A0A060XKJ3_ONCMY Loading...

Orthopedia homeobox a

AlphaFold DB , UniProt , Accession A0A060XKJ3, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110509671, Length 334 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M47.8Very low47.8Very low246 Ų246141.2 Ų141.2100%1.21275%0.754SS**  088.90-69.8-179.8141.500107.2
2L45.3Very low47.5Very low164 Ų164142.6 Ų142.686%0.85976%0.76SS**  trans-82.9135.3173.8-79.3113.2000108.4
3S48Very low47Very low84 Ų84136.6 Ų136.659%0.58775%0.753SS**  trans-66.4144.1-172.1-177.30000111.6A5 D6S3-A5 PolarHBondContact O-N 3.02Å; S3-D6 PolarHBondContact O-N 3.42Å; S3-D6 VanDerWaalsContact O-N 3.15Å
4H50.8Low47Very low163 Ų163139.6 Ų139.676%0.75576%0.759SS**THydrogen-bonded Turntrans-56.8-8.2176.5-173.3-105.2000114
5A54.1Low46.8Very low70 Ų70142 Ų14258%0.57977%0.77SS**THydrogen-bonded Turntrans-77.8-28.717600000114.1S3 L7S3-A5 PolarHBondContact O-N 3.02Å; A5-L7 VanDerWaalsContact C-N 3.32Å; A5-L7 PolarHBondContact O-N 3.47Å
6D47.4Very low46.5Very low117 Ų117140.4 Ų140.463%0.62677%0.772SS**THydrogen-bonded Turntrans-78.2-13.2-177-92.8-73.5000113.9S3S3-D6 PolarHBondContact O-N 3.42Å; S3-D6 VanDerWaalsContact O-N 3.15Å
7L49.9Very low46.5Very low141 Ų141136.6 Ų136.674%0.73876%0.759SS**THydrogen-bonded Turntrans-85.9-11179.6-154.180.5000113.3A5A5-L7 VanDerWaalsContact C-N 3.32Å; A5-L7 PolarHBondContact O-N 3.47Å
8L49.1Very low46.5Very low120 Ų120136 Ų13663%0.62876%0.762SS**SBendtrans-93.7-18.1-179.5-67177.3000113.3
9D42.9Very low46.4Very low137 Ų137133.8 Ų133.873%0.73375%0.748SS**G310 helixtrans-78.2-23.5177.5-153.963.8000112.5R11D9-R11 PolarHBondContact O-N 3.29Å
10A45.3Very low46.6Very low91 Ų91131.5 Ų131.575%0.75274%0.741SS**G310 helixtrans-76.2-0.217600000114.7
11R44.8Very low46.6Very low220 Ų220127.6 Ų127.683%0.8373%0.73SS**G310 helixtrans-110.41.8-175.8-156.177.3179.1-152.30.5114.3D9D9-R11 PolarHBondContact O-N 3.29Å
12L44.6Very low46.8Very low158 Ų158121.3 Ų121.383%0.82770%0.701SS**SBendtrans-115.412.4179.4-69.2178.5000114.6
13G41.5Very low47.2Very low65 Ų65118.7 Ų118.767%0.6768%0.684SS**SBendtrans-89.7-8.4-178.800000117.3
14E46.1Very low47.2Very low179 Ų179119.5 Ų119.584%0.83668%0.682SS**SBendtrans-125.546.8-164.8-88.5-70.6138.700114.3
15L44.5Very low47.3Very low175 Ų175119.8 Ų119.892%0.91668%0.677SS**  trans-147.453.2163.3-78.6-179.8000112.3
16S41.9Very low47.2Very low116 Ų116120.6 Ų120.681%0.81167%0.665SS**  trans-120.566.3159.7-162.50000109.9
17S46.1Very low47.7Very low77 Ų77121.2 Ų121.254%0.53867%0.666SS.*  trans-71.8126.6164.3-165.50000107.9N19 S20S17-N19 PolarHBondContact O-N 3.1Å; S17-S20 PolarHBondContact O-N 3.28Å
18P46.7Very low47.9Very low125 Ų125121.4 Ų121.481%0.81266%0.661SS**THydrogen-bonded Turntrans-67.813-177.926.8-34000114.2
19N45.3Very low48Very low94 Ų94121 Ų12150%0.50366%0.659SS.*THydrogen-bonded Turntrans-104.4-8.3-173.7-144.4-22.8000113.6S17 Q23S17-N19 PolarHBondContact O-N 3.1Å; N19-Q23 PolarHBondContact O-N 3.03Å
20S50.6Low48.6Very low87 Ų87116.7 Ų116.761%0.60864%0.643SS**Hα-helixtrans-73.9-34.6-177.555.90000113.3S17 Q23 L24S17-S20 PolarHBondContact O-N 3.28Å; S20-Q23 PolarHBondContact O-N 3.33Å; S20-L24 PolarHBondContact O-N 2.95Å; S20-L24 VanDerWaalsContact O-N 3.16Å
21G46.4Very low49Very low50 Ų50115.1 Ų115.152%0.51563%0.63SS.*Hα-helixtrans-66.5-38.5178.700000113.6L24 Y25G21-L24 PolarHBondContact O-N 3.26Å; G21-Y25 PolarHBondContact O-N 3.47Å
22L51Low49.5Very low115 Ų115107.6 Ų107.660%0.60262%0.615SS**Hα-helixtrans-74.8-27.5178-68.1175.1000112.5W26L22-W26 PolarHBondContact O-N 2.86Å
23Q53.6Low49.8Very low108 Ų108106.4 Ų106.451%0.50561%0.605SS.*Hα-helixtrans-72.8-34.1174.8-164.6141.22.300112N19 S20 W26 M27N19-Q23 PolarHBondContact O-N 3.03Å; S20-Q23 PolarHBondContact O-N 3.33Å; Q23-W26 PolarHBondContact O-N 2.89Å; Q23-M27 PolarHBondContact O-N 3.2Å; Q23-M27 VanDerWaalsContact O-N 3.12Å
24L49.1Very low50.4Low102 Ų102110.1 Ų110.153%0.53461%0.609SS.*Hα-helixtrans-71.5-38174.9-168.165.6000112.3S20 G21 W26 M27 K28S20-L24 PolarHBondContact O-N 2.95Å; S20-L24 VanDerWaalsContact O-N 3.16Å; G21-L24 PolarHBondContact O-N 3.26Å; L24-W26 VanDerWaalsContact C-N 3.3Å; L24-W26 PolarHBondContact O-N 3.45Å; L24-M27 PolarHBondContact O-N 3.35Å; L24-K28 WeakPolarHBondContact O-CG 3.49Å; L24-K28 PolarHBondContact O-N 3Å; L24-K28 VanDerWaalsContact O-N 3.08Å
25Y52.7Low50.6Low169 Ų169108.1 Ų108.166%0.66360%0.603SS**Hα-helixtrans-64.1-37.1174.3-163-103.1000111.7G21 K28 D29G21-Y25 PolarHBondContact O-N 3.47Å; Y25-K28 PolarHBondContact O-N 3.31Å; Y25-D29 PolarHBondContact O-N 2.88Å; Y25-D29 VanDerWaalsContact O-N 3.11Å
26W51.3Low50.7Low86 Ų86101.9 Ų101.933%0.32658%0.581SS.*Hα-helixtrans-68.1-34.5174.1-114.274.2000114.4L22 Q23 L24 A30 Y138 W169 K170L22-W26 PolarHBondContact O-N 2.86Å; Q23-W26 PolarHBondContact O-N 2.89Å; L24-W26 VanDerWaalsContact C-N 3.3Å; L24-W26 PolarHBondContact O-N 3.45Å; W26-A30 VanDerWaalsContact O-CB 3.25Å; W26-A30 WeakPolarHBondContact O-CB 3.42Å; W26-A30 PolarHBondContact O-N 3.42Å; W26-A30 VanDerWaalsContact O-N 3.09Å; W26-Y138 VanDerWaalsContact CZ2-OH 3.32Å; W26-Y138 WeakPolarHBondContact CZ2-OH 3.41Å; W26-Y138 AromaticContact NE1-CE2 3.63Å; W26-Y138 AromaticContact NE1-CZ 3.77Å; W26-Y138 PolarHBondContact NE1-OH 3.26Å; W26-Y138 VanDerWaalsContact NE1-OH 3.1Å; W26-W169 AromaticContact CH2-CZ3 3.93Å; W26-W169 HydrophobicContact CH2-CZ3 3.93Å; W26-W169 HydrophobicContact CZ2-CE3 4.44Å; W26-W169 AromaticContact CZ2-CZ3 3.8Å; W26-W169 HydrophobicContact CZ2-CZ3 3.8Å; W26-W169 HydrophobicContact CZ3-CZ3 4.41Å; W26-K170 HydrophobicContact CH2-CB 4.43Å; W26-K170 HydrophobicContact CH2-CD 3.83Å; W26-K170 HydrophobicContact CH2-CG 4.13Å; W26-K170 HydrophobicContact CZ3-CD 4.25Å; W26-K170 HydrophobicContact CZ3-CG 4.48Å
27M59.3Low50.8Low131 Ų131102.1 Ų102.165%0.64557%0.569SS**Hα-helixtrans-71.8-35.2174.7-76.7170.984.700111.8Q23 L24 A31Q23-M27 PolarHBondContact O-N 3.2Å; Q23-M27 VanDerWaalsContact O-N 3.12Å; L24-M27 PolarHBondContact O-N 3.35Å; M27-A31 WeakPolarHBondContact O-CB 3.4Å; M27-A31 PolarHBondContact O-N 3.05Å
28K52.6Low50.8Low145 Ų145108 Ų10863%0.6358%0.58SS**Hα-helixtrans-68.2-40.5177.1-72.1-179.1173.3-157.20112.3L24 Y25 A31 A32L24-K28 WeakPolarHBondContact O-CG 3.49Å; L24-K28 PolarHBondContact O-N 3Å; L24-K28 VanDerWaalsContact O-N 3.08Å; Y25-K28 PolarHBondContact O-N 3.31Å; K28-A31 PolarHBondContact O-N 3.2Å; K28-A32 PolarHBondContact O-N 2.7Å; K28-A32 VanDerWaalsContact O-N 3.16Å
29D51.9Low50.6Low110 Ų110108.9 Ų108.959%0.58857%0.573SS**Hα-helixtrans-72.7-37.5178-155.162000112.2Y25 A31 A32 E33Y25-D29 PolarHBondContact O-N 2.88Å; Y25-D29 VanDerWaalsContact O-N 3.11Å; D29-A31 VanDerWaalsContact C-N 3.33Å; D29-A31 PolarHBondContact O-N 2.87Å; D29-A32 PolarHBondContact O-N 3.38Å; D29-E33 PolarHBondContact O-N 3.11Å
30A56.3Low50.6Low48 Ų48107.8 Ų107.840%0.39758%0.577SS.*Hα-helixtrans-66.5-30.8172.900000113.5W26 L34W26-A30 VanDerWaalsContact O-CB 3.25Å; W26-A30 WeakPolarHBondContact O-CB 3.42Å; W26-A30 PolarHBondContact O-N 3.42Å; W26-A30 VanDerWaalsContact O-N 3.09Å; A30-L34 PolarHBondContact O-N 3.18Å
31A52.3Low50.3Low58 Ų58111 Ų11148%0.47959%0.586SS.*Hα-helixtrans-73-35.417400000112.2M27 K28 D29 E33 L34 L35M27-A31 WeakPolarHBondContact O-CB 3.4Å; M27-A31 PolarHBondContact O-N 3.05Å; K28-A31 PolarHBondContact O-N 3.2Å; D29-A31 VanDerWaalsContact C-N 3.33Å; D29-A31 PolarHBondContact O-N 2.87Å; A31-E33 VanDerWaalsContact C-N 3.34Å; A31-L34 PolarHBondContact O-N 2.98Å; A31-L35 PolarHBondContact O-N 2.95Å
32A54.7Low50.1Low61 Ų61117.4 Ų117.450%0.50460%0.6SS.*Hα-helixtrans-64.5-37.1174.300000112.1K28 D29 L35 G36K28-A32 PolarHBondContact O-N 2.7Å; K28-A32 VanDerWaalsContact O-N 3.16Å; D29-A32 PolarHBondContact O-N 3.38Å; A32-L35 PolarHBondContact O-N 3.32Å; A32-G36 PolarHBondContact O-N 3.47Å
33E52.2Low49.7Very low134 Ų134117.8 Ų117.863%0.62661%0.611SS**Hα-helixtrans-69.7-32.2176.2-125-161.8159.900113.2D29 A31 L35 G36 H37D29-E33 PolarHBondContact O-N 3.11Å; A31-E33 VanDerWaalsContact C-N 3.34Å; E33-L35 VanDerWaalsContact C-N 3.32Å; E33-G36 PolarHBondContact O-N 3.45Å; E33-H37 PolarHBondContact O-N 2.95Å
34L53.8Low49.3Very low143 Ų143123.6 Ų123.675%0.74963%0.628SS**Hα-helixtrans-71-26.9173.7-89.9170.1000113A30 A31A30-L34 PolarHBondContact O-N 3.18Å; A31-L34 PolarHBondContact O-N 2.98Å
35L50.5Low49.2Very low137 Ų137127.3 Ų127.372%0.71765%0.648SS**Hα-helixtrans-81.2-31.7173.6-163.862.8000112.1A31 A32 E33A31-L35 PolarHBondContact O-N 2.95Å; A32-L35 PolarHBondContact O-N 3.32Å; E33-L35 VanDerWaalsContact C-N 3.32Å
36G46.9Very low48.5Very low44 Ų44123.1 Ų123.145%0.45466%0.656SS.*Hα-helixtrans-75.2-19.7175.800000115.2A32 E33 R38 E39A32-G36 PolarHBondContact O-N 3.47Å; E33-G36 PolarHBondContact O-N 3.45Å; G36-R38 VanDerWaalsContact C-N 3.28Å; G36-R38 PolarHBondContact O-N 3.5Å; G36-E39 PolarHBondContact O-N 3.41Å
37H44Very low47.9Very low120 Ų120122.8 Ų122.856%0.55668%0.679SS**THydrogen-bonded Turntrans-74.8-8.9-177-114.5-85.2000115.2E33E33-H37 PolarHBondContact O-N 2.95Å
38R45.5Very low47.1Very low201 Ų201120.3 Ų120.376%0.75869%0.688SS**THydrogen-bonded Turntrans-78.8-27.3173.4-95.3178.165.7-158.4-0.7113.6G36G36-R38 VanDerWaalsContact C-N 3.28Å; G36-R38 PolarHBondContact O-N 3.5Å
39E43.3Very low46.6Very low144 Ų144120.3 Ų120.367%0.67370%0.699SS**THydrogen-bonded Turntrans-88.2-22.8-177.7-62.2-62117.500112.4G36 L41 K42G36-E39 PolarHBondContact O-N 3.41Å; E39-L41 PolarHBondContact O-N 3.45Å; E39-K42 PolarHBondContact O-N 2.95Å
40A44.3Very low46Very low71 Ų71118.1 Ų118.159%0.58770%0.702SS**THydrogen-bonded Turntrans-74.4-7.4-177.100000114.8
41L44.1Very low45.1Very low153 Ų153121.8 Ų121.880%0.80173%0.725SS**THydrogen-bonded Turntrans-88-1.6176.1-67.8176.4000113.7E39E39-L41 PolarHBondContact O-N 3.45Å
42K42.7Very low44.6Very low186 Ų186126 Ų12681%0.80974%0.739SS**SBendtrans-104.55.5-177.4-164.5147.1177.2178.60115.9E39E39-K42 PolarHBondContact O-N 2.95Å
43C42.1Very low44.1Very low123 Ų123129.4 Ų129.483%0.83176%0.756SS**SBendtrans-107.119.4177.2-62.50000114.4
44R46.4Very low43.2Very low230 Ų230125.6 Ų125.687%0.86875%0.753SS**SBendtrans-120.327.4-177.1-142.7176.4-153.3-120.60.5115.9
45L47.5Very low42.6Very low179 Ų179127.6 Ų127.694%0.93776%0.759SS**  trans-145128.6162.8-89.3112.1000110.6
46G37.2Very low42.1Very low82 Ų82127 Ų12785%0.84577%0.766SS**  trans11595-179.400000109.6
47G38.2Very low41.6Very low79 Ų79128.3 Ų128.381%0.81478%0.779SS**  cis107.491.540.600000106.3
48G42.9Very low41Very low79 Ų79130.7 Ų130.781%0.81479%0.79SS**  trans-75.9139.9177.900000111.5
49V41.3Very low40.8Very low145 Ų145128.2 Ų128.288%0.87979%0.792SS**  trans-147126.5157.7-1750000106.2
50G40.8Very low40.6Very low63 Ų63125.7 Ų125.765%0.64980%0.795SS**  trans-77.3169.5177.700000112.9
51S37.2Very low41.1Very low125 Ų125128.4 Ų128.487%0.87481%0.807SS**  trans-177139.8133.7-77.20000109.8
52D41.2Very low40.8Very low146 Ų146124.6 Ų124.678%0.78181%0.805SS**  trans-39.8159.5165.6-140.5-97.2000114.8G54D52-G54 PolarHBondContact OD1-N 3.25Å; D52-G54 VanDerWaalsContact OD1-N 3.15Å
53P44.8Very low41.8Very low133 Ų133121.4 Ų121.486%0.86480%0.803SS**  trans-134.6110.6136.733.3-18.1000112.4
54G33.3Very low41.4Very low54 Ų54121.9 Ų121.956%0.55780%0.797SS**  trans-106.3138.7158.700000112.1D52D52-G54 PolarHBondContact OD1-N 3.25Å; D52-G54 VanDerWaalsContact OD1-N 3.15Å
55H41.4Very low41.1Very low186 Ų186116.6 Ų116.686%0.86179%0.79SS**  trans81.3120.6148.8-95.773.1000122.2
56S38.6Very low40.8Very low124 Ų124113.5 Ų113.587%0.86778%0.779SS**  -165.7110.5119.1-70.70000106.7
57G37.7Very low41.1Very low71 Ų71118.7 Ų118.773%0.73278%0.781SS**  84.5135.192.200000109.1
58E31.1Very low41.2Very low170 Ų170118.6 Ų118.679%0.79478%0.78SS**  cis169.5126.831.9-150.5-168.271.200102.4
59L40.2Very low41.1Very low150 Ų150119.4 Ų119.479%0.78578%0.779SS**  158142.388.6-80.1168.6000107.7
60A39.7Very low41Very low90 Ų90118.9 Ų118.974%0.74478%0.776SS**  trans-111.4166.915600000107.1
61P54.5Low41Very low129 Ų129124.2 Ų124.284%0.83879%0.786SS**  cis-144.9-17644.431.2-4.7000115.9
62G37.8Very low41.3Very low73 Ų73126 Ų12675%0.75379%0.785SS**  trans-69.1-151.5-17400000116.8
63P64.6Low42Very low119 Ų119124.9 Ų124.977%0.77379%0.786SS**  cis-134.4-160.92.832.2-6.3000114.1
64D33.7Very low41.8Very low133 Ų133121.4 Ų121.471%0.71177%0.774SS**  trans103106.8157.7-75.1-69.1000122.1
65T38.6Very low42.2Very low118 Ų118126.2 Ų126.272%0.72479%0.787SS**  71.8142.6111.4-530000121.8
66V43.2Very low42.2Very low115 Ų115124 Ų12470%0.69778%0.782SS**  trans88.2108.4156.462.60000121.7
67E43.1Very low42.7Very low191 Ų191125.9 Ų125.989%0.89378%0.78SS**  trans30.8144.6130.5-47.3-177.714800120.2
68G40.6Very low42.7Very low77 Ų77129.4 Ų129.479%0.79478%0.782SS**  cis-177.4-175.210.800000105.2
69A39.6Very low43.1Very low95 Ų95128.6 Ų128.679%0.78578%0.784SS**  cis-168.7148.34.800000106.3
70T40Very low42.8Very low134 Ų134124.5 Ų124.582%0.82278%0.778SS**  trans171.4105.1134-830000111.3
71M40.7Very low42.5Very low176 Ų176123.8 Ų123.887%0.86778%0.779SS**  trans55.9113.8137.7-52.4-62.5-160.700121.7
72L42.1Very low41.7Very low163 Ų163123.4 Ų123.485%0.85378%0.779SS**  trans-84.9-164.6149.9-55170.2000109.5
73P57.4Low42Very low122 Ų122127.4 Ų127.479%0.79278%0.783SS**  cis-142178.4-11.227.7-2.9000116.6
74G39.7Very low41.4Very low60 Ų60127.8 Ų127.862%0.61979%0.786SS**  trans91.6147.7141.400000117.9
75D41.8Very low41.7Very low155 Ų155127.4 Ų127.483%0.82979%0.793SS**  cis-165.4174.45.5-80.2-55.1000110.4
76D41.2Very low41.5Very low140 Ų140125 Ų12575%0.74979%0.792SS**  trans-56171.1-168-57-94.3000122.3
77I48.5Very low41.4Very low162 Ų162128.4 Ų128.483%0.83180%0.802SS**  170.1109.2128.8-82.5157.3000107.5
78N38.9Very low41.1Very low145 Ų145128 Ų12878%0.77580%0.8SS**  73136.872.6-164.323.2000116.4
79N40.1Very low41Very low154 Ų154131.4 Ų131.482%0.82481%0.806SS**  trans92.5131.2154-145.434.1000116.8
80G32.1Very low40.8Very low64 Ų64133.6 Ų133.666%0.6680%0.804SS**  cis174.2143.15.900000107.5
81G35.1Very low41Very low74 Ų74132.5 Ų132.576%0.76380%0.802SS**  trans-77.9170.1-179.400000113.8
82S37.7Very low40.8Very low122 Ų122133.3 Ų133.385%0.85380%0.801SS**  trans-173.6123.1147-78.40000110.9
83N43.8Very low40.4Very low157 Ų157133 Ų13384%0.8480%0.795SS**  trans-66.8162.4155.1-88.4-18000110.1
84P51.1Low39.7Very low127 Ų127134.1 Ų134.183%0.82579%0.79SS**  -138.9157.1117.833.7-19.4000114.8
85S40.3Very low39.7Very low124 Ų124139.4 Ų139.487%0.86780%0.798SS**  trans-79.6152.9173.7-55.90000113.1
86G33.9Very low39.6Very low67 Ų67139.4 Ų139.469%0.69180%0.798SS**  trans127.6132.3137.800000119.5
87M41.4Very low39.8Very low187 Ų187141.8 Ų141.892%0.92180%0.802SS**  trans86.796.7157.3-52.6164.6106.700116.5
88Q37.7Very low39.4Very low182 Ų182142.5 Ų142.585%0.8580%0.802SS**  68.3107.674.5-167.2178.753.400114.3
89V38.8Very low39.3Very low149 Ų149143.6 Ų143.690%0.90380%0.802SS**  -161140.5125.7-166.40000110.6
90N35.2Very low39.4Very low142 Ų142144.7 Ų144.776%0.75980%0.802SS**  trans-70.3148.3-174.1-166.329.3000116
91S43Very low39.7Very low111 Ų111148.3 Ų148.378%0.77681%0.807SS**  trans-171.5107.2142.3-820000112.5
92K37.6Very low39.8Very low192 Ų192151.1 Ų151.184%0.83580%0.804SS**  trans39.3141.8143.7-65.3172.1174173.10120
93E33.8Very low39.9Very low157 Ų157149.4 Ų149.473%0.73479%0.792SS**  cis177.4149.5-12.4171.8147.364.600105.4
94Q42.3Very low39.7Very low146 Ų146147.1 Ų147.168%0.68279%0.788SS**  trans85.9104159-82.315732.300122.7
95Q40.1Very low39.3Very low171 Ų171150 Ų15080%0.79979%0.791SS**  54.9127.7124.8-67.7167.53.700118.7
96D40.1Very low39.5Very low155 Ų155149.7 Ų149.783%0.82979%0.789SS**  cis-155.6148.138-126.9-44.2000112.5
97K44.9Very low39.6Very low189 Ų189149.1 Ų149.182%0.82278%0.783SS**  trans-118.1131.9176.3-97.8-170.8176.1-165.20109
98Q39.4Very low39.9Very low177 Ų177144.7 Ų144.783%0.82779%0.785SS**  trans173.8135.1138.7-101.1162.821.400108.3
99Q38.2Very low40.1Very low168 Ų168141 Ų14179%0.78578%0.78SS**  cis-167.1141.313.7-159.4149.617.800108.9
100Q41.5Very low40.8Very low178 Ų178143.1 Ų143.183%0.83278%0.78SS**  trans-113.5160.7162.1-97.9-175.2-3.600108.9
101N38.3Very low41.6Very low140 Ų140141.7 Ų141.775%0.74978%0.781SS**  trans86.8138.3175.4-72.3-7.3000116.1
102N37.6Very low42.4Very low132 Ų132144.9 Ų144.971%0.70678%0.784SS**  cis-164.715514.7-134-2.5000111.9
103S38.4Very low43.6Very low87 Ų87145.6 Ų145.661%0.60879%0.787SS**  trans42.3118141.965.20000122.8
104S41.2Very low45.3Very low108 Ų108146.9 Ų146.976%0.75579%0.793SS**  trans43.9107.713452.40000120.4
105Q42.1Very low47Very low188 Ų188149.1 Ų149.188%0.87980%0.8SS**  trans-148.2128147.3-160.697.226.300109.8G107Q105-G107 PolarHBondContact O-N 2.93Å
106S43.8Very low48.9Very low117 Ų117152.3 Ų152.382%0.81881%0.805SS**  trans-58.7127.1168.762.20000110.9
107G35.9Very low50.9Low56 Ų56153.4 Ų153.458%0.57781%0.805SS**  trans-161.5100.7171.200000109.4Q105 S109Q105-G107 PolarHBondContact O-N 2.93Å; G107-S109 PolarHBondContact O-N 3.42Å; G107-S109 PolarHBondContact O-OG 2.87Å
108G47.8Very low53.1Low94 Ų94155.4 Ų155.497%0.96981%0.807SS**  trans-52.3102.3177.900000110.8
109S43.3Very low55.6Low105 Ų105149.2 Ų149.273%0.73478%0.782SS**  trans-118.8108.4175.4260000106.2G107 S111G107-S109 PolarHBondContact O-N 3.42Å; G107-S109 PolarHBondContact O-OG 2.87Å; S109-S111 PolarHBondContact O-N 2.96Å
110Q52Low58.4Low192 Ų192152.1 Ų152.190%0.89779%0.785SS**  trans-49.4111.5175.5-64.2-158.7-27.100108.8Q112Q110-Q112 PolarHBondContact O-N 3.39Å
111S53.3Low61Low112 Ų112146.7 Ų146.778%0.78376%0.759SS**  trans-67.587.4175.150.10000107.9S109 K113S109-S111 PolarHBondContact O-N 2.96Å; S111-K113 PolarHBondContact O-N 2.84Å
112Q60Low63.9Low179 Ų179143.2 Ų143.284%0.83674%0.743SS**  trans-51.5110.7165.6-74.3-151.4-2.900106.9Q110 Q114Q110-Q112 PolarHBondContact O-N 3.39Å; Q112-Q114 VanDerWaalsContact C-N 3.33Å; Q112-Q114 PolarHBondContact O-N 3.33Å
113K61.5Low66.7Low207 Ų207141.8 Ų141.890%0.974%0.741SS**  trans-51.296.2179.5-81.7168175.2167.70108.9S111 K115S111-K113 PolarHBondContact O-N 2.84Å; K113-K115 PolarHBondContact O-N 3.06Å
114Q69.9Low69.6Low183 Ų183141 Ų14186%0.85574%0.74SS**  trans-59.8114.6173.9-81.6-174.5-10.700107.8Q112 R116Q112-Q114 VanDerWaalsContact C-N 3.33Å; Q112-Q114 PolarHBondContact O-N 3.33Å; Q114-R116 PolarHBondContact O-N 3.46Å
115K77.8Confident72.3Confident194 Ų194137.3 Ų137.384%0.84371%0.711SS**PPolyproline II helixtrans-61.6123.1177-171.5172.3-178.3175.40107.9K113 H117K113-K115 PolarHBondContact O-N 3.06Å; K115-H117 PolarHBondContact O-N 3.08Å
116R79.1Confident75Confident238 Ų238131.1 Ų131.190%0.89868%0.683SS**PPolyproline II helixtrans-52.9128.2179.8-65.7-179.2-179.6-177.8-1.1109.8Q114 R118Q114-R116 PolarHBondContact O-N 3.46Å; R116-R118 PolarHBondContact O-N 2.97Å
117H83.8Confident77.6Confident178 Ų178130.4 Ų130.482%0.82467%0.67SS**PPolyproline II helixtrans-60.8124.8176.9-73.285000109.9K115K115-H117 PolarHBondContact O-N 3.08Å
118R90.8Very high80.5Confident230 Ų230129.4 Ų129.487%0.86865%0.65SS**PPolyproline II helixtrans-88.2130.1179.2-174.9177.7-179.3-179.31.7109.5R116 R120R116-R118 PolarHBondContact O-N 2.97Å; R118-R120 PolarHBondContact O-N 3.42Å
119T92.1Very high83Confident48 Ų48124.9 Ų124.929%0.29460%0.604SS.*PPolyproline II helixtrans-67.6127.9173.4-46.30000110.4F121 L153 R157T119-F121 HydrophobicContact CG2-CD1 4.31Å; T119-F121 HydrophobicContact CG2-CE1 3.99Å; T119-L153 HydrophobicContact CG2-CD2 4.13Å; T119-R157 WeakPolarHBondContact OG1-CD 3.47Å; T119-R157 PolarHBondContact OG1-NH1 3.4Å
120R95.5Very high85.6Confident228 Ų228123.6 Ų123.686%0.8659%0.587SS**PPolyproline II helixtrans-100.9126.9166.6-69.3177.267.4-1561.4107.8R118R118-R120 PolarHBondContact O-N 3.42Å
121F97.3Very high87.8Confident65 Ų65121.8 Ų121.829%0.28557%0.572SS.*PPolyproline II helixtrans-85.5139.3178-55.8-67000110.2T119 L126 L153 R157 W161T119-F121 HydrophobicContact CG2-CD1 4.31Å; T119-F121 HydrophobicContact CG2-CE1 3.99Å; F121-L126 HydrophobicContact CB-CD1 4.46Å; F121-L126 HydrophobicContact CB-CD2 3.71Å; F121-L126 HydrophobicContact CB-CG 3.83Å; F121-L126 HydrophobicContact CD2-CD2 4.14Å; F121-L126 HydrophobicContact CG-CD2 4.14Å; F121-L153 HydrophobicContact CD1-CD1 3.63Å; F121-L153 HydrophobicContact CD1-CD2 4.37Å; F121-L153 HydrophobicContact CE1-CD1 3.59Å; F121-L153 HydrophobicContact CE1-CD2 4.36Å; F121-R157 HydrophobicContact CE1-CB 4.48Å; F121-W161 AromaticContact CD2-CD1 3.89Å; F121-W161 AromaticContact CE2-CD1 3.61Å; F121-W161 HydrophobicContact CE2-CG 4.49Å; F121-W161 HydrophobicContact CZ-CB 4.32Å
122T98.3Very high89.9Confident67 Ų67117.1 Ų117.141%0.41154%0.539SS..PPolyproline II helixtrans-74.7158.8170.872.30000110.3A124 Q125 L126T122-A124 VanDerWaalsContact C-N 3.27Å; T122-A124 PolarHBondContact O-N 3.17Å; T122-Q125 PolarHBondContact O-N 3.2Å; T122-Q125 VanDerWaalsContact OG1-CG 3.24Å; T122-Q125 WeakPolarHBondContact OG1-CG 3.48Å; T122-Q125 PolarHBondContact OG1-N 2.89Å; T122-L126 WeakPolarHBondContact O-CG 3.22Å; T122-L126 PolarHBondContact O-N 3.28Å
123P97.9Very high91.7Very high102 Ų102109.1 Ų109.166%0.66250%0.501SS*.Hα-helixtrans-56.7-40176.3-26.435.5000113.2Q125 L126 N127P123-Q125 PolarHBondContact O-N 2.99Å; P123-L126 PolarHBondContact O-N 3.28Å; P123-N127 VanDerWaalsContact O-CG 3.31Å; P123-N127 PolarHBondContact O-N 2.83Å
124A97.9Very high93.4Very high71 Ų71103.3 Ų103.359%0.58749%0.492SS*.Hα-helixtrans-62.3-42.4177.400000112.4T122 N127 E128T122-A124 VanDerWaalsContact C-N 3.27Å; T122-A124 PolarHBondContact O-N 3.17Å; A124-N127 PolarHBondContact O-N 3.24Å; A124-E128 PolarHBondContact O-N 3.2Å
125Q98.3Very high94.7Very high30 Ų30102.7 Ų102.714%0.1449%0.486CS..Hα-helixtrans-62.9-43175.3-68.7172.2-25.600111.4T122 P123 E128 L129 I151T122-Q125 PolarHBondContact O-N 3.2Å; T122-Q125 VanDerWaalsContact OG1-CG 3.24Å; T122-Q125 WeakPolarHBondContact OG1-CG 3.48Å; T122-Q125 PolarHBondContact OG1-N 2.89Å; P123-Q125 PolarHBondContact O-N 2.99Å; Q125-E128 PolarHBondContact O-N 3.36Å; Q125-L129 WeakPolarHBondContact O-CB 3.24Å; Q125-L129 WeakPolarHBondContact O-CD1 3.23Å; Q125-L129 WeakPolarHBondContact O-CG 3.46Å; Q125-L129 PolarHBondContact O-N 3.33Å; Q125-I151 HydrophobicContact CG-CB 4.14Å; Q125-I151 PolarHBondContact NE2-O 3.35Å
126L98.4Very high95.6Very high58 Ų5895.3 Ų95.330%0.30446%0.458SS..Hα-helixtrans-62.1-42.2177.1-68.7175000111.9F121 T122 P123 E128 L129 E130 W161F121-L126 HydrophobicContact CB-CD1 4.46Å; F121-L126 HydrophobicContact CB-CD2 3.71Å; F121-L126 HydrophobicContact CB-CG 3.83Å; F121-L126 HydrophobicContact CD2-CD2 4.14Å; F121-L126 HydrophobicContact CG-CD2 4.14Å; T122-L126 WeakPolarHBondContact O-CG 3.22Å; T122-L126 PolarHBondContact O-N 3.28Å; P123-L126 PolarHBondContact O-N 3.28Å; L126-E128 PolarHBondContact O-N 3.4Å; L126-L129 PolarHBondContact O-N 3.01Å; L126-E130 WeakPolarHBondContact O-CB 3.42Å; L126-E130 WeakPolarHBondContact O-CG 3.19Å; L126-E130 PolarHBondContact O-N 2.89Å; L126-W161 VanDerWaalsContact CD2-NE1 3.34Å
127N98.1Very high96.4Very high102 Ų10286.6 Ų86.655%0.54543%0.427SS..Hα-helixtrans-60.1-44.9178.5-73.6-15000111.9P123 A124 E130 R131P123-N127 VanDerWaalsContact O-CG 3.31Å; P123-N127 PolarHBondContact O-N 2.83Å; A124-N127 PolarHBondContact O-N 3.24Å; N127-E130 PolarHBondContact O-N 3.45Å; N127-R131 VanDerWaalsContact O-CB 3.31Å; N127-R131 WeakPolarHBondContact O-CB 3.33Å; N127-R131 PolarHBondContact O-N 3.13Å
128E98.3Very high97.1Very high34 Ų3483.9 Ų83.916%0.15941%0.41CS..Hα-helixtrans-70-38179.4-171.658.2-158.100111.8A124 Q125 L126 R131 S132 L147 R150 I151A124-E128 PolarHBondContact O-N 3.2Å; Q125-E128 PolarHBondContact O-N 3.36Å; L126-E128 PolarHBondContact O-N 3.4Å; E128-R131 PolarHBondContact O-N 3.01Å; E128-R131 IonicContact OE2-CZ 3.68Å; E128-R131 IonicContact OE2-NE 3.96Å; E128-R131 IonicContact OE2-NH1 2.86Å; E128-R131 PolarHBondContact OE2-NH1 3.21Å; E128-S132 WeakPolarHBondContact O-CB 3.23Å; E128-S132 PolarHBondContact O-N 3.15Å; E128-L147 HydrophobicContact CG-CD1 3.79Å; E128-R150 IonicContact OE1-CZ 2.75Å; E128-R150 IonicContact OE1-NH1 3.94Å; E128-R150 PolarHBondContact OE1-NH1 2.95Å; E128-I151 HydrophobicContact CB-CG2 3.85Å; E128-I151 HydrophobicContact CG-CG2 3.67Å
129L98.4Very high97.4Very high0 Ų073.2 Ų73.20%037%0.371CS..Hα-helixtrans-61.4-42.9172-73.3164.2000112Q125 L126 S132 F133 L147 I151 V158 W161 F162Q125-L129 WeakPolarHBondContact O-CB 3.24Å; Q125-L129 WeakPolarHBondContact O-CD1 3.23Å; Q125-L129 WeakPolarHBondContact O-CG 3.46Å; Q125-L129 PolarHBondContact O-N 3.33Å; L126-L129 PolarHBondContact O-N 3.01Å; L129-S132 PolarHBondContact O-N 3.37Å; L129-F133 WeakPolarHBondContact O-CB 3.42Å; L129-F133 PolarHBondContact O-N 3.17Å; L129-L147 HydrophobicContact CD2-CD2 3.86Å; L129-L147 HydrophobicContact CD2-CG 4.45Å; L129-I151 HydrophobicContact CD1-CD1 4.15Å; L129-I151 HydrophobicContact CD2-CD1 3.76Å; L129-I151 HydrophobicContact CG-CD1 3.76Å; L129-V158 HydrophobicContact CD2-CG1 4.06Å; L129-V158 HydrophobicContact CD2-CG2 4.41Å; L129-W161 HydrophobicContact CB-CD2 4.03Å; L129-W161 HydrophobicContact CB-CE3 3.99Å; L129-W161 HydrophobicContact CB-CH2 3.66Å; L129-W161 HydrophobicContact CB-CZ2 3.68Å; L129-W161 HydrophobicContact CB-CZ3 3.82Å; L129-W161 HydrophobicContact CD1-CD2 3.92Å; L129-W161 HydrophobicContact CD1-CG 3.9Å; L129-W161 HydrophobicContact CD2-CD2 4.22Å; L129-W161 HydrophobicContact CD2-CE3 4.08Å; L129-W161 HydrophobicContact CG-CD2 4.3Å; L129-W161 HydrophobicContact CG-CE3 4.44Å; L129-F162 HydrophobicContact CD2-CE2 3.98Å
130E98.3Very high97.7Very high78 Ų7875.4 Ų75.436%0.36438%0.38SS..Hα-helixtrans-70.2-38.3177.7-72-167.2158.900112.5L126 N127 F133 A134 W161 R165L126-E130 WeakPolarHBondContact O-CB 3.42Å; L126-E130 WeakPolarHBondContact O-CG 3.19Å; L126-E130 PolarHBondContact O-N 2.89Å; N127-E130 PolarHBondContact O-N 3.45Å; E130-F133 WeakPolarHBondContact O-CB 3.35Å; E130-F133 PolarHBondContact O-N 3.35Å; E130-A134 PolarHBondContact O-N 3.33Å; E130-W161 HydrophobicContact CG-CH2 3.85Å; E130-W161 HydrophobicContact CG-CZ2 3.83Å; E130-R165 IonicContact OE1-CZ 2.7Å; E130-R165 VanDerWaalsContact OE1-CZ 3.28Å; E130-R165 IonicContact OE1-NH1 3.35Å; E130-R165 PolarHBondContact OE1-NH1 3.49Å; E130-R165 IonicContact OE1-NH2 3.64Å; E130-R165 PolarHBondContact OE1-NH2 3.11Å
131R98Very high97.8Very high154 Ų15467.3 Ų67.358%0.58135%0.354SS*.Hα-helixtrans-61.1-43.5173.3-175.5-174-70165.3-11.8111.5N127 E128 A134N127-R131 VanDerWaalsContact O-CB 3.31Å; N127-R131 WeakPolarHBondContact O-CB 3.33Å; N127-R131 PolarHBondContact O-N 3.13Å; E128-R131 PolarHBondContact O-N 3.01Å; E128-R131 IonicContact OE2-CZ 3.68Å; E128-R131 IonicContact OE2-NE 3.96Å; E128-R131 IonicContact OE2-NH1 2.86Å; E128-R131 PolarHBondContact OE2-NH1 3.21Å; R131-A134 PolarHBondContact O-N 3.37Å
132S97.7Very high97.8Very high14 Ų1471.1 Ų71.110%0.09837%0.371CS..Hα-helixtrans-65.6-41.8174.4-175.20000111.7E128 L129 A134 K135 T136E128-S132 WeakPolarHBondContact O-CB 3.23Å; E128-S132 PolarHBondContact O-N 3.15Å; L129-S132 PolarHBondContact O-N 3.37Å; S132-A134 VanDerWaalsContact C-N 3.27Å; S132-A134 PolarHBondContact O-N 3.41Å; S132-K135 WeakPolarHBondContact O-CB 3.31Å; S132-K135 PolarHBondContact O-N 3Å; S132-T136 PolarHBondContact O-N 3.07Å
133F97.9Very high97.8Very high11 Ų1171.8 Ų71.85%0.04837%0.37CS..Hα-helixtrans-60.8-33.9177-170.5-95.8000113.2L129 E130 K135 T136 H137 W161 F162 R165 R166 W169L129-F133 WeakPolarHBondContact O-CB 3.42Å; L129-F133 PolarHBondContact O-N 3.17Å; E130-F133 WeakPolarHBondContact O-CB 3.35Å; E130-F133 PolarHBondContact O-N 3.35Å; F133-K135 PolarHBondContact O-N 3.3Å; F133-T136 WeakPolarHBondContact CA-O 3.42Å; F133-T136 CarbonylContact O-C 3.4Å; F133-H137 AromaticContact CD1-CD2 3.46Å; F133-H137 VanDerWaalsContact CD1-CD2 3.46Å; F133-H137 WeakPolarHBondContact CD1-CD2 3.4Å; F133-H137 AromaticContact CD1-NE2 3.87Å; F133-H137 AromaticContact CD2-CD2 3.95Å; F133-H137 AromaticContact CE1-CD2 3.06Å; F133-H137 WeakPolarHBondContact CE1-CD2 3.49Å; F133-H137 AromaticContact CE1-NE2 3.39Å; F133-H137 WeakPolarHBondContact CE1-NE2 3.47Å; F133-H137 HydrophobicContact CE2-CB 4.02Å; F133-H137 AromaticContact CE2-CD2 3.6Å; F133-H137 AromaticContact CG-CD2 3.89Å; F133-H137 HydrophobicContact CZ-CB 4.16Å; F133-H137 AromaticContact CZ-CD2 3.13Å; F133-H137 WeakPolarHBondContact CZ-CD2 3.35Å; F133-H137 AromaticContact CZ-CG 3.83Å; F133-H137 AromaticContact CZ-NE2 3.84Å; F133-H137 PolarHBondContact O-CD2 2.73Å; F133-W161 HydrophobicContact CB-CH2 4.31Å; F133-W161 HydrophobicContact CB-CZ3 4.18Å; F133-W161 HydrophobicContact CD2-CZ3 4.27Å; F133-W161 HydrophobicContact CG-CZ3 4.47Å; F133-F162 HydrophobicContact CB-CE1 4.09Å; F133-F162 HydrophobicContact CB-CZ 4.47Å; F133-F162 AromaticContact CD2-CD1 3.71Å; F133-F162 HydrophobicContact CD2-CD1 3.71Å; F133-F162 AromaticContact CD2-CE1 3.68Å; F133-F162 HydrophobicContact CD2-CE1 3.68Å; F133-F162 HydrophobicContact CE2-CD1 4.33Å; F133-F162 HydrophobicContact CG-CE1 4.38Å; F133-R165 HydrophobicContact CD1-CG 3.98Å; F133-R165 HydrophobicContact CD2-CB 4.22Å; F133-R165 HydrophobicContact CD2-CG 3.61Å; F133-R165 HydrophobicContact CE1-CG 3.81Å; F133-R165 HydrophobicContact CE2-CB 3.95Å; F133-R165 HydrophobicContact CE2-CG 3.45Å; F133-R165 VanDerWaalsContact CE2-CG 3.45Å; F133-R165 HydrophobicContact CG-CG 3.88Å; F133-R165 HydrophobicContact CZ-CB 4.38Å; F133-R165 HydrophobicContact CZ-CG 3.56Å; F133-R166 HydrophobicContact CE2-CG 3.92Å; F133-R166 HydrophobicContact CZ-CG 4.34Å; F133-W169 HydrophobicContact CZ-CB 4.44Å
134A97.4Very high97.8Very high84 Ų8469.1 Ų69.169%0.69435%0.347SS*.Hα-helixtrans-65.2-28.117500000112.9E130 R131 S132E130-A134 PolarHBondContact O-N 3.33Å; R131-A134 PolarHBondContact O-N 3.37Å; S132-A134 VanDerWaalsContact C-N 3.27Å; S132-A134 PolarHBondContact O-N 3.41Å
135K97.2Very high97.9Very high170 Ų17069.9 Ų69.974%0.73934%0.338SS*.Hα-helixtrans-79.6-48.1175.1-59.5177-178.9-177.40111.4S132 F133S132-K135 WeakPolarHBondContact O-CB 3.31Å; S132-K135 PolarHBondContact O-N 3Å; F133-K135 PolarHBondContact O-N 3.3Å
136T96.7Very high97.9Very high40 Ų4073.9 Ų73.925%0.24536%0.357CS..  trans-148.1134.8176.7178.20000111.9S132 F133 Y138 P139 M143S132-T136 PolarHBondContact O-N 3.07Å; F133-T136 WeakPolarHBondContact CA-O 3.42Å; F133-T136 CarbonylContact O-C 3.4Å; T136-Y138 VanDerWaalsContact C-N 3.33Å; T136-Y138 PolarHBondContact OG1-N 3.18Å; T136-Y138 PolarHBondContact OG1-O 3.19Å; T136-P139 HydrophobicContact CG2-CB 4.14Å; T136-M143 HydrophobicContact CG2-CE 3.67Å; T136-M143 HydrophobicContact CG2-SD 4.29Å
137H97Very high97.9Very high54 Ų5471.2 Ų71.225%0.2534%0.343CS..SBendtrans-79.4-18.4174.9-58.9137.7000113.1F133 R166F133-H137 AromaticContact CD1-CD2 3.46Å; F133-H137 VanDerWaalsContact CD1-CD2 3.46Å; F133-H137 WeakPolarHBondContact CD1-CD2 3.4Å; F133-H137 AromaticContact CD1-NE2 3.87Å; F133-H137 AromaticContact CD2-CD2 3.95Å; F133-H137 AromaticContact CE1-CD2 3.06Å; F133-H137 WeakPolarHBondContact CE1-CD2 3.49Å; F133-H137 AromaticContact CE1-NE2 3.39Å; F133-H137 WeakPolarHBondContact CE1-NE2 3.47Å; F133-H137 HydrophobicContact CE2-CB 4.02Å; F133-H137 AromaticContact CE2-CD2 3.6Å; F133-H137 AromaticContact CG-CD2 3.89Å; F133-H137 HydrophobicContact CZ-CB 4.16Å; F133-H137 AromaticContact CZ-CD2 3.13Å; F133-H137 WeakPolarHBondContact CZ-CD2 3.35Å; F133-H137 AromaticContact CZ-CG 3.83Å; F133-H137 AromaticContact CZ-NE2 3.84Å; F133-H137 PolarHBondContact O-CD2 2.73Å; H137-R166 WeakPolarHBondContact O-CD 3.33Å; H137-R166 PolarHBondContact O-NH1 3.33Å
138Y97.7Very high97.9Very high122 Ų12266.6 Ų66.648%0.47832%0.319SS..SBendtrans-12774.6-177.9-64.9-95.4000108.9W26 T136 R166W26-Y138 VanDerWaalsContact CZ2-OH 3.32Å; W26-Y138 WeakPolarHBondContact CZ2-OH 3.41Å; W26-Y138 AromaticContact NE1-CE2 3.63Å; W26-Y138 AromaticContact NE1-CZ 3.77Å; W26-Y138 PolarHBondContact NE1-OH 3.26Å; W26-Y138 VanDerWaalsContact NE1-OH 3.1Å; T136-Y138 VanDerWaalsContact C-N 3.33Å; T136-Y138 PolarHBondContact OG1-N 3.18Å; T136-Y138 PolarHBondContact OG1-O 3.19Å; Y138-R166 VanDerWaalsContact CE1-CD 3.48Å
139P97Very high97.9Very high6 Ų672.1 Ų72.14%0.03935%0.349CS..  trans-67.5139177.329.6-36.8000110.4T136 M143 R144 F162T136-P139 HydrophobicContact CG2-CB 4.14Å; P139-M143 HydrophobicContact CB-CB 4.07Å; P139-M143 HydrophobicContact CB-SD 4.49Å; P139-R144 HydrophobicContact CB-CG 3.93Å; P139-R144 HydrophobicContact CG-CG 3.69Å; P139-R144 PolarHBondContact O-NH1 2.91Å; P139-F162 HydrophobicContact CB-CE1 4.43Å; P139-F162 VanDerWaalsContact CD-CE1 3.5Å; P139-F162 HydrophobicContact CG-CD1 3.54Å; P139-F162 HydrophobicContact CG-CD2 4.09Å; P139-F162 HydrophobicContact CG-CE1 3.5Å; P139-F162 VanDerWaalsContact CG-CE1 3.5Å; P139-F162 HydrophobicContact CG-CE2 4.06Å; P139-F162 HydrophobicContact CG-CG 3.86Å; P139-F162 HydrophobicContact CG-CZ 3.77Å
140D98.1Very high97.8Very high93 Ų9378 Ų7850%0.49737%0.371SS..  trans-67.6165.9174.9-170.924.5000112.1F142 M143 R144D140-F142 PolarHBondContact O-N 2.82Å; D140-M143 HydrophobicContact CB-CG 4.31Å; D140-M143 HydrophobicContact CB-SD 4.38Å; D140-M143 PolarHBondContact O-N 3.46Å; D140-R144 WeakPolarHBondContact O-CG 3.36Å; D140-R144 PolarHBondContact O-N 3.13Å
141I97.8Very high97.8Very high59 Ų5975.3 Ų75.330%0.30336%0.359SS..Hα-helixtrans-52.2-50.8179.7-175.660.5000111.7M143 R144 E145 E155I141-M143 VanDerWaalsContact C-N 3.33Å; I141-M143 PolarHBondContact O-N 3.42Å; I141-R144 PolarHBondContact O-N 2.95Å; I141-R144 VanDerWaalsContact O-N 3.08Å; I141-E145 HydrophobicContact CD1-CG 4.44Å; I141-E145 WeakPolarHBondContact O-CG 3.5Å; I141-E145 PolarHBondContact O-N 2.77Å; I141-E155 HydrophobicContact CD1-CG 4.01Å
142F98.1Very high97.8Very high145 Ų14571.1 Ų71.164%0.63636%0.363SS*.Hα-helixtrans-62.4-39.8-179.9-62.4-68.7000112.3D140 R144 E145 E146D140-F142 PolarHBondContact O-N 2.82Å; F142-R144 VanDerWaalsContact C-N 3.3Å; F142-R144 PolarHBondContact O-N 3.03Å; F142-E145 PolarHBondContact O-N 3.25Å; F142-E146 WeakPolarHBondContact O-CB 3.4Å; F142-E146 PolarHBondContact O-N 2.97Å
143M97.9Very high97.8Very high81 Ų8171.8 Ų71.840%0.39937%0.366SS..Hα-helixtrans-64.7-36.7176.4-62.8-179.171.700111.9T136 P139 D140 I141 L147T136-M143 HydrophobicContact CG2-CE 3.67Å; T136-M143 HydrophobicContact CG2-SD 4.29Å; P139-M143 HydrophobicContact CB-CB 4.07Å; P139-M143 HydrophobicContact CB-SD 4.49Å; D140-M143 HydrophobicContact CB-CG 4.31Å; D140-M143 HydrophobicContact CB-SD 4.38Å; D140-M143 PolarHBondContact O-N 3.46Å; I141-M143 VanDerWaalsContact C-N 3.33Å; I141-M143 PolarHBondContact O-N 3.42Å; M143-L147 VanDerWaalsContact O-CB 3.23Å; M143-L147 WeakPolarHBondContact O-CB 3.38Å; M143-L147 PolarHBondContact O-N 3.26Å; M143-L147 VanDerWaalsContact O-N 3.11Å
144R98.5Very high97.8Very high45 Ų4575.5 Ų75.517%0.1739%0.389CS..Hα-helixtrans-70.7-39.5176.9-67.5-165.7-53.5-85.2-0.7111.4P139 D140 I141 F142 L147 A148 E155 V158P139-R144 HydrophobicContact CB-CG 3.93Å; P139-R144 HydrophobicContact CG-CG 3.69Å; P139-R144 PolarHBondContact O-NH1 2.91Å; D140-R144 WeakPolarHBondContact O-CG 3.36Å; D140-R144 PolarHBondContact O-N 3.13Å; I141-R144 PolarHBondContact O-N 2.95Å; I141-R144 VanDerWaalsContact O-N 3.08Å; F142-R144 VanDerWaalsContact C-N 3.3Å; F142-R144 PolarHBondContact O-N 3.03Å; R144-L147 PolarHBondContact O-N 3.03Å; R144-A148 WeakPolarHBondContact O-CB 3.43Å; R144-A148 PolarHBondContact O-N 2.75Å; R144-E155 HydrophobicContact CB-CG 4.06Å; R144-E155 IonicContact CZ-OE1 3.28Å; R144-E155 VanDerWaalsContact CZ-OE1 3.27Å; R144-E155 IonicContact NE-OE1 3.27Å; R144-E155 PolarHBondContact NE-OE1 3.48Å; R144-E155 IonicContact NH2-OE1 2.73Å; R144-E155 PolarHBondContact NH2-OE1 3.06Å; R144-V158 HydrophobicContact CB-CG1 4.17Å; R144-V158 HydrophobicContact CG-CG1 4.15Å
145E98.6Very high97.8Very high87 Ų8773.7 Ų73.741%0.40737%0.366SS..Hα-helixtrans-63.1-48.7175.9-71.5177.4162.800111.7I141 F142 L147 A148 L149 E155I141-E145 HydrophobicContact CD1-CG 4.44Å; I141-E145 WeakPolarHBondContact O-CG 3.5Å; I141-E145 PolarHBondContact O-N 2.77Å; F142-E145 PolarHBondContact O-N 3.25Å; E145-L147 VanDerWaalsContact C-N 3.31Å; E145-L147 PolarHBondContact O-N 2.88Å; E145-A148 WeakPolarHBondContact O-CB 3.44Å; E145-A148 PolarHBondContact O-N 2.74Å; E145-L149 WeakPolarHBondContact O-CG 3.4Å; E145-L149 PolarHBondContact O-N 3.39Å; E145-E155 HydrophobicContact CG-CB 4.36Å; E145-E155 HydrophobicContact CG-CG 3.98Å
146E98.3Very high97.8Very high115 Ų11568 Ų6854%0.53735%0.348SS..Hα-helixtrans-59.4-43.8176.9-165.9-157.8160.500111.5F142 L149 R150F142-E146 WeakPolarHBondContact O-CB 3.4Å; F142-E146 PolarHBondContact O-N 2.97Å; E146-L149 PolarHBondContact O-N 3.47Å; E146-R150 WeakPolarHBondContact O-CB 3.43Å; E146-R150 PolarHBondContact O-N 2.78Å; E146-R150 IonicContact OE1-CZ 3.86Å; E146-R150 IonicContact OE1-NH2 3.92Å; E146-R150 PolarHBondContact OE1-NH2 3.48Å; E146-R150 IonicContact OE2-NH2 2.89Å
147L98.2Very high97.9Very high2 Ų270.6 Ų70.61%0.0135%0.354CS..Hα-helixtrans-64.6-41.3177.6-172.762.1000111.7E128 L129 M143 R144 E145 R150 I151 V158 F162E128-L147 HydrophobicContact CG-CD1 3.79Å; L129-L147 HydrophobicContact CD2-CD2 3.86Å; L129-L147 HydrophobicContact CD2-CG 4.45Å; M143-L147 VanDerWaalsContact O-CB 3.23Å; M143-L147 WeakPolarHBondContact O-CB 3.38Å; M143-L147 PolarHBondContact O-N 3.26Å; M143-L147 VanDerWaalsContact O-N 3.11Å; R144-L147 PolarHBondContact O-N 3.03Å; E145-L147 VanDerWaalsContact C-N 3.31Å; E145-L147 PolarHBondContact O-N 2.88Å; L147-R150 PolarHBondContact O-N 2.96Å; L147-I151 HydrophobicContact CD1-CG2 4.38Å; L147-I151 HydrophobicContact CG-CD1 4.21Å; L147-I151 VanDerWaalsContact O-CG1 3.23Å; L147-I151 WeakPolarHBondContact O-CG1 3.46Å; L147-I151 PolarHBondContact O-N 3.5Å; L147-I151 VanDerWaalsContact O-N 3.1Å; L147-V158 HydrophobicContact CD2-CG1 3.94Å; L147-F162 HydrophobicContact CD2-CE2 3.83Å; L147-F162 HydrophobicContact CD2-CZ 4.21Å
148A98.3Very high97.9Very high5 Ų568 Ų684%0.04134%0.342CS..Hα-helixtrans-61-44.9178.400000111.5R144 E145 I151 G152 L153 V158R144-A148 WeakPolarHBondContact O-CB 3.43Å; R144-A148 PolarHBondContact O-N 2.75Å; E145-A148 WeakPolarHBondContact O-CB 3.44Å; E145-A148 PolarHBondContact O-N 2.74Å; A148-I151 PolarHBondContact O-N 2.79Å; A148-G152 PolarHBondContact O-N 3.5Å; A148-L153 CarbonylContact C-O 3.47Å; A148-L153 WeakPolarHBondContact CB-O 3.35Å; A148-L153 PolarHBondContact O-N 2.9Å; A148-V158 HydrophobicContact CB-CG2 3.85Å
149L98.3Very high98Very high150 Ų15065.7 Ų65.779%0.78534%0.335SS*.Hα-helixtrans-60.2-47.7173.6-69171.9000111.4E145 E146 I151 G152E145-L149 WeakPolarHBondContact O-CG 3.4Å; E145-L149 PolarHBondContact O-N 3.39Å; E146-L149 PolarHBondContact O-N 3.47Å; L149-I151 VanDerWaalsContact C-N 3.3Å; L149-I151 PolarHBondContact O-N 2.94Å; L149-G152 PolarHBondContact O-N 3.12Å
150R97.7Very high98Very high124 Ų12468.3 Ų68.347%0.46835%0.351SS..Hα-helixtrans-60.6-35.8-177.8-165.5-175.1-55.4126.79.6113.4E128 E146 L147E128-R150 IonicContact OE1-CZ 2.75Å; E128-R150 IonicContact OE1-NH1 3.94Å; E128-R150 PolarHBondContact OE1-NH1 2.95Å; E146-R150 WeakPolarHBondContact O-CB 3.43Å; E146-R150 PolarHBondContact O-N 2.78Å; E146-R150 IonicContact OE1-CZ 3.86Å; E146-R150 IonicContact OE1-NH2 3.92Å; E146-R150 PolarHBondContact OE1-NH2 3.48Å; E146-R150 IonicContact OE2-NH2 2.89Å; L147-R150 PolarHBondContact O-N 2.96Å
151I97.6Very high98Very high20 Ų2064.8 Ų64.810%0.10333%0.331CS..Hα-helixtrans-105.83.9-174.374.2-170.2000113.9Q125 E128 L129 L147 A148 L149 L153 V158Q125-I151 HydrophobicContact CG-CB 4.14Å; Q125-I151 PolarHBondContact NE2-O 3.35Å; E128-I151 HydrophobicContact CB-CG2 3.85Å; E128-I151 HydrophobicContact CG-CG2 3.67Å; L129-I151 HydrophobicContact CD1-CD1 4.15Å; L129-I151 HydrophobicContact CD2-CD1 3.76Å; L129-I151 HydrophobicContact CG-CD1 3.76Å; L147-I151 HydrophobicContact CD1-CG2 4.38Å; L147-I151 HydrophobicContact CG-CD1 4.21Å; L147-I151 VanDerWaalsContact O-CG1 3.23Å; L147-I151 WeakPolarHBondContact O-CG1 3.46Å; L147-I151 PolarHBondContact O-N 3.5Å; L147-I151 VanDerWaalsContact O-N 3.1Å; A148-I151 PolarHBondContact O-N 2.79Å; L149-I151 VanDerWaalsContact C-N 3.3Å; L149-I151 PolarHBondContact O-N 2.94Å; I151-L153 HydrophobicContact CD1-CD1 3.64Å; I151-L153 HydrophobicContact CD1-CG 4.31Å; I151-L153 HydrophobicContact CG1-CB 4.1Å; I151-L153 HydrophobicContact CG1-CD1 3.77Å; I151-L153 HydrophobicContact CG1-CG 3.88Å; I151-V158 HydrophobicContact CD1-CG2 4.25Å
152G97.8Very high98.1Very high66 Ų6662.1 Ų62.168%0.6832%0.317SS*.THydrogen-bonded Turntrans6839.5177.200000113.9A148 L149A148-G152 PolarHBondContact O-N 3.5Å; L149-G152 PolarHBondContact O-N 3.12Å
153L97.3Very high98.1Very high29 Ų2959.3 Ų59.315%0.15231%0.306CS..  trans-122.2167.7177.8-64.9177.2000110.4T119 F121 A148 I151 R157 V158T119-L153 HydrophobicContact CG2-CD2 4.13Å; F121-L153 HydrophobicContact CD1-CD1 3.63Å; F121-L153 HydrophobicContact CD1-CD2 4.37Å; F121-L153 HydrophobicContact CE1-CD1 3.59Å; F121-L153 HydrophobicContact CE1-CD2 4.36Å; A148-L153 CarbonylContact C-O 3.47Å; A148-L153 WeakPolarHBondContact CB-O 3.35Å; A148-L153 PolarHBondContact O-N 2.9Å; I151-L153 HydrophobicContact CD1-CD1 3.64Å; I151-L153 HydrophobicContact CD1-CG 4.31Å; I151-L153 HydrophobicContact CG1-CB 4.1Å; I151-L153 HydrophobicContact CG1-CD1 3.77Å; I151-L153 HydrophobicContact CG1-CG 3.88Å; L153-R157 HydrophobicContact CB-CB 4.45Å; L153-V158 HydrophobicContact CB-CG2 4.5Å
154T98Very high98Very high88 Ų8860 Ų6054%0.5431%0.311SS..  trans-84.2150.116968.60000110.8S156 R157 V158T154-S156 PolarHBondContact O-N 3.46Å; T154-R157 WeakPolarHBondContact O-CA 3.34Å; T154-R157 WeakPolarHBondContact O-CB 3.47Å; T154-R157 PolarHBondContact O-N 2.84Å; T154-R157 WeakPolarHBondContact OG1-CG 3.38Å; T154-V158 PolarHBondContact O-N 3.32Å
155E98.3Very high98Very high46 Ų4660.2 Ų60.222%0.21531%0.312CS..Hα-helixtrans-49.9-44.9177.7-177.8-77.7155.100111.3I141 R144 E145 R157 V158 Q159I141-E155 HydrophobicContact CD1-CG 4.01Å; R144-E155 HydrophobicContact CB-CG 4.06Å; R144-E155 IonicContact CZ-OE1 3.28Å; R144-E155 VanDerWaalsContact CZ-OE1 3.27Å; R144-E155 IonicContact NE-OE1 3.27Å; R144-E155 PolarHBondContact NE-OE1 3.48Å; R144-E155 IonicContact NH2-OE1 2.73Å; R144-E155 PolarHBondContact NH2-OE1 3.06Å; E145-E155 HydrophobicContact CG-CB 4.36Å; E145-E155 HydrophobicContact CG-CG 3.98Å; E155-R157 PolarHBondContact O-N 3.33Å; E155-V158 CarbonylContact O-C 3.58Å; E155-V158 WeakPolarHBondContact O-CA 3.36Å; E155-V158 WeakPolarHBondContact O-CB 3.29Å; E155-V158 PolarHBondContact O-N 2.94Å; E155-Q159 PolarHBondContact O-N 2.9Å
156S97.6Very high97.9Very high51 Ų5158.7 Ų58.736%0.35730%0.302SS..Hα-helixtrans-56.9-35.3177.9178.90000112.8T154 Q159 V160T154-S156 PolarHBondContact O-N 3.46Å; S156-Q159 PolarHBondContact O-N 2.97Å; S156-V160 VanDerWaalsContact O-CG2 3.29Å; S156-V160 WeakPolarHBondContact O-CG2 3.28Å; S156-V160 PolarHBondContact O-N 3.19Å
157R97.9Very high97.8Very high95 Ų9555.9 Ų55.936%0.35830%0.298SS..Hα-helixtrans-70.5-39176.6-63.1-62.2133.5154.2-3.8112T119 F121 L153 T154 E155 W161T119-R157 WeakPolarHBondContact OG1-CD 3.47Å; T119-R157 PolarHBondContact OG1-NH1 3.4Å; F121-R157 HydrophobicContact CE1-CB 4.48Å; L153-R157 HydrophobicContact CB-CB 4.45Å; T154-R157 WeakPolarHBondContact O-CA 3.34Å; T154-R157 WeakPolarHBondContact O-CB 3.47Å; T154-R157 PolarHBondContact O-N 2.84Å; T154-R157 WeakPolarHBondContact OG1-CG 3.38Å; E155-R157 PolarHBondContact O-N 3.33Å; R157-W161 WeakPolarHBondContact O-CB 3.39Å; R157-W161 PolarHBondContact O-N 3.28Å
158V98.1Very high97.6Very high0 Ų061.6 Ų61.60%032%0.323CS..Hα-helixtrans-62.4-48.4173179.40000109.5L129 R144 L147 A148 I151 L153 T154 E155 V160 W161 F162L129-V158 HydrophobicContact CD2-CG1 4.06Å; L129-V158 HydrophobicContact CD2-CG2 4.41Å; R144-V158 HydrophobicContact CB-CG1 4.17Å; R144-V158 HydrophobicContact CG-CG1 4.15Å; L147-V158 HydrophobicContact CD2-CG1 3.94Å; A148-V158 HydrophobicContact CB-CG2 3.85Å; I151-V158 HydrophobicContact CD1-CG2 4.25Å; L153-V158 HydrophobicContact CB-CG2 4.5Å; T154-V158 PolarHBondContact O-N 3.32Å; E155-V158 CarbonylContact O-C 3.58Å; E155-V158 WeakPolarHBondContact O-CA 3.36Å; E155-V158 WeakPolarHBondContact O-CB 3.29Å; E155-V158 PolarHBondContact O-N 2.94Å; V158-V160 PolarHBondContact O-N 3.15Å; V158-W161 WeakPolarHBondContact O-CB 3.13Å; V158-W161 PolarHBondContact O-N 3.36Å; V158-W161 VanDerWaalsContact O-N 3.13Å; V158-F162 HydrophobicContact CG1-CD2 3.7Å; V158-F162 HydrophobicContact CG1-CE2 3.72Å; V158-F162 WeakPolarHBondContact O-CD2 3.06Å; V158-F162 PolarHBondContact O-N 3.39Å
159Q98.2Very high97.3Very high72 Ų7264.2 Ų64.234%0.33633%0.332SS..Hα-helixtrans-54.2-51.8176.7-170.6-164.4-000112E155 S156 W161 F162 Q163E155-Q159 PolarHBondContact O-N 2.9Å; S156-Q159 PolarHBondContact O-N 2.97Å; Q159-W161 VanDerWaalsContact C-N 3.32Å; Q159-W161 PolarHBondContact O-N 3.27Å; Q159-F162 PolarHBondContact O-N 2.85Å; Q159-Q163 WeakPolarHBondContact O-CG 3.4Å; Q159-Q163 PolarHBondContact O-N 3.37Å
160V98.1Very high97Very high61 Ų6163.1 Ų63.137%0.3732%0.321SS..Hα-helixtrans-63.1-37.9178.5171.80000111.5S156 V158 Q163 N164S156-V160 VanDerWaalsContact O-CG2 3.29Å; S156-V160 WeakPolarHBondContact O-CG2 3.28Å; S156-V160 PolarHBondContact O-N 3.19Å; V158-V160 PolarHBondContact O-N 3.15Å; V160-Q163 PolarHBondContact O-N 2.91Å; V160-N164 WeakPolarHBondContact O-CB 3.31Å; V160-N164 PolarHBondContact O-N 3.42Å; V160-N164 PolarHBondContact O-ND2 3.22Å
161W98.1Very high96.5Very high20 Ų2064.3 Ų64.38%0.07633%0.33CS..Hα-helixtrans-62.6-46.9175.4-174100.9000111.4F121 L126 L129 E130 F133 R157 V158 Q159 Q163 N164 R165F121-W161 AromaticContact CD2-CD1 3.89Å; F121-W161 AromaticContact CE2-CD1 3.61Å; F121-W161 HydrophobicContact CE2-CG 4.49Å; F121-W161 HydrophobicContact CZ-CB 4.32Å; L126-W161 VanDerWaalsContact CD2-NE1 3.34Å; L129-W161 HydrophobicContact CB-CD2 4.03Å; L129-W161 HydrophobicContact CB-CE3 3.99Å; L129-W161 HydrophobicContact CB-CH2 3.66Å; L129-W161 HydrophobicContact CB-CZ2 3.68Å; L129-W161 HydrophobicContact CB-CZ3 3.82Å; L129-W161 HydrophobicContact CD1-CD2 3.92Å; L129-W161 HydrophobicContact CD1-CG 3.9Å; L129-W161 HydrophobicContact CD2-CD2 4.22Å; L129-W161 HydrophobicContact CD2-CE3 4.08Å; L129-W161 HydrophobicContact CG-CD2 4.3Å; L129-W161 HydrophobicContact CG-CE3 4.44Å; E130-W161 HydrophobicContact CG-CH2 3.85Å; E130-W161 HydrophobicContact CG-CZ2 3.83Å; F133-W161 HydrophobicContact CB-CH2 4.31Å; F133-W161 HydrophobicContact CB-CZ3 4.18Å; F133-W161 HydrophobicContact CD2-CZ3 4.27Å; F133-W161 HydrophobicContact CG-CZ3 4.47Å; R157-W161 WeakPolarHBondContact O-CB 3.39Å; R157-W161 PolarHBondContact O-N 3.28Å; V158-W161 WeakPolarHBondContact O-CB 3.13Å; V158-W161 PolarHBondContact O-N 3.36Å; V158-W161 VanDerWaalsContact O-N 3.13Å; Q159-W161 VanDerWaalsContact C-N 3.32Å; Q159-W161 PolarHBondContact O-N 3.27Å; W161-Q163 PolarHBondContact O-N 3.47Å; W161-N164 PolarHBondContact O-N 3.16Å; W161-R165 HydrophobicContact CE3-CB 4.08Å; W161-R165 HydrophobicContact CH2-CB 4.15Å; W161-R165 HydrophobicContact CH2-CG 3.82Å; W161-R165 HydrophobicContact CZ2-CG 4.47Å; W161-R165 HydrophobicContact CZ3-CB 3.87Å; W161-R165 HydrophobicContact CZ3-CG 3.9Å; W161-R165 WeakPolarHBondContact O-CB 3.49Å; W161-R165 PolarHBondContact O-N 3.37Å
162F98.6Very high95.4Very high2 Ų270.6 Ų70.61%0.00935%0.352CS..Hα-helixtrans-63.5-39.7178.4-90.2-94.3000112.1L129 F133 P139 L147 V158 Q159 R165 R166L129-F162 HydrophobicContact CD2-CE2 3.98Å; F133-F162 HydrophobicContact CB-CE1 4.09Å; F133-F162 HydrophobicContact CB-CZ 4.47Å; F133-F162 AromaticContact CD2-CD1 3.71Å; F133-F162 HydrophobicContact CD2-CD1 3.71Å; F133-F162 AromaticContact CD2-CE1 3.68Å; F133-F162 HydrophobicContact CD2-CE1 3.68Å; F133-F162 HydrophobicContact CE2-CD1 4.33Å; F133-F162 HydrophobicContact CG-CE1 4.38Å; P139-F162 HydrophobicContact CB-CE1 4.43Å; P139-F162 VanDerWaalsContact CD-CE1 3.5Å; P139-F162 HydrophobicContact CG-CD1 3.54Å; P139-F162 HydrophobicContact CG-CD2 4.09Å; P139-F162 HydrophobicContact CG-CE1 3.5Å; P139-F162 VanDerWaalsContact CG-CE1 3.5Å; P139-F162 HydrophobicContact CG-CE2 4.06Å; P139-F162 HydrophobicContact CG-CG 3.86Å; P139-F162 HydrophobicContact CG-CZ 3.77Å; L147-F162 HydrophobicContact CD2-CE2 3.83Å; L147-F162 HydrophobicContact CD2-CZ 4.21Å; V158-F162 HydrophobicContact CG1-CD2 3.7Å; V158-F162 HydrophobicContact CG1-CE2 3.72Å; V158-F162 WeakPolarHBondContact O-CD2 3.06Å; V158-F162 PolarHBondContact O-N 3.39Å; Q159-F162 PolarHBondContact O-N 2.85Å; F162-R165 PolarHBondContact O-N 3.46Å; F162-R166 WeakPolarHBondContact O-CG 3.45Å; F162-R166 PolarHBondContact O-N 3.29Å
163Q98.2Very high93.7Very high87 Ų8773 Ų7341%0.40734%0.344SS..Hα-helixtrans-58.9-50172.9-71.1175.322.300111.6Q159 V160 W161 R165 R166 A167Q159-Q163 WeakPolarHBondContact O-CG 3.4Å; Q159-Q163 PolarHBondContact O-N 3.37Å; V160-Q163 PolarHBondContact O-N 2.91Å; W161-Q163 PolarHBondContact O-N 3.47Å; Q163-R165 VanDerWaalsContact C-N 3.3Å; Q163-R165 PolarHBondContact O-N 3.18Å; Q163-R166 PolarHBondContact O-N 3.27Å; Q163-A167 PolarHBondContact O-N 3.21Å
164N97.6Very high91.8Very high94 Ų9479.7 Ų79.750%0.50337%0.371SS..Hα-helixtrans-63.5-37.2178.1-74.5-38.7000112.3V160 W161 A167 K168V160-N164 WeakPolarHBondContact O-CB 3.31Å; V160-N164 PolarHBondContact O-N 3.42Å; V160-N164 PolarHBondContact O-ND2 3.22Å; W161-N164 PolarHBondContact O-N 3.16Å; N164-A167 PolarHBondContact O-N 3.47Å; N164-K168 PolarHBondContact O-N 3.04Å; N164-K168 VanDerWaalsContact O-N 3.12Å
165R97.6Very high89.7Confident50 Ų5078 Ų7819%0.18936%0.361CS..Hα-helixtrans-65.6-46177.4-172.765.4-177.6-165.4-2111E130 F133 W161 F162 Q163 A167 K168 W169E130-R165 IonicContact OE1-CZ 2.7Å; E130-R165 VanDerWaalsContact OE1-CZ 3.28Å; E130-R165 IonicContact OE1-NH1 3.35Å; E130-R165 PolarHBondContact OE1-NH1 3.49Å; E130-R165 IonicContact OE1-NH2 3.64Å; E130-R165 PolarHBondContact OE1-NH2 3.11Å; F133-R165 HydrophobicContact CD1-CG 3.98Å; F133-R165 HydrophobicContact CD2-CB 4.22Å; F133-R165 HydrophobicContact CD2-CG 3.61Å; F133-R165 HydrophobicContact CE1-CG 3.81Å; F133-R165 HydrophobicContact CE2-CB 3.95Å; F133-R165 HydrophobicContact CE2-CG 3.45Å; F133-R165 VanDerWaalsContact CE2-CG 3.45Å; F133-R165 HydrophobicContact CG-CG 3.88Å; F133-R165 HydrophobicContact CZ-CB 4.38Å; F133-R165 HydrophobicContact CZ-CG 3.56Å; W161-R165 HydrophobicContact CE3-CB 4.08Å; W161-R165 HydrophobicContact CH2-CB 4.15Å; W161-R165 HydrophobicContact CH2-CG 3.82Å; W161-R165 HydrophobicContact CZ2-CG 4.47Å; W161-R165 HydrophobicContact CZ3-CB 3.87Å; W161-R165 HydrophobicContact CZ3-CG 3.9Å; W161-R165 WeakPolarHBondContact O-CB 3.49Å; W161-R165 PolarHBondContact O-N 3.37Å; F162-R165 PolarHBondContact O-N 3.46Å; Q163-R165 VanDerWaalsContact C-N 3.3Å; Q163-R165 PolarHBondContact O-N 3.18Å; R165-A167 PolarHBondContact O-N 3.2Å; R165-K168 PolarHBondContact O-N 3.1Å; R165-W169 WeakPolarHBondContact O-CB 3.4Å; R165-W169 PolarHBondContact O-N 2.7Å
166R97.2Very high87.5Confident56 Ų5679.4 Ų79.421%0.21137%0.373CS..Hα-helixtrans-62.5-39.9174.6-72.7-164.5-62.5-91.14.1112.6F133 H137 Y138 F162 Q163 K168 W169 K170F133-R166 HydrophobicContact CE2-CG 3.92Å; F133-R166 HydrophobicContact CZ-CG 4.34Å; H137-R166 WeakPolarHBondContact O-CD 3.33Å; H137-R166 PolarHBondContact O-NH1 3.33Å; Y138-R166 VanDerWaalsContact CE1-CD 3.48Å; F162-R166 WeakPolarHBondContact O-CG 3.45Å; F162-R166 PolarHBondContact O-N 3.29Å; Q163-R166 PolarHBondContact O-N 3.27Å; R166-K168 PolarHBondContact O-N 2.68Å; R166-W169 WeakPolarHBondContact O-CB 3.47Å; R166-W169 PolarHBondContact O-N 3.45Å; R166-K170 WeakPolarHBondContact O-CB 3.48Å; R166-K170 PolarHBondContact O-N 3.34Å
167A96.4Very high85.3Confident55 Ų5583.8 Ų83.846%0.45539%0.393SS..Hα-helixtrans-59.6-46.7176.300000111.9Q163 N164 R165 K170 K171Q163-A167 PolarHBondContact O-N 3.21Å; N164-A167 PolarHBondContact O-N 3.47Å; R165-A167 PolarHBondContact O-N 3.2Å; A167-K170 PolarHBondContact O-N 3.29Å; A167-K171 PolarHBondContact O-N 2.99Å
168K93.6Very high83.2Confident123 Ų12384.2 Ų84.254%0.53541%0.406SS..Hα-helixtrans-62.4-42.4174.2-72.8-174.8-70.1-179.30111.9N164 R165 R166 K170 K171 R172N164-K168 PolarHBondContact O-N 3.04Å; N164-K168 VanDerWaalsContact O-N 3.12Å; R165-K168 PolarHBondContact O-N 3.1Å; R166-K168 PolarHBondContact O-N 2.68Å; K168-K170 PolarHBondContact O-N 3Å; K168-K171 PolarHBondContact O-N 3.13Å; K168-R172 PolarHBondContact O-N 3.44Å
169W91.9Very high80.9Confident59 Ų5992.6 Ų92.622%0.22344%0.442CS..Hα-helixtrans-60.2-43.8177.3-178.193.8000112W26 F133 R165 R166W26-W169 AromaticContact CH2-CZ3 3.93Å; W26-W169 HydrophobicContact CH2-CZ3 3.93Å; W26-W169 HydrophobicContact CZ2-CE3 4.44Å; W26-W169 AromaticContact CZ2-CZ3 3.8Å; W26-W169 HydrophobicContact CZ2-CZ3 3.8Å; W26-W169 HydrophobicContact CZ3-CZ3 4.41Å; F133-W169 HydrophobicContact CZ-CB 4.44Å; R165-W169 WeakPolarHBondContact O-CB 3.4Å; R165-W169 PolarHBondContact O-N 2.7Å; R166-W169 WeakPolarHBondContact O-CB 3.47Å; R166-W169 PolarHBondContact O-N 3.45Å
170K91.9Very high78.6Confident127 Ų12798.7 Ų98.755%0.55246%0.462SS*.Hα-helixtrans-61.9-43.3175-172.1168.773.6175.60111.9W26 R166 A167 K168 R172 K173W26-K170 HydrophobicContact CH2-CB 4.43Å; W26-K170 HydrophobicContact CH2-CD 3.83Å; W26-K170 HydrophobicContact CH2-CG 4.13Å; W26-K170 HydrophobicContact CZ3-CD 4.25Å; W26-K170 HydrophobicContact CZ3-CG 4.48Å; R166-K170 WeakPolarHBondContact O-CB 3.48Å; R166-K170 PolarHBondContact O-N 3.34Å; A167-K170 PolarHBondContact O-N 3.29Å; K168-K170 PolarHBondContact O-N 3Å; K170-R172 VanDerWaalsContact C-N 3.33Å; K170-R172 PolarHBondContact O-N 3.37Å; K170-K173 PolarHBondContact O-N 3.09Å
171K85.8Confident76.1Confident150 Ų150101.6 Ų101.665%0.65248%0.476SS*.Hα-helixtrans-63.6-34.3-176.8-170.1167.4-178.7174.30113.4A167 K168 K173 K174 T175A167-K171 PolarHBondContact O-N 2.99Å; K168-K171 PolarHBondContact O-N 3.13Å; K171-K173 PolarHBondContact O-N 3.35Å; K171-K173 VanDerWaalsContact O-N 3.16Å; K171-K174 PolarHBondContact O-N 3.16Å; K171-K174 VanDerWaalsContact O-N 3.09Å; K171-T175 PolarHBondContact O-N 3.48Å; K171-T175 PolarHBondContact O-OG1 3.37Å
172R75.9Confident73.6Confident152 Ų152107.1 Ų107.157%0.57451%0.514SS*.Hα-helixtrans-60.9-24-179.3-71.6-171.3-66.6-163.44114.1K168 K170K168-R172 PolarHBondContact O-N 3.44Å; K170-R172 VanDerWaalsContact C-N 3.33Å; K170-R172 PolarHBondContact O-N 3.37Å
173K61.1Low71.1Confident117 Ų117110.1 Ų110.151%0.50955%0.546SS..Hα-helixtrans-79.4-20.6177.1-65.6-177.2173.6179.70113.9K170 K171K170-K173 PolarHBondContact O-N 3.09Å; K171-K173 PolarHBondContact O-N 3.35Å; K171-K173 VanDerWaalsContact O-N 3.16Å
174K57.5Low68.5Low168 Ų168111.6 Ų111.673%0.7356%0.561SS**Hα-helixtrans-93.7-27.9-176.2-158.885163.6-178.80112.6K171K171-K174 PolarHBondContact O-N 3.16Å; K171-K174 VanDerWaalsContact O-N 3.09Å
175T53.8Low66.2Low54 Ų54115.6 Ų115.633%0.33158%0.581SS.*Hα-helixtrans-81.1-17.9-178.645.70000114K171 N177 V178 F179K171-T175 PolarHBondContact O-N 3.48Å; K171-T175 PolarHBondContact O-OG1 3.37Å; T175-N177 PolarHBondContact O-N 3.07Å; T175-V178 PolarHBondContact O-N 3.23Å; T175-F179 PolarHBondContact O-N 3.05Å; T175-F179 VanDerWaalsContact O-N 3.11Å
176T53.3Low63.7Low75 Ų75120 Ų12046%0.4661%0.608SS.*THydrogen-bonded Turntrans-67.7-18.8176-159.60000113.6
177N49.9Very low61.3Low143 Ų143123.8 Ų123.877%0.76564%0.639SS**THydrogen-bonded Turntrans-98.3-10.5176.4-98.5-4.4000114.1T175T175-N177 PolarHBondContact O-N 3.07Å
178V53.9Low58.9Low104 Ų104127 Ų12763%0.6365%0.654SS**THydrogen-bonded Turntrans-107-25.1-178.3-173.50000111.8T175T175-V178 PolarHBondContact O-N 3.23Å
179F50.4Low56.4Low176 Ų176129.6 Ų129.677%0.77267%0.667SS**THydrogen-bonded Turntrans-92.44.7178.1-92.5-88.2000115T175T175-F179 PolarHBondContact O-N 3.05Å; T175-F179 VanDerWaalsContact O-N 3.11Å
180R49.4Very low54.2Low199 Ų199136.3 Ų136.375%0.75170%0.701SS**THydrogen-bonded Turntrans-95.59.5171.2-72.3-164.1-166.9-96.83.7114.4
181N45.4Very low51.5Low123 Ų123133.4 Ų133.466%0.65871%0.707SS**  trans-131.886.6168.5-86.9-32.9000109.9G183N181-G183 PolarHBondContact O-N 3.31Å
182P46.3Very low49.7Very low136 Ų136134.6 Ų134.688%0.88372%0.72SS**THydrogen-bonded Turntrans-74.180.2159.432.8-29.1000107.3
183G46Very low48Very low65 Ų65134.9 Ų134.967%0.6773%0.727SS**THydrogen-bonded Turntrans-169.3-11.2-174.800000119.5N181N181-G183 PolarHBondContact O-N 3.31Å
184T44.2Very low47.2Very low118 Ų118135 Ų13572%0.72474%0.743SS**  trans-141.577.9-178.143.10000112.7L186T184-L186 PolarHBondContact O-N 3.06Å
185L48.8Very low46.4Very low178 Ų178133.7 Ų133.793%0.93274%0.739SS**  trans-88.481.2155.6-67.4-177.9000108.9
186L45.3Very low45.8Very low142 Ų142138.4 Ų138.474%0.74376%0.755SS**  trans-137.1131161.8-79.8169.3000109.1T184 T188T184-L186 PolarHBondContact O-N 3.06Å; L186-T188 PolarHBondContact O-N 3.4Å
187P46.8Very low45.2Very low135 Ų135142 Ų14288%0.87777%0.771SS**  trans-69.492.4165.6-12.628000109.1H189P187-H189 PolarHBondContact O-N 3.47Å
188T44.7Very low44.8Very low124 Ų124140.7 Ų140.776%0.76177%0.774SS**  trans-75.3110.2172.3-69.10000109.3L186 H190L186-T188 PolarHBondContact O-N 3.4Å; T188-H190 PolarHBondContact O-N 3.09Å
189H42.8Very low44Very low177 Ų177140.3 Ų140.382%0.81978%0.781SS**  trans-45.5129.4162.7-151-109.6000109.7P187 G191P187-H189 PolarHBondContact O-N 3.47Å; H189-G191 PolarHBondContact O-N 3.48Å
190H44.5Very low43.4Very low199 Ų199137 Ų13792%0.92179%0.787SS**SBendtrans-61.2110.7174.1-92.4-79.3000109.8T188T188-H190 PolarHBondContact O-N 3.09Å
191G36.8Very low42.9Very low66 Ų66132.6 Ų132.668%0.6879%0.793SS**  trans-169.793175.200000111H189H189-G191 PolarHBondContact O-N 3.48Å
192L47.7Very low42.5Very low176 Ų176131.3 Ų131.392%0.92180%0.799SS**  trans32.397.7148.1-154.177.5000118.5
193H38.9Very low42Very low158 Ų158129.7 Ų129.773%0.73180%0.798SS**  trans-167.1115135.6-145.4-127.4000110.9
194S44.6Very low41.4Very low119 Ų119130.3 Ų130.383%0.83280%0.796SS**  trans-113.797.6168.2172.20000106.8
195Q40.2Very low41.3Very low141 Ų141129.7 Ų129.766%0.65980%0.803SS**  trans-165.5130.1162.4-131.4176.4-35.400113.2
196F41.9Very low41Very low152 Ų152128.9 Ų128.967%0.66780%0.796SS**  trans52114.4160.570.5-93.4000119.5
197N40.1Very low40.6Very low150 Ų150125.7 Ų125.780%0.80280%0.798SS**  -178.6131.499.1-105.6-1.6000112.4
198S41.2Very low40.5Very low116 Ų116127.2 Ų127.281%0.81180%0.799SS**  trans-91.2165.4164.8-169.30000109.1
199A37.8Very low40.8Very low96 Ų96126.4 Ų126.479%0.79380%0.798SS**  trans81.192.6167.700000118
200A37.3Very low40.6Very low107 Ų107126.2 Ų126.288%0.88480%0.802SS**  trans-16475.213400000109.1
201A39.7Very low40.6Very low106 Ų106123 Ų12388%0.87680%0.8SS**  trans-84.5104.616000000107.5
202A36.6Very low40.4Very low96 Ų96125.6 Ų125.679%0.79381%0.808SS**  trans-180144.5152.300000110.8
203A36.3Very low39.7Very low103 Ų103126.4 Ų126.485%0.85181%0.805SS**  trans80.288.8164.100000117.9
204A33.8Very low39.7Very low78 Ų78127.4 Ų127.465%0.64581%0.809SS**  trans-17776.2131.600000109.7M206A204-M206 HydrophobicContact CB-CE 3.69Å; A204-M206 HydrophobicContact CB-SD 4.4Å; A204-M206 PolarHBondContact O-N 3.08Å
205A40.7Very low39.6Very low104 Ų104126 Ų12686%0.8680%0.804SS**  trans-81.899.2161.600000107.9
206M43.5Very low39.8Very low162 Ų162125.5 Ų125.580%0.79881%0.806SS**  trans-140.8110.11646.1-81.8-165.800109.7A204A204-M206 HydrophobicContact CB-CE 3.69Å; A204-M206 HydrophobicContact CB-SD 4.4Å; A204-M206 PolarHBondContact O-N 3.08Å
207G37.2Very low39.4Very low75 Ų75123.5 Ų123.577%0.77380%0.803SS**  trans71.991.6143.900000117.9S209G207-S209 PolarHBondContact O-N 3.42Å
208D45.2Very low39.9Very low167 Ų167120.4 Ų120.489%0.89379%0.789SS**  trans-49.7112.8142.7-86.5-80.7000109.8
209S49.1Very low40Very low106 Ų106125 Ų12574%0.74179%0.789SS**  trans161.685.2147-780000110.7G207G207-S209 PolarHBondContact O-N 3.42Å
210L39Very low40.4Very low174 Ų174131.2 Ų131.291%0.91179%0.792SS**  trans-159.985.4156.4-76.8-171.3000111.4
211C45.5Very low40.5Very low130 Ų130129.3 Ų129.388%0.87878%0.776SS**  170.570.3123.454.90000112F213C211-F213 PolarHBondContact O-N 3.3Å
212S33Very low40.7Very low121 Ų121130.2 Ų130.285%0.84677%0.771SS**  trans-62.4127.4147.2-90.20000108.5H214S212-H214 PolarHBondContact O-N 3.12Å; S212-H214 VanDerWaalsContact O-N 3.13Å
213F32.7Very low41.1Very low194 Ų194130.9 Ų130.985%0.85178%0.777SS**  trans-60.2105.7175.8-171.9-95.3000110C211 A215C211-F213 PolarHBondContact O-N 3.3Å; F213-A215 PolarHBondContact O-N 3.46Å
214H38.4Very low41.2Very low179 Ų179129 Ų12983%0.82977%0.768SS**  trans-79.3109.9172.2-129.1-115.2000108.9S212 N216S212-H214 PolarHBondContact O-N 3.12Å; S212-H214 VanDerWaalsContact O-N 3.13Å; H214-N216 VanDerWaalsContact C-N 3.33Å; H214-N216 PolarHBondContact O-N 3.48Å
215A42.2Very low41.5Very low88 Ų88133.6 Ų133.673%0.72778%0.778SS**  trans-72.383.4173.500000110.2F213F213-A215 PolarHBondContact O-N 3.46Å
216N45.4Very low41.6Very low132 Ų132134.8 Ų134.871%0.70678%0.777SS**  trans-156.973.8152.8-156.319.8000110.6H214 T218H214-N216 VanDerWaalsContact C-N 3.33Å; H214-N216 PolarHBondContact O-N 3.48Å; N216-T218 PolarHBondContact O-N 3.09Å; N216-T218 PolarHBondContact OD1-OG1 3.42Å
217D33.2Very low41.7Very low109 Ų109130.4 Ų130.458%0.58377%0.773SS**  trans-86.379.7173.7-140.3-60.9000108.7R219D217-R219 PolarHBondContact O-N 3.16Å; D217-R219 VanDerWaalsContact O-N 3.15Å; D217-R219 VanDerWaalsContact OD1-CB 3.28Å; D217-R219 WeakPolarHBondContact OD1-CB 3.32Å; D217-R219 WeakPolarHBondContact OD1-CD 3.45Å; D217-R219 VanDerWaalsContact OD1-CG 3.31Å; D217-R219 WeakPolarHBondContact OD1-CG 3.36Å; D217-R219 IonicContact OD1-NH1 3.75Å
218T49.4Very low41.8Very low86 Ų86134 Ų13453%0.52878%0.78SS.*  trans-8138.6169.8-41.90000111.1N216 W220 A221N216-T218 PolarHBondContact O-N 3.09Å; N216-T218 PolarHBondContact OD1-OG1 3.42Å; T218-W220 PolarHBondContact O-N 3.11Å; T218-A221 HydrophobicContact CG2-CB 3.59Å
219R43.5Very low41.6Very low212 Ų212131.6 Ų131.680%0.878%0.776SS**THydrogen-bonded Turntrans-86.113178.2-70.6-17757.1-93.2-5.3114.4D217D217-R219 PolarHBondContact O-N 3.16Å; D217-R219 VanDerWaalsContact O-N 3.15Å; D217-R219 VanDerWaalsContact OD1-CB 3.28Å; D217-R219 WeakPolarHBondContact OD1-CB 3.32Å; D217-R219 WeakPolarHBondContact OD1-CD 3.45Å; D217-R219 VanDerWaalsContact OD1-CG 3.31Å; D217-R219 WeakPolarHBondContact OD1-CG 3.36Å; D217-R219 IonicContact OD1-NH1 3.75Å
220W47.2Very low41.1Very low226 Ų226135.8 Ų135.886%0.85678%0.784SS**THydrogen-bonded Turntrans-133.711.5175.257.2-84.4000114.6T218 T222T218-W220 PolarHBondContact O-N 3.11Å; W220-T222 PolarHBondContact O-N 3.42Å; W220-T222 VanDerWaalsContact O-N 3.17Å
221A39.1Very low41.1Very low67 Ų67134.9 Ų134.955%0.55478%0.779SS**  trans-82.996.4170.500000110.3T218T218-A221 HydrophobicContact CG2-CB 3.59Å
222T43Very low40.6Very low125 Ų125136.4 Ų136.477%0.76777%0.773SS**  trans28.3113.3137.3-48.60000117.7W220 G224W220-T222 PolarHBondContact O-N 3.42Å; W220-T222 VanDerWaalsContact O-N 3.17Å; T222-G224 PolarHBondContact O-N 3.06Å
223A46Very low40.9Very low111 Ų111137 Ų13792%0.91777%0.766SS**  trans-57.6107.5153.200000109.1
224G37.7Very low41.7Very low64 Ų64133.3 Ų133.366%0.6676%0.762SS**  trans-138.2117.7171.700000108.4T222T222-G224 PolarHBondContact O-N 3.06Å
225M39.9Very low42.8Very low173 Ų173130.5 Ų130.585%0.85276%0.76SS**  trans-10.2148.6170.7-55.7-73.689.800119.8
226P42.6Very low42.5Very low129 Ų129130.3 Ų130.384%0.83876%0.758SS**  trans-84.3137.6170.835.1-29.6000111
227G45.5Very low42.1Very low71 Ų71132.7 Ų132.773%0.73277%0.77SS**  trans139.790.2163.500000113.4
228V39.5Very low42.1Very low151 Ų151130.9 Ų130.992%0.91578%0.777SS**  trans-168.8144.5134.7-850000109.9
229S41.6Very low41.6Very low116 Ų116138.9 Ų138.981%0.81180%0.798SS**  trans-54.6142-170.5-44.60000116.1
230Q39.4Very low41.2Very low193 Ų193135.7 Ų135.790%0.90279%0.791SS**  trans-110.6121.5164-100-104.813.200109.6Q232Q230-Q232 PolarHBondContact O-N 3.33Å
231L38.1Very low40.7Very low156 Ų156132.9 Ų132.982%0.81779%0.788SS**  trans-67112.4176.3-99.667.8000111.9
232Q34.8Very low40.6Very low161 Ų161136.6 Ų136.675%0.75279%0.794SS**  32.3112.8116.4-166.788.6-40.200121.3Q230Q230-Q232 PolarHBondContact O-N 3.33Å
233L38.8Very low40.6Very low133 Ų133138.6 Ų138.670%0.69679%0.794SS**  trans76.6158.7139.4-70.6166.5000122.7
234P50.6Low40.1Very low118 Ų118136.5 Ų136.577%0.76678%0.777SS**  cis-134.9-178.8-9.722.63.3000116.9
235P61.8Low40.2Very low119 Ų119142.4 Ų142.477%0.77379%0.789SS**  trans-113.6169.4-167.241.1-29.7000115.7
236A34.7Very low40.1Very low85 Ų85138.7 Ų138.770%0.70279%0.786SS**  trans-163.5129.4154.200000114.9
237L37.4Very low40Very low182 Ų182141.9 Ų141.995%0.95379%0.79SS**  trans56.7127.4142.4-62.6161.2000119
238G34.6Very low39.5Very low70 Ų70144.3 Ų144.372%0.72280%0.796SS**  cis149.4132.17.800000108.4
239R37.8Very low39.5Very low255 Ų255144.5 Ų144.596%0.96279%0.791SS**  trans-177.1134.9135.6-113-173.7174.9-105.22.2112.9
240Q36Very low39.5Very low144 Ų144145 Ų14567%0.67380%0.795SS**  trans-82.3143-179.7-177.7-131-27.600111.3
241H35.4Very low39.4Very low167 Ų167144.4 Ų144.477%0.77379%0.792SS**  trans-158.5136.9134.4-154.666000111.9
242Q37.9Very low38.9Very low146 Ų146142.9 Ų142.968%0.68279%0.792SS**  trans-96.6-179.9-175.4-95.3178.8-14.500112.1
243H42.6Very low38.9Very low166 Ų166140.2 Ų140.277%0.76979%0.791SS**  trans114.8137.7158.6-71.9-99.9000113.1
244A35.4Very low38.9Very low68 Ų68141.8 Ų141.856%0.56280%0.8SS**  cis178.2129.4-2500000105.7
245M39.7Very low38.1Very low188 Ų188142 Ų14293%0.92680%0.804SS**  trans60.9125.6137.9-47.7-172.7-156.300122.6
246A38.1Very low36.7Very low94 Ų94139.9 Ų139.978%0.77780%0.804SS**  159.9100.3127.200000108.7
247Q39.6Very low37.8Very low196 Ų196141.8 Ų141.892%0.91681%0.809SS**  49.7109.487.7-64.3-1642800115.5
248S36.5Very low38.7Very low123 Ų123139 Ų13986%0.8680%0.802SS**  -160.3120.9127.4-167.10000110.7
249L39.3Very low39.5Very low154 Ų154141.3 Ų141.381%0.80680%0.804SS**  trans-77.9150.8167.8-65.9161.2000109.3
250S40.4Very low39.6Very low128 Ų128136.7 Ų136.790%0.89580%0.799SS**  trans-168.6119.2137.9-80.40000110.1
251Q37.2Very low39.6Very low180 Ų180135.5 Ų135.584%0.84181%0.806SS**  trans-91.3150.5168.9-53.3-172.645.700109.3
252C28.5Very low39.8Very low123 Ų123136.9 Ų136.983%0.83182%0.815SS**  trans176.2115.1130.145.80000114.1
253S34.3Very low39.6Very low105 Ų105133.7 Ų133.773%0.73482%0.821SS**  37.4130.6125.9-55.60000125.4
254L38.5Very low39.3Very low166 Ų166133.9 Ų133.987%0.86983%0.827SS**  64116.1126.4-65.7164.9000122
255S34.1Very low39.2Very low123 Ų123136.2 Ų136.286%0.8684%0.84SS**  trans163.4114.6133.657.50000108.7
256G33.6Very low38.9Very low74 Ų74134 Ų13476%0.76383%0.832SS**  102.7125.976.600000110.5
257P56.7Low38.8Very low126 Ų126136.8 Ų136.882%0.81883%0.831SS**  trans-98163.8-176.437.9-32.1000113.1
258P55.8Low38.6Very low124 Ų124132.6 Ų132.681%0.80582%0.823SS**  trans-135.5172.1151.428.8-8.2000114.4
259P51.2Low38.7Very low118 Ų118132.3 Ų132.377%0.76682%0.821SS**  trans-117.1177-134.242.7-34.9000116.8
260N40.4Very low38.7Very low158 Ų158132.6 Ų132.685%0.84582%0.823SS**  trans-13.9138.1163.6-54.7-32.6000119.3
261S35.4Very low38.3Very low119 Ų119129.8 Ų129.883%0.83282%0.815SS**  trans-150.4132.2140.474.60000112.4
262M39.4Very low38.3Very low195 Ų195127.1 Ų127.196%0.96182%0.816SS**  trans-65.5155.4172.4-62-166.8-81.100112.5
263G34.9Very low38.5Very low79 Ų79124.8 Ų124.881%0.81481%0.812SS**  trans-168.3102.3169.200000112
264L36.3Very low38.7Very low170 Ų170128.5 Ų128.589%0.8982%0.823SS**  trans-72.1173.5175.2-74.8158.5000112.1
265S32.5Very low38.6Very low118 Ų118128.1 Ų128.183%0.82582%0.817SS**  trans77.6115.2160.448.90000118.5
266N33.9Very low38.6Very low141 Ų141127.4 Ų127.475%0.75481%0.812SS**  trans-141.2136.1131.5-162.226.9000111.7
267M36.7Very low38.7Very low153 Ų153131.1 Ų131.175%0.75481%0.809SS**  trans-80.6152.8-166.353.1-132151.100114.5
268S35.7Very low37.7Very low108 Ų108132.2 Ų132.276%0.75581%0.807SS**  trans-45139.4157.6-176.80000112.5
269S38.8Very low36.9Very low116 Ų116137.7 Ų137.781%0.81181%0.813SS**  trans-151.6134.8153.839.60000111.8
270N38.1Very low36.2Very low160 Ų160140.2 Ų140.286%0.85682%0.815SS**  trans-75.1169.5-172.6-65.8-48.4000114.2
271G32.7Very low36Very low70 Ų70140 Ų14072%0.72281%0.814SS**  trans147.890153.100000112.3
272S36.3Very low37.1Very low123 Ų123138.1 Ų138.186%0.8680%0.799SS**  81.7114.971.6-62.30000115.6
273G32.4Very low36.9Very low74 Ų74138.5 Ų138.576%0.76380%0.796SS**  trans82.2146.5146.700000116.6
274L38.7Very low37.7Very low183 Ų183140.5 Ų140.596%0.95879%0.794SS**  cis-160.8157.724.7-85.1168.7000111.8
275Q37.7Very low37.6Very low158 Ų158135.8 Ų135.874%0.73879%0.786SS**  trans-74.4161.5173.3-70.4177.80.600114.4
276S34.4Very low37.9Very low109 Ų109139 Ų13976%0.76279%0.791SS**  176.2115.7118.834.60000111.2
277H35.3Very low38.8Very low152 Ų152138.3 Ų138.370%0.70479%0.791SS**  65.612496.3-74.8-81.2000113.4
278L34.1Very low39.1Very low148 Ų148137 Ų13778%0.77579%0.794SS**  -168.714063.6-78156.9000110.6
279Y39.2Very low39.2Very low239 Ų239136.6 Ų136.694%0.93780%0.798SS**  173.8114.9124.7-99.5-75.6000108.9
280Q36.3Very low39Very low172 Ų172136.9 Ų136.980%0.80480%0.8SS**  trans-116.3150173.1-93.3-132.382.500109.3
281N37.8Very low38.9Very low154 Ų154137.7 Ų137.782%0.82480%0.803SS**  trans-167.4163.3134.5-118.439.3000110.5
282P57.1Low39Very low79 Ų79139.9 Ų139.951%0.51381%0.807SS.*  -129.3173.2-113.332.6-11000114.2
283F36.8Very low38.9Very low203 Ų203137.3 Ų137.389%0.8980%0.8SS**  trans173.3159.3140.8-92.2-56.1000110.2
284P51Low39.7Very low120 Ų120139.5 Ų139.578%0.77980%0.801SS**  -119.2159.6-129.634-16.3000115
285G33.4Very low39.8Very low71 Ų71136.8 Ų136.873%0.73279%0.792SS**  trans106.997.1150.100000115.6
286M40.4Very low39.7Very low185 Ų185136 Ų13691%0.91179%0.793SS**  170143.5111.9-73.7-123.28500109.1
287V52.1Low39.6Very low127 Ų127137.5 Ų137.577%0.7780%0.797SS**  trans-65.5157.4-161.1-63.80000116.7
288P43.7Very low39.9Very low125 Ų125136.8 Ų136.881%0.81280%0.804SS**  trans-100.7133.7163.935.2-24.9000111.4
289A37.9Very low39.8Very low101 Ų101133 Ų13384%0.83580%0.801SS**  trans-104.8133.2169.300000110.2
290S34.5Very low39.9Very low121 Ų121127.1 Ų127.185%0.84679%0.794SS**  trans-64145.1-169.9-520000114.8
291L35.2Very low40.4Very low177 Ų177125 Ų12593%0.92780%0.796SS**  trans-74.3129.8166-74.7157.9000110.7
292S35.5Very low40.2Very low116 Ų116125.5 Ų125.581%0.81179%0.793SS**  trans-125.7126.8153.7-68.10000107.3
293G34.2Very low39.5Very low69 Ų69128.5 Ų128.571%0.71180%0.804SS**  trans-64.1175.7164.200000111.2
294P49.3Very low39.3Very low120 Ų120125 Ų12578%0.77980%0.803SS**  -151.5163.867.138.6-17.7000117.7
295T39.2Very low38.7Very low126 Ų126124.3 Ų124.377%0.77380%0.801SS**  trans24.8128.8145.363.30000123.9
296N36.4Very low38.6Very low141 Ų141126.1 Ų126.175%0.75480%0.803SS**  trans67.1115.9130.3-156.9-15.8000119.2
297V33.2Very low39.2Very low142 Ų142122.2 Ų122.286%0.86179%0.791SS**  -162.2127.3125.5-83.90000111.7
298T41.3Very low38.8Very low136 Ų136124 Ų12483%0.83479%0.791SS**  trans-19.1131.1152-56.10000116.3
299G31.6Very low38.8Very low69 Ų69125 Ų12571%0.71179%0.79SS**  trans-168.3100164.900000112
300S41.6Very low39Very low115 Ų115125.7 Ų125.780%0.80478%0.779SS**  trans-54.4157.9162-660000110.8
301P45.1Very low40Very low128 Ų128125.4 Ų125.483%0.83177%0.772SS**  -126.9141.3127.926.4-11.8000112.7
302Q35.7Very low40.8Very low164 Ų164128.3 Ų128.377%0.76677%0.771SS**  trans-58149.2177.9-74.7-81.85.200113.5
303L42.3Very low41.6Very low143 Ų143133.1 Ų133.175%0.74977%0.771SS**  trans-24.6133.5153.2-65.4156.8000115.4
304C32Very low42.6Very low129 Ų129132.9 Ų132.987%0.87277%0.769SS**  trans-143.389.1136.8-163.40000108.3
305S37.5Very low43.6Very low105 Ų105131.1 Ų131.173%0.73476%0.756SS**  trans-83.7116.3165.3-62.80000107.8
306S32.7Very low45.5Very low109 Ų109128.3 Ų128.376%0.76274%0.742SS**  trans-113.7121.9150.5-106.10000107.3
307P51.5Low47.4Very low104 Ų104127.4 Ų127.468%0.67574%0.736SS**  trans-63.4156.815730.9-23.6000105.3
308E44.8Very low49.2Very low163 Ų163123.1 Ų123.176%0.76272%0.715SS**SBend-166.710.375.1-39.7-166.698.600111.5
309N44Very low51.2Low148 Ų148118.8 Ų118.879%0.79169%0.69SS**SBendtrans-120.313.2-162.9-68.9-57.8000117.6
310D40.9Very low53.6Low114 Ų114120.5 Ų120.561%0.6168%0.683SS**  trans-118.216.4-176.2-79.2-63.6000116.2W312 R313D310-W312 PolarHBondContact O-N 3.06Å; D310-W312 VanDerWaalsContact O-N 3.15Å; D310-R313 PolarHBondContact O-N 3.1Å; D310-R313 IonicContact OD1-NE 2.88Å
311V55.3Low55.7Low116 Ų116123.6 Ų123.670%0.70368%0.677SS**THydrogen-bonded Turntrans-66.6-20.3-177.8-171.50000113
312W52.9Low57.2Low237 Ų237125 Ų12590%0.89867%0.666SS**THydrogen-bonded Turntrans-94.1-10.9-176.6-64101.4000115D310D310-W312 PolarHBondContact O-N 3.06Å; D310-W312 VanDerWaalsContact O-N 3.15Å
313R53.2Low59.5Low217 Ų217124.9 Ų124.982%0.81966%0.663SS**SBendtrans-92.6-4.6-173.5-145.3179.6-69.2-91.63.3114D310D310-R313 PolarHBondContact O-N 3.1Å; D310-R313 IonicContact OD1-NE 2.88Å
314G54.4Low61.3Low65 Ų65120.8 Ų120.867%0.6765%0.649SS**  trans-119-2.8-170.600000117.4S316G314-S316 PolarHBondContact O-N 3.44Å
315T69.2Low63.5Low82 Ų82120.2 Ų120.250%0.50364%0.637SS.*  trans-8586.9-176.237.30000111.8L320T315-L320 HydrophobicContact CG2-CD1 4.07Å
316S79.5Confident65.3Low67 Ų67121.9 Ų121.947%0.46963%0.633SS.*  trans-53.8143.9168.8175.10000111G314 A318 S319 L320G314-S316 PolarHBondContact O-N 3.44Å; S316-A318 PolarHBondContact O-N 3.07Å; S316-A318 PolarHBondContact OG-N 3.49Å; S316-S319 WeakPolarHBondContact O-CA 3.3Å; S316-S319 WeakPolarHBondContact O-CB 3.39Å; S316-S319 PolarHBondContact O-N 3.09Å; S316-L320 PolarHBondContact O-N 2.81Å; S316-L320 VanDerWaalsContact O-N 3.09Å
317I75.9Confident67Low123 Ų123122.9 Ų122.963%0.63163%0.625SS**Hα-helixtrans-50.5-32172.2-90.5159.1000111.9R321I317-R321 WeakPolarHBondContact O-CB 3.25Å; I317-R321 VanDerWaalsContact O-CG 3.3Å; I317-R321 WeakPolarHBondContact O-CG 3.38Å; I317-R321 PolarHBondContact O-N 3.05Å
318A71.7Confident67.9Low52 Ų52122 Ų12243%0.4362%0.619SS.*Hα-helixtrans-66.7-37.7174.700000112.6S316 R322S316-A318 PolarHBondContact O-N 3.07Å; S316-A318 PolarHBondContact OG-N 3.49Å; A318-R322 PolarHBondContact O-N 3.16Å; A318-R322 VanDerWaalsContact O-N 3.1Å
319S82.6Confident69Low44 Ų44118.7 Ų118.731%0.30861%0.609SS.*Hα-helixtrans-70.9-40.2176.9-57.30000111.7S316 R321 R322 K323S316-S319 WeakPolarHBondContact O-CA 3.3Å; S316-S319 WeakPolarHBondContact O-CB 3.39Å; S316-S319 PolarHBondContact O-N 3.09Å; S319-R321 VanDerWaalsContact C-N 3.35Å; S319-R321 PolarHBondContact O-N 3.04Å; S319-R322 PolarHBondContact O-N 3.43Å; S319-K323 WeakPolarHBondContact O-CB 3.49Å; S319-K323 PolarHBondContact O-N 3.18Å
320L82.8Confident70.2Confident106 Ų106115.8 Ų115.856%0.55560%0.6SS**Hα-helixtrans-61.5-42.6173.5-110.575.7000112T315 S316 K323 A324T315-L320 HydrophobicContact CG2-CD1 4.07Å; S316-L320 PolarHBondContact O-N 2.81Å; S316-L320 VanDerWaalsContact O-N 3.09Å; L320-K323 PolarHBondContact O-N 3.04Å; L320-A324 PolarHBondContact O-N 3.44Å
321R84.9Confident71.3Confident179 Ų179115.8 Ų115.868%0.67560%0.598SS**Hα-helixtrans-64.6-43.3178.2-76.7174.9175.1175.6-1112.6I317 S319 A324 L325I317-R321 WeakPolarHBondContact O-CB 3.25Å; I317-R321 VanDerWaalsContact O-CG 3.3Å; I317-R321 WeakPolarHBondContact O-CG 3.38Å; I317-R321 PolarHBondContact O-N 3.05Å; S319-R321 VanDerWaalsContact C-N 3.35Å; S319-R321 PolarHBondContact O-N 3.04Å; R321-A324 PolarHBondContact O-N 3.36Å; R321-L325 PolarHBondContact O-N 3Å
322R78.3Confident71.7Confident158 Ų158114.4 Ų114.460%0.59659%0.593SS**Hα-helixtrans-62-46.8175.9-78.6-172.9-70.2161.2-1.8111.7A318 S319 A324 L325 E326A318-R322 PolarHBondContact O-N 3.16Å; A318-R322 VanDerWaalsContact O-N 3.1Å; S319-R322 PolarHBondContact O-N 3.43Å; R322-A324 VanDerWaalsContact C-N 3.27Å; R322-A324 PolarHBondContact O-N 3.02Å; R322-L325 WeakPolarHBondContact O-CB 3.48Å; R322-L325 PolarHBondContact O-N 3.22Å; R322-E326 PolarHBondContact O-N 3.18Å
323K82.6Confident71.9Confident162 Ų162112 Ų11270%0.70459%0.59SS**Hα-helixtrans-62.7-33.5179.5-164.7165.2-177.2171.70112.8S319 L320 H327S319-K323 WeakPolarHBondContact O-CB 3.49Å; S319-K323 PolarHBondContact O-N 3.18Å; L320-K323 PolarHBondContact O-N 3.04Å; K323-H327 PolarHBondContact O-N 3.3Å; K323-H327 VanDerWaalsContact O-N 3.09Å
324A80.7Confident71.7Confident57 Ų57109.8 Ų109.847%0.47160%0.6SS.*Hα-helixtrans-65.7-40.2173.300000112.4L320 R321 R322 H327 T328L320-A324 PolarHBondContact O-N 3.44Å; R321-A324 PolarHBondContact O-N 3.36Å; R322-A324 VanDerWaalsContact C-N 3.27Å; R322-A324 PolarHBondContact O-N 3.02Å; A324-H327 PolarHBondContact O-N 3.39Å; A324-T328 WeakPolarHBondContact O-CG2 3.45Å; A324-T328 PolarHBondContact O-N 3.15Å; A324-T328 PolarHBondContact O-OG1 3.31Å
325L77.9Confident72.6Confident116 Ų116112 Ų11261%0.60760%0.597SS**Hα-helixtrans-66-41.6176.7-69.6171.3000111.8R321 R322 H327 T328 V329R321-L325 PolarHBondContact O-N 3Å; R322-L325 WeakPolarHBondContact O-CB 3.48Å; R322-L325 PolarHBondContact O-N 3.22Å; L325-H327 VanDerWaalsContact C-N 3.31Å; L325-H327 PolarHBondContact O-N 3.31Å; L325-T328 WeakPolarHBondContact CA-OG1 3.38Å; L325-T328 PolarHBondContact O-N 3.35Å; L325-T328 VanDerWaalsContact O-N 3.16Å; L325-T328 PolarHBondContact O-OG1 3.44Å; L325-V329 WeakPolarHBondContact O-CG2 3.41Å; L325-V329 PolarHBondContact O-N 3.38Å
326E74.6Confident72.8Confident140 Ų140113.6 Ų113.665%0.65460%0.602SS**Hα-helixtrans-62.9-38.6175.9-68.4-176.4179.200112R322 T328 V329 S330R322-E326 PolarHBondContact O-N 3.18Å; E326-T328 VanDerWaalsContact C-N 3.33Å; E326-T328 PolarHBondContact O-N 3.44Å; E326-V329 PolarHBondContact O-N 3.15Å; E326-S330 PolarHBondContact O-N 3.23Å
327H69.6Low72.4Confident130 Ų130116.2 Ų116.260%0.60261%0.609SS**Hα-helixtrans-65.9-35.1174.9-164-84.9000112.5K323 A324 L325 M331K323-H327 PolarHBondContact O-N 3.3Å; K323-H327 VanDerWaalsContact O-N 3.09Å; A324-H327 PolarHBondContact O-N 3.39Å; L325-H327 VanDerWaalsContact C-N 3.31Å; L325-H327 PolarHBondContact O-N 3.31Å; H327-M331 WeakPolarHBondContact O-CG 3.36Å; H327-M331 PolarHBondContact O-N 3.24Å
328T69.4Low72.2Confident87 Ų87115.8 Ų115.853%0.53461%0.608SS.*Hα-helixtrans-70.3-34.5174.154.20000113.1A324 L325 E326A324-T328 WeakPolarHBondContact O-CG2 3.45Å; A324-T328 PolarHBondContact O-N 3.15Å; A324-T328 PolarHBondContact O-OG1 3.31Å; L325-T328 WeakPolarHBondContact CA-OG1 3.38Å; L325-T328 PolarHBondContact O-N 3.35Å; L325-T328 VanDerWaalsContact O-N 3.16Å; L325-T328 PolarHBondContact O-OG1 3.44Å; E326-T328 VanDerWaalsContact C-N 3.33Å; E326-T328 PolarHBondContact O-N 3.44Å
329V69.4Low72.2Confident92 Ų92119.8 Ų119.856%0.55862%0.619SS**Hα-helixtrans-69.9-41.1176.8173.10000110.7L325 E326 M331 S332L325-V329 WeakPolarHBondContact O-CG2 3.41Å; L325-V329 PolarHBondContact O-N 3.38Å; E326-V329 PolarHBondContact O-N 3.15Å; V329-M331 VanDerWaalsContact C-N 3.29Å; V329-M331 PolarHBondContact O-N 3.01Å; V329-S332 PolarHBondContact O-N 3.45Å; V329-S332 VanDerWaalsContact O-N 3.13Å; V329-S332 PolarHBondContact O-OG 3.06Å
330S68.4Low71.5Confident87 Ų87124.8 Ų124.861%0.60864%0.64SS**Hα-helixtrans-61.3-35.3178.1-168.30000113.1E326 S332E326-S330 PolarHBondContact O-N 3.23Å; S330-S332 VanDerWaalsContact C-N 3.3Å; S330-S332 PolarHBondContact O-N 3.46Å
331M64.1Low70.7Confident115 Ų115126.1 Ų126.157%0.56765%0.646SS**G310 helixtrans-78.5-9.7178.2-70.4-9967.300114.3H327 V329 F333H327-M331 WeakPolarHBondContact O-CG 3.36Å; H327-M331 PolarHBondContact O-N 3.24Å; V329-M331 VanDerWaalsContact C-N 3.29Å; V329-M331 PolarHBondContact O-N 3.01Å; M331-F333 VanDerWaalsContact C-N 3.34Å
332S64.1Low69.6Low86 Ų86122.1 Ų122.160%0.60164%0.644SS**G310 helixtrans-88.1-0.9178.365.80000114V329 S330V329-S332 PolarHBondContact O-N 3.45Å; V329-S332 VanDerWaalsContact O-N 3.13Å; V329-S332 PolarHBondContact O-OG 3.06Å; S330-S332 VanDerWaalsContact C-N 3.3Å; S330-S332 PolarHBondContact O-N 3.46Å
333F56.3Low68.9Low187 Ų187119.1 Ų119.182%0.8265%0.647SS**G310 helixtrans-116.215.6-177.1-104.4-83.6000114.5M331M331-F333 VanDerWaalsContact C-N 3.34Å
334T49.9Very low67.7Low170 Ų170115.2 Ų115.2100%1.04364%0.642SS**  trans-115.30172.7620000111.3

Retrieved 334 of 334 residues in 771.2 ms (Link to these results)