N 3Å
266K67.8Low65.8Low117 Ų11799.8 Ų99.851%0.50952%0.516SS..Hα-helixtrans-63.6-40.9177.7-76.9165.5176.4164.90112D262 M263 S264 K270D262-K266 WeakPolarHBondContact O-CB 3.32Å; D262-K266 WeakPolarHBondContact O-CD 3.47Å; D262-K266 VanDerWaalsContact O-CG 3.26Å; D262-K266 WeakPolarHBondContact O-CG 3.44Å; D262-K266 PolarHBondContact O-N 3.16Å; D262-K266 WeakPolarHBondContact OD1-CE 3.47Å; D262-K266 IonicContact OD1-NZ 2.65Å; D262-K266 PolarHBondContact OD1-NZ 2.86Å; D262-K266 IonicContact OD2-NZ 3.76Å; D262-K266 PolarHBondContact OD2-NZ 3.22Å; M263-K266 PolarHBondContact O-N 3.4Å; S264-K266 PolarHBondContact O-N 3.16Å; K266-K270 VanDerWaalsContact O-CB 3.31Å; K266-K270 WeakPolarHBondContact O-CB 3.31Å; K266-K270 PolarHBondContact O-N 3.29Å
267F69Low66.9Low144 Ų144103.4 Ų103.463%0.63252%0.52SS*.Hα-helixtrans-65.3-45175.2-178.1-112.5000111.8M263 S264 K270 I271M263-F267 WeakPolarHBondContact O-CB 3.35Å; M263-F267 PolarHBondContact O-N 2.87Å; S264-F267 PolarHBondContact O-N 3.3Å; F267-K270 WeakPolarHBondContact O-CB 3.22Å; F267-K270 PolarHBondContact O-N 2.9Å; F267-I271 HydrophobicContact CD1-CD1 3.88Å; F267-I271 HydrophobicContact CE1-CD1 3.49Å; F267-I271 VanDerWaalsContact CE1-CD1 3.49Å; F267-I271 HydrophobicContact CE2-CD1 4.32Å; F267-I271 HydrophobicContact CG-CD1 4.44Å; F267-I271 HydrophobicContact CZ-CD1 3.74Å; F267-I271 WeakPolarHBondContact O-CG1 3.31Å; F267-I271 PolarHBondContact O-N 2.89Å
268Q68.6Low67.9Low126 Ų126103.3 Ų103.359%0.58952%0.519SS*.Hα-helixtrans-64.8-43.7177.5-167175.74100112.1S264 L265 K270 I271 S272S264-Q268 WeakPolarHBondContact O-CB 3.29Å; S264-Q268 PolarHBondContact O-N 3.28Å; L265-Q268 PolarHBondContact O-N 3.12Å; Q268-K270 VanDerWaalsContact C-N 3.3Å; Q268-K270 PolarHBondContact O-N 3.32Å; Q268-I271 PolarHBondContact O-N 3.4Å; Q268-S272 PolarHBondContact O-N 3.02Å; Q268-S272 PolarHBondContact O-OG 3.04Å
269A75Confident69.3Low62 Ų62100.5 Ų100.551%0.51252%0.517SS..Hα-helixtrans-61.7-37.7174.100000112.1L265 S272 S273L265-A269 VanDerWaalsContact O-CB 3.29Å; L265-A269 WeakPolarHBondContact O-CB 3.34Å; L265-A269 PolarHBondContact O-N 3Å; A269-S272 PolarHBondContact O-N 3.48Å; A269-S273 PolarHBondContact O-N 2.76Å
270K76.4Confident70.7Confident114 Ų114100.1 Ų100.150%0.49651%0.512SS..Hα-helixtrans-61.3-47.9173.7-166.388.1177.3-169.20111.2K266 F267 Q268 S273 Y274K266-K270 VanDerWaalsContact O-CB 3.31Å; K266-K270 WeakPolarHBondContact O-CB 3.31Å; K266-K270 PolarHBondContact O-N 3.29Å; F267-K270 WeakPolarHBondContact O-CB 3.22Å; F267-K270 PolarHBondContact O-N 2.9Å; Q268-K270 VanDerWaalsContact C-N 3.3Å; Q268-K270 PolarHBondContact O-N 3.32Å; K270-S273 PolarHBondContact O-N 3.02Å; K270-S273 VanDerWaalsContact O-N 3.17Å; K270-S273 PolarHBondContact O-OG 3.16Å; K270-Y274 HydrophobicContact CD-CE2 4.22Å; K270-Y274 VanDerWaalsContact CE-OH 3.3Å; K270-Y274 WeakPolarHBondContact CE-OH 3.28Å; K270-Y274 HydrophobicContact CG-CD2 4.11Å; K270-Y274 HydrophobicContact CG-CE2 3.57Å; K270-Y274 WeakPolarHBondContact O-CD2 3.4Å; K270-Y274 PolarHBondContact O-N 3.08Å; K270-Y274 VanDerWaalsContact O-N 3.11Å
271I77.1Confident72Confident71 Ų71100.4 Ų100.436%0.36451%0.509SS..Hα-helixtrans-58-49.9176.4-70.7165.8000110.8F267 Q268 S273 Y274 L275F267-I271 HydrophobicContact CD1-CD1 3.88Å; F267-I271 HydrophobicContact CE1-CD1 3.49Å; F267-I271 VanDerWaalsContact CE1-CD1 3.49Å; F267-I271 HydrophobicContact CE2-CD1 4.32Å; F267-I271 HydrophobicContact CG-CD1 4.44Å; F267-I271 HydrophobicContact CZ-CD1 3.74Å; F267-I271 WeakPolarHBondContact O-CG1 3.31Å; F267-I271 PolarHBondContact O-N 2.89Å; Q268-I271 PolarHBondContact O-N 3.4Å; I271-S273 PolarHBondContact O-N 2.95Å; I271-Y274 PolarHBondContact O-N 3.4Å; I271-Y274 VanDerWaalsContact O-N 3.08Å; I271-L275 HydrophobicContact CG2-CD1 3.81Å; I271-L275 HydrophobicContact CG2-CG 4.24Å; I271-L275 WeakPolarHBondContact O-CG 3.28Å; I271-L275 PolarHBondContact O-N 3.14Å
272S75.8Confident73.4Confident70 Ų70101 Ų10149%0.4951%0.513SS..Hα-helixtrans-57.7-36177.3-62.70000112.6Q268 A269 F276Q268-S272 PolarHBondContact O-N 3.02Å; Q268-S272 PolarHBondContact O-OG 3.04Å; A269-S272 PolarHBondContact O-N 3.48Å; S272-F276 VanDerWaalsContact O-CB 3.29Å; S272-F276 WeakPolarHBondContact O-CB 3.3Å; S272-F276 PolarHBondContact O-N 2.96Å
273S80.5Confident74.8Confident62 Ų62101.3 Ų101.343%0.43452%0.517SS..Hα-helixtrans-69.1-34.4176.578.40000113.6A269 K270 I271 R277A269-S273 PolarHBondContact O-N 2.76Å; K270-S273 PolarHBondContact O-N 3.02Å; K270-S273 VanDerWaalsContact O-N 3.17Å; K270-S273 PolarHBondContact O-OG 3.16Å; I271-S273 PolarHBondContact O-N 2.95Å; S273-R277 WeakPolarHBondContact O-CB 3.5Å; S273-R277 PolarHBondContact O-N 3.05Å
274Y72.8Confident76Confident106 Ų106100 Ų10042%0.41651%0.512SS..Hα-helixtrans-69.6-52.6173.2-73.3-63.1000110.7K270 I271 F276 R277 D278K270-Y274 HydrophobicContact CD-CE2 4.22Å; K270-Y274 VanDerWaalsContact CE-OH 3.3Å; K270-Y274 WeakPolarHBondContact CE-OH 3.28Å; K270-Y274 HydrophobicContact CG-CD2 4.11Å; K270-Y274 HydrophobicContact CG-CE2 3.57Å; K270-Y274 WeakPolarHBondContact O-CD2 3.4Å; K270-Y274 PolarHBondContact O-N 3.08Å; K270-Y274 VanDerWaalsContact O-N 3.11Å; I271-Y274 PolarHBondContact O-N 3.4Å; I271-Y274 VanDerWaalsContact O-N 3.08Å; Y274-F276 VanDerWaalsContact C-N 3.3Å; Y274-F276 PolarHBondContact O-N 3.22Å; Y274-R277 PolarHBondContact O-N 3.48Å; Y274-D278 VanDerWaalsContact O-CG 3.25Å; Y274-D278 PolarHBondContact O-N 3.32Å
275L78.4Confident77.1Confident114 Ų114100.4 Ų100.460%0.59751%0.512SS*.Hα-helixtrans-56.4-42.2179.6-66.9175.5000112.3I271 N279I271-L275 HydrophobicContact CG2-CD1 3.81Å; I271-L275 HydrophobicContact CG2-CG 4.24Å; I271-L275 WeakPolarHBondContact O-CG 3.28Å; I271-L275 PolarHBondContact O-N 3.14Å; L275-N279 VanDerWaalsContact O-CB 3.27Å; L275-N279 WeakPolarHBondContact O-CB 3.46Å; L275-N279 PolarHBondContact O-N 3.27Å
276F84Confident77.8Confident151 Ų151101.1 Ų101.166%0.66251%0.512SS*.Hα-helixtrans-63.7-42.2175.6-178.8-98.6000112.6S272 Y274 N280S272-F276 VanDerWaalsContact O-CB 3.29Å; S272-F276 WeakPolarHBondContact O-CB 3.3Å; S272-F276 PolarHBondContact O-N 2.96Å; Y274-F276 VanDerWaalsContact C-N 3.3Å; Y274-F276 PolarHBondContact O-N 3.22Å; F276-N280 WeakPolarHBondContact O-CB 3.38Å; F276-N280 PolarHBondContact O-N 3.49Å
277R76.3Confident78.4Confident142 Ų142101.3 Ų101.354%0.53652%0.515SS..Hα-helixtrans-67.2-43.3179.1-172.2177.269171.95.1111.8S273 Y274 N279 N280 I281S273-R277 WeakPolarHBondContact O-CB 3.5Å; S273-R277 PolarHBondContact O-N 3.05Å; Y274-R277 PolarHBondContact O-N 3.48Å; R277-N279 VanDerWaalsContact C-N 3.35Å; R277-N280 WeakPolarHBondContact O-CB 3.37Å; R277-N280 PolarHBondContact O-N 2.97Å; R277-I281 HydrophobicContact CG-CD1 4.14Å; R277-I281 WeakPolarHBondContact O-CG1 3.44Å; R277-I281 PolarHBondContact O-N 3.26Å
278D74Confident78.8Confident71 Ų71100.8 Ų100.838%0.3851%0.514SS..Hα-helixtrans-70.3-35.3-178.7-58.8-19.1000110.5Y274 I281 N282Y274-D278 VanDerWaalsContact O-CG 3.25Å; Y274-D278 PolarHBondContact O-N 3.32Å; D278-I281 PolarHBondContact O-N 3.39Å; D278-N282 PolarHBondContact O-N 2.97Å; D278-N282 PolarHBondContact O-ND2 3.39Å
279N79.8Confident79.1Confident111 Ų11197.2 Ų97.259%0.59451%0.506SS*.Hα-helixtrans-63-43.7171.7-156-91000111.7L275 R277 N282 V283L275-N279 VanDerWaalsContact O-CB 3.27Å; L275-N279 WeakPolarHBondContact O-CB 3.46Å; L275-N279 PolarHBondContact O-N 3.27Å; R277-N279 VanDerWaalsContact C-N 3.35Å; N279-N282 PolarHBondContact O-N 2.96Å; N279-V283 WeakPolarHBondContact O-CG2 3.26Å; N279-V283 PolarHBondContact O-N 3.39Å
280N82.5Confident79.1Confident78 Ų7898.8 Ų98.842%0.41751%0.505SS..Hα-helixtrans-61.7-43.8176.6-165.8-45000112.2F276 R277 N282 V283 L284F276-N280 WeakPolarHBondContact O-CB 3.38Å; F276-N280 PolarHBondContact O-N 3.49Å; R277-N280 WeakPolarHBondContact O-CB 3.37Å; R277-N280 PolarHBondContact O-N 2.97Å; N280-N282 VanDerWaalsContact C-N 3.34Å; N280-N282 PolarHBondContact O-N 3.37Å; N280-V283 PolarHBondContact O-N 3.32Å; N280-L284 PolarHBondContact O-N 3.08Å; N280-L284 WeakPolarHBondContact OD1-CD1 3.29Å
281I80.3Confident79Confident86 Ų8698.8 Ų98.844%0.44151%0.507SS..Hα-helixtrans-60.9-41.5174.1-68.9166.2000111.5R277 D278 L284 T285R277-I281 HydrophobicContact CG-CD1 4.14Å; R277-I281 WeakPolarHBondContact O-CG1 3.44Å; R277-I281 PolarHBondContact O-N 3.26Å; D278-I281 PolarHBondContact O-N 3.39Å; I281-L284 PolarHBondContact O-N 3.23Å; I281-T285 WeakPolarHBondContact O-CB 3.26Å; I281-T285 PolarHBondContact O-N 3.36Å; I281-T285 PolarHBondContact O-OG1 3.04Å
282N80.4Confident78.3Confident109 Ų109102 Ų10258%0.58352%0.52SS*.Hα-helixtrans-65.3-38176.5-82.6-78.4000112.7D278 N279 N280 T285 Q286D278-N282 PolarHBondContact O-N 2.97Å; D278-N282 PolarHBondContact O-ND2 3.39Å; N279-N282 PolarHBondContact O-N 2.96Å; N280-N282 VanDerWaalsContact C-N 3.34Å; N280-N282 PolarHBondContact O-N 3.37Å; N282-T285 PolarHBondContact O-N 2.96Å; N282-Q286 WeakPolarHBondContact O-CB 3.3Å; N282-Q286 PolarHBondContact O-N 2.86Å
283V83.6Confident77.9Confident80 Ų80106.9 Ų106.949%0.48553%0.528SS..Hα-helixtrans-64.4-48174.8171.20000111.1N279 N280 T285 Q286 E287N279-V283 WeakPolarHBondContact O-CG2 3.26Å; N279-V283 PolarHBondContact O-N 3.39Å; N280-V283 PolarHBondContact O-N 3.32Å; V283-T285 VanDerWaalsContact C-N 3.31Å; V283-T285 PolarHBondContact O-N 2.65Å; V283-Q286 WeakPolarHBondContact O-CB 3.16Å; V283-Q286 PolarHBondContact O-N 3.04Å; V283-Q286 VanDerWaalsContact O-N 3.13Å; V283-E287 PolarHBondContact O-N 2.88Å
284L85.9Confident77Confident96 Ų96109.5 Ų109.550%0.50354%0.537SS..Hα-helixtrans-60-40.5176.2-73.3164.8000112.1N280 I281 Q286 E287 E288N280-L284 PolarHBondContact O-N 3.08Å; N280-L284 WeakPolarHBondContact OD1-CD1 3.29Å; I281-L284 PolarHBondContact O-N 3.23Å; L284-Q286 VanDerWaalsContact C-N 3.32Å; L284-Q286 PolarHBondContact O-N 3.17Å; L284-E287 PolarHBondContact O-N 2.79Å; L284-E288 PolarHBondContact O-N 2.82Å
285T82.6Confident76.1Confident80 Ų80110.7 Ų110.749%0.49155%0.546SS..Hα-helixtrans-67.2-33.7177.2-56.20000111.6I281 N282 V283 A289I281-T285 WeakPolarHBondContact O-CB 3.26Å; I281-T285 PolarHBondContact O-N 3.36Å; I281-T285 PolarHBondContact O-OG1 3.04Å; N282-T285 PolarHBondContact O-N 2.96Å; V283-T285 VanDerWaalsContact C-N 3.31Å; V283-T285 PolarHBondContact O-N 2.65Å; T285-A289 VanDerWaalsContact O-CB 3.22Å; T285-A289 WeakPolarHBondContact O-CB 3.32Å; T285-A289 PolarHBondContact O-N 3.43Å
286Q83.4Confident75Confident134 Ų134108.3 Ų108.363%0.62654%0.538SS*.Hα-helixtrans-68.8-40.7173.9-175178.3106.900111.9N282 V283 L284 A289 L290N282-Q286 WeakPolarHBondContact O-CB 3.3Å; N282-Q286 PolarHBondContact O-N 2.86Å; V283-Q286 WeakPolarHBondContact O-CB 3.16Å; V283-Q286 PolarHBondContact O-N 3.04Å; V283-Q286 VanDerWaalsContact O-N 3.13Å; L284-Q286 VanDerWaalsContact C-N 3.32Å; L284-Q286 PolarHBondContact O-N 3.17Å; Q286-A289 PolarHBondContact O-N 3.21Å; Q286-L290 HydrophobicContact CG-CD1 4.41Å; Q286-L290 WeakPolarHBondContact O-CG 3.49Å; Q286-L290 PolarHBondContact O-N 3.39Å
287E79.3Confident73.6Confident120 Ų120104.4 Ų104.456%0.56153%0.534SS*.Hα-helixtrans-62-50.4176.3-171.9170.7-167.800111.2V283 L284 A289 L290 E291V283-E287 PolarHBondContact O-N 2.88Å; L284-E287 PolarHBondContact O-N 2.79Å; E287-A289 VanDerWaalsContact C-N 3.33Å; E287-A289 PolarHBondContact O-N 3.32Å; E287-L290 WeakPolarHBondContact O-CB 3.48Å; E287-L290 PolarHBondContact O-N 3.08Å; E287-E291 PolarHBondContact O-N 3.02Å
288E77.4Confident72.3Confident134 Ų134103.1 Ų103.163%0.62654%0.538SS*.Hα-helixtrans-60.3-40.5175.8-171.6176.5-176.300111.9L284 L290 E291 H292L284-E288 PolarHBondContact O-N 2.82Å; E288-L290 VanDerWaalsContact C-N 3.28Å; E288-L290 PolarHBondContact O-N 3.48Å; E288-E291 PolarHBondContact O-N 3.14Å; E288-H292 WeakPolarHBondContact O-CB 3.41Å; E288-H292 PolarHBondContact O-N 3.09Å
289A75.8Confident71.1Confident51 Ų51106.7 Ų106.742%0.42155%0.552SS.*Hα-helixtrans-67.6-23.817600000113.9T285 Q286 E287 R293T285-A289 VanDerWaalsContact O-CB 3.22Å; T285-A289 WeakPolarHBondContact O-CB 3.32Å; T285-A289 PolarHBondContact O-N 3.43Å; Q286-A289 PolarHBondContact O-N 3.21Å; E287-A289 VanDerWaalsContact C-N 3.33Å; E287-A289 PolarHBondContact O-N 3.32Å; A289-R293 WeakPolarHBondContact O-CB 3.39Å; A289-R293 PolarHBondContact O-N 3.25Å
290L75.3Confident69.6Low94 Ų94105.8 Ų105.849%0.49255%0.554SS.*Hα-helixtrans-78.4-45.1171.2-72.9170000111Q286 E287 E288 H292 R293 L294Q286-L290 HydrophobicContact CG-CD1 4.41Å; Q286-L290 WeakPolarHBondContact O-CG 3.49Å; Q286-L290 PolarHBondContact O-N 3.39Å; E287-L290 WeakPolarHBondContact O-CB 3.48Å; E287-L290 PolarHBondContact O-N 3.08Å; E288-L290 VanDerWaalsContact C-N 3.28Å; E288-L290 PolarHBondContact O-N 3.48Å; L290-H292 PolarHBondContact O-N 2.91Å; L290-R293 WeakPolarHBondContact O-CB 3.32Å; L290-R293 PolarHBondContact O-N 2.74Å; L290-L294 PolarHBondContact O-N 3.3Å
291E74Confident68Low115 Ų115109.2 Ų109.254%0.53757%0.572SS.*Hα-helixtrans-59.9-46.2174.5-69.7-140.2133.600112E287 E288 R293 L294 H295E287-E291 PolarHBondContact O-N 3.02Å; E288-E291 PolarHBondContact O-N 3.14Å; E291-R293 PolarHBondContact O-N 3.08Å; E291-L294 WeakPolarHBondContact O-CB 3.25Å; E291-L294 PolarHBondContact O-N 3.43Å; E291-L294 VanDerWaalsContact O-N 3.07Å; E291-H295 PolarHBondContact O-N 3.45Å; E291-H295 PolarHBondContact O-ND1 3.29Å
292H63.4Low66.5Low138 Ų138114.1 Ų114.164%0.63959%0.593SS**Hα-helixtrans-66.4-28.4-178.3-151.6-67.3000112.1E288 L290 S296E288-H292 WeakPolarHBondContact O-CB 3.41Å; E288-H292 PolarHBondContact O-N 3.09Å; L290-H292 PolarHBondContact O-N 2.91Å; H292-S296 WeakPolarHBondContact O-CB 3.03Å; H292-S296 PolarHBondContact O-N 3.37Å
293R66.4Low64.9Low173 Ų173113.4 Ų113.465%0.65360%0.603SS**Hα-helixtrans-70.2-42.8170.3-170.4-169.4-52.7-1171.6111.6A289 L290 E291 S296 A297A289-R293 WeakPolarHBondContact O-CB 3.39Å; A289-R293 PolarHBondContact O-N 3.25Å; L290-R293 WeakPolarHBondContact O-CB 3.32Å; L290-R293 PolarHBondContact O-N 2.74Å; E291-R293 PolarHBondContact O-N 3.08Å; R293-S296 PolarHBondContact O-N 2.85Å; R293-A297 WeakPolarHBondContact O-CB 3.27Å; R293-A297 PolarHBondContact O-N 3.49Å
294L62.6Low63.2Low117 Ų117115.6 Ų115.661%0.61362%0.616SS**Hα-helixtrans-60.8-45.5177.6-121.5162.9000111.6L290 E291 N298L290-L294 PolarHBondContact O-N 3.3Å; E291-L294 WeakPolarHBondContact O-CB 3.25Å; E291-L294 PolarHBondContact O-N 3.43Å; E291-L294 VanDerWaalsContact O-N 3.07Å; L294-N298 PolarHBondContact O-ND2 3.42Å
295H52.4Low61.4Low131 Ų131117 Ų11761%0.60663%0.631SS**Hα-helixtrans-68.3-43.5176-67.799.9000112.2E291 A297 N298E291-H295 PolarHBondContact O-N 3.45Å; E291-H295 PolarHBondContact O-ND1 3.29Å; H295-A297 PolarHBondContact O-N 3.32Å; H295-N298 PolarHBondContact O-N 3.47Å
296S55.7Low59.8Low63 Ų63120.2 Ų120.244%0.44165%0.645SS.*Hα-helixtrans-61.5-41.2178.4-175.80000112.9H292 R293 N298 H299H292-S296 WeakPolarHBondContact O-CB 3.03Å; H292-S296 PolarHBondContact O-N 3.37Å; R293-S296 PolarHBondContact O-N 2.85Å; S296-N298 PolarHBondContact O-N 2.76Å; S296-H299 PolarHBondContact O-N 3.37Å; S296-H299 PolarHBondContact O-ND1 3.44Å
297A53.7Low57.8Low69 Ų69119 Ų11957%0.5765%0.652SS**Hα-helixtrans-61.6-26.3179.400000113.7R293 H295R293-A297 WeakPolarHBondContact O-CB 3.27Å; R293-A297 PolarHBondContact O-N 3.49Å; H295-A297 PolarHBondContact O-N 3.32Å
298N49.7Very low56.8Low116 Ų116119.6 Ų119.662%0.6266%0.664SS**Hα-helixtrans-79.7-16.9-178.7-82.9-84.4000114.1L294 H295 S296 S300L294-N298 PolarHBondContact O-ND2 3.42Å; H295-N298 PolarHBondContact O-N 3.47Å; S296-N298 PolarHBondContact O-N 2.76Å; N298-S300 PolarHBondContact O-N 3.42Å
299H49.7Very low55.2Low145 Ų145120.2 Ų120.267%0.67167%0.67SS**THydrogen-bonded Turntrans-81.8-11.3-176.898.2-77.4000114.3S296S296-H299 PolarHBondContact O-N 3.37Å; S296-H299 PolarHBondContact O-ND1 3.44Å
300S48.4Very low53.5Low92 Ų92125.2 Ų125.264%0.64368%0.684SS**  trans-106.942.1-171.3-144.60000114.2N298N298-S300 PolarHBondContact O-N 3.42Å
301L48.3Very low52Low150 Ų150126.3 Ų126.379%0.78570%0.699SS**  trans-120.334.5172.9-72.3177.4000113A303L301-A303 VanDerWaalsContact C-N 3.33Å; L301-A303 PolarHBondContact O-N 3.24Å
302Q48Very low50.6Low189 Ų189127.8 Ų127.888%0.88371%0.71SS**  trans-77.584.1170.7-165.2169.85.500110.2T304Q302-T304 PolarHBondContact O-N 3.39Å
303A47Very low49.5Very low95 Ų95127.6 Ų127.679%0.78572%0.719SS**  trans-60.6120.5-170.500000113.9L301L301-A303 VanDerWaalsContact C-N 3.33Å; L301-A303 PolarHBondContact O-N 3.24Å
304T48.6Very low48.2Very low126 Ų126127.4 Ų127.477%0.77373%0.725SS**  trans-91.5115.1164.641.80000109.7Q302 N306Q302-T304 PolarHBondContact O-N 3.39Å; T304-N306 VanDerWaalsContact C-N 3.27Å; T304-N306 PolarHBondContact O-N 3.04Å
305P47.9Very low47Very low124 Ų124130 Ų13081%0.80573%0.734SS**SBendtrans-84.260-168.634.6-37.4000113
306N48.5Very low46.4Very low149 Ų149130.2 Ų130.280%0.79774%0.744SS**  trans-172.199.6157.9-106.6-47.7000112.8T304T304-N306 VanDerWaalsContact C-N 3.27Å; T304-N306 PolarHBondContact O-N 3.04Å
307S40.8Very low45.5Very low109 Ų109134.6 Ų134.676%0.76276%0.757SS**  trans-165.7105.5153.3-84.50000110.2I309S307-I309 PolarHBondContact O-N 2.8Å
308T58.1Low44.8Very low132 Ų132136.5 Ų136.581%0.8176%0.764SS**  trans-80.3105.7170.4-60.40000108.8
309I45.6Very low44.8Very low147 Ų147136.6 Ų136.675%0.75477%0.771SS**  trans-129.4143.5168.3-59.5-177.1000108.5S307S307-I309 PolarHBondContact O-N 2.8Å
310H40.2Very low44.6Very low155 Ų155138 Ų13872%0.71878%0.782SS**  trans-76.8146.4-166.7-62.5-98.8000112.7L312H310-L312 PolarHBondContact O-N 3.25Å; H310-L312 VanDerWaalsContact O-N 3.15Å
311S43.3Very low44.6Very low117 Ų117139.2 Ų139.282%0.81879%0.786SS**  trans-62.3112.5167.8-176.80000109.8
312L45.1Very low44.6Very low147 Ų147138.1 Ų138.177%0.7778%0.781SS**  trans-87.3144.1167.7-102.569.6000110.2H310 H314H310-L312 PolarHBondContact O-N 3.25Å; H310-L312 VanDerWaalsContact O-N 3.15Å; L312-H314 PolarHBondContact O-N 3.35Å
313V39.8Very low44.7Very low134 Ų134136.2 Ų136.281%0.81278%0.776SS**  trans-52.4133.4-176.81770000111.5Q315V313-Q315 PolarHBondContact O-N 3.24Å
314H38Very low44.4Very low169 Ų169143.2 Ų143.278%0.78278%0.782SS**  trans-64.6114.4169.4-70.956.6000109.2L312 V316L312-H314 PolarHBondContact O-N 3.35Å; H314-V316 PolarHBondContact O-N 3.2Å
315Q38.4Very low44.1Very low171 Ų171143.9 Ų143.980%0.79978%0.781SS**  trans-74114.6163.9-78.7-170.2-2600108.9V313 H317V313-Q315 PolarHBondContact O-N 3.24Å; Q315-H317 PolarHBondContact O-N 3.48Å
316V39.3Very low43.7Very low136 Ų136144 Ų14482%0.82478%0.78SS**  trans-78.5108.2172179.80000107.9H314H314-V316 PolarHBondContact O-N 3.2Å
317H37.3Very low43.4Very low154 Ų154140.4 Ų140.471%0.71378%0.777SS**PPolyproline II helixtrans-68141.9165.6-75.8-87.9000109.7Q315Q315-H317 PolarHBondContact O-N 3.48Å
318P39.6Very low43.1Very low110 Ų110143.1 Ų143.171%0.71478%0.778SS**PPolyproline II helixtrans-65.6148.916830.4-34.4000109.8
319P49.3Very low42.1Very low118 Ų118145.1 Ų145.177%0.76678%0.78SS**PPolyproline II helixtrans-65145174.628.6-34.4000110.8
320L45Very low41.6Very low174 Ų174147.2 Ų147.291%0.91179%0.787SS**PPolyproline II helixtrans-60.9135.1163.4-84.6156000109
321V47.8Very low41.3Very low118 Ų118144.5 Ų144.572%0.71579%0.791SS**PPolyproline II helixtrans-83125.5168.5174.80000107.6L323V321-L323 PolarHBondContact O-N 3.45Å
322D48.2Very low40.7Very low127 Ų127150.4 Ų150.468%0.67980%0.797SS**  trans-64.494.7172.1-78.4-38.9000110W324D322-W324 PolarHBondContact O-N 3.48Å
323L51.1Low39.9Very low149 Ų149152.7 Ų152.778%0.7880%0.804SS**THydrogen-bonded Turntrans-74.116.5-173.3-152.675.1000113.7V321V321-L323 PolarHBondContact O-N 3.45Å
324W41.4Very low39.6Very low241 Ų241150.8 Ų150.891%0.91380%0.802SS**THydrogen-bonded Turntrans-116.5-4.2-169.2-50.2-25.7000113.5D322D322-W324 PolarHBondContact O-N 3.48Å
325N42.4Very low39.5Very low141 Ų141152.3 Ų152.375%0.75481%0.81SS**  trans-115.977.1-175.7-159.2-6.1000112.4
326T38.7Very low39.3Very low127 Ų127148.7 Ų148.778%0.77981%0.809SS**  trans-131.153.6172.1-41.80000110.7Q328T326-Q328 VanDerWaalsContact C-N 3.28Å; T326-Q328 PolarHBondContact O-N 2.96Å
327G42.4Very low39Very low73 Ų73145.9 Ų145.975%0.75381%0.808SS**  trans-87.546.5170.500000113.5
328Q34.2Very low38.9Very low166 Ų166142.5 Ų142.578%0.77681%0.814SS**  trans-154.2145.9164.4-94.9-56.9-2.600110.3T326T326-Q328 VanDerWaalsContact C-N 3.28Å; T326-Q328 PolarHBondContact O-N 2.96Å
329M36.3Very low38.4Very low174 Ų174147.5 Ų147.586%0.85782%0.82SS**  trans-125.5108-176.8172.5175.860.600109.9
330E36.4Very low37.8Very low191 Ų191151.1 Ų151.189%0.89383%0.829SS**  trans-146.2154.4172.4-118.5156.1-16000111.6
331A33.7Very low37.2Very low97 Ų97146.1 Ų146.180%0.80282%0.82SS**  trans-88.5151.1-152.300000114.9Q333A331-Q333 PolarHBondContact O-N 2.74Å
332Y30.6Very low36.4Very low242 Ų242147.6 Ų147.695%0.94983%0.829SS**  trans-66119.9162.9-75.6-93.2000110.5
333Q28.9Very low35.7Very low195 Ų195146.3 Ų146.391%0.91184%0.836SS**  trans-128.4147.1154.8-170.7164.2-9.600109.7A331A331-Q333 PolarHBondContact O-N 2.74Å
334A33.4Very low34.7Very low94 Ų94144.1 Ų144.178%0.77784%0.839SS**  trans-77.1159.6-161.300000115.5A336A334-A336 PolarHBondContact O-N 3.22Å
335E36.2Very low34.4Very low201 Ų201139.3 Ų139.394%0.93984%0.836SS**  trans-54.2115.2174.5177.5-177.1-15900113.8
336A33.7Very low33.9Very low95 Ų95139.5 Ų139.579%0.78584%0.842SS**  trans-163.2124.7159.500000113.1A334A334-A336 PolarHBondContact O-N 3.22Å
337G31.7Very low33.5Very low77 Ų77142.3 Ų142.379%0.79485%0.846SS**  trans71.1106.9155.800000117.9
338G35Very low33Very low83 Ų83143.7 Ų143.786%0.85685%0.851SS**  trans-90.2152.3174.400000114.8
339Y30.3Very low32.8Very low214 Ų214139.4 Ų139.484%0.83985%0.852SS**  trans-150.9156.6157.259.5-89.5000110.3
340M35.5Very low32.8Very low194 Ų194140 Ų14096%0.95686%0.857SS**  trans-87.1137.5176.1-66.6-117.2-66.600110.7
341G33.1Very low32.4Very low69 Ų69136.5 Ų136.571%0.71185%0.853SS**  trans-149.6107.9-177.100000113.3
342V30.9Very low32.6Very low149 Ų149138.3 Ų138.390%0.90385%0.853SS**  trans-46.9142.6-179179.40000114.7
343A33.2Very low32.9Very low100 Ų100132.6 Ų132.683%0.82685%0.846SS**  trans-73.4151.3175.700000113.9
344A30.3Very low33.1Very low103 Ų103128 Ų12885%0.85184%0.842SS**  trans-140.3134168.200000111.1
345V35.3Very low33Very low141 Ų141127.4 Ų127.486%0.85584%0.844SS**  trans-94.1142.4169.9171.50000108.7
346V31.7Very low32.9Very low144 Ų144127.6 Ų127.687%0.87385%0.845SS**  trans-156.2156.9149.3131.80000109.5
347E30.2Very low33Very low186 Ų186131.5 Ų131.587%0.86985%0.847SS**  trans-101.4-175.9-162.6-151.3176.7154.800113.9
348A32.3Very low33Very low102 Ų102133.8 Ų133.884%0.84385%0.845SS**  trans-64.7159.6-168.900000116.7
349G30Very low33Very low77 Ų77136 Ų13679%0.79484%0.842SS**  trans-156.5117.5168.900000113
350L35.6Very low33Very low185 Ų185129.3 Ų129.397%0.96984%0.837SS**  trans-85.3133.2172-86.2155.1000110.9
351C29.4Very low32.7Very low119 Ų119125 Ų12580%0.80482%0.822SS**  trans-158.4140.2150.1-156.90000112.6
352V36.8Very low32.6Very low134 Ų134128 Ų12881%0.81282%0.818SS**  trans-132.7130.4164.51730000107.5
353P37.2Very low32.6Very low122 Ų122128.8 Ų128.879%0.79281%0.811SS**  trans-117.7160.1146.735-25.9000110.8
354A34.3Very low32.8Very low100 Ų100129.3 Ų129.383%0.82681%0.809SS**  trans-130.1151.5-174.700000112.3
355G30.7Very low33Very low80 Ų80130 Ų13083%0.82581%0.805SS**  trans90.7121.7163.900000116.2
356E33.3Very low32.8Very low205 Ų205130.3 Ų130.396%0.95880%0.801SS**  -155.8169.4104-160.9153.1-149.400109
357E35.6Very low32.7Very low178 Ų178130.4 Ų130.483%0.83280%0.795SS**  trans-113.1160.4-174.6-175.7176.7-146.800110.8
358V33.3Very low32.9Very low125 Ų125129.3 Ų129.376%0.75879%0.791SS**  trans144110.1147.9168.20000114.4
359V34Very low32.8Very low130 Ų130132.7 Ų132.779%0.78879%0.789SS**  trans24.4128.9138.9-171.20000121.8
360G30.2Very low32.9Very low72 Ų72136.7 Ų136.774%0.74279%0.787SS**  trans174.1107.2146.600000110.7
361T29.9Very low32.8Very low104 Ų104135.6 Ų135.664%0.63878%0.777SS**  90.195.662.5-76.60000114.5
362E29.9Very low32.9Very low131 Ų131137.8 Ų137.861%0.61278%0.775SS**  trans-6.1133.9159.441.9-73.5152.100122.3
363H31.8Very low32.6Very low167 Ų167140.3 Ų140.377%0.77378%0.778SS**  164.2125.4105.7-88.3-68.1000116.8
364S36.6Very low32.2Very low110 Ų110143 Ų14377%0.76978%0.78SS**  trans62.6166.8142.4-70.80000120.7
365P35.7Very low31.9Very low118 Ų118147.8 Ų147.877%0.76678%0.783SS**  cis-136.5148.715.741.5-22.8000120.3
366L30.4Very low31.9Very low147 Ų147150.9 Ų150.977%0.7777%0.773SS**  21.1122.5126.2-151.6156000121.5
367L30.1Very low32.1Very low146 Ų146150.6 Ų150.676%0.76477%0.772SS**  trans173.9119.8134.4-88.4169.1000106.1
368E33.8Very low32.1Very low164 Ų164148.4 Ų148.477%0.76676%0.762SS**  74.591.865.6-166.6-178.9168.400113.8
369Q30.6Very low32.1Very low173 Ų173150 Ų15081%0.80877%0.766SS**  trans-156.6111.7142.7-117.6164.1-3.900110.5
370Q31.8Very low32.2Very low160 Ų160151.3 Ų151.375%0.74877%0.767SS**  trans-89121.9159.6166.5-175.8-15.500106.2E372Q370-E372 PolarHBondContact NE2-OE2 2.9Å
371E32.5Very low32.2Very low162 Ų162155.8 Ų155.876%0.75777%0.771SS**  trans-129.794.6171.7-144.6158.7-136.500108.7
372E33.3Very low32.4Very low166 Ų166158.5 Ų158.578%0.77678%0.781SS**  trans-77.6110.6158.7-70171.8104.800106.6Q370Q370-E372 PolarHBondContact NE2-OE2 2.9Å
373E30.6Very low32.5Very low187 Ų187156.6 Ų156.687%0.87479%0.787SS**  trans-116.3131.7164.5-148.2-179.8-149.400112
374Q28.2Very low33Very low179 Ų179156.4 Ų156.484%0.83679%0.791SS**  trans-95.2109.6-169.5170.9-177.659.400109.2
375F27.8Very low32.8Very low200 Ų200157.7 Ų157.788%0.87779%0.789SS**  trans-93145.7168.1-142.6-92.9000112.1
376K29.7Very low32.8Very low144 Ų144161.7 Ų161.763%0.62680%0.798SS**  trans-85149.4-156.2-66.5168.1149.7-145.60114.5E378K376-E378 HydrophobicContact CB-CG 4.14Å; K376-E378 VanDerWaalsContact CD-OE1 3.3Å; K376-E378 WeakPolarHBondContact CD-OE1 3.41Å; K376-E378 WeakPolarHBondContact CE-OE1 3.4Å; K376-E378 IonicContact NZ-OE1 2.68Å; K376-E378 PolarHBondContact NZ-OE1 3.41Å
377E37.4Very low32.7Very low199 Ų199162.9 Ų162.993%0.9380%0.799SS**  trans-103.982.1166.5-176.6-179.7-166.500109.2
378E35.7Very low32.9Very low133 Ų133161.5 Ų161.562%0.62180%0.802SS**  trans-157.7135.6170.850.3-163.5-178.400110.5K376K376-E378 HydrophobicContact CB-CG 4.14Å; K376-E378 VanDerWaalsContact CD-OE1 3.3Å; K376-E378 WeakPolarHBondContact CD-OE1 3.41Å; K376-E378 WeakPolarHBondContact CE-OE1 3.4Å; K376-E378 IonicContact NZ-OE1 2.68Å; K376-E378 PolarHBondContact NZ-OE1 3.41Å
379D34.6Very low32.7Very low157 Ų157158.2 Ų158.284%0.8480%0.803SS**  trans57.1129.1-161.5-69.2-32.1000114.8
380I35.4Very low32.7Very low159 Ų159157.5 Ų157.582%0.81580%0.801SS**  cis-119.3115.535.3-62.6159.3000112
381M29.8Very low32.6Very low165 Ų165156.8 Ų156.881%0.81380%0.802SS**  trans-94.294.2166.9-178.1-173.163.900110.7
382L34.4Very low32.6Very low162 Ų162154.9 Ų154.985%0.84880%0.802SS**  trans-135.596.3161.3-77.5-179.6000110.1
383A33.5Very low32.8Very low91 Ų91152.2 Ų152.275%0.75280%0.798SS**  trans-84.2134.9168.200000110.3
384L40.5Very low33.2Very low162 Ų162149.6 Ų149.685%0.84880%0.798SS**  trans-155.4126.7131.4-136.474.4000111.3
385D32.8Very low33.5Very low138 Ų138147.9 Ų147.974%0.73880%0.8SS**  trans2.7128.2164.6-47.4-33.1000120.5
386Q35.4Very low33.9Very low202 Ų202146.5 Ų146.594%0.94480%0.796SS**  trans-133.988.7136.7-166.7150.8100.200109.1
387E29.7Very low34Very low171 Ų171148.7 Ų148.780%0.79981%0.808SS**  trans-67.9145-176.8-169.8-178.9132.400112.3
388S34.3Very low33.7Very low117 Ų117142.2 Ų142.282%0.81880%0.795SS**  trans-83.7115.3174-177.20000111
389A29.3Very low33.5Very low95 Ų95143.5 Ų143.579%0.78581%0.806SS**  trans-119.7139.817700000111.9
390M30.1Very low33.5Very low158 Ų158140.5 Ų140.578%0.77880%0.803SS**  trans-130.2140.3-165.7-161.3-176.866.300110.7
391L30.4Very low33.7Very low145 Ų145139.2 Ų139.276%0.75981%0.808SS**  trans68.7160.3179-41.5176.4000113.4
392T31.3Very low33.8Very low123 Ų123135.3 Ų135.376%0.75581%0.81SS**  cis-155.9156.714.5-25.20000108.6
393P37.1Very low33.6Very low109 Ų109130.9 Ų130.971%0.70880%0.804SS**  trans-81.2154-178.232.1-37.3000114.8
394P40.8Very low33.6Very low133 Ų133132.7 Ų132.786%0.86481%0.811SS**  trans-79157.7179.332.5-35.7000114.2
395T33.2Very low33.4Very low142 Ų142130.6 Ų130.687%0.87181%0.81SS**  trans-108.4166.8-174.9-480000112.3
396Q36.8Very low34.1Very low171 Ų171130 Ų13080%0.79981%0.814SS**  trans-91.1171-178.1-66.3-173.8-5.400114.6
397Q31.7Very low33.8Very low191 Ų191124 Ų12489%0.89381%0.806SS**  trans71.4147.4174.5-49.9-177.6-70.600114.7
398G32Very low34Very low62 Ų62124.9 Ų124.964%0.63981%0.81SS**  cis157.1146.2-6.100000110.5
399D31.4Very low35Very low161 Ų161124.4 Ų124.486%0.86180%0.804SS**  cis-135.3-130.8-4.8-68.1-50.7000108.6
400A34.8Very low35.5Very low94 Ų94125.9 Ų125.978%0.77781%0.805SS**  cis-165.7172.43.300000111.9
401S38.3Very low35.7Very low131 Ų131124.7 Ų124.792%0.91681%0.807SS**  trans87.6117155.8-1520000121
402G31.9Very low36Very low83 Ų83125.3 Ų125.386%0.85681%0.806SS**  trans97.9117.5166.300000115.4
403G31.3Very low36.5Very low70 Ų70125.4 Ų125.472%0.72281%0.809SS**  cis175.3160.1-7.500000112.9
404S32.3Very low36.4Very low129 Ų129126.9 Ų126.990%0.90281%0.809SS**  trans67.2106.9167.4-57.20000120.4
405S35.7Very low36Very low118 Ų118127 Ų12783%0.82581%0.808SS**  trans-96.4-172.6137-130.80000108
406P48.8Very low36Very low126 Ų126126.8 Ų126.882%0.81880%0.797SS**  cis-135.3-1758.643.4-25.9000115.5
407G27.8Very low36Very low75 Ų75128.8 Ų128.877%0.77380%0.797SS**  trans165.6104.8158.700000118.5
408Q34.9Very low36.1Very low190 Ų190129.1 Ų129.189%0.88880%0.796SS**  trans-168.5162.2164.1-131.2-163.6-2.700109.1
409P56.2Low36.1Very low106 Ų106130.1 Ų130.169%0.68880%0.798SS**  cis-111.4-156.3-26.534.6-15.9000110.7
410P39.6Very low36.4Very low126 Ų126127.5 Ų127.582%0.81879%0.792SS**  -149-168.297.240.5-22000115.9
411T32.6Very low36.2Very low133 Ų133130.2 Ų130.282%0.81679%0.794SS**  trans-96.2175.1-159.2-36.30000116.5
412E36.8Very low35.9Very low158 Ų158130.2 Ų130.274%0.73879%0.788SS**  trans-53.8173.5179.5-51177.6177.200118.1
413P43.2Very low35.8Very low126 Ų126132.3 Ų132.382%0.81878%0.784SS**  -149.8126.4111.736.1-18.4000119.7
414I33.9Very low35.8Very low139 Ų139133.5 Ų133.571%0.71379%0.787SS**  trans9.2130.4137.7-37.1175.2000121.8
415T33.5Very low35.7Very low136 Ų136130.9 Ų130.983%0.83478%0.78SS**  164157.1126.535.80000111
416E32.5Very low35.4Very low137 Ų137133.3 Ų133.364%0.6478%0.783SS**  cis-152.7147.220.1-156.2-169.2161.600113.5
417R36.3Very low34.8Very low214 Ų214134.2 Ų134.281%0.80878%0.78SS**  trans22.5155.7150.9-62.1168.9-171.8138.6-3.2121.6
418K33.8Very low34.9Very low197 Ų197139 Ų13986%0.85778%0.782SS**  cis-159.616919.3-138.1-173.3172.4-174.10107.5
419A31.6Very low34.8Very low83 Ų83137 Ų13769%0.68678%0.783SS**  cis-149.3178.710.500000111.9
420S37.8Very low33.5Very low106 Ų106135.8 Ų135.874%0.74179%0.79SS**  trans-122.2175.4-166.4-50.10000114
421D31.6Very low32.9Very low151 Ų151133.2 Ų133.281%0.80779%0.786SS**  trans129.5144.1149.5-68.7-3.3000113.7
422V31.6Very low32.8Very low132 Ų132137 Ų13780%0.879%0.791SS**  cis-151171.9-4.2109.40000112.8
423T30.8Very low33Very low127 Ų127137.3 Ų137.378%0.77979%0.79SS**  trans-84145.6-166.3-49.70000117.4
424A30.9Very low33Very low95 Ų95136.2 Ų136.279%0.78578%0.783SS**  trans51.9117.6152.200000123.2
425G30.5Very low33Very low73 Ų73135.8 Ų135.875%0.75378%0.782SS**  94.583.588.700000119.8
426L29Very low33Very low169 Ų169134.2 Ų134.289%0.88578%0.776SS**  trans-165161.6161.8-131.164.8000107.3
427I35.2Very low33.1Very low145 Ų145133.7 Ų133.774%0.74478%0.777SS**  cis-130.1178.114.9-96.4178.2000111.4
428Q31.4Very low33.1Very low176 Ų176132.3 Ų132.382%0.82278%0.78SS**  trans-59.6158.7178.5-61.2147.5-6.600116.9
429T32.8Very low33.4Very low149 Ų149131.5 Ų131.591%0.91478%0.779SS**  trans-71.7126.7154.347.90000111.9
430G28.1Very low33.7Very low80 Ų80133.8 Ų133.883%0.82578%0.775SS**  trans157.4141.6165.500000112.8
431G26.3Very low33.5Very low72 Ų72132.6 Ų132.674%0.74278%0.78SS**  cis152.5128.6-8.600000112.6
432K31.4Very low33.8Very low211 Ų211130.3 Ų130.392%0.91777%0.768SS**  trans-168.4119.8158-113165.1-1771790112.5
433K40.3Very low34Very low165 Ų165127.6 Ų127.672%0.71777%0.766SS**  trans-68.3165.6149.2-124-169.5178.5-165.50107.8
434P43.8Very low34.2Very low103 Ų103126.8 Ų126.867%0.66976%0.758SS**  -137.2-170.555.147.5-31000112.5
435D34.2Very low34.5Very low131 Ų131130.8 Ų130.870%0.70176%0.762SS**  cis-149.1172.117.8-112.4-44.1000112
436C32.3Very low35Very low103 Ų103135.6 Ų135.670%0.69676%0.764SS**  trans57.985.3162.9-58.20000120.6
437D34.7Very low35.9Very low125 Ų125131.3 Ų131.367%0.66875%0.754SS**  34.3118.997.8-45.7-11.1000117
438E36.6Very low36.1Very low185 Ų185134 Ų13486%0.86476%0.76SS**  81.1114.571.1-79.9-170.7-157.200115.6
439E40Very low36.7Very low181 Ų181130.1 Ų130.185%0.84675%0.753SS**  trans-179.2148.4153.8-90-124.4161.100108.3
440E38.4Very low37Very low130 Ų130130.6 Ų130.661%0.60775%0.749SS**  cis-149.5147.9-16.5-158.9-158.1-170.200108.7N442E440-N442 PolarHBondContact OE1-ND2 3.49Å; E440-N442 WeakPolarHBondContact OE2-CB 3.43Å; E440-N442 PolarHBondContact OE2-ND2 3.41Å
441G34.6Very low37.7Very low81 Ų81139.4 Ų139.484%0.83577%0.765SS**  trans-112.679.1174.800000112.1G443G441-G443 PolarHBondContact O-N 2.79Å
442N36.8Very low38.2Very low103 Ų103142.8 Ų142.855%0.55177%0.766SS**  trans-90.984.9-165.1-148.1-38.1000114.9E440E440-N442 PolarHBondContact OE1-ND2 3.49Å; E440-N442 WeakPolarHBondContact OE2-CB 3.43Å; E440-N442 PolarHBondContact OE2-ND2 3.41Å
443G35.5Very low38.6Very low75 Ų75139.2 Ų139.277%0.77376%0.758SS**  trans-97.680.5167.800000112.1G441G441-G443 PolarHBondContact O-N 2.79Å
444N35.7Very low38.5Very low111 Ų111137.8 Ų137.859%0.59476%0.76SS**  trans-90.5109.6-171.4-165.1-10.2000114.1H446N444-H446 PolarHBondContact OD1-CD2 3.14Å
445M36.5Very low38.2Very low179 Ų179139.8 Ų139.888%0.88277%0.765SS**  trans-89.9102.6164.1-70.7-164.4-58.900110.8
446H41.9Very low38.4Very low173 Ų173140.4 Ų140.480%0.80177%0.769SS**  trans-85.5129.7167.2-109.4-81000111.8N444N444-H446 PolarHBondContact OD1-CD2 3.14Å
447A48.4Very low38.9Very low80 Ų80142.9 Ų142.966%0.66177%0.774SS**  trans-130.5136.8179.100000112.2
448F39.4Very low39.1Very low201 Ų201144.1 Ų144.188%0.88278%0.782SS**  trans62.1105.2161.4-77.3-72.1000121.4
449S42.2Very low39.3Very low95 Ų95141 Ų14166%0.66478%0.775SS**  104.9147.3110.8-154.10000119.2
450L40.2Very low39.3Very low158 Ų158137.7 Ų137.783%0.82777%0.769SS**  trans68.4135.7174.6-61.4144.7000114.1
451K41.9Very low39.4Very low266 Ų266138.4 Ų138.4100%1.15778%0.784SS**  cis-150.2012.3-168.8176.8-179.6179.80111.9

Retrieved 451 of 451 residues in 302.7 ms (Link to these results)