A0A0D9QWH7_CHLSB Loading...

NK6 homeobox 1

AlphaFold DB , UniProt , Accession A0A0D9QWH7, Species CHLSB (Chlorocebus sabaeus, Green monkey), Gene NKX6-1, Length 366 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
1M39.6Very low43.5Very low229 Ų229142.5 Ų142.5100%1.12883%0.825SS**  0114.90-63.2145.689.800105.3
2L40.7Very low43.8Very low169 Ų169144.9 Ų144.989%0.88582%0.823SS**  63.213056.9-58.2176.8000111.7
3A48.1Very low43.7Very low79 Ų79140.1 Ų140.165%0.65380%0.804SS**  cis-169.3156.9-900000111.3
4V44.5Very low44Very low155 Ų155136.6 Ų136.694%0.93980%0.801SS**  trans66147.4152.8169.10000116.6
5G40.7Very low44.1Very low69 Ų69139.9 Ų139.971%0.71180%0.802SS**  cis-159.7170.73.900000114.1
6A43Very low44.4Very low107 Ų107141.1 Ų141.188%0.88480%0.803SS**  trans-100.2159.4173.100000111
7M47.4Very low44.9Very low188 Ų188142.9 Ų142.993%0.92681%0.809SS**  trans-131.4120.3161.655174.567.900109.7
8E40Very low44.8Very low167 Ų167140.9 Ų140.978%0.7881%0.806SS**  trans-92.3109.5-173.2179.158.6-118.300110.5T10E8-T10 PolarHBondContact O-N 3.37Å
9G47.3Very low45.3Very low66 Ų66138.9 Ų138.968%0.6880%0.801SS**  trans-75.862.4-175.800000113.8R11G9-R11 PolarHBondContact O-N 3.36Å
10T41.8Very low46.1Very low88 Ų88137.4 Ų137.454%0.5480%0.796SS.*  trans-58.694.8-171.1-62.70000113.1E8 Q12E8-T10 PolarHBondContact O-N 3.37Å; T10-Q12 VanDerWaalsContact C-N 3.27Å; T10-Q12 HydrophobicContact CG2-CB 4.39Å; T10-Q12 HydrophobicContact CG2-CG 3.79Å; T10-Q12 PolarHBondContact O-N 3.43Å
11R45.9Very low46.6Very low251 Ų251136.1 Ų136.195%0.94779%0.793SS**  trans-80.966.7172.9-81.4-171.6168.1-95.2-2.3112.6G9G9-R11 PolarHBondContact O-N 3.36Å
12Q46.1Very low47.2Very low171 Ų171134 Ų13480%0.79979%0.785SS**  trans-80.5110.6161.3-76.1-17949.800110.4T10T10-Q12 VanDerWaalsContact C-N 3.27Å; T10-Q12 HydrophobicContact CG2-CB 4.39Å; T10-Q12 HydrophobicContact CG2-CG 3.79Å; T10-Q12 PolarHBondContact O-N 3.43Å
13S43.1Very low47.8Very low82 Ų82130.3 Ų130.357%0.57378%0.778SS**  trans-17491.9138.4-174.40000109.5F15S13-F15 PolarHBondContact O-N 2.84Å; S13-F15 WeakPolarHBondContact OG-CD2 3.4Å; S13-F15 WeakPolarHBondContact OG-CE2 3.2Å
14A47.2Very low47.8Very low92 Ų92131 Ų13176%0.7678%0.784SS**  trans-80.2102.9158.400000106.9L16A14-L16 VanDerWaalsContact C-N 3.31Å; A14-L16 PolarHBondContact O-N 2.86Å
15F46.1Very low48.1Very low186 Ų186131.7 Ų131.782%0.81678%0.782SS**  trans-63.893.8173.7-86.9-86.3000109.8S13 L17S13-F15 PolarHBondContact O-N 2.84Å; S13-F15 WeakPolarHBondContact OG-CD2 3.4Å; S13-F15 WeakPolarHBondContact OG-CE2 3.2Å; F15-L17 PolarHBondContact O-N 3.34Å
16L48.6Very low48.8Very low159 Ų159137.8 Ų137.883%0.83279%0.791SS**  trans-56.4120.4166.4-69.1171.8000107.7A14 S18A14-L16 VanDerWaalsContact C-N 3.31Å; A14-L16 PolarHBondContact O-N 2.86Å; L16-S18 VanDerWaalsContact C-N 3.26Å; L16-S18 PolarHBondContact O-N 3.36Å
17L52.7Low49.4Very low172 Ų172137.7 Ų137.790%0.90178%0.784SS**  trans-74.884.5-177.6-152.177000109F15 S19F15-L17 PolarHBondContact O-N 3.34Å; L17-S19 PolarHBondContact O-N 2.82Å
18S43.4Very low49.3Very low107 Ų107137.7 Ų137.775%0.74878%0.784SS**PPolyproline II helixtrans-53.5119.6179.8-176.10000110.6L16L16-S18 VanDerWaalsContact C-N 3.26Å; L16-S18 PolarHBondContact O-N 3.36Å
19S54.7Low49.9Very low103 Ų103134.4 Ų134.472%0.7279%0.786SS**PPolyproline II helixtrans-59.5131.7167.9-65.60000109.2L17L17-S19 PolarHBondContact O-N 2.82Å
20P60.7Low49.9Very low107 Ų107140.4 Ų140.470%0.69580%0.796SS**PPolyproline II helixtrans-63.2133.9177.926.3-34000110.1L22P20-L22 PolarHBondContact O-N 3.47Å
21P56.7Low49.9Very low112 Ų112143.5 Ų143.573%0.72781%0.806SS**PPolyproline II helixtrans-68.4124.7-178.426.5-33.6000111.2A23P21-A23 PolarHBondContact O-N 2.62Å
22L51.9Low49.8Very low185 Ų185139.4 Ų139.497%0.96980%0.795SS**SBendtrans-77.165.3177-70.7170.8000111.4P20P20-L22 PolarHBondContact O-N 3.47Å
23A53.7Low50.2Low90 Ų90135.3 Ų135.374%0.74478%0.782SS**  trans-13635.5-17100000113.9P21P21-A23 PolarHBondContact O-N 2.62Å
24A48.8Very low50.4Low94 Ų94136.2 Ų136.278%0.77779%0.786SS**  trans-138.324.8-17300000115.3
25L51.3Low50.5Low170 Ų170136.2 Ų136.289%0.8977%0.773SS**  trans-135.562.5-176.9-74.7175.9000112.8
26H54.4Low50.9Low196 Ų196137.4 Ų137.491%0.90777%0.774SS**  trans-150.522.8178.7-127-139000115.3
27S56Low51.2Low106 Ų106135 Ų13574%0.74177%0.767SS**SBendtrans-126.114.1-167.2-165.50000116.2
28M44.4Very low50.9Low187 Ų187131.2 Ų131.292%0.92176%0.761SS**SBendtrans-143.131.2-172-72.1-84.190.500113.7
29A53.7Low50.5Low99 Ų99131 Ų13182%0.81877%0.766SS**  trans-124.715.5-165.300000116.6
30E45.7Very low49.9Very low191 Ų191137.1 Ų137.189%0.89378%0.775SS**  trans-134.8112.3177.9-66.8-167.8129.800113.1
31M42.8Very low50.1Low153 Ų153137.4 Ų137.475%0.75478%0.777SS**  trans-175.2150.3136.757174.5-1.500112.4
32K43.1Very low50Low165 Ų165137.7 Ų137.772%0.71778%0.779SS**  trans74.789.9166.5-62.9157.9-179.8159.90117.9
33T54.2Low49.6Very low85 Ų85136.2 Ų136.252%0.52177%0.771SS.*  trans-73.4161.3142.751.10000111.4A145 A146T33-A145 CarbonylContact C-O 2.89Å; T33-A145 WeakPolarHBondContact CB-O 3.15Å; T33-A145 PolarHBondContact OG1-O 3.15Å; T33-A146 WeakPolarHBondContact OG1-CB 3.36Å
34P49.2Very low49.5Very low101 Ų101137 Ų13766%0.65677%0.768SS**  trans-107.7152.8159.536.3-28.3000113.3A145P34-A145 CarbonylContact C-O 2.94Å; P34-A145 WeakPolarHBondContact CA-O 3.37Å; P34-A145 VanDerWaalsContact N-O 3.12Å
35L47.8Very low49Very low92 Ų92139.5 Ų139.548%0.48277%0.774SS.*  trans-99.9138.8-173.2-166.9155.6000110.8A145 A146L35-A145 HydrophobicContact CB-CB 4.41Å; L35-A145 HydrophobicContact CD1-CB 4.33Å; L35-A145 VanDerWaalsContact N-N 3.17Å; L35-A145 PolarHBondContact N-O 3.2Å; L35-A146 WeakPolarHBondContact CD1-O 3.35Å; L35-A146 VanDerWaalsContact CG-O 3.28Å; L35-A146 WeakPolarHBondContact CG-O 3.28Å
36Y54.2Low48.3Very low212 Ų212134.6 Ų134.683%0.83177%0.765SS**  trans-119.9138.1171.5-106.8-75.9000111.5
37P55.8Low48.8Very low107 Ų107131.2 Ų131.270%0.69576%0.76SS**  trans-127.8130.1130.332.1-19.1000109.6
38A45.8Very low48.7Very low94 Ų94131.7 Ų131.778%0.77776%0.761SS**  cis78.990.247.900000113.7
39A35.8Very low48.3Very low103 Ų103128.1 Ų128.185%0.85175%0.754SS**  trans-155.6114160.700000111.5
40Y41.4Very low47.4Very low231 Ų231128.5 Ų128.591%0.90675%0.751SS**  trans-110.5179.4155.4-82-85.3000106.5
41P64.6Low46.9Very low113 Ų113124.6 Ų124.673%0.73475%0.745SS**  cis-123.5-148.6-2.138.8-16.7000109.5
42P55.8Low46.7Very low118 Ų118122.7 Ų122.777%0.76675%0.746SS**  cis-136.6177.8-5.342.2-22.8000118.3
43L43.3Very low46.4Very low154 Ų154119.9 Ų119.981%0.80675%0.747SS**  trans-54.6163.7158.9-100.774.4000112.7
44P51Low45.7Very low105 Ų105120.9 Ų120.968%0.68276%0.758SS**  -160.6-171.665.441-16.9000120.1
45T37.9Very low45.4Very low148 Ų148121.3 Ų121.391%0.90876%0.763SS**  trans84164.8163.167.10000119.9
46G36.6Very low45.1Very low67 Ų67121.6 Ų121.669%0.69177%0.773SS**  trans-140.3-152.9-157.600000116
47P65.6Low44.6Very low125 Ų125116.5 Ų116.581%0.81277%0.768SS**  trans-94.9172.1-157.342.2-41.1000114.1
48P53.8Low43.9Very low116 Ų116117.4 Ų117.475%0.75378%0.777SS**  -153.1162.887.940.4-21.6000118.6
49S35.6Very low43.8Very low111 Ų111118.6 Ų118.678%0.77678%0.78SS**  trans34.2133.4141.2-53.40000124.2
50S34.8Very low44.9Very low108 Ų108119.7 Ų119.776%0.75578%0.778SS**  178.3143.2112.545.20000114.8
51S35.5Very low44.8Very low109 Ų109114.1 Ų114.176%0.76277%0.773SS**  trans51.1148.4153.338.10000121.9
52S38.3Very low45Very low112 Ų112114.7 Ų114.778%0.78378%0.777SS**  cis-164.8175.8-5.2430000112
53S37.7Very low45.5Very low106 Ų106113.9 Ų113.974%0.74177%0.771SS**  trans-41.4165173.854.80000117.5
54S40.2Very low45.4Very low106 Ų106114.6 Ų114.674%0.74178%0.775SS**  cis-160.6172.237.2-38.30000116.2
55S41.3Very low44.8Very low110 Ų110113 Ų11377%0.76978%0.778SS**  trans-55.7177.4165.452.70000114.9
56S41.4Very low44.9Very low98 Ų98111.4 Ų111.469%0.68577%0.768SS**  cis-164.5141.525.924.30000108.8
57S45Very low45Very low105 Ų105116.9 Ų116.973%0.73478%0.775SS**  64.612061.777.30000116.6
58S40.8Very low43.8Very low127 Ų127117.9 Ų117.989%0.88877%0.774SS**  trans-171.1147.9153.3-85.70000115.2
59S44.1Very low44.3Very low118 Ų118117.9 Ų117.983%0.82577%0.774SS**  trans-153.1160.8165.5-57.70000107.9
60P58.9Low44.3Very low127 Ų127116.5 Ų116.583%0.82578%0.777SS**  trans-152.3-177.3133.434.6-14.4000117.1
61S38.9Very low44.2Very low114 Ų114114.9 Ų114.980%0.79778%0.777SS**  trans-153.6-155.5175.3-45.60000107.5
62P69.1Low44.4Very low124 Ų124118.6 Ų118.681%0.80579%0.787SS**  cis-110.9-102.8-17.432.2-9.2000112
63P66.4Low44.4Very low101 Ų101122.3 Ų122.366%0.65679%0.789SS**  cis-130.9-171.4-6.842.5-23.2000116.8
64L41.2Very low45.7Very low170 Ų170122.2 Ų122.289%0.8979%0.786SS**  trans68.6167.8168.4-58.5176.5000117.2
65G38.1Very low46.5Very low71 Ų71123 Ų12373%0.73279%0.789SS**  cis150.7158.6-700000112
66T40Very low46.3Very low115 Ų115121.9 Ų121.971%0.70679%0.786SS**  cis-160.8170.9-761.60000111.9
67H38.1Very low46.2Very low182 Ų182124.6 Ų124.684%0.84380%0.799SS**  trans70.4166.6158.894.5-61.7000123.8
68N41.8Very low45.8Very low146 Ų146123.4 Ų123.478%0.78180%0.803SS**  trans-171.3-168.6-166.7-145.66.6000108
69P64.3Low45.6Very low116 Ų116120.9 Ų120.975%0.75380%0.797SS**  cis-139.7-171.7-10.944.9-25.9000116.9
70G34.3Very low45.2Very low82 Ų82123.2 Ų123.285%0.84580%0.8SS**  trans116.3159.5167.200000114.8
71G33.8Very low44.3Very low73 Ų73122.9 Ų122.975%0.75380%0.8SS**  cis171.3173.8-6.100000112.6
72L39.7Very low44.4Very low187 Ų187123 Ų12398%0.97980%0.801SS**  trans88.9151.9166.8-53.2178000122.3
73K37.1Very low42.9Very low191 Ų191125.5 Ų125.583%0.8381%0.807SS**  trans177.9164-172.9171.3175.1177.6177.70108
74P64.8Low41.3Very low103 Ų103124 Ų12467%0.66981%0.809SS**  cis-105.5-130.7-3.438.2-19.5000111.5
75P58.3Low41.1Very low124 Ų124121.8 Ų121.881%0.80581%0.808SS**  cis-92.6-153.811.5-0.223.4000114.8
76A36.8Very low42.1Very low86 Ų86124 Ų12471%0.71181%0.81SS**  164.894.8-72.500000113.9
77T39.1Very low42.6Very low154 Ų154123.7 Ų123.795%0.94581%0.809SS**  trans-154.8157.4154.852.10000107
78G36.6Very low42.8Very low80 Ų80123.5 Ų123.583%0.82581%0.809SS**  cis-169.8130.3-14.600000106.7
79G37.1Very low42.4Very low74 Ų74125.7 Ų125.776%0.76381%0.814SS**  trans-106.3153.6-165.800000115.2
80L36Very low41.1Very low168 Ų168127.6 Ų127.688%0.8882%0.818SS**  trans-143.1135.4167-80.8180000112.8
81S39.6Very low41.3Very low120 Ų120129.4 Ų129.484%0.83982%0.817SS**  trans58.8117.4148.7-55.20000121.3
82S40.9Very low41.4Very low117 Ų117131 Ų13182%0.81882%0.824SS**  trans-96.4145.8162.2169.40000110.8
83L37.7Very low41.2Very low176 Ų176126.5 Ų126.592%0.92181%0.813SS**  trans-168.6142.4156.4-120.5146.4000113.4
84G32.6Very low41.9Very low69 Ų69124 Ų12471%0.71181%0.814SS**  trans94.1133.8156.500000117.1
85S36.4Very low41.3Very low123 Ų123124.3 Ų124.386%0.8682%0.816SS**  trans-117-156170.1-58.40000110.5
86P60Low40.9Very low118 Ų118126.8 Ų126.877%0.76682%0.817SS**  -83.9-170.2-127.343.4-29.1000112.7
87P50.3Low41.4Very low108 Ų108125.1 Ų125.170%0.70181%0.808SS**  cis-150.3-162.919.547.3-25.7000117.3
88Q41Very low42Very low179 Ų179124.3 Ų124.384%0.83680%0.796SS**  trans43.3119.2155.6-65.9-69.415.100119.1
89Q34.9Very low42.8Very low191 Ų191126.3 Ų126.389%0.89379%0.788SS**  trans-132.7124.9161-163.7169.86.300112.3
90L36.5Very low43.6Very low157 Ų157128.7 Ų128.782%0.82278%0.783SS**  trans-86.3151.8172.3-77.9159000111.1
91S38.6Very low44.5Very low119 Ų119127.7 Ų127.783%0.83278%0.777SS**  trans41.796.9152-59.10000119
92A35.8Very low45.2Very low108 Ų108128.7 Ų128.789%0.89377%0.772SS**  trans-112.7145.4144.200000108.7
93A36.3Very low45.6Very low91 Ų91127.5 Ų127.575%0.75276%0.764SS**  trans-112.1-169.6-165.800000113.5
94T51.2Low46Very low139 Ų139130.1 Ų130.185%0.85376%0.762SS**  trans70.7151.3177.534.30000116.2
95P51.5Low46.7Very low109 Ų109133 Ų13371%0.70877%0.768SS**  trans-124.8156.8-130.838.8-25.2000115.8
96H50.6Low46.7Very low177 Ų177132.6 Ų132.682%0.81977%0.765SS**  trans-113.9140.4158.8-54.4-16.3000107.1
97G45.9Very low45.6Very low51 Ų51135.4 Ų135.453%0.52677%0.77SS.*  cis128.4106.310.900000107.7N99 D100G97-N99 PolarHBondContact O-N 3.32Å; G97-D100 PolarHBondContact O-N 2.78Å
98I53.3Low45.7Very low136 Ų136136 Ų13670%0.69777%0.774SS**G310 helixtrans-58.1-15.1-163.2-89.3170.4000115.5D100I98-D100 VanDerWaalsContact C-N 3.32Å; I98-D100 PolarHBondContact O-N 2.92Å
99N52.7Low45.4Very low122 Ų122134.2 Ų134.265%0.65278%0.775SS**G310 helixtrans-70.7-19.2-177.3-59-41.4000114.8G97 I101 L102 S103G97-N99 PolarHBondContact O-N 3.32Å; N99-I101 VanDerWaalsContact C-N 3.31Å; N99-I101 PolarHBondContact O-N 3.38Å; N99-L102 PolarHBondContact O-N 2.93Å; N99-S103 PolarHBondContact O-OG 3.03Å
100D54.4Low45.2Very low124 Ų124129 Ų12966%0.66376%0.764SS**G310 helixtrans-68.9-29.7-178.9-122.6-94000112.7G97 I98 L102G97-D100 PolarHBondContact O-N 2.78Å; I98-D100 VanDerWaalsContact C-N 3.32Å; I98-D100 PolarHBondContact O-N 2.92Å; D100-L102 VanDerWaalsContact C-N 3.27Å; D100-L102 PolarHBondContact O-N 2.98Å
101I53.7Low45Very low148 Ų148127.4 Ų127.476%0.75977%0.766SS**G310 helixtrans-69.7-25.9179.9-62.9173.7000111.7N99N99-I101 VanDerWaalsContact C-N 3.31Å; N99-I101 PolarHBondContact O-N 3.38Å
102L53.9Low44.7Very low141 Ų141125.1 Ų125.174%0.73876%0.761SS**G310 helixtrans-99.6-6.7-170.8-75.6152.5000114.1N99 D100N99-L102 PolarHBondContact O-N 2.93Å; D100-L102 VanDerWaalsContact C-N 3.27Å; D100-L102 PolarHBondContact O-N 2.98Å
103S49.8Very low44.5Very low92 Ų92125 Ų12564%0.64376%0.761SS**  trans-107.313.5-165.3-56.80000115N99 P105N99-S103 PolarHBondContact O-OG 3.03Å; S103-P105 WeakPolarHBondContact O-CD 3.12Å
104R46.1Very low44.2Very low231 Ų231125.3 Ų125.387%0.87276%0.763SS**  trans-90.4115.4176.9-86.1-174.3158.8-143.1-5.9112
105P47.1Very low43.3Very low128 Ų128126.6 Ų126.683%0.83176%0.764SS**  trans-78.1143.2170.932.4-33.8000111.3S103S103-P105 WeakPolarHBondContact O-CD 3.12Å
106S36.9Very low43Very low115 Ų115127.6 Ų127.680%0.80477%0.77SS**  trans-148.8126.6167.7-168.60000110.6
107M37Very low42Very low178 Ų178124.9 Ų124.988%0.87777%0.771SS**  trans-160.4160-176.3-75.5-68.8-177.600107.3
108P53.2Low41.2Very low119 Ų119127 Ų12777%0.77378%0.784SS**  cis-132.8172.9-26.838.8-24.5000112.6
109V33.4Very low40.1Very low143 Ų143125.7 Ų125.787%0.86779%0.787SS**  trans-154.8147.9150.169.30000112.6
110A32.2Very low39.5Very low80 Ų80126.2 Ų126.266%0.66180%0.797SS**  trans-34.2160.4174.100000118.9
111S31.1Very low38.2Very low124 Ų124125.9 Ų125.987%0.86780%0.804SS**  cis-170.6167.1-6.9-101.80000112
112G31.8Very low36.9Very low71 Ų71122.6 Ų122.673%0.73281%0.807SS**  trans99.1115.5168.400000113.4
113A32.1Very low35.7Very low106 Ų106121.3 Ų121.388%0.87681%0.81SS**  cis74.4128.939.900000113.5
114A30.4Very low34.8Very low97 Ų97121.7 Ų121.780%0.80281%0.812SS**  cis-157.1170.4-8.200000111.4
115L32.8Very low34Very low167 Ų167115.9 Ų115.987%0.87481%0.807SS**  trans-75.8165.3165.3-62.1171.8000110.6
116P44Very low33.2Very low130 Ų130114.6 Ų114.684%0.84480%0.801SS**  -141.2172.9100.238.8-26.6000115.2
117S29.8Very low32.9Very low120 Ų120114.8 Ų114.884%0.83980%0.803SS**  trans-117.4146.6172.1170.60000109.7
118A28.8Very low32.6Very low96 Ų96111.5 Ų111.579%0.79380%0.797SS**  trans-165.7154.115700000112.7
119S31.5Very low31.7Very low107 Ų107110.9 Ų110.975%0.74880%0.795SS**  trans-85.3-174.6170.9-45.90000112.2
120P39.4Very low31.6Very low133 Ų133109.9 Ų109.986%0.86480%0.795SS**  -140.1172.9115.239-28.6000115
121S28Very low31.5Very low118 Ų118110.3 Ų110.383%0.82580%0.798SS**  trans-144134.7-178-57.40000112.5
122G26.5Very low31.5Very low79 Ų79110 Ų11081%0.81480%0.796SS**  trans71.3171.1172.700000115.6
123S28.4Very low31.5Very low114 Ų114110.5 Ų110.580%0.79779%0.794SS**  cis-165.5148.8-19.9520000107.5
124S29.4Very low31.4Very low100 Ų100110.9 Ų110.970%0.69979%0.79SS**  151.8158.589.951.10000111.2
125S30Very low31.5Very low109 Ų109112.5 Ų112.576%0.76280%0.795SS**  trans60.5150.2160.226.10000120.5
126S30Very low31.4Very low101 Ų101109.3 Ų109.371%0.70679%0.793SS**  cis-170.1150.1-10.445.70000112.6
127S30.5Very low30.8Very low119 Ų119108.5 Ų108.583%0.83279%0.79SS**  trans62.9153.5164.458.80000118
128S32Very low30.7Very low108 Ų108107.4 Ų107.476%0.75579%0.788SS**  cis-143.2176.29.758.40000113.7
129S33.4Very low30.5Very low106 Ų106107.8 Ų107.874%0.74179%0.791SS**  trans-43.4158.2166.950.90000115.2
130S31.4Very low30.3Very low123 Ų123107.5 Ų107.586%0.8680%0.795SS**  cis-159.4-174.443.5570000115.6
131A31.2Very low29.7Very low88 Ų88105.5 Ų105.573%0.72779%0.79SS**  trans-80.4165.2-16400000118.4
132S30.5Very low29.6Very low117 Ų117104.8 Ų104.882%0.81879%0.791SS**  trans120.3137133.676.30000120.3
133A31.3Very low29.6Very low83 Ų83105 Ų10569%0.68679%0.785SS**  trans57.8107.114300000123.1
134S30.4Very low29.4Very low114 Ų114102.5 Ų102.580%0.79777%0.772SS**  78.1146.1117.2-58.30000123.6
135S33Very low29.3Very low131 Ų13199.9 Ų99.992%0.91676%0.756SS**  trans73.8169157.988.30000119
136A30.4Very low29.2Very low99 Ų9996.9 Ų96.982%0.81874%0.738SS**  trans-144.5135.9-162.600000114.1
137S31.1Very low29.1Very low114 Ų11496.5 Ų96.580%0.79774%0.741SS**  trans-166.6132.4163.143.40000106.3
138A27Very low28.9Very low96 Ų9695.8 Ų95.879%0.79374%0.743SS**  87.4136.250.800000113.4
139A26Very low28.7Very low104 Ų10495.4 Ų95.486%0.8675%0.746SS**  trans68.6123.6-175.900000115.3
140A26.5Very low28.4Very low101 Ų10195.2 Ų95.284%0.83575%0.75SS**  98.5155.364.300000111
141A26.5Very low28.3Very low91 Ų9195.2 Ų95.275%0.75275%0.75SS**  cis-157.6-171.8700000111.9
142A26Very low28.4Very low103 Ų10396.5 Ų96.585%0.85175%0.754SS**  trans69.7157.7153.800000119.1
143A26.1Very low28.9Very low83 Ų8397.3 Ų97.369%0.68676%0.757SS**  cis-160.8146.5-18.500000108.7
144A25.9Very low28.9Very low62 Ų6298.5 Ų98.551%0.51277%0.767SS.*  58.9159.489.600000116.1
145A26.9Very low28.9Very low45 Ų4596.5 Ų96.537%0.37276%0.764SS.*  cis-134.1-109.13.700000114.7T33 P34 L35T33-A145 CarbonylContact C-O 2.89Å; T33-A145 WeakPolarHBondContact CB-O 3.15Å; T33-A145 PolarHBondContact OG1-O 3.15Å; P34-A145 CarbonylContact C-O 2.94Å; P34-A145 WeakPolarHBondContact CA-O 3.37Å; P34-A145 VanDerWaalsContact N-O 3.12Å; L35-A145 HydrophobicContact CB-CB 4.41Å; L35-A145 HydrophobicContact CD1-CB 4.33Å; L35-A145 VanDerWaalsContact N-N 3.17Å; L35-A145 PolarHBondContact N-O 3.2Å
146A27.1Very low29.2Very low46 Ų4698.2 Ų98.238%0.3876%0.762SS.*  trans-150.1-167-162.200000116.4T33 L35T33-A146 WeakPolarHBondContact OG1-CB 3.36Å; L35-A146 WeakPolarHBondContact CD1-O 3.35Å; L35-A146 VanDerWaalsContact CG-O 3.28Å; L35-A146 WeakPolarHBondContact CG-O 3.28Å
147A27.7Very low29.4Very low93 Ų93101.3 Ų101.377%0.76976%0.764SS**  trans75.4136.5171.500000117
148A27.6Very low29.6Very low105 Ų105101.1 Ų101.187%0.86877%0.769SS**  cis92115.7700000119
149A27Very low29.9Very low99 Ų99100.1 Ų100.182%0.81877%0.769SS**  trans-150.1136.7147.700000106.8
150A27.9Very low30.5Very low102 Ų102103 Ų10384%0.84377%0.769SS**  cis109.38213.900000114.6
151S29.2Very low31.3Very low123 Ų123104.5 Ų104.586%0.8677%0.77SS**  trans-169.9136.5144.855.70000111.3
152S32.1Very low32Very low116 Ų116110.8 Ų110.881%0.81177%0.774SS**  trans-91.4171.9-178.9-47.50000112.7
153P41.3Very low32.8Very low133 Ų133115 Ų11586%0.86477%0.774SS**  -138.618089.837.9-23.8000115.3
154A30.6Very low33.4Very low109 Ų109115.8 Ų115.890%0.90177%0.774SS**  trans-72.1156.1-165.500000116.6
155G32Very low33.9Very low72 Ų72118 Ų11874%0.74279%0.786SS**  trans-172.4102.417100000115.6
156L38.1Very low34.6Very low166 Ų166124.4 Ų124.487%0.86981%0.813SS**  trans46.490.8149-56.9177.8000120.7
157L35.4Very low35.3Very low164 Ų164127.1 Ų127.186%0.85983%0.83SS**  36107.9125.9-57.4175.7000120.6
158A34.6Very low36.7Very low110 Ų110127.9 Ų127.991%0.90983%0.826SS**  trans28.8118.5138.300000120.8
159G34.7Very low38.1Very low76 Ų76128.4 Ų128.478%0.78482%0.821SS**  trans-14629.3-179.400000117.7
160L38Very low39.7Very low164 Ų164129.4 Ų129.486%0.85982%0.819SS**SBendtrans-81.7141166-95.670.2000110.3R162L160-R162 VanDerWaalsContact C-N 3.31Å; L160-R162 PolarHBondContact O-N 2.97Å
161P42Very low41.2Very low133 Ų133129.9 Ų129.986%0.86481%0.814SS**  trans-72.582.6-18030.2-35.5000111.7F163P161-F163 PolarHBondContact O-N 3.44Å
162R41.3Very low42.6Very low222 Ų222129.8 Ų129.884%0.83881%0.81SS**  trans-71121.4168-165.5-175.1-162.7172.85.7108.5L160L160-R162 VanDerWaalsContact C-N 3.31Å; L160-R162 PolarHBondContact O-N 2.97Å
163F43.9Very low43.6Very low191 Ų191130.7 Ų130.784%0.83881%0.813SS**  trans-58.1139.3169.650.7-99.1000110.1P161P161-F163 PolarHBondContact O-N 3.44Å
164S37.4Very low44Very low101 Ų101127.8 Ų127.871%0.70681%0.808SS**  trans-161.1143.9174.3-78.60000111.3
165S37.1Very low44.8Very low109 Ų109131.1 Ų131.176%0.76281%0.809SS**  trans55.190.1164.1-158.40000118.7
166L42.3Very low45.5Very low179 Ų179138.2 Ų138.294%0.93782%0.815SS**  -122.5123.5118.6-82.296000108.1
167S41.7Very low45.6Very low103 Ų103139.4 Ų139.472%0.7281%0.814SS**PPolyproline II helixtrans-83.2143.2174.7-174.20000110.5
168P56Low45.8Very low108 Ų108134.6 Ų134.670%0.70179%0.794SS**PPolyproline II helixtrans-66154.3158.931-34.2000110.6
169P57.7Low46.6Very low116 Ų116135.2 Ų135.275%0.75379%0.789SS**PPolyproline II helixtrans-76.8158174.132.2-35.3000112.4
170P59.5Low47.2Very low120 Ų120136.9 Ų136.978%0.77979%0.788SS**PPolyproline II helixtrans-76.8150.6-179.331.7-35.7000113.2
171P60.3Low47.7Very low113 Ų113133.9 Ų133.973%0.73479%0.787SS**PPolyproline II helixtrans-76.9156.1170.333.2-35000112.1
172P58.1Low47.7Very low121 Ų121132.3 Ų132.379%0.78679%0.785SS**PPolyproline II helixtrans-69.8151.7175.830-35.4000112.3
173P53.4Low47.8Very low134 Ų134126.6 Ų126.687%0.8779%0.786SS**PPolyproline II helixtrans-82.4143.6-176.633.1-35.1000112.9
174G50.8Low48Very low73 Ų73124 Ų12475%0.75379%0.786SS**  trans124.794.5161.200000115.7
175L45.7Very low48.1Very low179 Ų179124 Ų12494%0.93779%0.791SS**  179100.4126.3-95.9170.7000108.7F177L175-F177 PolarHBondContact O-N 3.3Å
176Y46.7Very low48.2Very low220 Ų220123.6 Ų123.686%0.86380%0.795SS**  trans-87.6102.1-174.2-171.1-88.6000110.4S178Y176-S178 PolarHBondContact O-N 2.85Å
177F40.3Very low48.2Very low191 Ų191122.5 Ų122.584%0.83880%0.795SS**  trans-88.9102.6175.3-168.3-98.3000111.1L175L175-F177 PolarHBondContact O-N 3.3Å
178S39.9Very low48.3Very low64 Ų64120.7 Ų120.745%0.44879%0.793SS.*  trans-81.8128.2178.5-171.40000111.5Y176 S180Y176-S178 PolarHBondContact O-N 2.85Å; S178-S180 VanDerWaalsContact C-N 3.26Å; S178-S180 PolarHBondContact O-N 3.44Å
179P51.8Low47.5Very low123 Ų123127.1 Ų127.180%0.79980%0.803SS**SBendtrans-82.260.3-176.135.1-37000112.6
180S47.8Very low46.4Very low110 Ų110131.7 Ų131.777%0.76981%0.806SS**  trans-152.246.3-178.3-1530000114.7S178S178-S180 VanDerWaalsContact C-N 3.26Å; S178-S180 PolarHBondContact O-N 3.44Å
181A47.9Very low45.9Very low101 Ų101132 Ų13284%0.83581%0.809SS**SBendtrans-150.420.917900000115.4
182A42.5Very low45.2Very low100 Ų100136 Ų13683%0.82681%0.814SS**  trans-130.642.2-171.700000113.5
183A43.1Very low44.8Very low102 Ų102135.5 Ų135.584%0.84381%0.812SS**SBendtrans-112.917.3-175.600000114.3
184V47.3Very low44.7Very low138 Ų138137.6 Ų137.684%0.83681%0.814SS**SBendtrans-143149.2175.4-155.10000110.3
185A39.9Very low44.8Very low100 Ų100138 Ų13883%0.82681%0.81SS**  trans66.689.9168.700000118.5
186A38.8Very low45Very low101 Ų101138.4 Ų138.484%0.83581%0.807SS**  -168.787.3128.700000111.9G188A186-G188 PolarHBondContact O-N 3.01Å
187V42.5Very low45.1Very low156 Ų156134.5 Ų134.595%0.94580%0.801SS**  trans-79.9100.2167.5174.30000109.4
188G44.9Very low45.7Very low65 Ų65131.9 Ų131.967%0.6780%0.803SS**  trans73.1137.5160.500000117.3A186A186-G188 PolarHBondContact O-N 3.01Å
189R38.5Very low46.3Very low242 Ų242133 Ų13391%0.91383%0.825SS**  trans153.8147.6145.7-80.2-76.7172.8165.30.6108.1
190Y33.8Very low46.3Very low212 Ų212136.7 Ų136.783%0.83182%0.823SS**  trans-43.8138.9-175.8-80.9-112.1000114.7K192Y190-K192 PolarHBondContact O-N 3.32Å; Y190-K192 VanDerWaalsContact O-N 3.12Å
191P48.9Very low46.3Very low127 Ų127137.3 Ų137.383%0.82582%0.822SS**  trans-67.1110.616828.9-32.8000109.9
192K46Very low46.7Very low196 Ų196138 Ų13885%0.85282%0.818SS**  trans-66.2149.2164.3-79-179.6173.3-179.50109.6Y190Y190-K192 PolarHBondContact O-N 3.32Å; Y190-K192 VanDerWaalsContact O-N 3.12Å
193P49.5Very low47.7Very low112 Ų112139.2 Ų139.273%0.72781%0.809SS**  trans-65.6141.6-178.427-34.7000112.1A195P193-A195 PolarHBondContact O-N 3.45Å
194L52.3Low48.2Very low177 Ų177142.4 Ų142.493%0.92781%0.805SS**SBendtrans-7275175.3-17572.9000110.4
195A52.3Low48.9Very low81 Ų81145.2 Ų145.267%0.66980%0.8SS**  trans-110.5-21.1-17000000115P193P193-A195 PolarHBondContact O-N 3.45Å
196E50.9Low49.2Very low188 Ų188145.6 Ų145.688%0.87979%0.794SS**  trans-114.487-173.8-67.1-169.3126.300112.7
197L48.5Very low49.9Very low138 Ų138142.9 Ų142.972%0.72378%0.776SS**  trans-132.6110.9151.1-75.8178000107.7G199L197-G199 PolarHBondContact O-N 2.9Å
198P51.7Low50.7Low136 Ų136141.6 Ų141.688%0.88377%0.768SS**THydrogen-bonded Turntrans-67131.8-178.727.2-33.4000110.6
199G54.2Low51.1Low88 Ų88147.6 Ų147.691%0.90778%0.781SS**THydrogen-bonded Turntrans105.90.1169.600000117.3L197L197-G199 PolarHBondContact O-N 2.9Å
200R50.7Low51.9Low200 Ų200143.7 Ų143.776%0.75577%0.773SS**  trans-117.8114.7170.5-154.8174.8-160.3-91.23.3111.2
201T48.3Very low52.8Low124 Ų124137.5 Ų137.576%0.76176%0.761SS**  trans-60.6129.917644.80000110.2I203T201-I203 PolarHBondContact O-N 3.35Å
202P56.8Low53.4Low115 Ų115133.8 Ų133.875%0.74774%0.737SS**  trans-67.5134.3177.726.9-33.2000109.6F204P202-F204 PolarHBondContact O-N 2.83Å
203I63.3Low54Low125 Ų125130.1 Ų130.164%0.64173%0.733SS**  trans-74.283.4170.8-57177.3000107.2T201 W205T201-I203 PolarHBondContact O-N 3.35Å; I203-W205 PolarHBondContact O-N 3.5Å
204F53Low54.4Low170 Ų170133 Ų13375%0.74673%0.73SS**  trans-66.5110.2175.6178.8-110.3000109.2P202 P206P202-F204 PolarHBondContact O-N 2.83Å; F204-P206 HydrophobicContact CD1-CB 4.38Å; F204-P206 HydrophobicContact CD1-CG 3.84Å; F204-P206 HydrophobicContact CE1-CB 3.77Å; F204-P206 HydrophobicContact CE1-CG 3.7Å; F204-P206 HydrophobicContact CZ-CB 4.34Å; F204-P206 VanDerWaalsContact O-CD 3.32Å; F204-P206 WeakPolarHBondContact O-CD 3.35Å
205W62.2Low54.5Low196 Ų196132.1 Ų132.174%0.74271%0.714SS**  trans-90.5103.6168.6-7092000108.7I203 G207 V208I203-W205 PolarHBondContact O-N 3.5Å; W205-G207 PolarHBondContact O-N 3.43Å; W205-G207 VanDerWaalsContact O-N 3.17Å; W205-V208 HydrophobicContact CB-CG2 4.16Å
206P45.1Very low54.3Low108 Ų108134.8 Ų134.870%0.70172%0.717SS**THydrogen-bonded Turntrans-69.3116.7178.4-7.223.8000108.8F204F204-P206 HydrophobicContact CD1-CB 4.38Å; F204-P206 HydrophobicContact CD1-CG 3.84Å; F204-P206 HydrophobicContact CE1-CB 3.77Å; F204-P206 HydrophobicContact CE1-CG 3.7Å; F204-P206 HydrophobicContact CZ-CB 4.34Å; F204-P206 VanDerWaalsContact O-CD 3.32Å; F204-P206 WeakPolarHBondContact O-CD 3.35Å
207G54.8Low54.4Low44 Ų44130.1 Ų130.145%0.45471%0.711SS.*THydrogen-bonded Turntrans122.2-4171.800000117.4W205 M209 Q210W205-G207 PolarHBondContact O-N 3.43Å; W205-G207 VanDerWaalsContact O-N 3.17Å; G207-M209 PolarHBondContact O-N 2.99Å; G207-M209 VanDerWaalsContact O-N 3.13Å; G207-Q210 PolarHBondContact O-N 3.22Å; G207-Q210 VanDerWaalsContact O-O 3.13Å
208V58.5Low54.7Low129 Ų129134.5 Ų134.578%0.78272%0.718SS**THydrogen-bonded Turntrans-62.5-21.4179.9162.50000113.9W205W205-V208 HydrophobicContact CB-CG2 4.16Å
209M54.4Low54.9Low192 Ų192136.1 Ų136.195%0.94672%0.718SS**THydrogen-bonded Turntrans-109.115.8172.9-70.3-161.972.700114.6G207G207-M209 PolarHBondContact O-N 2.99Å; G207-M209 VanDerWaalsContact O-N 3.13Å
210Q55.3Low54.3Low159 Ų159136.4 Ų136.474%0.74371%0.712SS**SBendtrans-131.3109.5174.4-155.816428.100110.2G207 P212G207-Q210 PolarHBondContact O-N 3.22Å; G207-Q210 VanDerWaalsContact O-O 3.13Å; Q210-P212 WeakPolarHBondContact O-CD 3.45Å
211S53.2Low53.9Low82 Ų82133.3 Ų133.357%0.57372%0.72SS**  trans-52122.1-178.5-175.70000110.2
212P61.5Low53.7Low50 Ų50133.7 Ų133.733%0.32572%0.722SS.*  trans-63.4133.2-179.9-25.535.4000111.1Q210 W214 R215Q210-P212 WeakPolarHBondContact O-CD 3.45Å; P212-W214 HydrophobicContact CB-CD2 4.14Å; P212-W214 HydrophobicContact CB-CG 4.1Å; P212-W214 HydrophobicContact CB-CZ2 4.15Å; P212-W214 HydrophobicContact CG-CZ2 4.17Å; P212-W214 PolarHBondContact O-N 3.11Å; P212-R215 PolarHBondContact O-N 3.07Å
213P58.1Low53.5Low118 Ų118134.4 Ų134.477%0.76673%0.726SS**THydrogen-bonded Turntrans-65.5-3.7-173.725.6-35.3000114.3R215P213-R215 VanDerWaalsContact C-N 3.25Å; P213-R215 PolarHBondContact O-N 3.43Å
214W57.2Low52.3Low174 Ų174136.1 Ų136.166%0.65973%0.731SS**THydrogen-bonded Turntrans-75.9-6.2169.357.7-107.4000114.1P212P212-W214 HydrophobicContact CB-CD2 4.14Å; P212-W214 HydrophobicContact CB-CG 4.1Å; P212-W214 HydrophobicContact CB-CZ2 4.15Å; P212-W214 HydrophobicContact CG-CZ2 4.17Å; P212-W214 PolarHBondContact O-N 3.11Å
215R53.9Low51.9Low157 Ų157136 Ų13659%0.59273%0.733SS**SBendtrans-82.6-23.5174.9-73-162.3173.1-80.15.2114.3P212 P213 A217P212-R215 PolarHBondContact O-N 3.07Å; P213-R215 VanDerWaalsContact C-N 3.25Å; P213-R215 PolarHBondContact O-N 3.43Å; R215-A217 PolarHBondContact O-N 3.42Å
216D49.3Very low51.4Low137 Ų137130.5 Ų130.573%0.73374%0.738SS**  trans-83.641-178.7-65.4-56.2000113.7R218D216-R218 VanDerWaalsContact C-N 3.32Å; D216-R218 PolarHBondContact O-N 2.89Å
217A53.4Low51.3Low91 Ų91130.2 Ų130.275%0.75274%0.738SS**  trans-93.137.1179.400000113R215R215-A217 PolarHBondContact O-N 3.42Å
218R54.4Low51.2Low229 Ų229134.5 Ų134.586%0.86475%0.749SS**SBendtrans-112.6-6.3-173.6-71.2-171.1178.6-99.34.1116D216D216-R218 VanDerWaalsContact C-N 3.32Å; D216-R218 PolarHBondContact O-N 2.89Å
219L55.2Low50.9Low171 Ų171134.3 Ų134.390%0.89574%0.743SS**SBendtrans-137.666.4-173.9-66.8175.8000113.5
220A42.2Very low50.8Low94 Ų94130.4 Ų130.478%0.77773%0.726SS**  trans-167.2116.515700000111.8
221C41.1Very low50.8Low135 Ų135125.1 Ų125.191%0.91270%0.702SS**  trans-119.994.1168.4-80.20000110.5
222T44.2Very low51.2Low132 Ų132131.5 Ų131.581%0.8172%0.72SS**  trans-144.7132.9162.946.90000110.4
223P52.7Low51.1Low129 Ų129134.6 Ų134.684%0.83873%0.734SS**  trans-114.895.2176.636.5-25.8000112.5
224H39Very low51.2Low162 Ų162131.6 Ų131.675%0.7572%0.724SS**  trans-150130.1164.5-153.370.8000114.8
225Q43.3Very low51.4Low166 Ų166130.2 Ų130.278%0.77672%0.723SS**  trans43.9147.9167.3-98.3-178.391.500121.3S227Q225-S227 PolarHBondContact O-N 3.34Å
226G52.4Low51.9Low82 Ų82133.2 Ų133.285%0.84573%0.734SS**  trans-76.2102.6178.800000112.4
227S42.9Very low52.9Low102 Ų102133 Ų13371%0.71373%0.727SS**  trans-101.2135.1164.7-1750000110.6Q225 L229Q225-S227 PolarHBondContact O-N 3.34Å; S227-L229 PolarHBondContact O-N 3.35Å; S227-L229 VanDerWaalsContact O-N 3.1Å
228I52.5Low53.9Low133 Ų133136.7 Ų136.768%0.68273%0.728SS**  trans-77.990.5171.635.765.6000109.5L230I228-L230 HydrophobicContact CD1-CD1 4.2Å; I228-L230 PolarHBondContact O-N 2.9Å
229L53.3Low55.3Low125 Ų125130.2 Ų130.265%0.65471%0.714SS**  trans-61.395.8178.5-174.665.7000110.6S227 D231S227-L229 PolarHBondContact O-N 3.35Å; S227-L229 VanDerWaalsContact O-N 3.1Å; L229-D231 PolarHBondContact O-N 3.31Å
230L52.2Low56.8Low110 Ų110131 Ų13158%0.57671%0.705SS**  trans-76.699168.8-78.1157.8000108I228 R236I228-L230 HydrophobicContact CD1-CD1 4.2Å; I228-L230 PolarHBondContact O-N 2.9Å; L230-R236 HydrophobicContact CD2-CG 4.16Å
231D54.8Low59Low48 Ų48130.8 Ų130.826%0.25770%0.696SS.*  trans-58.1149.6165.8-64.9-100.8000110.8L229 D233 G234 K237L229-D231 PolarHBondContact O-N 3.31Å; D231-D233 PolarHBondContact O-N 3.27Å; D231-G234 PolarHBondContact O-N 3.31Å; D231-K237 IonicContact OD1-NZ 2.76Å; D231-K237 PolarHBondContact OD1-NZ 3.22Å; D231-K237 WeakPolarHBondContact OD2-CD 3.35Å; D231-K237 WeakPolarHBondContact OD2-CE 3.45Å; D231-K237 IonicContact OD2-NZ 3.02Å; D231-K237 PolarHBondContact OD2-NZ 3.36Å
232K60.6Low61.5Low216 Ų216130.2 Ų130.294%0.93969%0.689SS**THydrogen-bonded Turntrans-59.9-6.7-176.1-72.1157.456.91790115.1
233D59.7Low63.9Low115 Ų115127 Ų12762%0.61566%0.663SS**THydrogen-bonded Turntrans-92.71175.1-55.8-29.6000114.2D231 K235D231-D233 PolarHBondContact O-N 3.27Å; D233-K235 HydrophobicContact CB-CD 4.13Å; D233-K235 HydrophobicContact CB-CG 3.72Å; D233-K235 WeakPolarHBondContact O-CG 3.4Å; D233-K235 PolarHBondContact O-N 3.08Å; D233-K235 WeakPolarHBondContact OD2-CE 3.12Å; D233-K235 IonicContact OD2-NZ 3.72Å; D233-K235 PolarHBondContact OD2-NZ 3.46Å
234G61.6Low66Low55 Ų55123.8 Ų123.857%0.56764%0.644SS**  trans71.6-15.7176.600000116.8D231 R236D231-G234 PolarHBondContact O-N 3.31Å; G234-R236 PolarHBondContact O-N 3.18Å
235K61.1Low68.8Low146 Ų146118.7 Ų118.764%0.63564%0.635SS**  trans-67.1100.2174.511.8179.2177.7174.40109.9D233 K237D233-K235 HydrophobicContact CB-CD 4.13Å; D233-K235 HydrophobicContact CB-CG 3.72Å; D233-K235 WeakPolarHBondContact O-CG 3.4Å; D233-K235 PolarHBondContact O-N 3.08Å; D233-K235 WeakPolarHBondContact OD2-CE 3.12Å; D233-K235 IonicContact OD2-NZ 3.72Å; D233-K235 PolarHBondContact OD2-NZ 3.46Å; K235-K237 PolarHBondContact O-N 2.95Å
236R63.2Low71.3Confident219 Ų219118 Ų11883%0.82663%0.632SS**  trans-56.597.8176.6-65-171-67.9-164.3-1.8110.8L230 G234 H238L230-R236 HydrophobicContact CD2-CG 4.16Å; G234-R236 PolarHBondContact O-N 3.18Å; R236-H238 PolarHBondContact O-N 3.33Å
237K71.7Confident73.5Confident132 Ų132116.1 Ų116.157%0.57460%0.601SS**  trans-59.4126.1171-69.8-178.8-175.9154.70108.6D231 K235 T239D231-K237 IonicContact OD1-NZ 2.76Å; D231-K237 PolarHBondContact OD1-NZ 3.22Å; D231-K237 WeakPolarHBondContact OD2-CD 3.35Å; D231-K237 WeakPolarHBondContact OD2-CE 3.45Å; D231-K237 IonicContact OD2-NZ 3.02Å; D231-K237 PolarHBondContact OD2-NZ 3.36Å; K235-K237 PolarHBondContact O-N 2.95Å; K237-T239 PolarHBondContact O-N 2.97Å
238H72.9Confident76.1Confident170 Ų170114.8 Ų114.879%0.78759%0.585SS**  trans-75.378.2178-169.2-43.5000110.1R236 R240R236-H238 PolarHBondContact O-N 3.33Å; H238-R240 PolarHBondContact O-N 2.96Å
239T84.8Confident78.3Confident93 Ų93115.3 Ų115.357%0.57158%0.583SS**PPolyproline II helixtrans-51.3130.5172.3-60.20000109.5K237 P241K237-T239 PolarHBondContact O-N 2.97Å; T239-P241 WeakPolarHBondContact O-CD 3.23Å
240R86.4Confident80.4Confident186 Ų186110.5 Ų110.570%0.70256%0.561SS**PPolyproline II helixtrans-67.5126.9-178.9-171.6-173.8-175.7-70.8-0.2108.9H238 T242H238-R240 PolarHBondContact O-N 2.96Å; R240-T242 PolarHBondContact O-N 3.13Å
241P87.7Confident82.6Confident90 Ų90105.2 Ų105.258%0.58453%0.533SS*.PPolyproline II helixtrans-53.7130.3178.2-28.836000112.4T239T239-P241 WeakPolarHBondContact O-CD 3.23Å
242T93.8Very high84.6Confident124 Ų124104.5 Ų104.576%0.76153%0.528SS*.  trans-105.5151.9173.649.30000109.5R240R240-T242 PolarHBondContact O-N 3.13Å
243F95.1Very high86.4Confident64 Ų6499.6 Ų99.628%0.28151%0.507SS..  trans-88.1147.9174.2-55.9-57.6000109.8Q247 I248 M275 Q279 W283F243-Q247 HydrophobicContact CB-CB 4.33Å; F243-I248 HydrophobicContact CB-CD1 4.33Å; F243-I248 HydrophobicContact CB-CG1 3.93Å; F243-I248 WeakPolarHBondContact O-CD1 3.45Å; F243-M275 HydrophobicContact CD1-CE 3.59Å; F243-M275 HydrophobicContact CD1-SD 4.41Å; F243-M275 HydrophobicContact CE1-CE 3.43Å; F243-M275 VanDerWaalsContact CE1-CE 3.43Å; F243-M275 HydrophobicContact CE2-CE 4.45Å; F243-M275 HydrophobicContact CG-CE 4.19Å; F243-M275 HydrophobicContact CZ-CE 3.89Å; F243-Q279 HydrophobicContact CE1-CB 4.44Å; F243-Q279 HydrophobicContact CE1-CG 4.48Å; F243-Q279 HydrophobicContact CZ-CB 4.42Å; F243-W283 AromaticContact CD2-CD1 3.82Å; F243-W283 AromaticContact CE2-CD1 3.81Å
244S97.2Very high88.2Confident62 Ų6295.5 Ų95.543%0.43449%0.486SS..  trans-62.1151175.6174.60000111.3Q246 Q247 I248S244-Q246 PolarHBondContact O-N 2.91Å; S244-Q246 PolarHBondContact OG-N 3.26Å; S244-Q247 WeakPolarHBondContact O-CB 3.43Å; S244-Q247 PolarHBondContact O-N 2.87Å; S244-I248 WeakPolarHBondContact O-CG1 3.31Å; S244-I248 PolarHBondContact O-N 3.41Å
245G97.1Very high89.9Confident54 Ų5493.1 Ų93.156%0.55746%0.46SS*.Hα-helixtrans-54.9-37.6175.500000112.8I248 F249G245-I248 PolarHBondContact O-N 3.44Å; G245-F249 WeakPolarHBondContact O-CB 3.37Å; G245-F249 PolarHBondContact O-N 2.95Å
246Q97.4Very high91.7Very high153 Ų15392.5 Ų92.572%0.71546%0.46SS*.Hα-helixtrans-65-41.4175.1-175.4-177.51.700112.4S244 F249 A250S244-Q246 PolarHBondContact O-N 2.91Å; S244-Q246 PolarHBondContact OG-N 3.26Å; Q246-F249 PolarHBondContact O-N 2.86Å; Q246-A250 PolarHBondContact O-N 3.18Å
247Q97.6Very high93.3Very high42 Ų4288.8 Ų88.820%0.19645%0.452CS..Hα-helixtrans-64.5-45.5175.6-68.2172.5-37.600110.4F243 S244 F249 A250 L251 L273 M275F243-Q247 HydrophobicContact CB-CB 4.33Å; S244-Q247 WeakPolarHBondContact O-CB 3.43Å; S244-Q247 PolarHBondContact O-N 2.87Å; Q247-F249 PolarHBondContact O-N 3.44Å; Q247-A250 PolarHBondContact O-N 3.3Å; Q247-L251 WeakPolarHBondContact O-CB 3.48Å; Q247-L251 WeakPolarHBondContact O-CD1 3.3Å; Q247-L251 WeakPolarHBondContact O-CG 3.45Å; Q247-L251 PolarHBondContact O-N 2.84Å; Q247-L273 HydrophobicContact CG-CB 4.37Å; Q247-L273 PolarHBondContact NE2-O 2.96Å; Q247-M275 HydrophobicContact CB-SD 4.1Å; Q247-M275 HydrophobicContact CG-SD 4.18Å
248I97.5Very high94.4Very high73 Ų7384.7 Ų84.737%0.37444%0.438SS..Hα-helixtrans-61.4-45.3177.8-65167.5000110.9F243 S244 G245 L251 E252F243-I248 HydrophobicContact CB-CD1 4.33Å; F243-I248 HydrophobicContact CB-CG1 3.93Å; F243-I248 WeakPolarHBondContact O-CD1 3.45Å; S244-I248 WeakPolarHBondContact O-CG1 3.31Å; S244-I248 PolarHBondContact O-N 3.41Å; G245-I248 PolarHBondContact O-N 3.44Å; I248-L251 PolarHBondContact O-N 3.46Å; I248-E252 WeakPolarHBondContact O-CB 3.43Å; I248-E252 PolarHBondContact O-N 3.43Å
249F97.9Very high95.6Very high145 Ų14579.5 Ų79.564%0.63641%0.413SS*.Hα-helixtrans-59.6-47177.8174.6-102.1000112.3G245 Q246 Q247 E252 K253G245-F249 WeakPolarHBondContact O-CB 3.37Å; G245-F249 PolarHBondContact O-N 2.95Å; Q246-F249 PolarHBondContact O-N 2.86Å; Q247-F249 PolarHBondContact O-N 3.44Å; F249-E252 PolarHBondContact O-N 2.83Å; F249-K253 WeakPolarHBondContact O-CB 3.37Å; F249-K253 PolarHBondContact O-N 2.96Å
250A97.4Very high96.2Very high23 Ų2382.6 Ų82.619%0.1942%0.415CS..Hα-helixtrans-65.9-43.8178.300000112.5Q246 Q247 E252 K253 T254 L273Q246-A250 PolarHBondContact O-N 3.18Å; Q247-A250 PolarHBondContact O-N 3.3Å; A250-E252 VanDerWaalsContact C-N 3.29Å; A250-E252 PolarHBondContact O-N 3.02Å; A250-K253 PolarHBondContact O-N 3.44Å; A250-T254 PolarHBondContact O-N 3.26Å; A250-T254 PolarHBondContact O-OG1 3.04Å; A250-L273 HydrophobicContact CB-CD1 4.03Å; A250-L273 HydrophobicContact CB-CD2 3.58Å; A250-L273 HydrophobicContact CB-CG 4.41Å
251L98.2Very high96.7Very high0 Ų074.9 Ų74.90%039%0.388CS..Hα-helixtrans-59.5-39.5175.1-71163.5000111.9Q247 I248 F255 L269 L273 M275 V280 W283 F284Q247-L251 WeakPolarHBondContact O-CB 3.48Å; Q247-L251 WeakPolarHBondContact O-CD1 3.3Å; Q247-L251 WeakPolarHBondContact O-CG 3.45Å; Q247-L251 PolarHBondContact O-N 2.84Å; I248-L251 PolarHBondContact O-N 3.46Å; L251-F255 WeakPolarHBondContact O-CB 3.38Å; L251-F255 PolarHBondContact O-N 3.42Å; L251-L269 HydrophobicContact CD2-CD2 3.95Å; L251-L269 HydrophobicContact CD2-CG 4.44Å; L251-L273 HydrophobicContact CD2-CD1 3.98Å; L251-L273 HydrophobicContact CG-CD1 3.78Å; L251-M275 HydrophobicContact CD1-CE 4.08Å; L251-M275 HydrophobicContact CD1-SD 3.99Å; L251-V280 HydrophobicContact CD2-CG1 4.1Å; L251-V280 HydrophobicContact CD2-CG2 4.36Å; L251-W283 HydrophobicContact CB-CD2 3.93Å; L251-W283 HydrophobicContact CB-CE3 3.93Å; L251-W283 HydrophobicContact CB-CH2 3.76Å; L251-W283 HydrophobicContact CB-CZ2 3.72Å; L251-W283 HydrophobicContact CB-CZ3 3.86Å; L251-W283 HydrophobicContact CD1-CD2 3.94Å; L251-W283 HydrophobicContact CD1-CG 3.86Å; L251-W283 HydrophobicContact CD2-CD2 4.45Å; L251-W283 HydrophobicContact CD2-CE3 4.44Å; L251-W283 HydrophobicContact CG-CD2 4.34Å; L251-F284 HydrophobicContact CD2-CD2 4.45Å; L251-F284 HydrophobicContact CD2-CE2 3.91Å
252E98.2Very high97.1Very high32 Ų3273 Ų7315%0.1538%0.38CS..Hα-helixtrans-70.7-46.4178-161.266.3-11800112I248 F249 A250 T254 F255 E256 W283 R287I248-E252 WeakPolarHBondContact O-CB 3.43Å; I248-E252 PolarHBondContact O-N 3.43Å; F249-E252 PolarHBondContact O-N 2.83Å; A250-E252 VanDerWaalsContact C-N 3.29Å; A250-E252 PolarHBondContact O-N 3.02Å; E252-T254 VanDerWaalsContact C-N 3.29Å; E252-T254 PolarHBondContact O-N 3.15Å; E252-F255 CarbonylContact O-C 3.59Å; E252-F255 WeakPolarHBondContact O-CA 3.46Å; E252-F255 WeakPolarHBondContact O-CB 3.48Å; E252-F255 PolarHBondContact O-N 2.95Å; E252-F255 WeakPolarHBondContact OE1-CD1 3.32Å; E252-E256 WeakPolarHBondContact O-CG 3.19Å; E252-E256 PolarHBondContact O-N 3.4Å; E252-W283 HydrophobicContact CB-CH2 4.3Å; E252-W283 WeakPolarHBondContact OE2-CH2 3.44Å; E252-R287 VanDerWaalsContact CD-NE 3.26Å; E252-R287 IonicContact OE1-CZ 3.76Å; E252-R287 IonicContact OE1-NE 2.78Å; E252-R287 PolarHBondContact OE1-NE 3.49Å; E252-R287 IonicContact OE1-NH1 3.27Å; E252-R287 IonicContact OE1-NH2 3.46Å; E252-R287 PolarHBondContact OE1-NH2 2.99Å; E252-R287 WeakPolarHBondContact OE2-CD 3.44Å; E252-R287 IonicContact OE2-CZ 3.27Å; E252-R287 IonicContact OE2-NE 3.95Å; E252-R287 PolarHBondContact OE2-NE 2.82Å; E252-R287 IonicContact OE2-NH1 2.72Å; E252-R287 PolarHBondContact OE2-NH1 3.22Å; E252-R287 IonicContact OE2-NH2 2.8Å; E252-R287 PolarHBondContact OE2-NH2 2.81Å
253K98.1Very high97.3Very high114 Ų11468.6 Ų68.650%0.49636%0.359SS..Hα-helixtrans-56.9-41.2174.7-177.2176.9-179.8177.80112F249 A250 Q257F249-K253 WeakPolarHBondContact O-CB 3.37Å; F249-K253 PolarHBondContact O-N 2.96Å; A250-K253 PolarHBondContact O-N 3.44Å; K253-Q257 PolarHBondContact O-N 3.4Å
254T97.1Very high97.4Very high29 Ų2970 Ų7018%0.17838%0.375CS..Hα-helixtrans-71-34.9174.1-53.50000111.9A250 E252 E256 Q257 T258 L261 L269 F284A250-T254 PolarHBondContact O-N 3.26Å; A250-T254 PolarHBondContact O-OG1 3.04Å; E252-T254 VanDerWaalsContact C-N 3.29Å; E252-T254 PolarHBondContact O-N 3.15Å; T254-E256 VanDerWaalsContact C-N 3.35Å; T254-Q257 PolarHBondContact O-N 3Å; T254-T258 PolarHBondContact O-N 3.41Å; T254-T258 PolarHBondContact O-OG1 3.3Å; T254-L261 HydrophobicContact CG2-CD2 3.86Å; T254-L269 HydrophobicContact CG2-CD2 4.04Å; T254-F284 HydrophobicContact CG2-CZ 4.29Å
255F97.9Very high97.4Very high4 Ų470.5 Ų70.52%0.01837%0.37CS..Hα-helixtrans-65.7-35.1175.1-178.3-102.3000112.9L251 E252 Q257 T258 K259 W283 F284 R287 R288 W291L251-F255 WeakPolarHBondContact O-CB 3.38Å; L251-F255 PolarHBondContact O-N 3.42Å; E252-F255 CarbonylContact O-C 3.59Å; E252-F255 WeakPolarHBondContact O-CA 3.46Å; E252-F255 WeakPolarHBondContact O-CB 3.48Å; E252-F255 PolarHBondContact O-N 2.95Å; E252-F255 WeakPolarHBondContact OE1-CD1 3.32Å; F255-Q257 VanDerWaalsContact C-N 3.31Å; F255-Q257 PolarHBondContact O-N 3.21Å; F255-T258 WeakPolarHBondContact CA-O 3.41Å; F255-T258 CarbonylContact O-C 3.56Å; F255-K259 HydrophobicContact CD1-CD 4.25Å; F255-K259 HydrophobicContact CD2-CD 4.32Å; F255-K259 HydrophobicContact CE1-CD 3.75Å; F255-K259 HydrophobicContact CE2-CB 4.1Å; F255-K259 HydrophobicContact CE2-CD 3.82Å; F255-K259 HydrophobicContact CZ-CB 4.48Å; F255-K259 HydrophobicContact CZ-CD 3.52Å; F255-K259 WeakPolarHBondContact O-CD 3.43Å; F255-K259 WeakPolarHBondContact O-CE 3.45Å; F255-K259 PolarHBondContact O-NZ 3.31Å; F255-W283 HydrophobicContact CB-CH2 4.45Å; F255-W283 HydrophobicContact CB-CZ3 4.07Å; F255-W283 HydrophobicContact CG-CZ3 4.46Å; F255-F284 HydrophobicContact CB-CE1 4.01Å; F255-F284 HydrophobicContact CB-CZ 4.1Å; F255-F284 AromaticContact CD2-CD1 3.91Å; F255-F284 HydrophobicContact CD2-CD1 3.91Å; F255-F284 AromaticContact CD2-CE1 3.84Å; F255-F284 HydrophobicContact CD2-CE1 3.84Å; F255-F284 HydrophobicContact CG-CE1 4.44Å; F255-R287 HydrophobicContact CD1-CG 3.56Å; F255-R287 HydrophobicContact CD2-CB 4.34Å; F255-R287 HydrophobicContact CD2-CG 3.82Å; F255-R287 HydrophobicContact CE1-CG 3.58Å; F255-R287 HydrophobicContact CE2-CB 4.27Å; F255-R287 HydrophobicContact CE2-CG 3.85Å; F255-R287 HydrophobicContact CG-CG 3.69Å; F255-R287 HydrophobicContact CZ-CB 4.47Å; F255-R287 HydrophobicContact CZ-CG 3.72Å; F255-R288 HydrophobicContact CE2-CG 3.85Å; F255-R288 HydrophobicContact CZ-CG 4.39Å; F255-W291 HydrophobicContact CE1-CB 4.38Å; F255-W291 HydrophobicContact CE1-CG 4.38Å; F255-W291 HydrophobicContact CZ-CB 4.05Å; F255-W291 HydrophobicContact CZ-CG 4.13Å
256E97.4Very high97.5Very high134 Ų13470.5 Ų70.563%0.62635%0.353SS*.Hα-helixtrans-60.9-40.3172.6-74.1172.4173.400111.6E252 T254 K259E252-E256 WeakPolarHBondContact O-CG 3.19Å; E252-E256 PolarHBondContact O-N 3.4Å; T254-E256 VanDerWaalsContact C-N 3.35Å; E256-K259 VanDerWaalsContact C-NZ 3.34Å; E256-K259 PolarHBondContact O-NZ 3.29Å
257Q96.9Very high97.5Very high140 Ų14065.1 Ų65.165%0.65434%0.335SS*.Hα-helixtrans-70.7-56.7173.4-64.3171.9-22.800112.1K253 T254 F255K253-Q257 PolarHBondContact O-N 3.4Å; T254-Q257 PolarHBondContact O-N 3Å; F255-Q257 VanDerWaalsContact C-N 3.31Å; F255-Q257 PolarHBondContact O-N 3.21Å
258T96.6Very high97.5Very high46 Ų4670.8 Ų70.828%0.28236%0.355SS..  trans-128.1120.6-175.960.40000111.2T254 F255 Y260T254-T258 PolarHBondContact O-N 3.41Å; T254-T258 PolarHBondContact O-OG1 3.3Å; F255-T258 WeakPolarHBondContact CA-O 3.41Å; F255-T258 CarbonylContact O-C 3.56Å; T258-Y260 PolarHBondContact O-N 3.17Å
259K96.9Very high97.5Very high62 Ų6268.3 Ų68.327%0.2734%0.342SS..SBendtrans-74.1-15.9179.8-52.6-65.8161.8-66.80112.5F255 E256 R288F255-K259 HydrophobicContact CD1-CD 4.25Å; F255-K259 HydrophobicContact CD2-CD 4.32Å; F255-K259 HydrophobicContact CE1-CD 3.75Å; F255-K259 HydrophobicContact CE2-CB 4.1Å; F255-K259 HydrophobicContact CE2-CD 3.82Å; F255-K259 HydrophobicContact CZ-CB 4.48Å; F255-K259 HydrophobicContact CZ-CD 3.52Å; F255-K259 WeakPolarHBondContact O-CD 3.43Å; F255-K259 WeakPolarHBondContact O-CE 3.45Å; F255-K259 PolarHBondContact O-NZ 3.31Å; E256-K259 VanDerWaalsContact C-NZ 3.34Å; E256-K259 PolarHBondContact O-NZ 3.29Å; K259-R288 WeakPolarHBondContact O-CD 3.44Å; K259-R288 WeakPolarHBondContact O-CG 3.4Å
260Y97.3Very high97.5Very high157 Ų15761.6 Ų61.662%0.61631%0.314SS*.SBendtrans-137.5130.7-178.4-62.6-107.9000108.2T258 R288T258-Y260 PolarHBondContact O-N 3.17Å; Y260-R288 VanDerWaalsContact CE1-NH1 3.33Å
261L96.8Very high97.5Very high24 Ų2470.3 Ų70.313%0.12634%0.343CS..  trans-101.5129.4178.8-75.5173.2000112.3T254 E265 R266 L269 V280 F284T254-L261 HydrophobicContact CG2-CD2 3.86Å; L261-E265 HydrophobicContact CD2-CB 3.86Å; L261-R266 HydrophobicContact CB-CB 4.3Å; L261-R266 PolarHBondContact O-NH2 2.83Å; L261-L269 HydrophobicContact CD1-CD2 3.73Å; L261-V280 HydrophobicContact CD1-CG1 3.89Å; L261-F284 HydrophobicContact CD1-CD1 4.1Å; L261-F284 HydrophobicContact CD1-CD2 3.84Å; L261-F284 HydrophobicContact CD1-CE1 3.74Å; L261-F284 HydrophobicContact CD1-CE2 3.49Å; L261-F284 VanDerWaalsContact CD1-CE2 3.49Å; L261-F284 HydrophobicContact CD1-CG 4.16Å; L261-F284 HydrophobicContact CD1-CZ 3.44Å; L261-F284 VanDerWaalsContact CD1-CZ 3.44Å; L261-F284 HydrophobicContact CG-CD1 4.07Å; L261-F284 HydrophobicContact CG-CE1 3.69Å; L261-F284 HydrophobicContact CG-CE2 4.37Å; L261-F284 HydrophobicContact CG-CZ 3.88Å
262A97.1Very high97.5Very high52 Ų5274.8 Ų74.843%0.4337%0.374SS..  trans-64.8164.1167.400000111.3E265 R266A262-E265 HydrophobicContact CB-CG 4.19Å; A262-E265 WeakPolarHBondContact CB-OE2 3.45Å; A262-E265 PolarHBondContact N-OE2 3.01Å; A262-E265 PolarHBondContact O-N 3.18Å; A262-R266 WeakPolarHBondContact O-CB 3.41Å; A262-R266 PolarHBondContact O-N 3.5Å
263G97.1Very high97.4Very high31 Ų3174.5 Ų74.532%0.3237%0.373SS..Hα-helixtrans-54.3-57.2177.900000113.5E265 R266 A267G263-E265 PolarHBondContact O-N 2.83Å; G263-R266 PolarHBondContact O-N 2.93Å; G263-R266 VanDerWaalsContact O-N 3.15Å; G263-A267 PolarHBondContact O-N 3.29Å
264P97.4Very high97.4Very high93 Ų9372.5 Ų72.560%0.60439%0.385SS*.Hα-helixtrans-64.1-23-178.2-24.935.6000114.9R268P264-R268 WeakPolarHBondContact O-CG 3.33Å; P264-R268 PolarHBondContact O-N 3.29Å; P264-R268 PolarHBondContact O-NE 2.88Å
265E97.3Very high97.4Very high72 Ų7271.9 Ų71.934%0.33638%0.38SS..Hα-helixtrans-80.1-41.9174.8-58.7175.7134.800111.1L261 A262 G263 A267 R268 L269L261-E265 HydrophobicContact CD2-CB 3.86Å; A262-E265 HydrophobicContact CB-CG 4.19Å; A262-E265 WeakPolarHBondContact CB-OE2 3.45Å; A262-E265 PolarHBondContact N-OE2 3.01Å; A262-E265 PolarHBondContact O-N 3.18Å; G263-E265 PolarHBondContact O-N 2.83Å; E265-A267 VanDerWaalsContact C-N 3.35Å; E265-R268 PolarHBondContact O-N 3.18Å; E265-L269 WeakPolarHBondContact O-CB 3.4Å; E265-L269 PolarHBondContact O-N 2.89Å
266R98.3Very high97.4Very high55 Ų5575.3 Ų75.321%0.20840%0.402CS..Hα-helixtrans-62.4-41.9175.8-164.4-171.2-42.1107.59.9111.8L261 A262 G263 L269 A270 E277 V280L261-R266 HydrophobicContact CB-CB 4.3Å; L261-R266 PolarHBondContact O-NH2 2.83Å; A262-R266 WeakPolarHBondContact O-CB 3.41Å; A262-R266 PolarHBondContact O-N 3.5Å; G263-R266 PolarHBondContact O-N 2.93Å; G263-R266 VanDerWaalsContact O-N 3.15Å; R266-L269 PolarHBondContact O-N 2.9Å; R266-A270 WeakPolarHBondContact O-CB 3.49Å; R266-A270 PolarHBondContact O-N 2.99Å; R266-E277 WeakPolarHBondContact CD-O 3.34Å; R266-E277 WeakPolarHBondContact CD-OE2 3.34Å; R266-E277 HydrophobicContact CG-CB 4.44Å; R266-E277 HydrophobicContact CG-CG 4.14Å; R266-E277 IonicContact CZ-OE2 2.82Å; R266-E277 IonicContact NE-OE2 2.67Å; R266-E277 IonicContact NH1-OE2 2.75Å; R266-E277 PolarHBondContact NH1-OE2 3.35Å; R266-V280 HydrophobicContact CG-CB 4.02Å; R266-V280 HydrophobicContact CG-CG1 3.79Å
267A98Very high97.4Very high40 Ų4072.8 Ų72.833%0.33139%0.39SS..Hα-helixtrans-60.5-46.3174.800000111.8G263 E265 A270 Y271 E277G263-A267 PolarHBondContact O-N 3.29Å; E265-A267 VanDerWaalsContact C-N 3.35Å; A267-A270 PolarHBondContact O-N 2.88Å; A267-Y271 WeakPolarHBondContact O-CB 3.15Å; A267-Y271 PolarHBondContact O-N 2.76Å; A267-E277 HydrophobicContact CB-CG 4.45Å
268R97.9Very high97.5Very high160 Ų16069.8 Ų69.860%0.60439%0.385SS*.Hα-helixtrans-60.1-49.8174.6-80179-76.6157.5-6.3112.2P264 E265 A270 Y271 S272P264-R268 WeakPolarHBondContact O-CG 3.33Å; P264-R268 PolarHBondContact O-N 3.29Å; P264-R268 PolarHBondContact O-NE 2.88Å; E265-R268 PolarHBondContact O-N 3.18Å; R268-A270 PolarHBondContact O-N 3.37Å; R268-Y271 PolarHBondContact O-N 3.49Å; R268-S272 PolarHBondContact O-N 3.17Å; R268-S272 PolarHBondContact O-OG 3.27Å
269L97.7Very high97.5Very high21 Ų2171.5 Ų71.511%0.1139%0.39CS..Hα-helixtrans-66-36.2-179.7-172.363.5000112.7L251 T254 L261 E265 R266 L273 V280 F284L251-L269 HydrophobicContact CD2-CD2 3.95Å; L251-L269 HydrophobicContact CD2-CG 4.44Å; T254-L269 HydrophobicContact CG2-CD2 4.04Å; L261-L269 HydrophobicContact CD1-CD2 3.73Å; E265-L269 WeakPolarHBondContact O-CB 3.4Å; E265-L269 PolarHBondContact O-N 2.89Å; R266-L269 PolarHBondContact O-N 2.9Å; L269-L273 HydrophobicContact CD1-CD1 3.82Å; L269-L273 HydrophobicContact CD1-CG 4.22Å; L269-L273 HydrophobicContact CG-CD1 4.04Å; L269-L273 WeakPolarHBondContact O-CB 3.37Å; L269-L273 VanDerWaalsContact O-CG 3.3Å; L269-L273 WeakPolarHBondContact O-CG 3.43Å; L269-L273 PolarHBondContact O-N 2.86Å; L269-V280 HydrophobicContact CD2-CG1 4.1Å; L269-F284 HydrophobicContact CD2-CE2 3.99Å; L269-F284 HydrophobicContact CD2-CZ 4.3Å
270A98.1Very high97.5Very high5 Ų568.6 Ų68.64%0.04138%0.377CS..Hα-helixtrans-61.3-50173.800000111.1R266 A267 R268 L273 G274 M275 E277 V280R266-A270 WeakPolarHBondContact O-CB 3.49Å; R266-A270 PolarHBondContact O-N 2.99Å; A267-A270 PolarHBondContact O-N 2.88Å; R268-A270 PolarHBondContact O-N 3.37Å; A270-L273 PolarHBondContact O-N 3.32Å; A270-G274 PolarHBondContact O-N 2.68Å; A270-M275 CarbonylContact C-O 3.45Å; A270-M275 WeakPolarHBondContact CB-O 3.14Å; A270-M275 PolarHBondContact O-N 3.46Å; A270-M275 VanDerWaalsContact O-O 3.1Å; A270-E277 HydrophobicContact CB-CG 4.09Å; A270-V280 HydrophobicContact CB-CG2 3.98Å
271Y97.9Very high97.6Very high206 Ų20667.5 Ų67.581%0.80838%0.375SS*.Hα-helixtrans-59.1-51.6176.7-176.7-97000112.2A267 R268 L273 G274A267-Y271 WeakPolarHBondContact O-CB 3.15Å; A267-Y271 PolarHBondContact O-N 2.76Å; R268-Y271 PolarHBondContact O-N 3.49Å; Y271-L273 PolarHBondContact O-N 2.99Å; Y271-L273 VanDerWaalsContact O-N 3.08Å; Y271-G274 PolarHBondContact O-N 3.4Å
272S97.3Very high97.6Very high93 Ų9369.9 Ų69.965%0.6539%0.391SS*.Hα-helixtrans-62.6-16.7-179.1-630000115R268R268-S272 PolarHBondContact O-N 3.17Å; R268-S272 PolarHBondContact O-OG 3.27Å
273L96.7Very high97.6Very high26 Ų2668.9 Ų68.914%0.13638%0.376CS..Hα-helixtrans-111.50.5-179.1-62-176.6000114.1Q247 A250 L251 L269 A270 Y271 M275Q247-L273 HydrophobicContact CG-CB 4.37Å; Q247-L273 PolarHBondContact NE2-O 2.96Å; A250-L273 HydrophobicContact CB-CD1 4.03Å; A250-L273 HydrophobicContact CB-CD2 3.58Å; A250-L273 HydrophobicContact CB-CG 4.41Å; L251-L273 HydrophobicContact CD2-CD1 3.98Å; L251-L273 HydrophobicContact CG-CD1 3.78Å; L269-L273 HydrophobicContact CD1-CD1 3.82Å; L269-L273 HydrophobicContact CD1-CG 4.22Å; L269-L273 HydrophobicContact CG-CD1 4.04Å; L269-L273 WeakPolarHBondContact O-CB 3.37Å; L269-L273 VanDerWaalsContact O-CG 3.3Å; L269-L273 WeakPolarHBondContact O-CG 3.43Å; L269-L273 PolarHBondContact O-N 2.86Å; A270-L273 PolarHBondContact O-N 3.32Å; Y271-L273 PolarHBondContact O-N 2.99Å; Y271-L273 VanDerWaalsContact O-N 3.08Å; L273-M275 VanDerWaalsContact C-N 3.27Å; L273-M275 HydrophobicContact CB-CB 4.47Å; L273-M275 HydrophobicContact CB-CG 3.97Å; L273-M275 HydrophobicContact CB-SD 3.99Å; L273-M275 HydrophobicContact CD1-SD 4.26Å; L273-M275 PolarHBondContact O-N 3.48Å
274G97.3Very high97.7Very high72 Ų7267.7 Ų67.774%0.74236%0.362SS*.THydrogen-bonded Turntrans62.933.5-173.900000112.9A270 Y271A270-G274 PolarHBondContact O-N 2.68Å; Y271-G274 PolarHBondContact O-N 3.4Å
275M97.2Very high97.7Very high16 Ų1667.3 Ų67.38%0.07935%0.352CS..  trans-116.6159.7-176.7-64.8-178.764.300110.6F243 Q247 L251 A270 L273 Q279 V280F243-M275 HydrophobicContact CD1-CE 3.59Å; F243-M275 HydrophobicContact CD1-SD 4.41Å; F243-M275 HydrophobicContact CE1-CE 3.43Å; F243-M275 VanDerWaalsContact CE1-CE 3.43Å; F243-M275 HydrophobicContact CE2-CE 4.45Å; F243-M275 HydrophobicContact CG-CE 4.19Å; F243-M275 HydrophobicContact CZ-CE 3.89Å; Q247-M275 HydrophobicContact CB-SD 4.1Å; Q247-M275 HydrophobicContact CG-SD 4.18Å; L251-M275 HydrophobicContact CD1-CE 4.08Å; L251-M275 HydrophobicContact CD1-SD 3.99Å; A270-M275 CarbonylContact C-O 3.45Å; A270-M275 WeakPolarHBondContact CB-O 3.14Å; A270-M275 PolarHBondContact O-N 3.46Å; A270-M275 VanDerWaalsContact O-O 3.1Å; L273-M275 VanDerWaalsContact C-N 3.27Å; L273-M275 HydrophobicContact CB-CB 4.47Å; L273-M275 HydrophobicContact CB-CG 3.97Å; L273-M275 HydrophobicContact CB-SD 3.99Å; L273-M275 HydrophobicContact CD1-SD 4.26Å; L273-M275 PolarHBondContact O-N 3.48Å; M275-Q279 HydrophobicContact CE-CB 3.84Å; M275-V280 HydrophobicContact CB-CG2 4.2Å
276T98.1Very high97.7Very high77 Ų7768.3 Ų68.347%0.47236%0.36SS..  trans-83.3150.3170.869.20000110.9S278 Q279 V280T276-S278 PolarHBondContact O-N 2.72Å; T276-S278 VanDerWaalsContact O-N 3.11Å; T276-Q279 WeakPolarHBondContact O-CB 3.13Å; T276-Q279 PolarHBondContact O-N 3.37Å; T276-Q279 WeakPolarHBondContact OG1-CG 3.5Å; T276-Q279 PolarHBondContact OG1-N 2.92Å; T276-V280 PolarHBondContact O-N 3.39Å; T276-V280 VanDerWaalsContact O-N 3.07Å
277E97.9Very high97.7Very high81 Ų8169.8 Ų69.838%0.37937%0.365SS..Hα-helixtrans-52.8-33.6172.2-88-157.1-110.500112.8R266 A267 A270 V280 K281R266-E277 WeakPolarHBondContact CD-O 3.34Å; R266-E277 WeakPolarHBondContact CD-OE2 3.34Å; R266-E277 HydrophobicContact CG-CB 4.44Å; R266-E277 HydrophobicContact CG-CG 4.14Å; R266-E277 IonicContact CZ-OE2 2.82Å; R266-E277 IonicContact NE-OE2 2.67Å; R266-E277 IonicContact NH1-OE2 2.75Å; R266-E277 PolarHBondContact NH1-OE2 3.35Å; A267-E277 HydrophobicContact CB-CG 4.45Å; A270-E277 HydrophobicContact CB-CG 4.09Å; E277-V280 PolarHBondContact O-N 3.11Å; E277-K281 VanDerWaalsContact O-CB 3.23Å; E277-K281 WeakPolarHBondContact O-CB 3.35Å; E277-K281 PolarHBondContact O-N 3.17Å
278S97.9Very high97.7Very high77 Ų7769.9 Ų69.954%0.53836%0.357SS..Hα-helixtrans-65.8-43.5176.4-169.10000111.9T276 V280 K281 V282T276-S278 PolarHBondContact O-N 2.72Å; T276-S278 VanDerWaalsContact O-N 3.11Å; S278-V280 PolarHBondContact O-N 3.02Å; S278-K281 PolarHBondContact O-N 2.76Å; S278-V282 WeakPolarHBondContact O-CB 3.36Å; S278-V282 VanDerWaalsContact O-CG2 3.31Å; S278-V282 WeakPolarHBondContact O-CG2 3.48Å; S278-V282 PolarHBondContact O-N 2.92Å
279Q97.4Very high97.7Very high82 Ų8265.3 Ų65.338%0.38335%0.347SS..Hα-helixtrans-61.6-44.2174.1-72.2165.9-25.100111.5F243 M275 T276 V282 W283F243-Q279 HydrophobicContact CE1-CB 4.44Å; F243-Q279 HydrophobicContact CE1-CG 4.48Å; F243-Q279 HydrophobicContact CZ-CB 4.42Å; M275-Q279 HydrophobicContact CE-CB 3.84Å; T276-Q279 WeakPolarHBondContact O-CB 3.13Å; T276-Q279 PolarHBondContact O-N 3.37Å; T276-Q279 WeakPolarHBondContact OG1-CG 3.5Å; T276-Q279 PolarHBondContact OG1-N 2.92Å; Q279-V282 PolarHBondContact O-N 3.06Å; Q279-W283 WeakPolarHBondContact O-CB 3.41Å; Q279-W283 PolarHBondContact O-N 2.88Å
280V97.9Very high97.5Very high1 Ų171.5 Ų71.51%0.00637%0.373CS..Hα-helixtrans-63.3-45.3176.3-178.70000111L251 L261 R266 L269 A270 M275 T276 E277 S278 V282 W283 F284L251-V280 HydrophobicContact CD2-CG1 4.1Å; L251-V280 HydrophobicContact CD2-CG2 4.36Å; L261-V280 HydrophobicContact CD1-CG1 3.89Å; R266-V280 HydrophobicContact CG-CB 4.02Å; R266-V280 HydrophobicContact CG-CG1 3.79Å; L269-V280 HydrophobicContact CD2-CG1 4.1Å; A270-V280 HydrophobicContact CB-CG2 3.98Å; M275-V280 HydrophobicContact CB-CG2 4.2Å; T276-V280 PolarHBondContact O-N 3.39Å; T276-V280 VanDerWaalsContact O-N 3.07Å; E277-V280 PolarHBondContact O-N 3.11Å; S278-V280 PolarHBondContact O-N 3.02Å; V280-V282 PolarHBondContact O-N 3.4Å; V280-W283 PolarHBondContact O-N 3.01Å; V280-F284 HydrophobicContact CG1-CD2 3.92Å; V280-F284 HydrophobicContact CG1-CE2 4.12Å; V280-F284 WeakPolarHBondContact O-CD2 3.33Å; V280-F284 PolarHBondContact O-N 3.2Å
281K97.7Very high97.4Very high133 Ų13376.3 Ų76.358%0.57839%0.39SS*.Hα-helixtrans-56.9-47.2175.6-178.6179.6177.9-179.20111.8E277 S278 Q285E277-K281 VanDerWaalsContact O-CB 3.23Å; E277-K281 WeakPolarHBondContact O-CB 3.35Å; E277-K281 PolarHBondContact O-N 3.17Å; S278-K281 PolarHBondContact O-N 2.76Å; K281-Q285 WeakPolarHBondContact O-CB 3.35Å; K281-Q285 PolarHBondContact O-N 3.49Å
282V97.9Very high97.2Very high74 Ų7473.3 Ų73.345%0.44838%0.377SS..Hα-helixtrans-67-40.5178.11700000111.4S278 Q279 V280 Q285 N286S278-V282 WeakPolarHBondContact O-CB 3.36Å; S278-V282 VanDerWaalsContact O-CG2 3.31Å; S278-V282 WeakPolarHBondContact O-CG2 3.48Å; S278-V282 PolarHBondContact O-N 2.92Å; Q279-V282 PolarHBondContact O-N 3.06Å; V280-V282 PolarHBondContact O-N 3.4Å; V282-Q285 PolarHBondContact O-N 2.89Å; V282-N286 WeakPolarHBondContact O-CB 3.37Å; V282-N286 VanDerWaalsContact O-CG 3.31Å; V282-N286 PolarHBondContact O-N 3.25Å; V282-N286 PolarHBondContact O-ND2 3.11Å; V282-N286 VanDerWaalsContact O-ND2 3.13Å
283W97.7Very high97Very high32 Ų3276.8 Ų76.812%0.12138%0.381CS..Hα-helixtrans-61.2-50.6175.5-168.3104.5000111.2F243 L251 E252 F255 Q279 V280 Q285 N286 R287F243-W283 AromaticContact CD2-CD1 3.82Å; F243-W283 AromaticContact CE2-CD1 3.81Å; L251-W283 HydrophobicContact CB-CD2 3.93Å; L251-W283 HydrophobicContact CB-CE3 3.93Å; L251-W283 HydrophobicContact CB-CH2 3.76Å; L251-W283 HydrophobicContact CB-CZ2 3.72Å; L251-W283 HydrophobicContact CB-CZ3 3.86Å; L251-W283 HydrophobicContact CD1-CD2 3.94Å; L251-W283 HydrophobicContact CD1-CG 3.86Å; L251-W283 HydrophobicContact CD2-CD2 4.45Å; L251-W283 HydrophobicContact CD2-CE3 4.44Å; L251-W283 HydrophobicContact CG-CD2 4.34Å; E252-W283 HydrophobicContact CB-CH2 4.3Å; E252-W283 WeakPolarHBondContact OE2-CH2 3.44Å; F255-W283 HydrophobicContact CB-CH2 4.45Å; F255-W283 HydrophobicContact CB-CZ3 4.07Å; F255-W283 HydrophobicContact CG-CZ3 4.46Å; Q279-W283 WeakPolarHBondContact O-CB 3.41Å; Q279-W283 PolarHBondContact O-N 2.88Å; V280-W283 PolarHBondContact O-N 3.01Å; W283-Q285 VanDerWaalsContact C-N 3.29Å; W283-Q285 PolarHBondContact O-N 3.4Å; W283-N286 PolarHBondContact O-N 2.93Å; W283-R287 HydrophobicContact CE3-CB 3.93Å; W283-R287 HydrophobicContact CE3-CG 4.43Å; W283-R287 HydrophobicContact CH2-CB 4.15Å; W283-R287 HydrophobicContact CH2-CG 3.8Å; W283-R287 HydrophobicContact CZ3-CB 3.67Å; W283-R287 HydrophobicContact CZ3-CG 3.67Å; W283-R287 WeakPolarHBondContact O-CB 3.46Å; W283-R287 PolarHBondContact O-N 3.23Å
284F98.3Very high96.7Very high6 Ų681.8 Ų81.83%0.02640%0.402CS..Hα-helixtrans-63.7-31.8177.8-90.6-105.3000113L251 T254 F255 L261 L269 V280 R288L251-F284 HydrophobicContact CD2-CD2 4.45Å; L251-F284 HydrophobicContact CD2-CE2 3.91Å; T254-F284 HydrophobicContact CG2-CZ 4.29Å; F255-F284 HydrophobicContact CB-CE1 4.01Å; F255-F284 HydrophobicContact CB-CZ 4.1Å; F255-F284 AromaticContact CD2-CD1 3.91Å; F255-F284 HydrophobicContact CD2-CD1 3.91Å; F255-F284 AromaticContact CD2-CE1 3.84Å; F255-F284 HydrophobicContact CD2-CE1 3.84Å; F255-F284 HydrophobicContact CG-CE1 4.44Å; L261-F284 HydrophobicContact CD1-CD1 4.1Å; L261-F284 HydrophobicContact CD1-CD2 3.84Å; L261-F284 HydrophobicContact CD1-CE1 3.74Å; L261-F284 HydrophobicContact CD1-CE2 3.49Å; L261-F284 VanDerWaalsContact CD1-CE2 3.49Å; L261-F284 HydrophobicContact CD1-CG 4.16Å; L261-F284 HydrophobicContact CD1-CZ 3.44Å; L261-F284 VanDerWaalsContact CD1-CZ 3.44Å; L261-F284 HydrophobicContact CG-CD1 4.07Å; L261-F284 HydrophobicContact CG-CE1 3.69Å; L261-F284 HydrophobicContact CG-CE2 4.37Å; L261-F284 HydrophobicContact CG-CZ 3.88Å; L269-F284 HydrophobicContact CD2-CE2 3.99Å; L269-F284 HydrophobicContact CD2-CZ 4.3Å; V280-F284 HydrophobicContact CG1-CD2 3.92Å; V280-F284 HydrophobicContact CG1-CE2 4.12Å; V280-F284 WeakPolarHBondContact O-CD2 3.33Å; V280-F284 PolarHBondContact O-N 3.2Å; F284-R288 WeakPolarHBondContact O-CB 3.42Å; F284-R288 WeakPolarHBondContact O-CG 2.96Å; F284-R288 PolarHBondContact O-N 2.82Å; F284-R288 PolarHBondContact O-NE 3.1Å
285Q98Very high96.1Very high85 Ų8582.9 Ų82.940%0.39739%0.387SS..Hα-helixtrans-68.7-43.4173.4-172.556.867.500112.1K281 V282 W283 T289K281-Q285 WeakPolarHBondContact O-CB 3.35Å; K281-Q285 PolarHBondContact O-N 3.49Å; V282-Q285 PolarHBondContact O-N 2.89Å; W283-Q285 VanDerWaalsContact C-N 3.29Å; W283-Q285 PolarHBondContact O-N 3.4Å; Q285-T289 PolarHBondContact O-N 2.8Å; Q285-T289 VanDerWaalsContact O-N 3.17Å; Q285-T289 PolarHBondContact O-OG1 3.27Å
286N97.6Very high95.5Very high92 Ų9285.2 Ų85.249%0.49241%0.409SS..Hα-helixtrans-66.6-39.8175.8-72.2-34000111.8V282 W283 T289 K290V282-N286 WeakPolarHBondContact O-CB 3.37Å; V282-N286 VanDerWaalsContact O-CG 3.31Å; V282-N286 PolarHBondContact O-N 3.25Å; V282-N286 PolarHBondContact O-ND2 3.11Å; V282-N286 VanDerWaalsContact O-ND2 3.13Å; W283-N286 PolarHBondContact O-N 2.93Å; N286-T289 PolarHBondContact O-N 2.75Å; N286-K290 PolarHBondContact O-N 3.02Å
287R97.6Very high94.7Very high86 Ų8684.1 Ų84.133%0.32541%0.408SS..Hα-helixtrans-64.4-47.1177.4-169.170-166.1176.95.5111.7E252 F255 W283 T289 K290 W291E252-R287 VanDerWaalsContact CD-NE 3.26Å; E252-R287 IonicContact OE1-CZ 3.76Å; E252-R287 IonicContact OE1-NE 2.78Å; E252-R287 PolarHBondContact OE1-NE 3.49Å; E252-R287 IonicContact OE1-NH1 3.27Å; E252-R287 IonicContact OE1-NH2 3.46Å; E252-R287 PolarHBondContact OE1-NH2 2.99Å; E252-R287 WeakPolarHBondContact OE2-CD 3.44Å; E252-R287 IonicContact OE2-CZ 3.27Å; E252-R287 IonicContact OE2-NE 3.95Å; E252-R287 PolarHBondContact OE2-NE 2.82Å; E252-R287 IonicContact OE2-NH1 2.72Å; E252-R287 PolarHBondContact OE2-NH1 3.22Å; E252-R287 IonicContact OE2-NH2 2.8Å; E252-R287 PolarHBondContact OE2-NH2 2.81Å; F255-R287 HydrophobicContact CD1-CG 3.56Å; F255-R287 HydrophobicContact CD2-CB 4.34Å; F255-R287 HydrophobicContact CD2-CG 3.82Å; F255-R287 HydrophobicContact CE1-CG 3.58Å; F255-R287 HydrophobicContact CE2-CB 4.27Å; F255-R287 HydrophobicContact CE2-CG 3.85Å; F255-R287 HydrophobicContact CG-CG 3.69Å; F255-R287 HydrophobicContact CZ-CB 4.47Å; F255-R287 HydrophobicContact CZ-CG 3.72Å; W283-R287 HydrophobicContact CE3-CB 3.93Å; W283-R287 HydrophobicContact CE3-CG 4.43Å; W283-R287 HydrophobicContact CH2-CB 4.15Å; W283-R287 HydrophobicContact CH2-CG 3.8Å; W283-R287 HydrophobicContact CZ3-CB 3.67Å; W283-R287 HydrophobicContact CZ3-CG 3.67Å; W283-R287 WeakPolarHBondContact O-CB 3.46Å; W283-R287 PolarHBondContact O-N 3.23Å; R287-T289 VanDerWaalsContact C-N 3.29Å; R287-T289 PolarHBondContact O-N 2.67Å; R287-K290 PolarHBondContact O-N 3.13Å; R287-W291 WeakPolarHBondContact O-CB 3.38Å; R287-W291 PolarHBondContact O-N 3.46Å
288R97.5Very high93.8Very high43 Ų4383.8 Ų83.816%0.16241%0.406CS..Hα-helixtrans-57.9-36.4172.5-80-177.2-75.1133.46.6113.2F255 K259 Y260 F284 R292F255-R288 HydrophobicContact CE2-CG 3.85Å; F255-R288 HydrophobicContact CZ-CG 4.39Å; K259-R288 WeakPolarHBondContact O-CD 3.44Å; K259-R288 WeakPolarHBondContact O-CG 3.4Å; Y260-R288 VanDerWaalsContact CE1-NH1 3.33Å; F284-R288 WeakPolarHBondContact O-CB 3.42Å; F284-R288 WeakPolarHBondContact O-CG 2.96Å; F284-R288 PolarHBondContact O-N 2.82Å; F284-R288 PolarHBondContact O-NE 3.1Å; R288-R292 WeakPolarHBondContact O-CG 3.48Å; R288-R292 PolarHBondContact O-N 3.18Å
289T97.3Very high92.6Very high64 Ų6486.4 Ų86.439%0.39341%0.411SS..Hα-helixtrans-69.9-41.2176.1-67.20000112.4Q285 N286 R287 R292 K293Q285-T289 PolarHBondContact O-N 2.8Å; Q285-T289 VanDerWaalsContact O-N 3.17Å; Q285-T289 PolarHBondContact O-OG1 3.27Å; N286-T289 PolarHBondContact O-N 2.75Å; R287-T289 VanDerWaalsContact C-N 3.29Å; R287-T289 PolarHBondContact O-N 2.67Å; T289-R292 PolarHBondContact OG1-NH2 3.21Å; T289-K293 PolarHBondContact O-N 3.38Å; T289-K293 VanDerWaalsContact O-N 3.11Å
290K94.9Very high91.5Very high151 Ų15185.6 Ų85.666%0.65742%0.419SS*.Hα-helixtrans-61.9-44.7171.8-74.1-173.2175-1740111.9N286 R287 K293 K294N286-K290 PolarHBondContact O-N 3.02Å; R287-K290 PolarHBondContact O-N 3.13Å; K290-K293 PolarHBondContact O-N 3.48Å; K290-K294 PolarHBondContact O-N 3.05Å
291W95Very high90.2Very high105 Ų10589.9 Ų89.940%0.39845%0.445SS..Hα-helixtrans-57.8-52.2178.217980.6000111.9F255 R287 K293 K294 H295F255-W291 HydrophobicContact CE1-CB 4.38Å; F255-W291 HydrophobicContact CE1-CG 4.38Å; F255-W291 HydrophobicContact CZ-CB 4.05Å; F255-W291 HydrophobicContact CZ-CG 4.13Å; R287-W291 WeakPolarHBondContact O-CB 3.38Å; R287-W291 PolarHBondContact O-N 3.46Å; W291-K293 VanDerWaalsContact C-N 3.32Å; W291-K293 PolarHBondContact O-N 3.24Å; W291-K294 PolarHBondContact O-N 3.32Å; W291-K294 VanDerWaalsContact O-N 3.17Å; W291-H295 AromaticContact CD1-CD2 3.83Å; W291-H295 AromaticContact CD2-CD2 3.76Å; W291-H295 AromaticContact CE2-CD2 3.31Å; W291-H295 AromaticContact CZ2-CD2 3.6Å; W291-H295 AromaticContact NE1-CD2 3.37Å; W291-H295 PolarHBondContact NE1-CD2 3.47Å; W291-H295 PolarHBondContact O-CD2 3.36Å; W291-H295 PolarHBondContact O-N 3.06Å; W291-H295 VanDerWaalsContact O-N 3.11Å
292R94.9Very high88.4Confident143 Ų14386 Ų8654%0.5444%0.438SS..Hα-helixtrans-58.8-40.2175.1-72.2-173.3-59.8129.32.7112.9R288 T289 K294 H295 A296R288-R292 WeakPolarHBondContact O-CG 3.48Å; R288-R292 PolarHBondContact O-N 3.18Å; T289-R292 PolarHBondContact OG1-NH2 3.21Å; R292-K294 VanDerWaalsContact C-N 3.33Å; R292-K294 PolarHBondContact O-N 2.99Å; R292-H295 PolarHBondContact O-N 3.06Å; R292-A296 WeakPolarHBondContact O-CB 3.47Å; R292-A296 PolarHBondContact O-N 3.27Å
293K93.3Very high86.5Confident167 Ų16789.6 Ų89.673%0.72645%0.448SS*.Hα-helixtrans-65-36.1178.3-173172.5-1791770112.2T289 K290 W291 A297T289-K293 PolarHBondContact O-N 3.38Å; T289-K293 VanDerWaalsContact O-N 3.11Å; K290-K293 PolarHBondContact O-N 3.48Å; W291-K293 VanDerWaalsContact C-N 3.32Å; W291-K293 PolarHBondContact O-N 3.24Å; K293-A297 WeakPolarHBondContact O-CB 3.39Å; K293-A297 PolarHBondContact O-N 3.27Å
294K88.5Confident84.5Confident131 Ų13195 Ų9557%0.5747%0.472SS*.Hα-helixtrans-63.8-55.3173.9-177.2-179.2165.3-1790110.7K290 W291 R292 A296 A297 E298K290-K294 PolarHBondContact O-N 3.05Å; W291-K294 PolarHBondContact O-N 3.32Å; W291-K294 VanDerWaalsContact O-N 3.17Å; R292-K294 VanDerWaalsContact C-N 3.33Å; R292-K294 PolarHBondContact O-N 2.99Å; K294-A296 VanDerWaalsContact C-N 3.33Å; K294-A296 PolarHBondContact O-N 3.47Å; K294-A297 WeakPolarHBondContact O-CB 3.5Å; K294-A297 PolarHBondContact O-N 2.98Å; K294-E298 WeakPolarHBondContact CE-OE1 3.25Å; K294-E298 WeakPolarHBondContact CE-OE2 2.74Å; K294-E298 HydrophobicContact CG-CG 4.49Å; K294-E298 IonicContact NZ-OE1 3.44Å; K294-E298 PolarHBondContact NZ-OE1 3.15Å; K294-E298 WeakPolarHBondContact O-CG 3.48Å; K294-E298 PolarHBondContact O-N 2.88Å
295H85.3Confident82.5Confident94 Ų94102.4 Ų102.444%0.43550%0.504SS..Hα-helixtrans-59.9-39.2-179.2-78-69.9000113.5W291 R292 A297 E298 M299W291-H295 AromaticContact CD1-CD2 3.83Å; W291-H295 AromaticContact CD2-CD2 3.76Å; W291-H295 AromaticContact CE2-CD2 3.31Å; W291-H295 AromaticContact CZ2-CD2 3.6Å; W291-H295 AromaticContact NE1-CD2 3.37Å; W291-H295 PolarHBondContact NE1-CD2 3.47Å; W291-H295 PolarHBondContact O-CD2 3.36Å; W291-H295 PolarHBondContact O-N 3.06Å; W291-H295 VanDerWaalsContact O-N 3.11Å; R292-H295 PolarHBondContact O-N 3.06Å; H295-A297 VanDerWaalsContact C-N 3.34Å; H295-A297 PolarHBondContact O-N 3.12Å; H295-E298 IonicContact CE1-OE2 2.87Å; H295-E298 PolarHBondContact CE1-OE2 3.01Å; H295-E298 IonicContact ND1-OE2 3.73Å; H295-E298 PolarHBondContact O-N 3.06Å; H295-M299 WeakPolarHBondContact O-CG 3.4Å; H295-M299 PolarHBondContact O-N 2.91Å
296A84.4Confident80.4Confident66 Ų66104.8 Ų104.855%0.54552%0.515SS..Hα-helixtrans-64.7-36.1175.700000112.8R292 K294 A300R292-A296 WeakPolarHBondContact O-CB 3.47Å; R292-A296 PolarHBondContact O-N 3.27Å; K294-A296 VanDerWaalsContact C-N 3.33Å; K294-A296 PolarHBondContact O-N 3.47Å; A296-A300 PolarHBondContact O-N 3.25Å
297A81.9Confident78.3Confident54 Ų54104.9 Ų104.945%0.44652%0.516SS..Hα-helixtrans-70.3-38.9175.400000112.1K293 K294 H295 A300 T301K293-A297 WeakPolarHBondContact O-CB 3.39Å; K293-A297 PolarHBondContact O-N 3.27Å; K294-A297 WeakPolarHBondContact O-CB 3.5Å; K294-A297 PolarHBondContact O-N 2.98Å; H295-A297 VanDerWaalsContact C-N 3.34Å; H295-A297 PolarHBondContact O-N 3.12Å; A297-A300 PolarHBondContact O-N 3.28Å; A297-T301 PolarHBondContact O-N 3Å; A297-T301 PolarHBondContact O-OG1 2.99Å
298E77.9Confident76.3Confident73 Ų73103.3 Ų103.334%0.34152%0.518SS..Hα-helixtrans-65.5-38.1177.5-71171.5146.600112.2K294 H295 T301 A302K294-E298 WeakPolarHBondContact CE-OE1 3.25Å; K294-E298 WeakPolarHBondContact CE-OE2 2.74Å; K294-E298 HydrophobicContact CG-CG 4.49Å; K294-E298 IonicContact NZ-OE1 3.44Å; K294-E298 PolarHBondContact NZ-OE1 3.15Å; K294-E298 WeakPolarHBondContact O-CG 3.48Å; K294-E298 PolarHBondContact O-N 2.88Å; H295-E298 IonicContact CE1-OE2 2.87Å; H295-E298 PolarHBondContact CE1-OE2 3.01Å; H295-E298 IonicContact ND1-OE2 3.73Å; H295-E298 PolarHBondContact O-N 3.06Å; E298-T301 PolarHBondContact O-N 3.35Å; E298-T301 PolarHBondContact O-OG1 3.22Å; E298-A302 VanDerWaalsContact O-CB 3.25Å; E298-A302 WeakPolarHBondContact O-CB 3.43Å; E298-A302 PolarHBondContact O-N 2.93Å
299M73.9Confident74.2Confident132 Ų132107.2 Ų107.265%0.6554%0.538SS*.Hα-helixtrans-67.7-35.5173.6-66.9-65.1151.600112.6H295 K303H295-M299 WeakPolarHBondContact O-CG 3.4Å; H295-M299 PolarHBondContact O-N 2.91Å; M299-K303 PolarHBondContact O-N 3.02Å
300A73.6Confident72.2Confident66 Ų66107.9 Ų107.955%0.54554%0.542SS..Hα-helixtrans-68.8-38.5175.900000112.7A296 A297 K304A296-A300 PolarHBondContact O-N 3.25Å; A297-A300 PolarHBondContact O-N 3.28Å; A300-K304 PolarHBondContact O-N 3.44Å
301T70.9Confident70.3Confident91 Ų91106.8 Ų106.856%0.55854%0.54SS*.Hα-helixtrans-76.4-32.6175.955.70000112.7A297 E298 K304 K305A297-T301 PolarHBondContact O-N 3Å; A297-T301 PolarHBondContact O-OG1 2.99Å; E298-T301 PolarHBondContact O-N 3.35Å; E298-T301 PolarHBondContact O-OG1 3.22Å; T301-K304 PolarHBondContact O-N 3.03Å; T301-K305 PolarHBondContact O-N 2.91Å
302A60Low68.5Low52 Ų52111.6 Ų111.643%0.4356%0.558SS.*Hα-helixtrans-60.9-47.3171.100000111.4E298 K304 K305 Q306E298-A302 VanDerWaalsContact O-CB 3.25Å; E298-A302 WeakPolarHBondContact O-CB 3.43Å; E298-A302 PolarHBondContact O-N 2.93Å; A302-K304 VanDerWaalsContact C-N 3.33Å; A302-K304 PolarHBondContact O-N 3.45Å; A302-K305 WeakPolarHBondContact O-CB 3.45Å; A302-K305 PolarHBondContact O-N 3.43Å; A302-K305 VanDerWaalsContact O-N 3.11Å; A302-Q306 PolarHBondContact O-N 2.93Å
303K57.1Low66.5Low148 Ų148110.6 Ų110.664%0.64356%0.562SS**Hα-helixtrans-59.1-43.1175.3-175.5168.2-178.7174.10111.9M299 K305 Q306 D307M299-K303 PolarHBondContact O-N 3.02Å; K303-K305 VanDerWaalsContact C-N 3.3Å; K303-K305 PolarHBondContact O-N 2.82Å; K303-Q306 PolarHBondContact O-N 3.03Å; K303-D307 VanDerWaalsContact O-CB 3.25Å; K303-D307 WeakPolarHBondContact O-CB 3.38Å; K303-D307 PolarHBondContact O-N 3.11Å
304K56.8Low64.6Low147 Ų147109.1 Ų109.164%0.63956%0.556SS**Hα-helixtrans-63.3-33.2176.6-175.1164.9-176.3171.10113A300 T301 A302 S308A300-K304 PolarHBondContact O-N 3.44Å; T301-K304 PolarHBondContact O-N 3.03Å; A302-K304 VanDerWaalsContact C-N 3.33Å; A302-K304 PolarHBondContact O-N 3.45Å; K304-S308 WeakPolarHBondContact O-CB 3.47Å; K304-S308 PolarHBondContact O-N 3.24Å; K304-S308 PolarHBondContact O-OG 3.03Å
305K56Low62.6Low161 Ų161105.1 Ų105.170%0.755%0.552SS**Hα-helixtrans-65.2-49.1172.1-81.9-164.1170.3-164.90111.7T301 A302 K303 D307 S308 E309T301-K305 PolarHBondContact O-N 2.91Å; A302-K305 WeakPolarHBondContact O-CB 3.45Å; A302-K305 PolarHBondContact O-N 3.43Å; A302-K305 VanDerWaalsContact O-N 3.11Å; K303-K305 VanDerWaalsContact C-N 3.3Å; K303-K305 PolarHBondContact O-N 2.82Å; K305-D307 VanDerWaalsContact C-N 3.33Å; K305-D307 PolarHBondContact O-N 3.03Å; K305-S308 CarbonylContact O-C 3.51Å; K305-S308 PolarHBondContact O-N 2.85Å; K305-E309 WeakPolarHBondContact O-CB 3.33Å; K305-E309 PolarHBondContact O-N 2.96Å
306Q54.2Low60.6Low134 Ų134104 Ų10463%0.62656%0.559SS**Hα-helixtrans-59.9-44.1178.3-170-179.318.700111.6A302 K303 S308 E309 T310A302-Q306 PolarHBondContact O-N 2.93Å; K303-Q306 PolarHBondContact O-N 3.03Å; Q306-S308 PolarHBondContact O-N 3.39Å; Q306-E309 CarbonylContact O-C 3.38Å; Q306-E309 WeakPolarHBondContact O-CA 3.49Å; Q306-E309 WeakPolarHBondContact O-CB 3.25Å; Q306-E309 PolarHBondContact O-N 3.35Å; Q306-T310 PolarHBondContact O-N 3.37Å; Q306-T310 PolarHBondContact O-OG1 3.43Å
307D53.1Low58.4Low95 Ų95104.5 Ų104.551%0.50856%0.558SS.*Hα-helixtrans-57.1-45.7175.6-162.465.2000111.6K303 K305 E309 T310 E311K303-D307 VanDerWaalsContact O-CB 3.25Å; K303-D307 WeakPolarHBondContact O-CB 3.38Å; K303-D307 PolarHBondContact O-N 3.11Å; K305-D307 VanDerWaalsContact C-N 3.33Å; K305-D307 PolarHBondContact O-N 3.03Å; D307-E309 VanDerWaalsContact C-N 3.3Å; D307-E309 PolarHBondContact O-N 2.88Å; D307-T310 WeakPolarHBondContact CA-OG1 3.43Å; D307-T310 PolarHBondContact O-OG1 3.28Å; D307-E311 WeakPolarHBondContact O-CB 3.13Å; D307-E311 WeakPolarHBondContact O-CG 3.32Å; D307-E311 PolarHBondContact O-N 3.21Å
308S55.7Low56.5Low52 Ų52108.7 Ų108.736%0.36457%0.569SS.*Hα-helixtrans-74.1-14.2174.3-57.50000114.4K304 K305 Q306 R312K304-S308 WeakPolarHBondContact O-CB 3.47Å; K304-S308 PolarHBondContact O-N 3.24Å; K304-S308 PolarHBondContact O-OG 3.03Å; K305-S308 CarbonylContact O-C 3.51Å; K305-S308 PolarHBondContact O-N 2.85Å; Q306-S308 PolarHBondContact O-N 3.39Å; S308-R312 VanDerWaalsContact O-CB 3.32Å; S308-R312 WeakPolarHBondContact O-CB 3.49Å; S308-R312 WeakPolarHBondContact O-CD 3.45Å; S308-R312 WeakPolarHBondContact O-CG 3.25Å; S308-R312 PolarHBondContact O-N 2.89Å
309E54.6Low54.7Low126 Ų126112 Ų11259%0.58959%0.588SS**Hα-helixtrans-89.4-39.6176.2-167.2170.9155.600109.9K305 Q306 D307 R312 L313K305-E309 WeakPolarHBondContact O-CB 3.33Å; K305-E309 PolarHBondContact O-N 2.96Å; Q306-E309 CarbonylContact O-C 3.38Å; Q306-E309 WeakPolarHBondContact O-CA 3.49Å; Q306-E309 WeakPolarHBondContact O-CB 3.25Å; Q306-E309 PolarHBondContact O-N 3.35Å; D307-E309 VanDerWaalsContact C-N 3.3Å; D307-E309 PolarHBondContact O-N 2.88Å; E309-R312 PolarHBondContact O-N 3.45Å; E309-L313 WeakPolarHBondContact O-CB 3.46Å; E309-L313 WeakPolarHBondContact O-CG 3.27Å; E309-L313 PolarHBondContact O-N 2.85Å
310T55.3Low53.3Low78 Ų78112.7 Ų112.748%0.47959%0.59SS.*Hα-helixtrans-65.7-39.9168.746.10000112.3Q306 D307 R312 L313 K314Q306-T310 PolarHBondContact O-N 3.37Å; Q306-T310 PolarHBondContact O-OG1 3.43Å; D307-T310 WeakPolarHBondContact CA-OG1 3.43Å; D307-T310 PolarHBondContact O-OG1 3.28Å; T310-R312 VanDerWaalsContact C-N 3.34Å; T310-L313 PolarHBondContact O-N 3.27Å; T310-K314 VanDerWaalsContact O-CB 3.25Å; T310-K314 WeakPolarHBondContact O-CB 3.41Å; T310-K314 PolarHBondContact O-N 2.87Å
311E54.4Low52.2Low128 Ų128119 Ų11960%0.59861%0.609SS**Hα-helixtrans-63.3-38.1171-84.3-76.4106.700112D307 K314 G315D307-E311 WeakPolarHBondContact O-CB 3.13Å; D307-E311 WeakPolarHBondContact O-CG 3.32Å; D307-E311 PolarHBondContact O-N 3.21Å; E311-K314 PolarHBondContact O-N 2.8Å; E311-G315 PolarHBondContact O-N 3.22Å
312R56.7Low51.3Low206 Ų206122.9 Ų122.978%0.77762%0.62SS**Hα-helixtrans-78-24.5178.8-76.1179.472.6-1571.2114.1S308 E309 T310 A316S308-R312 VanDerWaalsContact O-CB 3.32Å; S308-R312 WeakPolarHBondContact O-CB 3.49Å; S308-R312 WeakPolarHBondContact O-CD 3.45Å; S308-R312 WeakPolarHBondContact O-CG 3.25Å; S308-R312 PolarHBondContact O-N 2.89Å; E309-R312 PolarHBondContact O-N 3.45Å; T310-R312 VanDerWaalsContact C-N 3.34Å; R312-A316 WeakPolarHBondContact O-CB 3.35Å; R312-A316 PolarHBondContact O-N 3.46Å
313L53.9Low50.8Low122 Ų122126.8 Ų126.864%0.63963%0.634SS**Hα-helixtrans-77.3-33.8168.4-72.5167.9000111E309 T310 A316 S317E309-L313 WeakPolarHBondContact O-CB 3.46Å; E309-L313 WeakPolarHBondContact O-CG 3.27Å; E309-L313 PolarHBondContact O-N 2.85Å; T310-L313 PolarHBondContact O-N 3.27Å; L313-A316 PolarHBondContact O-N 2.91Å; L313-S317 PolarHBondContact O-N 3.23Å
314K53.1Low50.6Low136 Ų136126.9 Ų126.959%0.59164%0.641SS**Hα-helixtrans-71.6-49.7175.3-171164.1-177174.30112.4T310 E311 A316 S317 E318T310-K314 VanDerWaalsContact O-CB 3.25Å; T310-K314 WeakPolarHBondContact O-CB 3.41Å; T310-K314 PolarHBondContact O-N 2.87Å; E311-K314 PolarHBondContact O-N 2.8Å; K314-A316 PolarHBondContact O-N 3.41Å; K314-S317 WeakPolarHBondContact O-CA 3.42Å; K314-S317 VanDerWaalsContact O-CB 3.27Å; K314-S317 WeakPolarHBondContact O-CB 3.1Å; K314-S317 PolarHBondContact O-N 3.49Å; K314-E318 PolarHBondContact O-N 3.27Å
315G45.2Very low50.4Low47 Ų47125.8 Ų125.849%0.48564%0.642SS.*THydrogen-bonded Turntrans-73.40.2172.800000114.9E311E311-G315 PolarHBondContact O-N 3.22Å
316A43.5Very low50.2Low70 Ų70128.4 Ų128.458%0.57965%0.65SS**THydrogen-bonded Turntrans-97.3-9.116300000112.6R312 L313 K314R312-A316 WeakPolarHBondContact O-CB 3.35Å; R312-A316 PolarHBondContact O-N 3.46Å; L313-A316 PolarHBondContact O-N 2.91Å; K314-A316 PolarHBondContact O-N 3.41Å
317S39.5Very low50.5Low76 Ų76129.1 Ų129.153%0.53166%0.658SS.*SBendtrans-93.5-0.8171.6-165.70000112.3L313 K314 N319L313-S317 PolarHBondContact O-N 3.23Å; K314-S317 WeakPolarHBondContact O-CA 3.42Å; K314-S317 VanDerWaalsContact O-CB 3.27Å; K314-S317 WeakPolarHBondContact O-CB 3.1Å; K314-S317 PolarHBondContact O-N 3.49Å; S317-N319 VanDerWaalsContact C-N 3.35Å
318E41.1Very low51.2Low143 Ų143131 Ų13167%0.66866%0.661SS**SBendtrans-99.828.7175.6-67.1176.2159.100111.3K314K314-E318 PolarHBondContact O-N 3.27Å
319N40.3Very low51.4Low141 Ų141134 Ų13475%0.75468%0.679SS**  trans-13336.1172.2-160.5104.1000110.8S317S317-N319 VanDerWaalsContact C-N 3.35Å
320E45.4Very low51.7Low148 Ų148135.9 Ų135.969%0.69269%0.693SS**  trans-119.752.2167.9-68.3-178154.700108.6E322E320-E322 PolarHBondContact O-N 3.15Å
321E49.8Very low52Low199 Ų199136.9 Ų136.993%0.9370%0.695SS**THydrogen-bonded Turntrans-70.746.8175.9-65.5-169137.500112.6
322E51.7Low52.4Low171 Ų171136.5 Ų136.580%0.79970%0.704SS**THydrogen-bonded Turntrans-134.3-18.7179.4-160.3161.3-164.400114.2E320E320-E322 PolarHBondContact O-N 3.15Å
323D50.3Low52.6Low134 Ų134131 Ų13172%0.71769%0.69SS**SBendtrans-90-18.2-178.1-91.2-19.3000115.3D325D323-D325 VanDerWaalsContact C-N 3.31Å; D323-D325 PolarHBondContact O-N 3Å
324D51.7Low53.3Low151 Ų151127.7 Ų127.781%0.80768%0.677SS**G310 helixtrans-73.3-15.6-178.8-96.9-36.8000114.1Y326D324-Y326 VanDerWaalsContact C-N 3.26Å; D324-Y326 PolarHBondContact O-N 3.36Å
325D52.1Low54Low123 Ų123126 Ų12666%0.65867%0.674SS**G310 helixtrans-64.9-31.7179.3-164.2-123.9000111.9D323 N327 K328D323-D325 VanDerWaalsContact C-N 3.31Å; D323-D325 PolarHBondContact O-N 3Å; D325-N327 VanDerWaalsContact C-N 3.26Å; D325-N327 PolarHBondContact O-N 3.2Å; D325-K328 PolarHBondContact O-N 3.36Å
326Y52.4Low55.3Low217 Ų217128 Ų12885%0.85167%0.673SS**G310 helixtrans-70.3-12.9-174.2-104.8-81000115.7D324D324-Y326 VanDerWaalsContact C-N 3.26Å; D324-Y326 PolarHBondContact O-N 3.36Å
327N60.6Low56.5Low149 Ų149130.1 Ų130.180%0.79767%0.672SS**G310 helixtrans-116.15.9-178.5-149.35000113.1D325D325-N327 VanDerWaalsContact C-N 3.26Å; D325-N327 PolarHBondContact O-N 3.2Å
328K68.3Low58Low134 Ų134132.2 Ų132.258%0.58367%0.671SS**SBendtrans-72133.6169.5-168.4-175.9178.2-165.60108.9D325 L330D325-K328 PolarHBondContact O-N 3.36Å; K328-L330 PolarHBondContact O-N 2.84Å; K328-L330 VanDerWaalsContact O-N 3.15Å
329P60.5Low59.5Low114 Ų114129 Ų12974%0.7466%0.658SS**  trans-54.3124.2172.3-26.235000110.3D331P329-D331 PolarHBondContact O-N 3.37Å
330L59.3Low61.1Low167 Ų167126.6 Ų126.687%0.87465%0.648SS**  trans-57.5110-176.5-66.6174.3000109.9K328 P332K328-L330 PolarHBondContact O-N 2.84Å; K328-L330 VanDerWaalsContact O-N 3.15Å; L330-P332 VanDerWaalsContact O-CD 3.26Å; L330-P332 WeakPolarHBondContact O-CD 3.38Å
331D61.3Low62.5Low99 Ų99125.8 Ų125.853%0.52965%0.645SS.*  trans-70.3112.9177.2-166.8-32.8000108.3P329 N333 S334P329-D331 PolarHBondContact O-N 3.37Å; D331-N333 PolarHBondContact O-N 2.97Å; D331-S334 WeakPolarHBondContact O-CB 3.26Å; D331-S334 PolarHBondContact O-N 2.98Å
332P64.8Low63.7Low119 Ų119120.6 Ų120.677%0.77362%0.623SS**THydrogen-bonded Turntrans-59.6-22.1-167.8-26.435.9000114.4L330L330-P332 VanDerWaalsContact O-CD 3.26Å; L330-P332 WeakPolarHBondContact O-CD 3.38Å
333N60Low64.8Low92 Ų92118 Ų11849%0.49261%0.614SS.*THydrogen-bonded Turntrans-89.3-5.1-178.4-170.176.3000113.3D331 E337D331-N333 PolarHBondContact O-N 2.97Å; N333-E337 PolarHBondContact O-N 2.84Å
334S67.8Low65.9Low52 Ų52119.3 Ų119.336%0.36461%0.613SS.*Hα-helixtrans-71.6-32.9-175.6-170.60000113.6D331 K338D331-S334 WeakPolarHBondContact O-CB 3.26Å; D331-S334 PolarHBondContact O-N 2.98Å; S334-K338 PolarHBondContact O-N 3.5Å
335D67.9Low67Low101 Ų101118.9 Ų118.954%0.5460%0.604SS.*Hα-helixtrans-74.2-36.4176.5-121.5-86.9000111.5E337 K338 I339D335-E337 VanDerWaalsContact C-N 3.27Å; D335-E337 PolarHBondContact O-N 2.72Å; D335-K338 CarbonylContact O-C 3.59Å; D335-K338 WeakPolarHBondContact O-CB 3.5Å; D335-K338 PolarHBondContact O-N 2.79Å; D335-I339 HydrophobicContact CB-CD1 4.42Å; D335-I339 WeakPolarHBondContact O-CB 3.37Å; D335-I339 VanDerWaalsContact O-CG1 3.25Å; D335-I339 WeakPolarHBondContact O-CG1 3.42Å; D335-I339 PolarHBondContact O-N 3.02Å
336D72.5Confident67.8Low87 Ų87118.9 Ų118.947%0.46560%0.6SS.*Hα-helixtrans-58.3-36.1175.7-75.5-54.4000112.8T340D336-T340 WeakPolarHBondContact O-CB 3.25Å; D336-T340 PolarHBondContact O-N 3.49Å; D336-T340 PolarHBondContact O-OG1 3.27Å
337E69.9Low68.5Low116 Ų116116.9 Ų116.954%0.54260%0.596SS.*Hα-helixtrans-68.6-39173.5-66.6-162147.900112.6N333 D335 Q341N333-E337 PolarHBondContact O-N 2.84Å; D335-E337 VanDerWaalsContact C-N 3.27Å; D335-E337 PolarHBondContact O-N 2.72Å; E337-Q341 WeakPolarHBondContact O-CB 3.42Å; E337-Q341 VanDerWaalsContact O-CG 3.26Å; E337-Q341 WeakPolarHBondContact O-CG 3.21Å; E337-Q341 PolarHBondContact O-N 2.84Å; E337-Q341 PolarHBondContact O-NE2 2.93Å
338K69.8Low68.3Low119 Ų119114.2 Ų114.252%0.51759%0.588SS.*Hα-helixtrans-68.1-43.1175.6-69.8174-176.7167.40111.2S334 D335 Q341 L342S334-K338 PolarHBondContact O-N 3.5Å; D335-K338 CarbonylContact O-C 3.59Å; D335-K338 WeakPolarHBondContact O-CB 3.5Å; D335-K338 PolarHBondContact O-N 2.79Å; K338-Q341 PolarHBondContact O-N 2.81Å; K338-L342 WeakPolarHBondContact O-CB 3.5Å; K338-L342 WeakPolarHBondContact O-CG 3.26Å; K338-L342 PolarHBondContact O-N 2.9Å
339I72.5Confident67.7Low76 Ų76112.6 Ų112.639%0.3959%0.594SS.*Hα-helixtrans-60.2-48.1173.9-68.6164.8000109.9D335 Q341 L342 L343D335-I339 HydrophobicContact CB-CD1 4.42Å; D335-I339 WeakPolarHBondContact O-CB 3.37Å; D335-I339 VanDerWaalsContact O-CG1 3.25Å; D335-I339 WeakPolarHBondContact O-CG1 3.42Å; D335-I339 PolarHBondContact O-N 3.02Å; I339-Q341 VanDerWaalsContact C-N 3.34Å; I339-Q341 PolarHBondContact O-N 3.41Å; I339-L342 PolarHBondContact O-N 2.84Å; I339-L343 HydrophobicContact CG2-CD1 3.95Å; I339-L343 WeakPolarHBondContact O-CB 3.32Å; I339-L343 WeakPolarHBondContact O-CD1 3.45Å; I339-L343 PolarHBondContact O-N 3.38Å
340T74.8Confident67.3Low91 Ų91112.5 Ų112.556%0.55860%0.596SS**Hα-helixtrans-61.4-41177.2-61.30000111.8D336 K344D336-T340 WeakPolarHBondContact O-CB 3.25Å; D336-T340 PolarHBondContact O-N 3.49Å; D336-T340 PolarHBondContact O-OG1 3.27Å; T340-K344 WeakPolarHBondContact O-CB 3.18Å; T340-K344 PolarHBondContact O-N 3.21Å
341Q73.6Confident67.2Low131 Ų131107.7 Ų107.761%0.61259%0.587SS**Hα-helixtrans-67.2-39.2174.9-76178.57300112.8E337 K338 I339 K344 K345E337-Q341 WeakPolarHBondContact O-CB 3.42Å; E337-Q341 VanDerWaalsContact O-CG 3.26Å; E337-Q341 WeakPolarHBondContact O-CG 3.21Å; E337-Q341 PolarHBondContact O-N 2.84Å; E337-Q341 PolarHBondContact O-NE2 2.93Å; K338-Q341 PolarHBondContact O-N 2.81Å; I339-Q341 VanDerWaalsContact C-N 3.34Å; I339-Q341 PolarHBondContact O-N 3.41Å; Q341-K344 PolarHBondContact O-N 3.41Å; Q341-K345 WeakPolarHBondContact O-CB 3.21Å; Q341-K345 PolarHBondContact O-N 3.32Å
342L75.8Confident66.6Low89 Ų89106.6 Ų106.647%0.46660%0.599SS.*Hα-helixtrans-65.6-47.3174.9-79.7164.8000111.9K338 I339 K344 K345 H346K338-L342 WeakPolarHBondContact O-CB 3.5Å; K338-L342 WeakPolarHBondContact O-CG 3.26Å; K338-L342 PolarHBondContact O-N 2.9Å; I339-L342 PolarHBondContact O-N 2.84Å; L342-K344 VanDerWaalsContact C-N 3.31Å; L342-K344 PolarHBondContact O-N 3.49Å; L342-K345 PolarHBondContact O-N 2.93Å; L342-H346 WeakPolarHBondContact O-CB 3.45Å; L342-H346 PolarHBondContact O-N 3.3Å
343L74.1Confident65.4Low117 Ų117105 Ų10561%0.61361%0.605SS**Hα-helixtrans-59.1-43.1173.7-94.269.5000110.9I339 H346 K347I339-L343 HydrophobicContact CG2-CD1 3.95Å; I339-L343 WeakPolarHBondContact O-CB 3.32Å; I339-L343 WeakPolarHBondContact O-CD1 3.45Å; I339-L343 PolarHBondContact O-N 3.38Å; L343-H346 PolarHBondContact O-N 3.42Å; L343-K347 WeakPolarHBondContact O-CB 3.39Å; L343-K347 PolarHBondContact O-N 2.81Å
344K73.3Confident64.7Low161 Ų161104.1 Ų104.170%0.762%0.617SS**Hα-helixtrans-65.8-43177.6-171.6154.7-179.7171.20112.3T340 Q341 L342 K347 S348T340-K344 WeakPolarHBondContact O-CB 3.18Å; T340-K344 PolarHBondContact O-N 3.21Å; Q341-K344 PolarHBondContact O-N 3.41Å; L342-K344 VanDerWaalsContact C-N 3.31Å; L342-K344 PolarHBondContact O-N 3.49Å; K344-K347 PolarHBondContact O-N 2.82Å; K344-S348 PolarHBondContact O-N 3.26Å; K344-S348 PolarHBondContact O-OG 2.87Å; K344-S348 VanDerWaalsContact O-OG 3.12Å
345K76.5Confident63.4Low142 Ų142109.6 Ų109.662%0.61764%0.641SS**Hα-helixtrans-62.6-42.9176.2-177173.5178.9177.70111.9Q341 L342 S348 S349Q341-K345 WeakPolarHBondContact O-CB 3.21Å; Q341-K345 PolarHBondContact O-N 3.32Å; L342-K345 PolarHBondContact O-N 2.93Å; K345-S348 WeakPolarHBondContact CA-OG 3.18Å; K345-S348 PolarHBondContact O-N 2.88Å; K345-S348 PolarHBondContact O-OG 3.46Å; K345-S349 VanDerWaalsContact O-CB 3.29Å; K345-S349 WeakPolarHBondContact O-CB 3.29Å; K345-S349 PolarHBondContact O-N 3.12Å
346H68.6Low62.3Low123 Ų123111.6 Ų111.657%0.56965%0.651SS**Hα-helixtrans-72.7-33.1175.5-70.5-171.4000111.8L342 L343 S349 S350L342-H346 WeakPolarHBondContact O-CB 3.45Å; L342-H346 PolarHBondContact O-N 3.3Å; L343-H346 PolarHBondContact O-N 3.42Å; H346-S349 PolarHBondContact O-N 2.9Å; H346-S350 WeakPolarHBondContact O-CB 3.18Å; H346-S350 PolarHBondContact O-N 3.27Å
347K66.1Low60.7Low176 Ų176115.1 Ų115.177%0.76567%0.669SS**Hα-helixtrans-67.9-31.5173-167.762.6171.7178.70112.9L343 K344L343-K347 WeakPolarHBondContact O-CB 3.39Å; L343-K347 PolarHBondContact O-N 2.81Å; K344-K347 PolarHBondContact O-N 2.82Å
348S57.8Low59.4Low92 Ų92117.8 Ų117.864%0.64368%0.681SS**Hα-helixtrans-79.1-28.2169.853.20000113.8K344 K345K344-S348 PolarHBondContact O-N 3.26Å; K344-S348 PolarHBondContact O-OG 2.87Å; K344-S348 VanDerWaalsContact O-OG 3.12Å; K345-S348 WeakPolarHBondContact CA-OG 3.18Å; K345-S348 PolarHBondContact O-N 2.88Å; K345-S348 PolarHBondContact O-OG 3.46Å
349S54.7Low57.9Low101 Ų101116.5 Ų116.571%0.70669%0.693SS**Hα-helixtrans-86.6-24.8-179.8-165.70000113.7K345 H346 G351K345-S349 VanDerWaalsContact O-CB 3.29Å; K345-S349 WeakPolarHBondContact O-CB 3.29Å; K345-S349 PolarHBondContact O-N 3.12Å; H346-S349 PolarHBondContact O-N 2.9Å; S349-G351 PolarHBondContact O-N 3.24Å
350S51.7Low56.5Low111 Ų111118.1 Ų118.178%0.77671%0.711SS**SBendtrans-92.151.5177.4-163.70000110.7H346H346-S350 WeakPolarHBondContact O-CB 3.18Å; H346-S350 PolarHBondContact O-N 3.27Å
351G57.1Low55Low67 Ų67122.6 Ų122.669%0.69173%0.725SS**SBendtrans-137.28.2-167.800000116.2S349S349-G351 PolarHBondContact O-N 3.24Å
352G48.6Very low54.3Low75 Ų75121.5 Ų121.577%0.77373%0.73SS**SBendtrans-164.898.4-177.700000115.5
353G41.3Very low53.1Low87 Ų87125.5 Ų125.590%0.89775%0.746SS**  trans79.5139167.600000115.8
354G44.5Very low51.9Low72 Ų72125.5 Ų125.574%0.74276%0.756SS**  cis170.7-173.3-6.200000112.9
355L40.8Very low51.1Low168 Ų168123.1 Ų123.188%0.8876%0.759SS**  trans78.6103.8168.7-61.5171.9000119.9
356L44.1Very low50Low142 Ų142125.3 Ų125.374%0.74379%0.793SS**  70.9116.5109.3-167.1140.2000120.8
357L39Very low49Very low162 Ų162125.5 Ų125.585%0.84880%0.804SS**  trans178.2108.6138.8-94.6164.3000106.2
358H43.5Very low48.2Very low171 Ų171122.8 Ų122.879%0.79281%0.806SS**  91.585.156.6-160.5-62.5000114.5
359A38.2Very low47.6Very low92 Ų92124.5 Ų124.576%0.7682%0.815SS**  trans-163.5150.215800000107.1
360S42.8Very low47.2Very low111 Ų111125.9 Ų125.978%0.77682%0.821SS**  cis-177.3142-18.5-88.20000103.5
361E43.7Very low46.9Very low184 Ų184126.8 Ų126.886%0.8682%0.824SS**  trans-64.7168.1173.4-90.4-161.6137.400112.5
362P58.3Low46.2Very low109 Ų109130.8 Ų130.871%0.70883%0.833SS**  cis-151.7-176.537.744.8-23.8000119.6
363E50.7Low46.1Very low173 Ų173134.8 Ų134.881%0.80884%0.837SS**  trans48.4118142.9-72.9-91.487.300120
364S49Very low46.4Very low116 Ų116138.5 Ų138.581%0.81183%0.833SS**  -174.2164.4100.5-163.80000111.9
365S57.2Low46.6Very low111 Ų111144 Ų14478%0.77684%0.84SS**  trans-78159.7-179.7-43.30000114.1
366S52Low47.1Very low189 Ų189141.8 Ų141.8100%1.32284%0.837SS**  -156.80115.1-170.80000111.7

Retrieved 366 of 366 residues in 52 ms (Link to these results)