A0A087YSB6_POEFO Loading...

Forkhead box E3

AlphaFold DB (A0A3B3TV00), UniProt , Accession A0A087YSB6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 418 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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 low43.6Very low248 Ų248154.3 Ų154.3100%1.22283%0.826SS**  0131.10-70.8172.2175.500106.8
2T37.9Very low43.5Very low147 Ų147154.9 Ų154.990%0.90282%0.824SS**  trans-124.9161.2-157.2-31.80000111
3L41.4Very low43Very low167 Ų167151.5 Ų151.587%0.87482%0.818SS**  trans-66.7163.9-161.1-71.2155.3000118
4A45Very low43Very low77 Ų77152.3 Ų152.364%0.63682%0.822SS**  trans102104.7133.900000121.7
5N46.9Very low43Very low152 Ų152152.7 Ų152.781%0.81382%0.819SS**  64.4172.2120.3-78.1-29.7000122.9
6Y45.6Very low42.8Very low222 Ų222151.6 Ų151.687%0.87182%0.82SS**  trans80.2142.5-176.1-57.3-81.3000115.8
7S43.1Very low42.6Very low92 Ų92148.3 Ų148.364%0.64382%0.818SS**  cis159.8132.9-40.954.20000108.4
8Y43.6Very low42.5Very low223 Ų223149.4 Ų149.488%0.87582%0.816SS**  trans43.3123.6152.7-101.1-94.3000121.6
9F44.5Very low43.4Very low211 Ų211147.6 Ų147.693%0.92581%0.812SS**  trans-149.9163.9132-145.3-101.9000112.8
10S43.8Very low43.4Very low91 Ų91144.8 Ų144.864%0.63680%0.804SS**  trans-131.9166.6-166.3-173.30000112.8
11G39.6Very low44Very low67 Ų67144 Ų14469%0.69181%0.805SS**  trans145.8106.117300000110.6
12M43.2Very low44.1Very low162 Ų162136.4 Ų136.480%0.79878%0.782SS**  cis78.2111.445.5-65.7-159.668.800116.5
13C37.1Very low44Very low111 Ų111138.5 Ų138.575%0.7578%0.782SS**  trans70.5132152.3-56.60000118.1
14N42.9Very low43.7Very low162 Ų162134.5 Ų134.587%0.86677%0.773SS**  -156.5168.570.7-145.316.9000115.6
15M42.2Very low43.4Very low159 Ų159136.5 Ų136.578%0.78378%0.782SS**  trans-94-178.4-177.1-73.6-172.973.600115.1
16T39.5Very low43.8Very low135 Ų135134.4 Ų134.483%0.82878%0.777SS**  trans87144.915966.40000118
17A40.3Very low43.3Very low95 Ų95130.6 Ų130.679%0.78577%0.771SS**  cis-164.5162.5-21.500000110.8
18E41.5Very low43.2Very low168 Ų168132.2 Ų132.279%0.78578%0.777SS**  trans-55.9167.1162.3-86.6-89.4145.500112.7
19P57.8Low43.1Very low115 Ų115130.2 Ų130.275%0.74778%0.777SS**  cis-146.8178.631.841.5-19.9000120.3
20S44.7Very low43.1Very low92 Ų92125.4 Ų125.464%0.64377%0.77SS**  trans-58.7162.4164.3170.60000115.3
21P55.4Low43.7Very low127 Ų127126.8 Ų126.883%0.82578%0.777SS**  -134177.6126.939.2-29.9000114.2
22A49.3Very low43.5Very low90 Ų90130.1 Ų130.174%0.74478%0.779SS**  trans-136168.8-174.300000114
23E36.5Very low43.4Very low191 Ų191129.5 Ų129.589%0.89378%0.784SS**  trans87.3128.2156.9-62.6-119.8122.200123.2
24A35.7Very low43.4Very low83 Ų83128.3 Ų128.369%0.68678%0.777SS**  trans82.7104.3136.600000124.6
25S38.6Very low43.5Very low118 Ų118128.5 Ų128.583%0.82578%0.777SS**  51.2167117.7-58.10000123.1
26P56.1Low43.2Very low109 Ų109127.8 Ų127.871%0.70878%0.777SS**  cis-135.8-167.7-16.434-11000115.8
27D34.2Very low43.2Very low142 Ų142127.8 Ų127.876%0.75978%0.777SS**  trans89.8112.5146.3-69.6-24.2000126.1
28V40.5Very low43.6Very low125 Ų125128.9 Ų128.976%0.75878%0.775SS**  57119.4127.8-1730000122.3
29M41.2Very low43.7Very low181 Ų181127.9 Ų127.989%0.89278%0.775SS**  -175133.4117.9-97.5178.683.500112.5
30S44.9Very low43.5Very low110 Ų110128.3 Ų128.377%0.76978%0.778SS**  trans-98.1172.2172.5-51.70000111.5
31P56.1Low44Very low121 Ų121128.8 Ų128.879%0.78678%0.779SS**  -154.31579438.3-19.2000119
32N36.3Very low44Very low137 Ų137128.3 Ų128.373%0.73378%0.775SS**  trans23.2131.4148-84-40.3000123.4
33V39.8Very low44.1Very low149 Ų149129.8 Ų129.890%0.90378%0.777SS**  -142.9142.8107.7-172.10000109.3
34S38Very low44.6Very low86 Ų86128.9 Ų128.960%0.60178%0.778SS**  trans-113.8162.4-177.3-60.30000114
35L44.5Very low45Very low165 Ų165132.6 Ų132.686%0.86478%0.783SS**  trans128.5105.9161.4-93.664.1000109.7
36D36.4Very low44.9Very low145 Ų145133 Ų13378%0.77578%0.775SS**  cis77.6107.949-16631.8000114.2
37T39.4Very low44.2Very low135 Ų135135.9 Ų135.983%0.82878%0.779SS**  trans-173.9142.5154.8-71.50000108.3
38P48.8Very low44.1Very low117 Ų117133.8 Ų133.876%0.7678%0.782SS**  trans-112.8-174.1-150.242.5-35.4000117.9
39L44.6Very low44.1Very low148 Ų148139.1 Ų139.178%0.77579%0.788SS**  trans-53.4172.1-178-63.5159.5000116.7
40P51.8Low44.4Very low124 Ų124136 Ų13681%0.80578%0.782SS**  -133.5144.8100.437.7-30.5000115.8
41P56Low44Very low102 Ų102138.9 Ų138.966%0.66278%0.78SS**  trans-94.7-172.2166.942.9-35.6000110.9
42P55.5Low43.2Very low116 Ų116138.9 Ų138.975%0.75377%0.774SS**  trans-94.2179.9-145.541-40.3000114.7
43P51Low42.9Very low122 Ų122139.7 Ų139.779%0.79278%0.778SS**  trans-116.9112.7150.533-21000112.8
44L46.9Very low42.7Very low172 Ų172140 Ų14090%0.90177%0.773SS**  trans-95.5117.1140.5-83.2177000107.4
45M43.6Very low42.9Very low161 Ų161142.8 Ų142.879%0.79378%0.78SS**  trans-157155.8167.3-75.8-16079.900108.8
46L37.7Very low42.5Very low127 Ų127141.9 Ų141.967%0.66578%0.775SS**  cis-158.1167.1-33.2-170.362.6000106.2
47Q41.5Very low42.4Very low168 Ų168143.7 Ų143.779%0.78578%0.776SS**  trans-45.3152.6-178.1-58.4128.4-24.500117
48A31.5Very low42.3Very low99 Ų99142 Ų14282%0.81877%0.769SS**  trans-145.9123.513900000111.8
49R39.5Very low41.6Very low236 Ų236145 Ų14589%0.89177%0.773SS**  trans-104.1142.3143.7-76.5-166.3-178.1-158.34.5106.2
50P48.7Very low41.7Very low116 Ų116143 Ų14375%0.75377%0.769SS**  -130.314710024.9-8.3000110.6
51K36.8Very low40.9Very low170 Ų170146 Ų14674%0.73977%0.772SS**  65.6111.764-94.4-159.7175.7-168.50114.9
52D37.8Very low39.6Very low121 Ų121144.2 Ų144.265%0.64777%0.773SS**  trans107.1122.8140.1-53.7-16.5000119.3
53N31.4Very low38.6Very low155 Ų155144.4 Ų144.483%0.82978%0.777SS**  trans70.1139.4163.5-49-31.7000115.9
54I35.3Very low38.2Very low155 Ų155144 Ų14480%0.79578%0.776SS**  -157.4142.252.1-85178.8000111.5
55L41.9Very low38.1Very low145 Ų145141.8 Ų141.876%0.75977%0.772SS**  trans53.9107.9153.5-132.861.9000118.9
56I36.7Very low37.7Very low145 Ų145139.1 Ų139.174%0.74477%0.77SS**  45111.383.1-51.6176.6000113.3
57K34.4Very low38Very low184 Ų184137.3 Ų137.380%0.877%0.773SS**  174.6109.1103.3-162.9136.7-178178.70113.6
58S36.3Very low37.9Very low98 Ų98138 Ų13869%0.68578%0.776SS**  trans40.9130.7140.175.70000123
59E34.8Very low38.1Very low180 Ų180141.6 Ų141.684%0.84178%0.782SS**  trans-44.3168.7135.9-71.7-166.6121.700112.4
60P46.2Very low37.9Very low106 Ų106133.4 Ų133.469%0.68877%0.771SS**  cis-152.6-172.32747.3-26.9000118.3
61Q34.5Very low37.2Very low188 Ų188132 Ų13288%0.87978%0.778SS**  trans75.5145.7147.5-76.1-75.44.600121.9
62G30.3Very low37.2Very low65 Ų65128.9 Ų128.967%0.6778%0.784SS**  trans106.1127.6171.800000114.2
63S34Very low37.4Very low120 Ų120130.1 Ų130.184%0.83980%0.795SS**  cis-165.6152.4-5.844.90000110.1
64S41.3Very low37.6Very low112 Ų112125.8 Ų125.878%0.78379%0.788SS**  trans-66.1171.9171.2-57.20000113.2
65P46.9Very low38Very low126 Ų126127.4 Ų127.482%0.81879%0.791SS**  -132.2156.9108.636.6-28.9000115.8
66S34.3Very low38.1Very low105 Ų105127.3 Ų127.373%0.73480%0.797SS**  trans-61.2149.3166.7-52.20000111.2
67A43.2Very low38.2Very low90 Ų90128.5 Ų128.574%0.74480%0.8SS**  cis94.8101.745.900000114
68E39.2Very low38.2Very low181 Ų181127.2 Ų127.285%0.84680%0.796SS**  trans-145.2104165.6-34.9-80.516100104.2
69D37.5Very low38.4Very low175 Ų175131.6 Ų131.694%0.93681%0.806SS**  57.1139.693.8-16133.9000118
70G34.8Very low38.8Very low65 Ų65129.6 Ų129.667%0.6780%0.8SS**  trans117.3106.9159.100000119.4
71G32.8Very low38.8Very low87 Ų87129.9 Ų129.990%0.89780%0.801SS**  trans97.8113.5133.600000119.5
72A37.4Very low39.3Very low103 Ų103125.9 Ų125.985%0.85179%0.79SS**  trans-96.8139170.200000112.6
73V42Very low40.1Very low147 Ų147125.7 Ų125.789%0.89179%0.789SS**  trans-140.4133.6152.6-172.90000108.1
74G36.3Very low40.8Very low65 Ų65125.8 Ų125.867%0.6779%0.789SS**  trans-88.7157.7-171.800000114.7
75H42Very low41.5Very low188 Ų188130.5 Ų130.587%0.8779%0.79SS**  trans-122.1123158.9-92-92.2000109.6
76T44.8Very low42.1Very low143 Ų143134.4 Ų134.488%0.87779%0.788SS**  trans-83.1111.6176.6-520000109.2
77E39.2Very low43.3Very low171 Ų171140.7 Ų140.780%0.79980%0.796SS**  trans-127.7101.3174.1-87.5-81.6141.300110.1
78E35Very low44.1Very low157 Ų157146.1 Ų146.173%0.73480%0.802SS**  trans25.495.3146.4-68.2-63.3130.200118.4L80E78-L80 VanDerWaalsContact C-N 3.31Å; E78-L80 PolarHBondContact O-N 3.31Å
79H38.6Very low45.1Very low190 Ų190148 Ų14888%0.8880%0.802SS**  trans-78.672.7174.6-155.886.6000112.5
80L45.2Very low46.1Very low138 Ų138145.5 Ų145.572%0.72380%0.795SS**  trans-60.8127.7172-89.2156000111.2E78 T82E78-L80 VanDerWaalsContact C-N 3.31Å; E78-L80 PolarHBondContact O-N 3.31Å; L80-T82 PolarHBondContact O-N 3.45Å
81P45.1Very low47.4Very low111 Ų111148.1 Ų148.172%0.72180%0.798SS**  trans-68.8108.3-177.727.4-33.5000109.7G83P81-G83 VanDerWaalsContact C-N 3.32Å; P81-G83 PolarHBondContact O-N 3.33Å
82T45.8Very low48.9Very low104 Ų104150.1 Ų150.164%0.63878%0.784SS**  trans-64.693.5176.5-66.90000109.4L80 S84L80-T82 PolarHBondContact O-N 3.45Å; T82-S84 PolarHBondContact O-N 3.41Å
83G45.8Very low50.3Low62 Ų62157.1 Ų157.164%0.63979%0.788SS**  trans-48.5128.9-179.500000110.9P81 R85P81-G83 VanDerWaalsContact C-N 3.32Å; P81-G83 PolarHBondContact O-N 3.33Å; G83-R85 PolarHBondContact O-N 3.31Å
84S49.1Very low52.1Low121 Ų121153.2 Ų153.285%0.84678%0.778SS**  trans-49.9104.8-163.8-48.50000111.8T82 R86T82-S84 PolarHBondContact O-N 3.41Å; S84-R86 PolarHBondContact O-N 2.8Å
85R55.5Low54.5Low212 Ų212153.5 Ų153.580%0.876%0.761SS**  trans-63.988.5175.7-64.3-175.5-164.5169.67.1108.2G83 R87G83-R85 PolarHBondContact O-N 3.31Å; R85-R87 PolarHBondContact O-N 3.23Å
86R60.7Low56.7Low207 Ų207145.4 Ų145.478%0.78173%0.725SS**  trans-45103.2177.1-178.3-174.4-167.2163.811.5108.1S84 K88S84-R86 PolarHBondContact O-N 2.8Å; R86-K88 PolarHBondContact O-N 3.2Å
87R58.2Low58.8Low237 Ų237143.6 Ų143.689%0.89472%0.715SS**  trans-46.1102.7-167.8-65.4-179.5-174.1163.71.5109R85 R89R85-R87 PolarHBondContact O-N 3.23Å; R87-R89 PolarHBondContact O-N 3.23Å
88K60.3Low61.3Low204 Ų204139.1 Ų139.189%0.88769%0.692SS**  trans-68.992177.1-85.1178.6176.8173.90105.4R86R86-K88 PolarHBondContact O-N 3.2Å
89R61.7Low64.1Low222 Ų222133.6 Ų133.684%0.83867%0.671SS**PPolyproline II helixtrans-46.2128.2171.5-65.3-179.872.1155.45.3106.5R87 V91R87-R89 PolarHBondContact O-N 3.23Å; R89-V91 PolarHBondContact O-N 3.23Å
90P57.1Low66.8Low122 Ų122127.2 Ų127.279%0.79264%0.639SS**PPolyproline II helixtrans-48.7121.6-179.2-29.735.4000109.4Q92P90-Q92 PolarHBondContact O-N 3.18Å
91V62Low69.2Low120 Ų120122.5 Ų122.573%0.72761%0.614SS**PPolyproline II helixtrans-62.6116.4174.6179.10000105R89 R93R89-V91 PolarHBondContact O-N 3.23Å; V91-R93 PolarHBondContact O-N 3.26Å
92Q65.9Low71.6Confident128 Ų128117.2 Ų117.260%0.59858%0.58SS**PPolyproline II helixtrans-54.4118.6177.4-72.3178.7-4700107.5P90 G94 K95P90-Q92 PolarHBondContact O-N 3.18Å; Q92-G94 PolarHBondContact O-N 2.77Å; Q92-K95 HydrophobicContact CB-CB 4.33Å; Q92-K95 WeakPolarHBondContact O-CB 3.43Å; Q92-K95 PolarHBondContact O-N 2.95Å
93R66.2Low73.9Confident250 Ų250112.3 Ų112.394%0.94355%0.55SS**THydrogen-bonded Turntrans-54.3130.9-176.3-57-174.4-160.2-118.27.1108.1V91V91-R93 PolarHBondContact O-N 3.26Å
94G80.1Confident76.4Confident66 Ų66109.4 Ų109.468%0.6852%0.52SS*.THydrogen-bonded Turntrans86.1-8.6-175.900000116.6Q92 P96Q92-G94 PolarHBondContact O-N 2.77Å; G94-P96 WeakPolarHBondContact O-CD 3.37Å
95K86.8Confident78.6Confident70 Ų70103.7 Ų103.730%0.30448%0.48SS..  trans-73.8123.5173.5-173167.6-174.2173.50110.8Q92 F131 Y132Q92-K95 HydrophobicContact CB-CB 4.33Å; Q92-K95 WeakPolarHBondContact O-CB 3.43Å; Q92-K95 PolarHBondContact O-N 2.95Å; K95-F131 HydrophobicContact CB-CD1 4.32Å; K95-F131 HydrophobicContact CB-CD2 4.17Å; K95-F131 HydrophobicContact CB-CE1 3.97Å; K95-F131 HydrophobicContact CB-CE2 3.78Å; K95-F131 HydrophobicContact CB-CG 4.43Å; K95-F131 HydrophobicContact CB-CZ 3.68Å; K95-F131 HydrophobicContact CD-CE1 3.77Å; K95-F131 HydrophobicContact CD-CZ 3.82Å; K95-F131 HydrophobicContact CG-CD1 4.06Å; K95-F131 HydrophobicContact CG-CE1 3.61Å; K95-F131 HydrophobicContact CG-CE2 4.36Å; K95-F131 HydrophobicContact CG-CZ 3.79Å; K95-Y132 VanDerWaalsContact CE-OH 3.27Å; K95-Y132 WeakPolarHBondContact CE-OH 3.3Å
96P88.4Confident80.5Confident19 Ų1993.9 Ų93.912%0.12344%0.443CS..  trans-60.9145.9179-23.233.2000112.7G94 Y98 F129 Y132G94-P96 WeakPolarHBondContact O-CD 3.37Å; P96-Y98 HydrophobicContact CB-CD2 3.77Å; P96-Y98 HydrophobicContact CB-CE2 4.4Å; P96-Y98 PolarHBondContact O-N 3.4Å; P96-F129 HydrophobicContact CB-CD1 3.88Å; P96-F129 HydrophobicContact CB-CE1 4.03Å; P96-F129 HydrophobicContact CG-CB 3.96Å; P96-F129 HydrophobicContact CG-CD1 3.4Å; P96-F129 VanDerWaalsContact CG-CD1 3.4Å; P96-F129 HydrophobicContact CG-CE1 4.07Å; P96-F129 HydrophobicContact CG-CG 3.81Å; P96-Y132 HydrophobicContact CG-CE2 4.16Å
97P88.8Confident82.2Confident104 Ų10484 Ų8468%0.67541%0.406SS*.SBendtrans-74.725.9-178.533-37.3000114
98Y91.6Very high84Confident78 Ų7872.9 Ų72.931%0.30637%0.365SS..  trans-106.4139.9-175.5-58.8-59.3000111.9P96 M106 F129 F184P96-Y98 HydrophobicContact CB-CD2 3.77Å; P96-Y98 HydrophobicContact CB-CE2 4.4Å; P96-Y98 PolarHBondContact O-N 3.4Å; Y98-M106 HydrophobicContact CD1-CE 4.11Å; Y98-M106 HydrophobicContact CD2-CE 3.8Å; Y98-M106 HydrophobicContact CE2-CE 4.25Å; Y98-M106 HydrophobicContact CG-CE 3.73Å; Y98-F129 AromaticContact CD2-CE1 3.94Å; Y98-F129 HydrophobicContact CD2-CE1 3.94Å; Y98-F129 AromaticContact CD2-CZ 3.73Å; Y98-F129 HydrophobicContact CD2-CZ 3.73Å; Y98-F129 AromaticContact CE2-CE1 3.87Å; Y98-F129 HydrophobicContact CE2-CE1 3.87Å; Y98-F129 AromaticContact CE2-CZ 3.82Å; Y98-F129 HydrophobicContact CE2-CZ 3.82Å; Y98-F184 HydrophobicContact CD1-CB 3.75Å; Y98-F184 HydrophobicContact CE1-CB 3.72Å
99S93.8Very high85.6Confident41 Ų4164.7 Ų64.729%0.28734%0.335SS..  trans-74.1160.217070.70000111.1I101 A102 L103S99-I101 PolarHBondContact O-N 3.04Å; S99-A102 WeakPolarHBondContact O-CB 3.5Å; S99-A102 PolarHBondContact O-N 2.83Å; S99-A102 PolarHBondContact OG-N 2.99Å; S99-L103 WeakPolarHBondContact O-CG 3.23Å; S99-L103 PolarHBondContact O-N 3.49Å
100Y95.6Very high87.2Confident55 Ų5558.5 Ų58.522%0.21632%0.318CS..Hα-helixtrans-58.2-35174.6-66.9-61.2000112.6L103 I104 Y132 W139 I143Y100-L103 HydrophobicContact CD1-CD1 4.02Å; Y100-L103 HydrophobicContact CE1-CD1 4.45Å; Y100-L103 PolarHBondContact O-N 2.86Å; Y100-I104 WeakPolarHBondContact O-CD1 3.32Å; Y100-I104 VanDerWaalsContact O-CG1 3.23Å; Y100-I104 WeakPolarHBondContact O-CG1 3.48Å; Y100-I104 PolarHBondContact O-N 3.31Å; Y100-Y132 HydrophobicContact CE1-CE1 4.22Å; Y100-W139 HydrophobicContact CE1-CB 4.21Å; Y100-I143 HydrophobicContact CD1-CD1 3.79Å; Y100-I143 HydrophobicContact CD1-CG1 4.35Å; Y100-I143 HydrophobicContact CG-CD1 4.41Å
101I95Very high89Confident39 Ų3953.2 Ų53.220%0.228%0.284CS..Hα-helixtrans-59.5-48.6172.7-57.9174.2000110.2S99 L103 I104 A105 N146 N150 F153 F179S99-I101 PolarHBondContact O-N 3.04Å; I101-L103 PolarHBondContact O-N 3.14Å; I101-I104 PolarHBondContact O-N 3.33Å; I101-A105 WeakPolarHBondContact O-CB 3.36Å; I101-A105 PolarHBondContact O-N 2.8Å; I101-N146 WeakPolarHBondContact CG1-OD1 3.11Å; I101-N150 WeakPolarHBondContact CD1-OD1 3.43Å; I101-F153 HydrophobicContact CB-CE2 4.43Å; I101-F153 HydrophobicContact CB-CZ 4.4Å; I101-F153 HydrophobicContact CG1-CE2 4.49Å; I101-F153 HydrophobicContact CG2-CE2 4.01Å; I101-F153 HydrophobicContact CG2-CZ 3.77Å; I101-F153 WeakPolarHBondContact O-CZ 3.23Å; I101-F179 HydrophobicContact CG2-CE1 4.28Å; I101-F179 HydrophobicContact CG2-CZ 3.87Å
102A94.4Very high90.5Very high1 Ų154 Ų541%0.00829%0.292CS..Hα-helixtrans-64.9-37.9178.200000112.9S99 A105 M106 F184S99-A102 WeakPolarHBondContact O-CB 3.5Å; S99-A102 PolarHBondContact O-N 2.83Å; S99-A102 PolarHBondContact OG-N 2.99Å; A102-A105 PolarHBondContact O-N 3.26Å; A102-M106 WeakPolarHBondContact O-CB 3.28Å; A102-M106 WeakPolarHBondContact O-CE 3.12Å; A102-M106 WeakPolarHBondContact O-CG 3.4Å; A102-M106 PolarHBondContact O-N 2.95Å; A102-F184 HydrophobicContact CB-CB 4.08Å; A102-F184 HydrophobicContact CB-CD1 4.49Å; A102-F184 WeakPolarHBondContact CB-O 3.27Å
103L95.8Very high91.9Very high1 Ų153.4 Ų53.41%0.00529%0.289CS..Hα-helixtrans-62.3-41.9174.8-67.9173.8000112.2S99 Y100 I101 M106 A107 I125 F129 Y132S99-L103 WeakPolarHBondContact O-CG 3.23Å; S99-L103 PolarHBondContact O-N 3.49Å; Y100-L103 HydrophobicContact CD1-CD1 4.02Å; Y100-L103 HydrophobicContact CE1-CD1 4.45Å; Y100-L103 PolarHBondContact O-N 2.86Å; I101-L103 PolarHBondContact O-N 3.14Å; L103-M106 HydrophobicContact CD2-CE 3.92Å; L103-A107 PolarHBondContact O-N 2.99Å; L103-A107 VanDerWaalsContact O-N 3.15Å; L103-I125 HydrophobicContact CB-CD1 3.89Å; L103-I125 HydrophobicContact CB-CG1 4.22Å; L103-F129 HydrophobicContact CD2-CD2 3.62Å; L103-F129 HydrophobicContact CD2-CE2 3.38Å; L103-F129 HydrophobicContact CD2-CZ 4.12Å; L103-Y132 HydrophobicContact CD1-CE2 3.74Å; L103-Y132 HydrophobicContact CD2-CE2 4.5Å
104I97Very high93.3Very high0 Ų046.5 Ų46.50%026%0.263CS..Hα-helixtrans-67.8-46.9175.9-64.3159.5000110.5Y100 I101 M106 A107 I108 I121 I143 N146 L147 F153Y100-I104 WeakPolarHBondContact O-CD1 3.32Å; Y100-I104 VanDerWaalsContact O-CG1 3.23Å; Y100-I104 WeakPolarHBondContact O-CG1 3.48Å; Y100-I104 PolarHBondContact O-N 3.31Å; I101-I104 PolarHBondContact O-N 3.33Å; I104-M106 PolarHBondContact O-N 3.2Å; I104-A107 WeakPolarHBondContact O-CB 3.49Å; I104-A107 PolarHBondContact O-N 3.31Å; I104-A107 VanDerWaalsContact O-N 3.09Å; I104-I108 HydrophobicContact CG2-CD1 3.8Å; I104-I108 HydrophobicContact CG2-CG1 4.42Å; I104-I108 WeakPolarHBondContact O-CG1 3.26Å; I104-I108 PolarHBondContact O-N 2.83Å; I104-I121 HydrophobicContact CG1-CG2 4.17Å; I104-I121 HydrophobicContact CG2-CD1 4.27Å; I104-I143 HydrophobicContact CD1-CD1 4.08Å; I104-I143 HydrophobicContact CD1-CG2 4.29Å; I104-I143 HydrophobicContact CG1-CD1 3.82Å; I104-I143 HydrophobicContact CG1-CG2 4.27Å; I104-N146 HydrophobicContact CD1-CB 3.88Å; I104-L147 HydrophobicContact CD1-CD2 4.05Å; I104-L147 HydrophobicContact CD1-CG 3.99Å; I104-L147 HydrophobicContact CG1-CD2 4.45Å; I104-L147 HydrophobicContact CG2-CD2 3.64Å; I104-F153 HydrophobicContact CB-CE1 3.93Å; I104-F153 HydrophobicContact CB-CE2 4.21Å; I104-F153 HydrophobicContact CB-CZ 3.64Å; I104-F153 HydrophobicContact CD1-CE2 3.95Å; I104-F153 HydrophobicContact CD1-CZ 4.26Å; I104-F153 HydrophobicContact CG2-CD1 3.72Å; I104-F153 HydrophobicContact CG2-CD2 4.41Å; I104-F153 HydrophobicContact CG2-CE1 3.34Å; I104-F153 HydrophobicContact CG2-CE2 4.08Å; I104-F153 HydrophobicContact CG2-CG 4.25Å; I104-F153 HydrophobicContact CG2-CZ 3.54Å
105A95.4Very high94Very high2 Ų246.4 Ų46.42%0.01724%0.244CC..Hα-helixtrans-58.9-45.3179.100000111.7I101 A102 A107 I108 A109 L171 F179I101-A105 WeakPolarHBondContact O-CB 3.36Å; I101-A105 PolarHBondContact O-N 2.8Å; A102-A105 PolarHBondContact O-N 3.26Å; A105-A107 VanDerWaalsContact C-N 3.35Å; A105-A107 PolarHBondContact O-N 2.91Å; A105-I108 PolarHBondContact O-N 3.46Å; A105-A109 VanDerWaalsContact O-CB 3.31Å; A105-A109 WeakPolarHBondContact O-CB 3.37Å; A105-A109 PolarHBondContact O-N 2.74Å; A105-L171 HydrophobicContact CB-CD1 3.99Å; A105-F179 HydrophobicContact CB-CB 4.44Å; A105-F179 HydrophobicContact CB-CD1 3.8Å; A105-F179 HydrophobicContact CB-CD2 4.18Å; A105-F179 HydrophobicContact CB-CE1 3.99Å; A105-F179 HydrophobicContact CB-CE2 4.36Å; A105-F179 HydrophobicContact CB-CG 3.88Å; A105-F179 HydrophobicContact CB-CZ 4.26Å
106M95.4Very high94.5Very high5 Ų544.7 Ų44.73%0.02524%0.238CC..Hα-helixtrans-58.5-44.1172.6-75.4-174.3-73.100112.1Y98 A102 L103 I104 I108 A109 N110 F124 F129 F184Y98-M106 HydrophobicContact CD1-CE 4.11Å; Y98-M106 HydrophobicContact CD2-CE 3.8Å; Y98-M106 HydrophobicContact CE2-CE 4.25Å; Y98-M106 HydrophobicContact CG-CE 3.73Å; A102-M106 WeakPolarHBondContact O-CB 3.28Å; A102-M106 WeakPolarHBondContact O-CE 3.12Å; A102-M106 WeakPolarHBondContact O-CG 3.4Å; A102-M106 PolarHBondContact O-N 2.95Å; L103-M106 HydrophobicContact CD2-CE 3.92Å; I104-M106 PolarHBondContact O-N 3.2Å; M106-I108 VanDerWaalsContact C-N 3.33Å; M106-I108 PolarHBondContact O-N 3.17Å; M106-A109 PolarHBondContact O-N 3.03Å; M106-N110 WeakPolarHBondContact O-CB 2.83Å; M106-N110 PolarHBondContact O-N 2.96Å; M106-N110 PolarHBondContact O-ND2 2.83Å; M106-F124 HydrophobicContact CB-CE1 3.97Å; M106-F124 HydrophobicContact CB-CZ 4.26Å; M106-F129 HydrophobicContact CE-CE2 4Å; M106-F129 HydrophobicContact CE-CZ 3.92Å; M106-F129 HydrophobicContact SD-CZ 4.42Å; M106-F184 HydrophobicContact CG-CD1 3.56Å; M106-F184 HydrophobicContact CG-CD2 4.11Å; M106-F184 HydrophobicContact CG-CE1 3.43Å; M106-F184 VanDerWaalsContact CG-CE1 3.43Å; M106-F184 HydrophobicContact CG-CE2 3.98Å; M106-F184 HydrophobicContact CG-CG 3.92Å; M106-F184 HydrophobicContact CG-CZ 3.66Å; M106-F184 HydrophobicContact SD-CD1 4.33Å; M106-F184 HydrophobicContact SD-CD2 4.1Å; M106-F184 HydrophobicContact SD-CE2 4.35Å; M106-F184 HydrophobicContact SD-CG 4.09Å
107A96.9Very high94.9Very high1 Ų145.6 Ų45.61%0.00824%0.243CC..Hα-helixtrans-61.6-40.6179.800000112.5L103 I104 A105 L116 I121 F124L103-A107 PolarHBondContact O-N 2.99Å; L103-A107 VanDerWaalsContact O-N 3.15Å; I104-A107 WeakPolarHBondContact O-CB 3.49Å; I104-A107 PolarHBondContact O-N 3.31Å; I104-A107 VanDerWaalsContact O-N 3.09Å; A105-A107 VanDerWaalsContact C-N 3.35Å; A105-A107 PolarHBondContact O-N 2.91Å; A107-L116 HydrophobicContact CB-CD2 3.88Å; A107-I121 HydrophobicContact CB-CG1 4.46Å; A107-I121 HydrophobicContact CB-CG2 4.42Å; A107-F124 VanDerWaalsContact CA-CD1 3.45Å; A107-F124 HydrophobicContact CB-CB 4.02Å; A107-F124 HydrophobicContact CB-CD1 3.4Å; A107-F124 HydrophobicContact CB-CE1 3.95Å; A107-F124 HydrophobicContact CB-CG 3.76Å
108I96Very high95.3Very high3 Ų343 Ų432%0.01522%0.223CC..Hα-helixtrans-72.2-44.8178.5-64.9173.7000110.8I104 A105 M106 N110 S111 R114 L116 F153 W169I104-I108 HydrophobicContact CG2-CD1 3.8Å; I104-I108 HydrophobicContact CG2-CG1 4.42Å; I104-I108 WeakPolarHBondContact O-CG1 3.26Å; I104-I108 PolarHBondContact O-N 2.83Å; A105-I108 PolarHBondContact O-N 3.46Å; M106-I108 VanDerWaalsContact C-N 3.33Å; M106-I108 PolarHBondContact O-N 3.17Å; I108-N110 VanDerWaalsContact C-N 3.32Å; I108-N110 PolarHBondContact O-N 3.35Å; I108-S111 WeakPolarHBondContact O-CB 3.36Å; I108-S111 PolarHBondContact O-N 3.44Å; I108-S111 PolarHBondContact O-OG 2.95Å; I108-R114 WeakPolarHBondContact CG2-O 3.31Å; I108-L116 HydrophobicContact CG1-CB 4.29Å; I108-F153 HydrophobicContact CD1-CD1 4.07Å; I108-F153 HydrophobicContact CD1-CE1 4.36Å; I108-W169 HydrophobicContact CD1-CB 4.42Å
109A93.9Very high95.5Very high32 Ų3241.4 Ų41.426%0.26423%0.23SC..Hα-helixtrans-65.7-30.6-179.900000113.7A105 M106 S111A105-A109 VanDerWaalsContact O-CB 3.31Å; A105-A109 WeakPolarHBondContact O-CB 3.37Å; A105-A109 PolarHBondContact O-N 2.74Å; M106-A109 PolarHBondContact O-N 3.03Å; A109-S111 VanDerWaalsContact C-N 3.27Å
110N94.3Very high95.7Very high91 Ų9140.3 Ų40.349%0.48723%0.226SC..THydrogen-bonded Turntrans-84.52.8174.9-71.8-111.6000112.7M106 I108 F124 R128M106-N110 WeakPolarHBondContact O-CB 2.83Å; M106-N110 PolarHBondContact O-N 2.96Å; M106-N110 PolarHBondContact O-ND2 2.83Å; I108-N110 VanDerWaalsContact C-N 3.32Å; I108-N110 PolarHBondContact O-N 3.35Å; N110-F124 HydrophobicContact CB-CD2 4.44Å; N110-F124 HydrophobicContact CB-CE2 3.51Å; N110-F124 HydrophobicContact CB-CZ 3.92Å; N110-R128 PolarHBondContact OD1-NH1 3.06Å
111S95.2Very high95.8Very high12 Ų1237.7 Ų37.78%0.08422%0.216CC..SBendtrans-90.1138.6174.176.60000110.7I108 A109 E113 R114 K115I108-S111 WeakPolarHBondContact O-CB 3.36Å; I108-S111 PolarHBondContact O-N 3.44Å; I108-S111 PolarHBondContact O-OG 2.95Å; A109-S111 VanDerWaalsContact C-N 3.27Å; S111-E113 PolarHBondContact O-N 2.82Å; S111-R114 PolarHBondContact O-N 3.22Å; S111-R114 VanDerWaalsContact O-N 3.14Å; S111-R114 WeakPolarHBondContact OG-CA 3.28Å; S111-R114 PolarHBondContact OG-N 2.67Å; S111-K115 PolarHBondContact OG-N 3.04Å; S111-K115 PolarHBondContact OG-O 3.38Å
112P94.8Very high95.9Very high137 Ų13737.3 Ų37.389%0.8921%0.212SC*.THydrogen-bonded Turntrans-64.5-28.2-175.325.7-34.7000112.8
113E94.2Very high96Very high115 Ų11543.7 Ų43.754%0.53724%0.24SC..THydrogen-bonded Turntrans-94.58.1-179.4-59-177.8163.200113.3S111 K115S111-E113 PolarHBondContact O-N 2.82Å; E113-K115 HydrophobicContact CB-CD 4.25Å; E113-K115 HydrophobicContact CB-CG 3.79Å; E113-K115 PolarHBondContact O-N 3.19Å; E113-K115 WeakPolarHBondContact OE2-CE 3.33Å; E113-K115 IonicContact OE2-NZ 2.8Å
114R94.9Very high96.1Very high104 Ų10445.4 Ų45.439%0.39225%0.247SC..SBendtrans4826.3-171.2-69.5-78.5-178.4140.9-6.9113.6I108 S111 E176 D180I108-R114 WeakPolarHBondContact CG2-O 3.31Å; S111-R114 PolarHBondContact O-N 3.22Å; S111-R114 VanDerWaalsContact O-N 3.14Å; S111-R114 WeakPolarHBondContact OG-CA 3.28Å; S111-R114 PolarHBondContact OG-N 2.67Å; R114-E176 IonicContact CZ-OE1 2.71Å; R114-E176 IonicContact NE-OE1 2.95Å; R114-E176 IonicContact NH1-OE1 3.92Å; R114-E176 PolarHBondContact NH1-OE1 3.32Å; R114-D180 IonicContact CZ-OD1 3.79Å; R114-D180 IonicContact NH1-OD1 3.74Å; R114-D180 PolarHBondContact NH1-OD1 2.82Å; R114-D180 IonicContact NH1-OD2 3.85Å; R114-D180 IonicContact NH2-OD1 3.63Å
115K95.3Very high96.1Very high64 Ų6445.4 Ų45.428%0.27825%0.247SC..EExtended strand (participates in β ladder)trans-146.4140179.974.1-167.4174.4-166.90110.4S111 E113 Y168 W169 T170S111-K115 PolarHBondContact OG-N 3.04Å; S111-K115 PolarHBondContact OG-O 3.38Å; E113-K115 HydrophobicContact CB-CD 4.25Å; E113-K115 HydrophobicContact CB-CG 3.79Å; E113-K115 PolarHBondContact O-N 3.19Å; E113-K115 WeakPolarHBondContact OE2-CE 3.33Å; E113-K115 IonicContact OE2-NZ 2.8Å; K115-Y168 HydrophobicContact CB-CD1 4.42Å; K115-Y168 HydrophobicContact CD-CD1 4.2Å; K115-Y168 HydrophobicContact CD-CG 4.32Å; K115-Y168 HydrophobicContact CG-CD1 3.81Å; K115-Y168 HydrophobicContact CG-CE1 4.35Å; K115-Y168 HydrophobicContact CG-CG 4.32Å; K115-W169 WeakPolarHBondContact CA-O 3.4Å; K115-T170 HydrophobicContact CB-CG2 3.46Å; K115-T170 VanDerWaalsContact CB-CG2 3.46Å
116L96.8Very high96.1Very high35 Ų3548 Ų4818%0.18326%0.259CS..EExtended strand (participates in β ladder)trans-140.5145.1-176.5-15467.6000111.9A107 I108 G120 I121 W169A107-L116 HydrophobicContact CB-CD2 3.88Å; I108-L116 HydrophobicContact CG1-CB 4.29Å; L116-G120 VanDerWaalsContact CD2-C 3.42Å; L116-I121 HydrophobicContact CB-CG1 4.19Å; L116-I121 HydrophobicContact CD2-CB 4.44Å; L116-I121 HydrophobicContact CD2-CG1 3.84Å; L116-I121 HydrophobicContact CG-CG1 4.27Å; L116-W169 PolarHBondContact N-O 3.04Å; L116-W169 PolarHBondContact O-N 2.95Å
117T97.4Very high96.2Very high37 Ų3753.4 Ų53.423%0.22729%0.285CS..EExtended strand (participates in β ladder)trans-77.7159.3172.967.40000110.6G119 G120 I121 Y168T117-G119 PolarHBondContact O-N 2.9Å; T117-G120 WeakPolarHBondContact O-CA 3.25Å; T117-G120 PolarHBondContact O-N 3.23Å; T117-G120 PolarHBondContact OG1-N 3.09Å; T117-I121 WeakPolarHBondContact O-CG1 3.43Å; T117-I121 PolarHBondContact O-N 3.48Å; T117-Y168 HydrophobicContact CG2-CD1 3.9Å; T117-Y168 HydrophobicContact CG2-CE1 3.82Å
118L97.1Very high96.1Very high50 Ų5059.5 Ų59.526%0.26231%0.308SS..Hα-helixtrans-53-38.1175.618063000113I121 Y122 I143 R144 L147L118-I121 PolarHBondContact O-N 3.14Å; L118-Y122 HydrophobicContact CD1-CD1 4.45Å; L118-Y122 HydrophobicContact CD1-CE1 3.62Å; L118-Y122 HydrophobicContact CD1-CE2 4.43Å; L118-Y122 HydrophobicContact CG-CE1 4.11Å; L118-Y122 HydrophobicContact CG-CE2 4.01Å; L118-Y122 PolarHBondContact O-N 3.27Å; L118-I143 HydrophobicContact CD1-CG2 4.22Å; L118-R144 HydrophobicContact CD1-CG 4.03Å; L118-R144 HydrophobicContact CD2-CG 3.97Å; L118-L147 HydrophobicContact CD1-CD1 3.58Å
119G97.1Very high96Very high44 Ų4460.7 Ų60.745%0.45431%0.313SS..Hα-helixtrans-67.7-39.4175.300000112.9T117 Y122 K123T117-G119 PolarHBondContact O-N 2.9Å; G119-Y122 PolarHBondContact O-N 2.95Å; G119-K123 PolarHBondContact O-N 3.35Å
120G97Very high96Very high19 Ų1962.8 Ų62.820%0.19632%0.324CS..Hα-helixtrans-62.3-42.1173.600000112.6L116 T117 Y122 K123 F124L116-G120 VanDerWaalsContact CD2-C 3.42Å; T117-G120 WeakPolarHBondContact O-CA 3.25Å; T117-G120 PolarHBondContact O-N 3.23Å; T117-G120 PolarHBondContact OG1-N 3.09Å; G120-Y122 VanDerWaalsContact C-N 3.3Å; G120-Y122 PolarHBondContact O-N 2.9Å; G120-K123 PolarHBondContact O-N 3.44Å; G120-K123 VanDerWaalsContact O-N 3.17Å; G120-F124 PolarHBondContact O-N 2.99Å
121I97.8Very high95.9Very high0 Ų062 Ų620%032%0.316CS..Hα-helixtrans-59.1-43.5176.1-63.1167.2000110.4I104 A107 L116 T117 L118 I125 I143 L147 W169I104-I121 HydrophobicContact CG1-CG2 4.17Å; I104-I121 HydrophobicContact CG2-CD1 4.27Å; A107-I121 HydrophobicContact CB-CG1 4.46Å; A107-I121 HydrophobicContact CB-CG2 4.42Å; L116-I121 HydrophobicContact CB-CG1 4.19Å; L116-I121 HydrophobicContact CD2-CB 4.44Å; L116-I121 HydrophobicContact CD2-CG1 3.84Å; L116-I121 HydrophobicContact CG-CG1 4.27Å; T117-I121 WeakPolarHBondContact O-CG1 3.43Å; T117-I121 PolarHBondContact O-N 3.48Å; L118-I121 PolarHBondContact O-N 3.14Å; I121-I125 HydrophobicContact CG2-CD1 3.82Å; I121-I125 VanDerWaalsContact O-CG1 3.29Å; I121-I125 WeakPolarHBondContact O-CG1 3.35Å; I121-I125 PolarHBondContact O-N 2.71Å; I121-I143 HydrophobicContact CG2-CG2 3.95Å; I121-L147 HydrophobicContact CD1-CD1 4.01Å; I121-L147 HydrophobicContact CD1-CD2 4.03Å; I121-W169 HydrophobicContact CD1-CB 4.35Å
122Y97.3Very high95.9Very high30 Ų3061.7 Ų61.712%0.11831%0.313CS..Hα-helixtrans-62.4-46175.7-58.3-25.1000112L118 G119 G120 I125 M126 W139 Q140 I143 R144L118-Y122 HydrophobicContact CD1-CD1 4.45Å; L118-Y122 HydrophobicContact CD1-CE1 3.62Å; L118-Y122 HydrophobicContact CD1-CE2 4.43Å; L118-Y122 HydrophobicContact CG-CE1 4.11Å; L118-Y122 HydrophobicContact CG-CE2 4.01Å; L118-Y122 PolarHBondContact O-N 3.27Å; G119-Y122 PolarHBondContact O-N 2.95Å; G120-Y122 VanDerWaalsContact C-N 3.3Å; G120-Y122 PolarHBondContact O-N 2.9Å; Y122-I125 PolarHBondContact O-N 3.07Å; Y122-M126 WeakPolarHBondContact O-CE 3.32Å; Y122-M126 WeakPolarHBondContact O-CG 3.1Å; Y122-M126 PolarHBondContact O-N 3.05Å; Y122-M126 VanDerWaalsContact O-N 3.1Å; Y122-W139 HydrophobicContact CD1-CH2 4.16Å; Y122-W139 AromaticContact CD1-CZ3 3.93Å; Y122-W139 HydrophobicContact CD1-CZ3 3.93Å; Y122-W139 HydrophobicContact CG-CH2 4.4Å; Y122-Q140 HydrophobicContact CD1-CB 4.4Å; Y122-Q140 HydrophobicContact CD1-CG 3.79Å; Y122-Q140 HydrophobicContact CD2-CG 4.3Å; Y122-Q140 HydrophobicContact CE1-CB 3.78Å; Y122-Q140 HydrophobicContact CE1-CG 3.68Å; Y122-Q140 HydrophobicContact CE2-CG 4.21Å; Y122-Q140 HydrophobicContact CG-CG 4.1Å; Y122-I143 HydrophobicContact CD1-CG2 4.33Å; Y122-I143 HydrophobicContact CE1-CB 4.2Å; Y122-I143 HydrophobicContact CE1-CG2 3.93Å; Y122-R144 WeakPolarHBondContact OH-CG 3.35Å; Y122-R144 PolarHBondContact OH-NH1 3.46Å
123K97.3Very high95.8Very high136 Ų13662.1 Ų62.159%0.59130%0.297SS*.Hα-helixtrans-57.9-54.2179.4-172.7-170.3174.3-165.20110.7G119 G120 I125 M126 E127G119-K123 PolarHBondContact O-N 3.35Å; G120-K123 PolarHBondContact O-N 3.44Å; G120-K123 VanDerWaalsContact O-N 3.17Å; K123-I125 VanDerWaalsContact C-N 3.3Å; K123-I125 PolarHBondContact O-N 2.93Å; K123-M126 PolarHBondContact O-N 2.65Å; K123-M126 VanDerWaalsContact O-N 3.15Å; K123-E127 VanDerWaalsContact CE-OE2 3.3Å; K123-E127 WeakPolarHBondContact CE-OE2 3.39Å; K123-E127 IonicContact NZ-OE2 3.91Å; K123-E127 VanDerWaalsContact O-CB 3.29Å; K123-E127 WeakPolarHBondContact O-CB 3.37Å; K123-E127 PolarHBondContact O-N 3.36Å
124F97.4Very high95.7Very high36 Ų3663.6 Ų63.616%0.15830%0.304CS..Hα-helixtrans-54.9-44.2-178.8178.3-89.9000112.6M106 A107 N110 G120 E127 R128M106-F124 HydrophobicContact CB-CE1 3.97Å; M106-F124 HydrophobicContact CB-CZ 4.26Å; A107-F124 VanDerWaalsContact CA-CD1 3.45Å; A107-F124 HydrophobicContact CB-CB 4.02Å; A107-F124 HydrophobicContact CB-CD1 3.4Å; A107-F124 HydrophobicContact CB-CE1 3.95Å; A107-F124 HydrophobicContact CB-CG 3.76Å; N110-F124 HydrophobicContact CB-CD2 4.44Å; N110-F124 HydrophobicContact CB-CE2 3.51Å; N110-F124 HydrophobicContact CB-CZ 3.92Å; G120-F124 PolarHBondContact O-N 2.99Å; F124-E127 PolarHBondContact O-N 3.02Å; F124-R128 WeakPolarHBondContact O-CB 3.5Å; F124-R128 PolarHBondContact O-N 2.95Å
125I96.9Very high95.2Very high0 Ų065 Ų650%032%0.319CS..Hα-helixtrans-66.6-43.4-180-66.6170.5000111.1L103 I121 Y122 K123 E127 F129 Y132 W139 I143L103-I125 HydrophobicContact CB-CD1 3.89Å; L103-I125 HydrophobicContact CB-CG1 4.22Å; I121-I125 HydrophobicContact CG2-CD1 3.82Å; I121-I125 VanDerWaalsContact O-CG1 3.29Å; I121-I125 WeakPolarHBondContact O-CG1 3.35Å; I121-I125 PolarHBondContact O-N 2.71Å; Y122-I125 PolarHBondContact O-N 3.07Å; K123-I125 VanDerWaalsContact C-N 3.3Å; K123-I125 PolarHBondContact O-N 2.93Å; I125-E127 VanDerWaalsContact C-N 3.34Å; I125-F129 WeakPolarHBondContact O-CA 3.39Å; I125-F129 WeakPolarHBondContact O-CB 3.35Å; I125-F129 PolarHBondContact O-N 3.38Å; I125-Y132 HydrophobicContact CG2-CD2 3.53Å; I125-Y132 HydrophobicContact CG2-CE2 4.27Å; I125-Y132 HydrophobicContact CG2-CG 3.79Å; I125-W139 HydrophobicContact CB-CH2 4.44Å; I125-W139 HydrophobicContact CB-CZ3 4.41Å; I125-W139 HydrophobicContact CD1-CZ3 4.29Å; I125-W139 HydrophobicContact CG2-CH2 4.34Å; I125-W139 HydrophobicContact CG2-CZ3 4.19Å; I125-I143 HydrophobicContact CD1-CD1 3.62Å; I125-I143 HydrophobicContact CD1-CG1 4.26Å
126M95.9Very high94.8Very high56 Ų5664 Ų6428%0.27632%0.321SS..Hα-helixtrans-69.3-32.3178.5-68.4-175.7-57.800113Y122 K123 R133 W139Y122-M126 WeakPolarHBondContact O-CE 3.32Å; Y122-M126 WeakPolarHBondContact O-CG 3.1Å; Y122-M126 PolarHBondContact O-N 3.05Å; Y122-M126 VanDerWaalsContact O-N 3.1Å; K123-M126 PolarHBondContact O-N 2.65Å; K123-M126 VanDerWaalsContact O-N 3.15Å; M126-R133 HydrophobicContact CB-CG 4.16Å; M126-R133 WeakPolarHBondContact O-CG 3.35Å; M126-R133 PolarHBondContact O-NE 3.29Å; M126-W139 HydrophobicContact CG-CH2 3.94Å; M126-W139 HydrophobicContact CG-CZ2 3.61Å; M126-W139 HydrophobicContact SD-CH2 4.43Å; M126-W139 HydrophobicContact SD-CZ2 3.95Å
127E96.4Very high94.7Very high120 Ų12070.8 Ų70.856%0.56135%0.349SS*.Hα-helixtrans-69.3-56.6178-169.3170.2158.300110.4K123 F124 I125 R133K123-E127 VanDerWaalsContact CE-OE2 3.3Å; K123-E127 WeakPolarHBondContact CE-OE2 3.39Å; K123-E127 IonicContact NZ-OE2 3.91Å; K123-E127 VanDerWaalsContact O-CB 3.29Å; K123-E127 WeakPolarHBondContact O-CB 3.37Å; K123-E127 PolarHBondContact O-N 3.36Å; F124-E127 PolarHBondContact O-N 3.02Å; I125-E127 VanDerWaalsContact C-N 3.34Å; E127-R133 PolarHBondContact O-NH2 3.01Å
128R95.2Very high94.5Very high129 Ų12977.4 Ų77.449%0.48737%0.374SS..Hα-helixtrans-77.4-25.3-175.4-167.2166.9-175.1155.2-1.3114.6N110 F124N110-R128 PolarHBondContact OD1-NH1 3.06Å; F124-R128 WeakPolarHBondContact O-CB 3.5Å; F124-R128 PolarHBondContact O-N 2.95Å
129F94.2Very high94.4Very high27 Ų2775.6 Ų75.612%0.11836%0.364CS..  trans-130.889.8-177.4-58.6-67.6000111.1P96 Y98 L103 M106 I125 F131 Y132P96-F129 HydrophobicContact CB-CD1 3.88Å; P96-F129 HydrophobicContact CB-CE1 4.03Å; P96-F129 HydrophobicContact CG-CB 3.96Å; P96-F129 HydrophobicContact CG-CD1 3.4Å; P96-F129 VanDerWaalsContact CG-CD1 3.4Å; P96-F129 HydrophobicContact CG-CE1 4.07Å; P96-F129 HydrophobicContact CG-CG 3.81Å; Y98-F129 AromaticContact CD2-CE1 3.94Å; Y98-F129 HydrophobicContact CD2-CE1 3.94Å; Y98-F129 AromaticContact CD2-CZ 3.73Å; Y98-F129 HydrophobicContact CD2-CZ 3.73Å; Y98-F129 AromaticContact CE2-CE1 3.87Å; Y98-F129 HydrophobicContact CE2-CE1 3.87Å; Y98-F129 AromaticContact CE2-CZ 3.82Å; Y98-F129 HydrophobicContact CE2-CZ 3.82Å; L103-F129 HydrophobicContact CD2-CD2 3.62Å; L103-F129 HydrophobicContact CD2-CE2 3.38Å; L103-F129 HydrophobicContact CD2-CZ 4.12Å; M106-F129 HydrophobicContact CE-CE2 4Å; M106-F129 HydrophobicContact CE-CZ 3.92Å; M106-F129 HydrophobicContact SD-CZ 4.42Å; I125-F129 WeakPolarHBondContact O-CA 3.39Å; I125-F129 WeakPolarHBondContact O-CB 3.35Å; I125-F129 PolarHBondContact O-N 3.38Å; F129-F131 PolarHBondContact O-N 3.14Å; F129-Y132 HydrophobicContact CB-CD2 3.8Å; F129-Y132 HydrophobicContact CB-CE2 4.29Å; F129-Y132 PolarHBondContact O-N 3.23Å
130P93Very high94.4Very high77 Ų7775.2 Ų75.250%0.535%0.35SS..G310 helixtrans-52.6-30.2-175.7-29.535.6000115.1Y132 R133P130-Y132 PolarHBondContact O-N 3.32Å; P130-R133 WeakPolarHBondContact O-CB 3.36Å; P130-R133 WeakPolarHBondContact O-CG 3.45Å; P130-R133 PolarHBondContact O-N 2.98Å
131F93.1Very high94.4Very high75 Ų7578.9 Ų78.933%0.32937%0.365SS..G310 helixtrans-48.5-28.2173177.7-92000114.6K95 F129K95-F131 HydrophobicContact CB-CD1 4.32Å; K95-F131 HydrophobicContact CB-CD2 4.17Å; K95-F131 HydrophobicContact CB-CE1 3.97Å; K95-F131 HydrophobicContact CB-CE2 3.78Å; K95-F131 HydrophobicContact CB-CG 4.43Å; K95-F131 HydrophobicContact CB-CZ 3.68Å; K95-F131 HydrophobicContact CD-CE1 3.77Å; K95-F131 HydrophobicContact CD-CZ 3.82Å; K95-F131 HydrophobicContact CG-CD1 4.06Å; K95-F131 HydrophobicContact CG-CE1 3.61Å; K95-F131 HydrophobicContact CG-CE2 4.36Å; K95-F131 HydrophobicContact CG-CZ 3.79Å; F129-F131 PolarHBondContact O-N 3.14Å
132Y94.5Very high94.4Very high4 Ų480.6 Ų80.62%0.01638%0.377CS..G310 helixtrans-95.82.5-179.2-66.3-68.7000114.3K95 P96 Y100 L103 I125 F129 P130 W139K95-Y132 VanDerWaalsContact CE-OH 3.27Å; K95-Y132 WeakPolarHBondContact CE-OH 3.3Å; P96-Y132 HydrophobicContact CG-CE2 4.16Å; Y100-Y132 HydrophobicContact CE1-CE1 4.22Å; L103-Y132 HydrophobicContact CD1-CE2 3.74Å; L103-Y132 HydrophobicContact CD2-CE2 4.5Å; I125-Y132 HydrophobicContact CG2-CD2 3.53Å; I125-Y132 HydrophobicContact CG2-CE2 4.27Å; I125-Y132 HydrophobicContact CG2-CG 3.79Å; F129-Y132 HydrophobicContact CB-CD2 3.8Å; F129-Y132 HydrophobicContact CB-CE2 4.29Å; F129-Y132 PolarHBondContact O-N 3.23Å; P130-Y132 PolarHBondContact O-N 3.32Å; Y132-W139 HydrophobicContact CD1-CB 4.08Å; Y132-W139 AromaticContact CD1-CD1 3.83Å; Y132-W139 HydrophobicContact CD1-CD2 4.01Å; Y132-W139 AromaticContact CD1-CG 3.72Å; Y132-W139 HydrophobicContact CD1-CG 3.72Å; Y132-W139 HydrophobicContact CE1-CB 4.31Å; Y132-W139 HydrophobicContact CE1-CG 4.42Å; Y132-W139 HydrophobicContact CG-CD2 4.48Å; Y132-W139 VanDerWaalsContact O-CZ2 3.27Å; Y132-W139 WeakPolarHBondContact O-CZ2 3.46Å; Y132-W139 PolarHBondContact O-NE1 3.21Å
133R93.8Very high94.4Very high146 Ų14679.2 Ų79.255%0.55137%0.372SS*.THydrogen-bonded Turntrans-67.6-40.5176.6-66.5174.8-174.4178.92.6111.5M126 E127 P130M126-R133 HydrophobicContact CB-CG 4.16Å; M126-R133 WeakPolarHBondContact O-CG 3.35Å; M126-R133 PolarHBondContact O-NE 3.29Å; E127-R133 PolarHBondContact O-NH2 3.01Å; P130-R133 WeakPolarHBondContact O-CB 3.36Å; P130-R133 WeakPolarHBondContact O-CG 3.45Å; P130-R133 PolarHBondContact O-N 2.98Å
134E90.2Very high94.4Very high146 Ų14677.1 Ų77.168%0.68236%0.36SS*.SBendtrans-78157.9177.2-65.6172-153.500112.5S136E134-S136 PolarHBondContact O-N 3.35Å; E134-S136 VanDerWaalsContact O-N 3.12Å
135N84.7Confident94.4Very high134 Ų13480.2 Ų80.272%0.71738%0.375SS*.SBendtrans53.337.6169.3-68.3-71.9000114.7K137 K138N135-K137 VanDerWaalsContact C-N 3.34Å; N135-K137 PolarHBondContact O-N 3.02Å; N135-K137 VanDerWaalsContact O-N 3.14Å; N135-K138 PolarHBondContact O-N 3.48Å
136S87.5Confident94.5Very high44 Ų4481.3 Ų81.331%0.30838%0.381SS..Hα-helixtrans-49.3-44.2-168.362.40000115.3E134 K138 W139 Q140E134-S136 PolarHBondContact O-N 3.35Å; E134-S136 VanDerWaalsContact O-N 3.12Å; S136-K138 VanDerWaalsContact C-N 3.26Å; S136-K138 PolarHBondContact O-N 3.27Å; S136-K138 VanDerWaalsContact O-N 3.12Å; S136-W139 PolarHBondContact O-N 3.18Å; S136-Q140 VanDerWaalsContact O-CB 3.28Å; S136-Q140 WeakPolarHBondContact O-CB 3.15Å; S136-Q140 WeakPolarHBondContact O-CG 3.45Å; S136-Q140 PolarHBondContact O-N 3.22Å
137K94.1Very high94.5Very high177 Ų17778.9 Ų78.977%0.7737%0.369SS*.Hα-helixtrans-50.9-40.8-175.9-63.8-179.7-178.9176.60113.5N135 N141N135-K137 VanDerWaalsContact C-N 3.34Å; N135-K137 PolarHBondContact O-N 3.02Å; N135-K137 VanDerWaalsContact O-N 3.14Å; K137-N141 PolarHBondContact O-N 3.23Å
138K93.9Very high94.5Very high175 Ų17578.3 Ų78.376%0.76137%0.374SS*.Hα-helixtrans-72.4-52-172.2-173.7172.3-176.2170.20112.4N135 S136 N141 S142N135-K138 PolarHBondContact O-N 3.48Å; S136-K138 VanDerWaalsContact C-N 3.26Å; S136-K138 PolarHBondContact O-N 3.27Å; S136-K138 VanDerWaalsContact O-N 3.12Å; K138-N141 WeakPolarHBondContact O-CB 3.4Å; K138-N141 PolarHBondContact O-N 2.96Å; K138-S142 PolarHBondContact O-N 2.96Å; K138-S142 PolarHBondContact O-OG 2.65Å
139W95Very high94.4Very high13 Ų1375.7 Ų75.75%0.04937%0.369CS..Hα-helixtrans-76.2-31.6-178.868.6-103.1000112.1Y100 Y122 I125 M126 Y132 S136 N141 S142 I143Y100-W139 HydrophobicContact CE1-CB 4.21Å; Y122-W139 HydrophobicContact CD1-CH2 4.16Å; Y122-W139 AromaticContact CD1-CZ3 3.93Å; Y122-W139 HydrophobicContact CD1-CZ3 3.93Å; Y122-W139 HydrophobicContact CG-CH2 4.4Å; I125-W139 HydrophobicContact CB-CH2 4.44Å; I125-W139 HydrophobicContact CB-CZ3 4.41Å; I125-W139 HydrophobicContact CD1-CZ3 4.29Å; I125-W139 HydrophobicContact CG2-CH2 4.34Å; I125-W139 HydrophobicContact CG2-CZ3 4.19Å; M126-W139 HydrophobicContact CG-CH2 3.94Å; M126-W139 HydrophobicContact CG-CZ2 3.61Å; M126-W139 HydrophobicContact SD-CH2 4.43Å; M126-W139 HydrophobicContact SD-CZ2 3.95Å; Y132-W139 HydrophobicContact CD1-CB 4.08Å; Y132-W139 AromaticContact CD1-CD1 3.83Å; Y132-W139 HydrophobicContact CD1-CD2 4.01Å; Y132-W139 AromaticContact CD1-CG 3.72Å; Y132-W139 HydrophobicContact CD1-CG 3.72Å; Y132-W139 HydrophobicContact CE1-CB 4.31Å; Y132-W139 HydrophobicContact CE1-CG 4.42Å; Y132-W139 HydrophobicContact CG-CD2 4.48Å; Y132-W139 VanDerWaalsContact O-CZ2 3.27Å; Y132-W139 WeakPolarHBondContact O-CZ2 3.46Å; Y132-W139 PolarHBondContact O-NE1 3.21Å; S136-W139 PolarHBondContact O-N 3.18Å; W139-N141 PolarHBondContact O-N 2.97Å; W139-S142 CarbonylContact O-C 3.58Å; W139-S142 WeakPolarHBondContact O-CA 3.37Å; W139-S142 WeakPolarHBondContact O-CB 3.48Å; W139-S142 PolarHBondContact O-N 3.16Å; W139-I143 HydrophobicContact CE3-CG1 3.73Å; W139-I143 HydrophobicContact CZ3-CG1 3.92Å; W139-I143 PolarHBondContact O-N 3.48Å
140Q97.2Very high94.4Very high36 Ų3674.9 Ų74.917%0.16837%0.366CS..Hα-helixtrans-60.9-33.6172.7-72.9179.5-0.400111.8Y122 S136 I143 R144Y122-Q140 HydrophobicContact CD1-CB 4.4Å; Y122-Q140 HydrophobicContact CD1-CG 3.79Å; Y122-Q140 HydrophobicContact CD2-CG 4.3Å; Y122-Q140 HydrophobicContact CE1-CB 3.78Å; Y122-Q140 HydrophobicContact CE1-CG 3.68Å; Y122-Q140 HydrophobicContact CE2-CG 4.21Å; Y122-Q140 HydrophobicContact CG-CG 4.1Å; S136-Q140 VanDerWaalsContact O-CB 3.28Å; S136-Q140 WeakPolarHBondContact O-CB 3.15Å; S136-Q140 WeakPolarHBondContact O-CG 3.45Å; S136-Q140 PolarHBondContact O-N 3.22Å; Q140-I143 PolarHBondContact O-N 3.32Å; Q140-R144 WeakPolarHBondContact O-CG 3.49Å; Q140-R144 PolarHBondContact O-N 2.9Å; Q140-R144 PolarHBondContact O-NH1 2.93Å
141N97.3Very high94.4Very high95 Ų9574.1 Ų74.151%0.50836%0.358SS..Hα-helixtrans-64.4-42.8172.3-159.339.5000111.8K137 K138 W139 I143 R144 H145K137-N141 PolarHBondContact O-N 3.23Å; K138-N141 WeakPolarHBondContact O-CB 3.4Å; K138-N141 PolarHBondContact O-N 2.96Å; W139-N141 PolarHBondContact O-N 2.97Å; N141-I143 VanDerWaalsContact C-N 3.3Å; N141-I143 PolarHBondContact O-N 2.94Å; N141-R144 PolarHBondContact O-N 3.49Å; N141-R144 PolarHBondContact OD1-NH2 2.79Å; N141-H145 WeakPolarHBondContact O-CB 3.45Å; N141-H145 PolarHBondContact O-N 3.01Å
142S97.3Very high94.4Very high37 Ų3770.8 Ų70.826%0.25934%0.344SS..Hα-helixtrans-61.3-36.2173.5-51.90000112.6K138 W139 N146K138-S142 PolarHBondContact O-N 2.96Å; K138-S142 PolarHBondContact O-OG 2.65Å; W139-S142 CarbonylContact O-C 3.58Å; W139-S142 WeakPolarHBondContact O-CA 3.37Å; W139-S142 WeakPolarHBondContact O-CB 3.48Å; W139-S142 PolarHBondContact O-N 3.16Å; S142-N146 WeakPolarHBondContact O-CB 3.44Å; S142-N146 PolarHBondContact O-N 3.35Å; S142-N146 PolarHBondContact O-ND2 3.09Å
143I97.7Very high94.4Very high0 Ų071.1 Ų71.10%035%0.345CS..Hα-helixtrans-64.7-51.7174.1-67.1-68.6000111.2Y100 I104 L118 I121 Y122 I125 W139 Q140 N141 H145 N146 L147Y100-I143 HydrophobicContact CD1-CD1 3.79Å; Y100-I143 HydrophobicContact CD1-CG1 4.35Å; Y100-I143 HydrophobicContact CG-CD1 4.41Å; I104-I143 HydrophobicContact CD1-CD1 4.08Å; I104-I143 HydrophobicContact CD1-CG2 4.29Å; I104-I143 HydrophobicContact CG1-CD1 3.82Å; I104-I143 HydrophobicContact CG1-CG2 4.27Å; L118-I143 HydrophobicContact CD1-CG2 4.22Å; I121-I143 HydrophobicContact CG2-CG2 3.95Å; Y122-I143 HydrophobicContact CD1-CG2 4.33Å; Y122-I143 HydrophobicContact CE1-CB 4.2Å; Y122-I143 HydrophobicContact CE1-CG2 3.93Å; I125-I143 HydrophobicContact CD1-CD1 3.62Å; I125-I143 HydrophobicContact CD1-CG1 4.26Å; W139-I143 HydrophobicContact CE3-CG1 3.73Å; W139-I143 HydrophobicContact CZ3-CG1 3.92Å; W139-I143 PolarHBondContact O-N 3.48Å; Q140-I143 PolarHBondContact O-N 3.32Å; N141-I143 VanDerWaalsContact C-N 3.3Å; N141-I143 PolarHBondContact O-N 2.94Å; I143-H145 VanDerWaalsContact C-N 3.28Å; I143-H145 PolarHBondContact O-N 3.26Å; I143-N146 PolarHBondContact O-N 3.43Å; I143-N146 VanDerWaalsContact O-N 3.07Å; I143-L147 HydrophobicContact CG2-CD1 4.07Å; I143-L147 WeakPolarHBondContact O-CG 3.46Å; I143-L147 PolarHBondContact O-N 3.15Å
144R97.8Very high94.5Very high92 Ų9265.4 Ų65.435%0.34733%0.326SS..Hα-helixtrans-55.3-45.3177.5-70.7-174.4-60.6-91.610112L118 Y122 Q140 N141 L147 T148L118-R144 HydrophobicContact CD1-CG 4.03Å; L118-R144 HydrophobicContact CD2-CG 3.97Å; Y122-R144 WeakPolarHBondContact OH-CG 3.35Å; Y122-R144 PolarHBondContact OH-NH1 3.46Å; Q140-R144 WeakPolarHBondContact O-CG 3.49Å; Q140-R144 PolarHBondContact O-N 2.9Å; Q140-R144 PolarHBondContact O-NH1 2.93Å; N141-R144 PolarHBondContact O-N 3.49Å; N141-R144 PolarHBondContact OD1-NH2 2.79Å; R144-L147 PolarHBondContact O-N 3.43Å; R144-T148 PolarHBondContact O-N 2.93Å; R144-T148 PolarHBondContact O-OG1 3.32Å
145H97.6Very high94.9Very high101 Ų10164 Ų6447%0.46832%0.318SS..Hα-helixtrans-62.8-40.5176170.568.3000112.9N141 I143 T148 L149N141-H145 WeakPolarHBondContact O-CB 3.45Å; N141-H145 PolarHBondContact O-N 3.01Å; I143-H145 VanDerWaalsContact C-N 3.28Å; I143-H145 PolarHBondContact O-N 3.26Å; H145-T148 PolarHBondContact O-N 2.88Å; H145-T148 PolarHBondContact O-OG1 3.43Å; H145-L149 WeakPolarHBondContact CE1-CD1 3.41Å; H145-L149 WeakPolarHBondContact NE2-CD1 3.31Å; H145-L149 WeakPolarHBondContact O-CB 3.49Å; H145-L149 PolarHBondContact O-N 2.99Å
146N97.3Very high95.4Very high24 Ų2459.3 Ų59.313%0.12829%0.293CS..Hα-helixtrans-70.7-31.5179.4-86.9-95.4000113.1I101 I104 S142 I143 N150I101-N146 WeakPolarHBondContact CG1-OD1 3.11Å; I104-N146 HydrophobicContact CD1-CB 3.88Å; S142-N146 WeakPolarHBondContact O-CB 3.44Å; S142-N146 PolarHBondContact O-N 3.35Å; S142-N146 PolarHBondContact O-ND2 3.09Å; I143-N146 PolarHBondContact O-N 3.43Å; I143-N146 VanDerWaalsContact O-N 3.07Å; N146-N150 PolarHBondContact O-N 3Å; N146-N150 PolarHBondContact O-ND2 3.42Å; N146-N150 PolarHBondContact OD1-ND2 3.42Å
147L96.8Very high95.7Very high4 Ų461.2 Ų61.22%0.02130%0.304CS..Hα-helixtrans-65.4-38.1175-72.8167.5000112.4I104 L118 I121 I143 R144 F153 W169I104-L147 HydrophobicContact CD1-CD2 4.05Å; I104-L147 HydrophobicContact CD1-CG 3.99Å; I104-L147 HydrophobicContact CG1-CD2 4.45Å; I104-L147 HydrophobicContact CG2-CD2 3.64Å; L118-L147 HydrophobicContact CD1-CD1 3.58Å; I121-L147 HydrophobicContact CD1-CD1 4.01Å; I121-L147 HydrophobicContact CD1-CD2 4.03Å; I143-L147 HydrophobicContact CG2-CD1 4.07Å; I143-L147 WeakPolarHBondContact O-CG 3.46Å; I143-L147 PolarHBondContact O-N 3.15Å; R144-L147 PolarHBondContact O-N 3.43Å; L147-F153 HydrophobicContact CD2-CB 4.1Å; L147-F153 HydrophobicContact CD2-CD2 4.23Å; L147-F153 HydrophobicContact CD2-CG 4.04Å; L147-W169 HydrophobicContact CB-CD2 4.25Å; L147-W169 HydrophobicContact CB-CE3 4.14Å; L147-W169 HydrophobicContact CB-CH2 3.91Å; L147-W169 HydrophobicContact CB-CZ2 4.03Å; L147-W169 HydrophobicContact CB-CZ3 3.96Å; L147-W169 HydrophobicContact CD1-CD2 4.3Å; L147-W169 HydrophobicContact CD1-CG 4.41Å; L147-W169 HydrophobicContact CD2-CB 4.22Å; L147-W169 HydrophobicContact CD2-CD2 3.85Å; L147-W169 HydrophobicContact CD2-CE3 3.96Å; L147-W169 HydrophobicContact CD2-CG 3.97Å; L147-W169 HydrophobicContact CG-CD2 4.37Å; L147-W169 VanDerWaalsContact O-CZ3 3.26Å; L147-W169 WeakPolarHBondContact O-CZ3 3.19Å
148T95.8Very high95.5Very high109 Ų10955.9 Ų55.967%0.66928%0.279SS*.Hα-helixtrans-89.5-23.3178.2580000113.8R144 H145 W169R144-T148 PolarHBondContact O-N 2.93Å; R144-T148 PolarHBondContact O-OG1 3.32Å; H145-T148 PolarHBondContact O-N 2.88Å; H145-T148 PolarHBondContact O-OG1 3.43Å; T148-W169 HydrophobicContact CG2-CH2 4.13Å
149L94.5Very high95.3Very high73 Ų7353.4 Ų53.438%0.38227%0.27SS..Hα-helixtrans-81.8-31.6-179.5-178.9146.6000113.4H145 R190H145-L149 WeakPolarHBondContact CE1-CD1 3.41Å; H145-L149 WeakPolarHBondContact NE2-CD1 3.31Å; H145-L149 WeakPolarHBondContact O-CB 3.49Å; H145-L149 PolarHBondContact O-N 2.99Å; L149-R190 PolarHBondContact O-NH2 3.12Å
150N93.3Very high94.7Very high11 Ų1159.7 Ų59.76%0.05931%0.313CS..  trans-107.7125.1-171.1-61-81.7000112I101 N146 C152 F153I101-N150 WeakPolarHBondContact CD1-OD1 3.43Å; N146-N150 PolarHBondContact O-N 3Å; N146-N150 PolarHBondContact O-ND2 3.42Å; N146-N150 PolarHBondContact OD1-ND2 3.42Å; N150-C152 PolarHBondContact O-N 3.41Å; N150-F153 HydrophobicContact CB-CD2 4.18Å; N150-F153 HydrophobicContact CB-CE2 4.35Å; N150-F153 PolarHBondContact O-N 3.31Å; N150-F153 VanDerWaalsContact O-N 3.09Å
151D92.5Very high94Very high61 Ų6161.2 Ų61.233%0.32634%0.338SS..THydrogen-bonded Turntrans-64.3-10.6-178.5-35.9-56.1000113.4F153 R190 F191 R193D151-F153 PolarHBondContact O-N 2.76Å; D151-R190 IonicContact OD2-CZ 3.46Å; D151-R190 IonicContact OD2-NH1 3.59Å; D151-R190 PolarHBondContact OD2-NH1 3.43Å; D151-R190 IonicContact OD2-NH2 2.74Å; D151-R190 PolarHBondContact OD2-NH2 3.04Å; D151-F191 HydrophobicContact CB-CD1 4.19Å; D151-F191 HydrophobicContact CB-CE1 4.19Å; D151-R193 HydrophobicContact CB-CG 3.89Å
152C93.3Very high93.2Very high5 Ų564.6 Ų64.63%0.03434%0.344CS..THydrogen-bonded Turntrans-64.8-17.7171.8-500000113.4N150 L171 D172 A175 F191N150-C152 PolarHBondContact O-N 3.41Å; C152-L171 CarbonylContact O-C 3.54Å; C152-L171 WeakPolarHBondContact O-CA 3.47Å; C152-D172 PolarHBondContact O-N 3.44Å; C152-A175 HydrophobicContact CB-CB 4.13Å; C152-F191 HydrophobicContact CB-CD1 4.46Å; C152-F191 VanDerWaalsContact SG-CD1 3.54Å
153F95.7Very high92.4Very high11 Ų1169 Ų695%0.04837%0.371CS..EExtended strand (participates in β ladder)trans-116.7119.7-175.3-55.7-56.3000110.5I101 I104 I108 L147 N150 D151 W169 T170 L171I101-F153 HydrophobicContact CB-CE2 4.43Å; I101-F153 HydrophobicContact CB-CZ 4.4Å; I101-F153 HydrophobicContact CG1-CE2 4.49Å; I101-F153 HydrophobicContact CG2-CE2 4.01Å; I101-F153 HydrophobicContact CG2-CZ 3.77Å; I101-F153 WeakPolarHBondContact O-CZ 3.23Å; I104-F153 HydrophobicContact CB-CE1 3.93Å; I104-F153 HydrophobicContact CB-CE2 4.21Å; I104-F153 HydrophobicContact CB-CZ 3.64Å; I104-F153 HydrophobicContact CD1-CE2 3.95Å; I104-F153 HydrophobicContact CD1-CZ 4.26Å; I104-F153 HydrophobicContact CG2-CD1 3.72Å; I104-F153 HydrophobicContact CG2-CD2 4.41Å; I104-F153 HydrophobicContact CG2-CE1 3.34Å; I104-F153 HydrophobicContact CG2-CE2 4.08Å; I104-F153 HydrophobicContact CG2-CG 4.25Å; I104-F153 HydrophobicContact CG2-CZ 3.54Å; I108-F153 HydrophobicContact CD1-CD1 4.07Å; I108-F153 HydrophobicContact CD1-CE1 4.36Å; L147-F153 HydrophobicContact CD2-CB 4.1Å; L147-F153 HydrophobicContact CD2-CD2 4.23Å; L147-F153 HydrophobicContact CD2-CG 4.04Å; N150-F153 HydrophobicContact CB-CD2 4.18Å; N150-F153 HydrophobicContact CB-CE2 4.35Å; N150-F153 PolarHBondContact O-N 3.31Å; N150-F153 VanDerWaalsContact O-N 3.09Å; D151-F153 PolarHBondContact O-N 2.76Å; F153-W169 HydrophobicContact CB-CE3 4.12Å; F153-W169 HydrophobicContact CB-CZ3 4.45Å; F153-T170 WeakPolarHBondContact CA-O 3.38Å; F153-L171 HydrophobicContact CD1-CD1 4.27Å; F153-L171 HydrophobicContact CE1-CD1 3.87Å
154V96.2Very high91.9Very high25 Ų2571.5 Ų71.515%0.15240%0.397CS..EExtended strand (participates in β ladder)trans-104.8132.9-178.1-173.10000109.3I156 W169 T170 D172 Y202V154-I156 HydrophobicContact CB-CD1 4.36Å; V154-I156 HydrophobicContact CG1-CD1 3.88Å; V154-W169 WeakPolarHBondContact O-CA 3.28Å; V154-T170 PolarHBondContact N-O 2.92Å; V154-T170 PolarHBondContact O-N 2.83Å; V154-D172 HydrophobicContact CG2-CB 4.04Å; V154-Y202 HydrophobicContact CG1-CD1 4.4Å; V154-Y202 HydrophobicContact CG1-CE1 4.03Å
155K96.6Very high91.4Very high116 Ų11676.8 Ų76.850%0.50442%0.422SS..EExtended strand (participates in β ladder)trans-84.8115.4175.3-178.2-168.2170.9-164.40109.2N167 W169K155-N167 VanDerWaalsContact CE-ND2 3.32Å; K155-N167 WeakPolarHBondContact CE-ND2 3.43Å; K155-N167 WeakPolarHBondContact CE-OD1 3.17Å; K155-N167 HydrophobicContact CG-CB 3.89Å; K155-W169 HydrophobicContact CB-CE3 4.15Å; K155-W169 HydrophobicContact CB-CH2 3.91Å; K155-W169 HydrophobicContact CB-CZ2 4.32Å; K155-W169 HydrophobicContact CB-CZ3 3.82Å; K155-W169 HydrophobicContact CG-CH2 4.39Å; K155-W169 HydrophobicContact CG-CZ2 4.34Å
156I95.3Very high91.2Very high37 Ų3774.2 Ų74.219%0.1942%0.423CS..EExtended strand (participates in β ladder)trans-102.5121179.3-51.3-58.2000108.6V154 Y168 T170 Y202V154-I156 HydrophobicContact CB-CD1 4.36Å; V154-I156 HydrophobicContact CG1-CD1 3.88Å; I156-Y168 PolarHBondContact N-O 3.4Å; I156-Y168 PolarHBondContact O-N 3.21Å; I156-T170 HydrophobicContact CD1-CG2 4.32Å; I156-T170 HydrophobicContact CG1-CG2 3.65Å; I156-T170 WeakPolarHBondContact CG1-OG1 3.41Å; I156-Y202 HydrophobicContact CD1-CE1 3.77Å; I156-Y202 WeakPolarHBondContact CD1-OH 3.27Å; I156-Y202 WeakPolarHBondContact CG2-OH 3.33Å
157P94Very high91.1Very high84 Ų8475.6 Ų75.655%0.54543%0.43SS..PPolyproline II helixtrans-65.2152.6174.530.1-31.7000110.3Y202P157-Y202 VanDerWaalsContact CD-OH 3.23Å; P157-Y202 WeakPolarHBondContact CD-OH 3.37Å
158R91Very high91.1Very high65 Ų6577.5 Ų77.525%0.24544%0.438CS..PPolyproline II helixtrans-78.4149.6175.5-51.5-16791.5-147.28.6110.1R162 P163 G166 Y168R158-R162 PolarHBondContact NH1-O 3.17Å; R158-P163 PolarHBondContact NH1-O 3.04Å; R158-G166 VanDerWaalsContact CD-O 3.28Å; R158-G166 WeakPolarHBondContact CD-O 3.29Å; R158-G166 WeakPolarHBondContact CG-O 3.45Å; R158-Y168 HydrophobicContact CB-CE2 4.46Å; R158-Y168 HydrophobicContact CG-CD2 3.98Å; R158-Y168 HydrophobicContact CG-CE2 3.94Å; R158-Y168 PolarHBondContact NH2-OH 3.32Å
159E89.2Confident91.2Very high123 Ų12373.8 Ų73.858%0.57541%0.412SS*.PPolyproline II helixtrans-59.1137.2169-70.3164.9-166.800110.8G161 R162E159-G161 PolarHBondContact O-N 3.28Å; E159-R162 PolarHBondContact O-N 2.99Å; E159-R162 VanDerWaalsContact O-N 3.14Å; E159-R162 IonicContact OE2-NE 3.57Å
160P83.1Confident91.3Very high145 Ų14571.7 Ų71.794%0.94240%0.402SS*.THydrogen-bonded Turntrans-65.7-11.2-173.725-34000114.7
161G82.7Confident91.4Very high67 Ų6772.1 Ų72.169%0.69140%0.404SS*.THydrogen-bonded Turntrans-88.8-6.9175.700000115.8E159 P163E159-G161 PolarHBondContact O-N 3.28Å; G161-P163 WeakPolarHBondContact O-CD 3.35Å
162R80.4Confident91.4Very high167 Ų16769.7 Ų69.763%0.6339%0.391SS*.SBendtrans-115.687.8-175.9-67.7-173.6-174.8-95.43.9111.4R158 E159 G164R158-R162 PolarHBondContact NH1-O 3.17Å; E159-R162 PolarHBondContact O-N 2.99Å; E159-R162 VanDerWaalsContact O-N 3.14Å; E159-R162 IonicContact OE2-NE 3.57Å; R162-G164 PolarHBondContact O-N 3.39Å
163P79.1Confident91.3Very high130 Ų13073.3 Ų73.384%0.84442%0.415SS*.  trans-59.3140.3177.625.2-33.9000110.9R158 G161R158-P163 PolarHBondContact NH1-O 3.04Å; G161-P163 WeakPolarHBondContact O-CD 3.35Å
164G87Confident91Very high52 Ų5276 Ų7654%0.53644%0.439SS..  trans154.9168.5177.200000114.1R162R162-G164 PolarHBondContact O-N 3.39Å
165K89.1Confident90.5Very high202 Ų20274.9 Ų74.988%0.87843%0.432SS*.SBendtrans-81.4122.9-158.8-171.6172.1-176.41700113.9
166G92.3Very high90Very high47 Ų4771.9 Ų71.949%0.48542%0.42SS..SBendtrans87.8-158.4167.300000114R158R158-G166 VanDerWaalsContact CD-O 3.28Å; R158-G166 WeakPolarHBondContact CD-O 3.29Å; R158-G166 WeakPolarHBondContact CG-O 3.45Å
167N95.3Very high89.5Confident53 Ų5376.4 Ų76.428%0.28344%0.444SS..  trans-121.5160.8179-66.7-96.2000108.8K155K155-N167 VanDerWaalsContact CE-ND2 3.32Å; K155-N167 WeakPolarHBondContact CE-ND2 3.43Å; K155-N167 WeakPolarHBondContact CE-OD1 3.17Å; K155-N167 HydrophobicContact CG-CB 3.89Å
168Y96.6Very high88.9Confident45 Ų4574.6 Ų74.618%0.17643%0.429CS..EExtended strand (participates in β ladder)trans-80.2150.4169.4-70.7-83.1000109.7K115 T117 I156 R158K115-Y168 HydrophobicContact CB-CD1 4.42Å; K115-Y168 HydrophobicContact CD-CD1 4.2Å; K115-Y168 HydrophobicContact CD-CG 4.32Å; K115-Y168 HydrophobicContact CG-CD1 3.81Å; K115-Y168 HydrophobicContact CG-CE1 4.35Å; K115-Y168 HydrophobicContact CG-CG 4.32Å; T117-Y168 HydrophobicContact CG2-CD1 3.9Å; T117-Y168 HydrophobicContact CG2-CE1 3.82Å; I156-Y168 PolarHBondContact N-O 3.4Å; I156-Y168 PolarHBondContact O-N 3.21Å; R158-Y168 HydrophobicContact CB-CE2 4.46Å; R158-Y168 HydrophobicContact CG-CD2 3.98Å; R158-Y168 HydrophobicContact CG-CE2 3.94Å; R158-Y168 PolarHBondContact NH2-OH 3.32Å
169W97.6Very high88.5Confident31 Ų3172 Ų7212%0.11742%0.42CS..EExtended strand (participates in β ladder)trans-120.6125.2170.9-67.791.6000108.3I108 K115 L116 I121 L147 T148 F153 V154 K155I108-W169 HydrophobicContact CD1-CB 4.42Å; K115-W169 WeakPolarHBondContact CA-O 3.4Å; L116-W169 PolarHBondContact N-O 3.04Å; L116-W169 PolarHBondContact O-N 2.95Å; I121-W169 HydrophobicContact CD1-CB 4.35Å; L147-W169 HydrophobicContact CB-CD2 4.25Å; L147-W169 HydrophobicContact CB-CE3 4.14Å; L147-W169 HydrophobicContact CB-CH2 3.91Å; L147-W169 HydrophobicContact CB-CZ2 4.03Å; L147-W169 HydrophobicContact CB-CZ3 3.96Å; L147-W169 HydrophobicContact CD1-CD2 4.3Å; L147-W169 HydrophobicContact CD1-CG 4.41Å; L147-W169 HydrophobicContact CD2-CB 4.22Å; L147-W169 HydrophobicContact CD2-CD2 3.85Å; L147-W169 HydrophobicContact CD2-CE3 3.96Å; L147-W169 HydrophobicContact CD2-CG 3.97Å; L147-W169 HydrophobicContact CG-CD2 4.37Å; L147-W169 VanDerWaalsContact O-CZ3 3.26Å; L147-W169 WeakPolarHBondContact O-CZ3 3.19Å; T148-W169 HydrophobicContact CG2-CH2 4.13Å; F153-W169 HydrophobicContact CB-CE3 4.12Å; F153-W169 HydrophobicContact CB-CZ3 4.45Å; V154-W169 WeakPolarHBondContact O-CA 3.28Å; K155-W169 HydrophobicContact CB-CE3 4.15Å; K155-W169 HydrophobicContact CB-CH2 3.91Å; K155-W169 HydrophobicContact CB-CZ2 4.32Å; K155-W169 HydrophobicContact CB-CZ3 3.82Å; K155-W169 HydrophobicContact CG-CH2 4.39Å; K155-W169 HydrophobicContact CG-CZ2 4.34Å
170T96.6Very high87.8Confident29 Ų2970.2 Ų70.218%0.17841%0.414CS..EExtended strand (participates in β ladder)trans-109.2167.7171.953.10000109.8K115 F153 V154 I156K115-T170 HydrophobicContact CB-CG2 3.46Å; K115-T170 VanDerWaalsContact CB-CG2 3.46Å; F153-T170 WeakPolarHBondContact CA-O 3.38Å; V154-T170 PolarHBondContact N-O 2.92Å; V154-T170 PolarHBondContact O-N 2.83Å; I156-T170 HydrophobicContact CD1-CG2 4.32Å; I156-T170 HydrophobicContact CG1-CG2 3.65Å; I156-T170 WeakPolarHBondContact CG1-OG1 3.41Å
171L95.2Very high87.3Confident19 Ų1970.4 Ų70.410%0.09941%0.407CS..EExtended strand (participates in β ladder)trans-76.2152.8158.9-139.797.4000109.8A105 C152 F153 A175 E176 F179A105-L171 HydrophobicContact CB-CD1 3.99Å; C152-L171 CarbonylContact O-C 3.54Å; C152-L171 WeakPolarHBondContact O-CA 3.47Å; F153-L171 HydrophobicContact CD1-CD1 4.27Å; F153-L171 HydrophobicContact CE1-CD1 3.87Å; L171-A175 VanDerWaalsContact CD2-C 3.42Å; L171-A175 HydrophobicContact CD2-CB 3.95Å; L171-A175 WeakPolarHBondContact CD2-O 3.39Å; L171-A175 HydrophobicContact CG-CB 4.44Å; L171-E176 HydrophobicContact CD2-CB 3.93Å; L171-E176 HydrophobicContact CD2-CG 4.37Å; L171-F179 HydrophobicContact CD1-CD2 4.2Å; L171-F179 HydrophobicContact CD1-CE2 4.3Å; L171-F179 HydrophobicContact CD2-CD2 3.87Å; L171-F179 HydrophobicContact CD2-CE2 4.29Å
172D94.1Very high86.6Confident10 Ų1069.4 Ų69.45%0.05340%0.397CS..  trans-71130.7163.2-173.6-29.2000108.4C152 V154 A174 A175 E176 R193C152-D172 PolarHBondContact O-N 3.44Å; V154-D172 HydrophobicContact CG2-CB 4.04Å; D172-A174 PolarHBondContact O-N 3.28Å; D172-A174 PolarHBondContact OD1-N 2.97Å; D172-A175 HydrophobicContact CB-CB 4.13Å; D172-A175 WeakPolarHBondContact O-CA 3.44Å; D172-A175 VanDerWaalsContact O-CB 3.32Å; D172-A175 WeakPolarHBondContact O-CB 3.45Å; D172-A175 PolarHBondContact O-N 3.21Å; D172-E176 PolarHBondContact O-N 3.03Å; D172-R193 WeakPolarHBondContact OD2-CD 3.3Å; D172-R193 WeakPolarHBondContact OD2-CG 3.5Å; D172-R193 IonicContact OD2-CZ 3.76Å; D172-R193 IonicContact OD2-NE 3.63Å; D172-R193 PolarHBondContact OD2-NE 3.28Å
173P91.1Very high86.5Confident82 Ų8264.6 Ų64.653%0.53239%0.389SS..G310 helixtrans-51.9-37.2174.9-28.936000113.5A175 E176P173-A175 PolarHBondContact O-N 3.38Å; P173-E176 PolarHBondContact O-N 3.18Å
174A87.9Confident86.5Confident68 Ų6860.3 Ų60.356%0.56236%0.357SS*.G310 helixtrans-69.5-2.4176.100000113.8D172 F191D172-A174 PolarHBondContact O-N 3.28Å; D172-A174 PolarHBondContact OD1-N 2.97Å; A174-F191 HydrophobicContact CB-CE2 4.37Å; A174-F191 HydrophobicContact CB-CZ 4.1Å; A174-F191 WeakPolarHBondContact O-CE2 3.29Å
175A86.5Confident85.9Confident0 Ų063.8 Ų63.80%036%0.362CS..G310 helixtrans-113-6.9176.600000114.1C152 L171 D172 P173 M178 F179 F191C152-A175 HydrophobicContact CB-CB 4.13Å; L171-A175 VanDerWaalsContact CD2-C 3.42Å; L171-A175 HydrophobicContact CD2-CB 3.95Å; L171-A175 WeakPolarHBondContact CD2-O 3.39Å; L171-A175 HydrophobicContact CG-CB 4.44Å; D172-A175 HydrophobicContact CB-CB 4.13Å; D172-A175 WeakPolarHBondContact O-CA 3.44Å; D172-A175 VanDerWaalsContact O-CB 3.32Å; D172-A175 WeakPolarHBondContact O-CB 3.45Å; D172-A175 PolarHBondContact O-N 3.21Å; P173-A175 PolarHBondContact O-N 3.38Å; A175-M178 VanDerWaalsContact CA-CE 3.43Å; A175-M178 HydrophobicContact CB-CE 3.33Å; A175-M178 WeakPolarHBondContact O-CB 3.47Å; A175-M178 PolarHBondContact O-N 3.18Å; A175-F179 VanDerWaalsContact O-CD2 3.25Å; A175-F179 WeakPolarHBondContact O-CD2 3.5Å; A175-F191 HydrophobicContact CB-CE1 4.23Å; A175-F191 HydrophobicContact CB-CE2 4.32Å; A175-F191 HydrophobicContact CB-CZ 4.1Å
176E85.5Confident84.9Confident54 Ų5463.8 Ų63.825%0.25236%0.357SS..THydrogen-bonded Turntrans-68.8-47.9-169.6-165.9150-149.800112.6R114 L171 D172 P173 M178 F179 D180R114-E176 IonicContact CZ-OE1 2.71Å; R114-E176 IonicContact NE-OE1 2.95Å; R114-E176 IonicContact NH1-OE1 3.92Å; R114-E176 PolarHBondContact NH1-OE1 3.32Å; L171-E176 HydrophobicContact CD2-CB 3.93Å; L171-E176 HydrophobicContact CD2-CG 4.37Å; D172-E176 PolarHBondContact O-N 3.03Å; P173-E176 PolarHBondContact O-N 3.18Å; E176-M178 PolarHBondContact O-N 3.25Å; E176-F179 PolarHBondContact O-N 3.06Å; E176-D180 PolarHBondContact O-N 2.91Å; E176-D180 VanDerWaalsContact O-N 3.16Å
177D85.3Confident84Confident132 Ų13266 Ų6671%0.70635%0.351SS*.Hα-helixtrans-50.4-28.6171.6-57.2-15.7000113.4F179D177-F179 PolarHBondContact O-N 3.41Å
178M82.5Confident82.8Confident45 Ų4576 Ų7622%0.22238%0.384CS..Hα-helixtrans-74.7-4.2-178.5-51-167.5-78.500114.1A175 E176 R187 F191A175-M178 VanDerWaalsContact CA-CE 3.43Å; A175-M178 HydrophobicContact CB-CE 3.33Å; A175-M178 WeakPolarHBondContact O-CB 3.47Å; A175-M178 PolarHBondContact O-N 3.18Å; E176-M178 PolarHBondContact O-N 3.25Å; M178-R187 VanDerWaalsContact CB-NH2 3.29Å; M178-R187 PolarHBondContact O-NH2 3.46Å; M178-R187 VanDerWaalsContact SD-CZ 3.56Å; M178-R187 PolarHBondContact SD-NH1 3.27Å; M178-F191 HydrophobicContact CE-CB 3.7Å; M178-F191 HydrophobicContact CE-CD1 4.34Å; M178-F191 HydrophobicContact CE-CD2 3.37Å; M178-F191 HydrophobicContact CE-CE2 4.01Å; M178-F191 HydrophobicContact CE-CG 3.56Å; M178-F191 HydrophobicContact SD-CB 4.31Å; M178-F191 HydrophobicContact SD-CD2 3.97Å; M178-F191 HydrophobicContact SD-CG 4.46Å
179F80.6Confident81.8Confident12 Ų1282.4 Ų82.45%0.05341%0.413CS..Hα-helixtrans-134.5-24.6-177.2-58.6-75.9000114.3I101 A105 L171 A175 E176 D177 N181 G182 F184 R187I101-F179 HydrophobicContact CG2-CE1 4.28Å; I101-F179 HydrophobicContact CG2-CZ 3.87Å; A105-F179 HydrophobicContact CB-CB 4.44Å; A105-F179 HydrophobicContact CB-CD1 3.8Å; A105-F179 HydrophobicContact CB-CD2 4.18Å; A105-F179 HydrophobicContact CB-CE1 3.99Å; A105-F179 HydrophobicContact CB-CE2 4.36Å; A105-F179 HydrophobicContact CB-CG 3.88Å; A105-F179 HydrophobicContact CB-CZ 4.26Å; L171-F179 HydrophobicContact CD1-CD2 4.2Å; L171-F179 HydrophobicContact CD1-CE2 4.3Å; L171-F179 HydrophobicContact CD2-CD2 3.87Å; L171-F179 HydrophobicContact CD2-CE2 4.29Å; A175-F179 VanDerWaalsContact O-CD2 3.25Å; A175-F179 WeakPolarHBondContact O-CD2 3.5Å; E176-F179 PolarHBondContact O-N 3.06Å; D177-F179 PolarHBondContact O-N 3.41Å; F179-N181 PolarHBondContact O-N 2.98Å; F179-G182 PolarHBondContact O-N 3.48Å; F179-F184 HydrophobicContact CB-CE1 4.07Å; F179-F184 HydrophobicContact CD1-CD1 4.25Å; F179-F184 HydrophobicContact CD1-CE1 4.47Å; F179-R187 VanDerWaalsContact CZ-NH2 3.3Å
180D75.2Confident80.9Confident85 Ų8586.3 Ų86.346%0.45543%0.428SS..Hα-helixtrans-61.9-37.6-175.1-94.9-5.8000113.5R114 E176 G182R114-D180 IonicContact CZ-OD1 3.79Å; R114-D180 IonicContact NH1-OD1 3.74Å; R114-D180 PolarHBondContact NH1-OD1 2.82Å; R114-D180 IonicContact NH1-OD2 3.85Å; R114-D180 IonicContact NH2-OD1 3.63Å; E176-D180 PolarHBondContact O-N 2.91Å; E176-D180 VanDerWaalsContact O-N 3.16Å; D180-G182 PolarHBondContact O-N 3.41Å
181N72.4Confident80Confident148 Ų14886.5 Ų86.579%0.79143%0.426SS*.THydrogen-bonded Turntrans-76.423.9176.6-56.781000114.4F179 S183F179-N181 PolarHBondContact O-N 2.98Å; N181-S183 VanDerWaalsContact C-N 3.26Å; N181-S183 PolarHBondContact O-N 3.32Å
182G68.6Low79.3Confident46 Ų4692.8 Ų92.847%0.47445%0.453SS..SBendtrans74.38.3178.300000115.4F179 D180 F184F179-G182 PolarHBondContact O-N 3.48Å; D180-G182 PolarHBondContact O-N 3.41Å; G182-F184 WeakPolarHBondContact O-CD2 3.38Å; G182-F184 PolarHBondContact O-N 3.44Å
183S77.7Confident78.4Confident67 Ų6797.7 Ų97.747%0.46947%0.471SS..  trans-77.163.7-178.4-161.50000112.7N181 L185N181-S183 VanDerWaalsContact C-N 3.26Å; N181-S183 PolarHBondContact O-N 3.32Å; S183-L185 PolarHBondContact O-N 3.28Å
184F78.6Confident77.4Confident39 Ų3999.9 Ų99.917%0.17148%0.483CS..  trans-82.81.4177.5-60.6-61.5000113.6Y98 A102 M106 F179 G182Y98-F184 HydrophobicContact CD1-CB 3.75Å; Y98-F184 HydrophobicContact CE1-CB 3.72Å; A102-F184 HydrophobicContact CB-CB 4.08Å; A102-F184 HydrophobicContact CB-CD1 4.49Å; A102-F184 WeakPolarHBondContact CB-O 3.27Å; M106-F184 HydrophobicContact CG-CD1 3.56Å; M106-F184 HydrophobicContact CG-CD2 4.11Å; M106-F184 HydrophobicContact CG-CE1 3.43Å; M106-F184 VanDerWaalsContact CG-CE1 3.43Å; M106-F184 HydrophobicContact CG-CE2 3.98Å; M106-F184 HydrophobicContact CG-CG 3.92Å; M106-F184 HydrophobicContact CG-CZ 3.66Å; M106-F184 HydrophobicContact SD-CD1 4.33Å; M106-F184 HydrophobicContact SD-CD2 4.1Å; M106-F184 HydrophobicContact SD-CE2 4.35Å; M106-F184 HydrophobicContact SD-CG 4.09Å; F179-F184 HydrophobicContact CB-CE1 4.07Å; F179-F184 HydrophobicContact CD1-CD1 4.25Å; F179-F184 HydrophobicContact CD1-CE1 4.47Å; G182-F184 WeakPolarHBondContact O-CD2 3.38Å; G182-F184 PolarHBondContact O-N 3.44Å
185L75.5Confident76Confident125 Ų125103.3 Ų103.365%0.65449%0.492SS*.SBendtrans-70.7158.9176.4-69177.3000112S183 R187S183-L185 PolarHBondContact O-N 3.28Å; L185-R187 PolarHBondContact O-N 3Å
186R68.6Low74.6Confident202 Ų202109.3 Ų109.376%0.76253%0.528SS*.  trans-69.6104.8-175.4178.8178161.8-155.1-2.1111.5
187R73.1Confident73.3Confident93 Ų93111.5 Ų111.535%0.35155%0.549SS..  trans-58.4144.5175.8-152.5172.1-62127.19.5112.5M178 F179 L185 K189M178-R187 VanDerWaalsContact CB-NH2 3.29Å; M178-R187 PolarHBondContact O-NH2 3.46Å; M178-R187 VanDerWaalsContact SD-CZ 3.56Å; M178-R187 PolarHBondContact SD-NH1 3.27Å; F179-R187 VanDerWaalsContact CZ-NH2 3.3Å; L185-R187 PolarHBondContact O-N 3Å; R187-K189 WeakPolarHBondContact CG-O 3.35Å
188R69.3Low71.8Confident263 Ų263111 Ų11199%0.99255%0.551SS**SBendtrans-87.3-26.8-177.9-157.3172.3-172.9148.2-3.9113.5
189K76.8Confident70.4Confident180 Ų180115.8 Ų115.878%0.78357%0.568SS**SBendtrans-110.3135.2173.8-171.5176.1-179.8-178.10109R187R187-K189 WeakPolarHBondContact CG-O 3.35Å
190R77.7Confident69Low114 Ų114120.3 Ų120.343%0.4360%0.598SS.*  trans-77138.2176.2-164.7-167.8171.9-94.417.9109.1L149 D151L149-R190 PolarHBondContact O-NH2 3.12Å; D151-R190 IonicContact OD2-CZ 3.46Å; D151-R190 IonicContact OD2-NH1 3.59Å; D151-R190 PolarHBondContact OD2-NH1 3.43Å; D151-R190 IonicContact OD2-NH2 2.74Å; D151-R190 PolarHBondContact OD2-NH2 3.04Å
191F78.6Confident68.1Low32 Ų32119.5 Ų119.514%0.1461%0.61CS.*  trans-62.7145.6165.5179.2-107.2000109.9D151 C152 A174 A175 M178 R193D151-F191 HydrophobicContact CB-CD1 4.19Å; D151-F191 HydrophobicContact CB-CE1 4.19Å; C152-F191 HydrophobicContact CB-CD1 4.46Å; C152-F191 VanDerWaalsContact SG-CD1 3.54Å; A174-F191 HydrophobicContact CB-CE2 4.37Å; A174-F191 HydrophobicContact CB-CZ 4.1Å; A174-F191 WeakPolarHBondContact O-CE2 3.29Å; A175-F191 HydrophobicContact CB-CE1 4.23Å; A175-F191 HydrophobicContact CB-CE2 4.32Å; A175-F191 HydrophobicContact CB-CZ 4.1Å; M178-F191 HydrophobicContact CE-CB 3.7Å; M178-F191 HydrophobicContact CE-CD1 4.34Å; M178-F191 HydrophobicContact CE-CD2 3.37Å; M178-F191 HydrophobicContact CE-CE2 4.01Å; M178-F191 HydrophobicContact CE-CG 3.56Å; M178-F191 HydrophobicContact SD-CB 4.31Å; M178-F191 HydrophobicContact SD-CD2 3.97Å; M178-F191 HydrophobicContact SD-CG 4.46Å; F191-R193 HydrophobicContact CE1-CG 3.75Å; F191-R193 HydrophobicContact CZ-CG 4.03Å
192K79.3Confident67.4Low152 Ų152117 Ų11766%0.66159%0.59SS**  trans-145135.5168.2-71.8-171.4172.2-169.10105.2T194K192-T194 PolarHBondContact O-N 3.04Å
193R75.3Confident66.6Low112 Ų112120.3 Ų120.342%0.42360%0.595SS.*  trans-66.2120.2170.9-64.417681.7-160.7-2.2107.8D151 D172 F191 D195D151-R193 HydrophobicContact CB-CG 3.89Å; D172-R193 WeakPolarHBondContact OD2-CD 3.3Å; D172-R193 WeakPolarHBondContact OD2-CG 3.5Å; D172-R193 IonicContact OD2-CZ 3.76Å; D172-R193 IonicContact OD2-NE 3.63Å; D172-R193 PolarHBondContact OD2-NE 3.28Å; F191-R193 HydrophobicContact CE1-CG 3.75Å; F191-R193 HydrophobicContact CZ-CG 4.03Å; R193-D195 PolarHBondContact O-N 2.74Å
194T70.8Confident65.2Low129 Ų129124.8 Ų124.879%0.79161%0.608SS**  trans-84.498.5173460000108.5K192K192-T194 PolarHBondContact O-N 3.04Å
195D59Low63.9Low139 Ų139128.8 Ų128.874%0.74364%0.641SS**  trans61.4132.7167-54.5-42.4000119.5R193 S197R193-D195 PolarHBondContact O-N 2.74Å; D195-S197 PolarHBondContact O-N 3.48Å
196V56.5Low62.6Low126 Ų126127.8 Ų127.876%0.76464%0.644SS**THydrogen-bonded Turntrans-8658.6-167.6-169.90000110.5
197S57.6Low61.9Low100 Ų100121.6 Ų121.670%0.69963%0.632SS**THydrogen-bonded Turntrans-110.6-30.3178-163.80000113.2D195 Y199D195-S197 PolarHBondContact O-N 3.48Å; S197-Y199 PolarHBondContact O-N 3.14Å
198T54.6Low60.9Low121 Ų121122.6 Ų122.674%0.74266%0.66SS**SBendtrans-81.4-10-169.7-38.60000115
199Y51.8Low59.9Low147 Ų147119.3 Ų119.358%0.57665%0.653SS**  trans-138.980.1176.8-93.4-83.4000111.9S197 G201S197-Y199 PolarHBondContact O-N 3.14Å; Y199-G201 PolarHBondContact O-N 3.15Å
200P52.2Low59Low107 Ų107115.1 Ų115.170%0.69564%0.643SS**THydrogen-bonded Turntrans-70.1-10.1179.228.1-35.2000114.3Q204P200-Q204 PolarHBondContact O-OE1 2.89Å
201G55.6Low57.7Low68 Ų68115.5 Ų115.570%0.70166%0.66SS**THydrogen-bonded Turntrans-102.9-0.8-172.500000117.3Y199Y199-G201 PolarHBondContact O-N 3.15Å
202Y57.7Low56.4Low95 Ų95118 Ų11837%0.37369%0.687SS.*SBendtrans-114-1.7-167.3-149.2-101.7000116.7V154 I156 P157V154-Y202 HydrophobicContact CG1-CD1 4.4Å; V154-Y202 HydrophobicContact CG1-CE1 4.03Å; I156-Y202 HydrophobicContact CD1-CE1 3.77Å; I156-Y202 WeakPolarHBondContact CD1-OH 3.27Å; I156-Y202 WeakPolarHBondContact CG2-OH 3.33Å; P157-Y202 VanDerWaalsContact CD-OH 3.23Å; P157-Y202 WeakPolarHBondContact CD-OH 3.37Å
203M53.5Low55.2Low115 Ų115117.6 Ų117.657%0.56770%0.697SS**  trans-131.313.1-174.5-71.7-83.491.100115.9S205M203-S205 PolarHBondContact O-N 3.1Å
204Q47.3Very low53.9Low162 Ų162120.7 Ų120.776%0.75772%0.719SS**THydrogen-bonded Turntrans-73.267.8161.5-79.186-2.100111.9P200P200-Q204 PolarHBondContact O-OE1 2.89Å
205S51Low52.5Low123 Ų123117.9 Ų117.986%0.8672%0.715SS**THydrogen-bonded Turntrans-149.936.7156.7-94.60000111.8M203M203-S205 PolarHBondContact O-N 3.1Å
206S49.5Very low51.4Low103 Ų103122.5 Ų122.572%0.7272%0.722SS**SBendtrans-71.2121.7152.6-62.70000107.9
207S52.7Low50.7Low73 Ų73120.8 Ų120.851%0.5171%0.714SS.*  trans-48.5138.9179.948.50000113.1F209 T210S207-F209 PolarHBondContact O-N 2.88Å; S207-T210 PolarHBondContact O-N 3.37Å; S207-T210 PolarHBondContact O-OG1 2.94Å
208A52.7Low50Low113 Ų113121.3 Ų121.393%0.93472%0.718SS**THydrogen-bonded Turntrans-64.818.5173.300000115.1
209F48.1Very low49.3Very low194 Ų194125 Ų12585%0.85172%0.719SS**THydrogen-bonded Turntrans-125.70.9-176.9-124.9-87.1000113.7S207 P211S207-F209 PolarHBondContact O-N 2.88Å; F209-P211 WeakPolarHBondContact O-CD 3.45Å
210T57.2Low49.1Very low92 Ų92123.4 Ų123.456%0.56473%0.727SS**SBendtrans-84.1112.6163.546.30000108.3S207 A212S207-T210 PolarHBondContact O-N 3.37Å; S207-T210 PolarHBondContact O-OG1 2.94Å; T210-A212 PolarHBondContact O-N 3.12Å
211P50.4Low48.4Very low122 Ų122126.3 Ų126.379%0.79274%0.737SS**  trans-61.6126.2173.526-32.8000108.6F209 T213F209-P211 WeakPolarHBondContact O-CD 3.45Å; P211-T213 PolarHBondContact O-N 2.96Å
212A51.9Low48Very low84 Ų84128 Ų12869%0.69473%0.734SS**  trans-60.5124.717000000108.2T210 M214T210-A212 PolarHBondContact O-N 3.12Å; A212-M214 PolarHBondContact O-N 3.01Å
213T53.2Low47.1Very low144 Ų144131.1 Ų131.188%0.88376%0.756SS**  trans-6983.3167.448.60000108.1P211 G215P211-T213 PolarHBondContact O-N 2.96Å; T213-G215 PolarHBondContact O-N 3Å
214M49.1Very low46.3Very low178 Ų178136.7 Ų136.788%0.87777%0.772SS**  trans-55.1134.4170.2-77.7-169.5168.800108.8A212 R216A212-M214 PolarHBondContact O-N 3.01Å; M214-R216 PolarHBondContact O-N 2.99Å
215G41Very low45.7Very low70 Ų70133 Ų13372%0.72277%0.769SS**  trans-56.1129.4-178.800000110.9T213 P217T213-G215 PolarHBondContact O-N 3Å; G215-P217 VanDerWaalsContact O-CD 3.3Å; G215-P217 WeakPolarHBondContact O-CD 3.39Å
216R36.2Very low44.8Very low235 Ų235130 Ų13089%0.88776%0.759SS**  trans-63.1115.6175.1-172.5178.1-169.6-103.45.3108.5M214 S218M214-R216 PolarHBondContact O-N 2.99Å; R216-S218 PolarHBondContact O-N 3.25Å
217P42.5Very low44.3Very low91 Ų91133.8 Ų133.859%0.59177%0.769SS**PPolyproline II helixtrans-64.8129.8175.726-32.2000109.3G215 Y219G215-P217 VanDerWaalsContact O-CD 3.3Å; G215-P217 WeakPolarHBondContact O-CD 3.39Å; P217-Y219 PolarHBondContact O-N 2.84Å
218S42.9Very low43.5Very low111 Ų111133.6 Ų133.678%0.77678%0.778SS**PPolyproline II helixtrans-77.4116.7172.9-173.40000108.6R216 P220R216-S218 PolarHBondContact O-N 3.25Å; S218-P220 WeakPolarHBondContact O-CD 3.38Å
219Y38.2Very low42.7Very low198 Ų198134.1 Ų134.178%0.77678%0.775SS**PPolyproline II helixtrans-70124.7171.5-69-84.3000109.6P217 N221P217-Y219 PolarHBondContact O-N 2.84Å; Y219-N221 PolarHBondContact O-N 2.81Å
220P49Very low42.1Very low114 Ų114128.4 Ų128.474%0.7477%0.771SS**  trans-76.4109.716830.6-30000108.3S218S218-P220 WeakPolarHBondContact O-CD 3.38Å
221N36.1Very low41.1Very low167 Ų167135.1 Ų135.189%0.89379%0.788SS**  trans-86.1120.7170.6-160.621.4000108.5Y219Y219-N221 PolarHBondContact O-N 2.81Å
222T48.7Very low40.4Very low105 Ų105132.2 Ų132.264%0.64478%0.779SS**  trans-138.5148.7-178.5-420000109.5
223L39Very low39.7Very low159 Ų159134.7 Ų134.783%0.83279%0.786SS**  trans82.686.9172.4-48.5177.3000116.6
224Y35.1Very low38.9Very low232 Ų232135.4 Ų135.491%0.9178%0.779SS**  -138.8141.8101.3-159.7-103.3000110.2
225A34.6Very low38.4Very low84 Ų84133.5 Ų133.569%0.69477%0.772SS**  trans-111.8138.7179.600000109.4
226G33.1Very low38.3Very low62 Ų62137.2 Ų137.264%0.63978%0.781SS**  trans176.3108.6171.500000114.6
227I39.4Very low38.3Very low182 Ų182130.2 Ų130.293%0.93377%0.774SS**  trans38.8115.1137.9-33.2174.4000115.5
228G35.6Very low38Very low68 Ų68132.8 Ų132.870%0.70179%0.788SS**  cis148.4143.728.500000107.6
229S36.5Very low37.9Very low124 Ų124132.5 Ų132.587%0.86779%0.785SS**  trans25121.8147.6-154.20000120.3
230G34Very low38.4Very low75 Ų75128.8 Ų128.877%0.77379%0.786SS**  trans177.8118.1167.800000115.3
231Y36Very low38Very low233 Ų233131.7 Ų131.791%0.91479%0.789SS**  trans-62.5159.7178.6-68.4-104.3000116
232G36.6Very low38.7Very low60 Ų60129.6 Ų129.662%0.61978%0.784SS**  trans94.7120.3143.200000116.5
233T36.7Very low38.3Very low137 Ų137128.4 Ų128.484%0.8479%0.785SS**  95.1120.265.643.80000114.8
234Q37.4Very low38.3Very low158 Ų158128.7 Ų128.774%0.73879%0.785SS**  trans82.8119.5151.2-56.9-68.439.300121.6
235L38.2Very low38.5Very low139 Ų139126.2 Ų126.273%0.72878%0.783SS**  40126126.1-59.5165.5000119.9
236T37.9Very low38.7Very low148 Ų148129.5 Ų129.591%0.90878%0.784SS**  -162.9145.8110.212.20000111.3
237A37.3Very low39.2Very low88 Ų88135.2 Ų135.273%0.72779%0.794SS**  trans-99.6149.9171.300000109.6
238T35.5Very low39Very low145 Ų145136.9 Ų136.989%0.8979%0.79SS**  trans-173.1128.213631.40000110.9
239S42.2Very low39Very low104 Ų104142.9 Ų142.973%0.72780%0.8SS**  trans-105.1145.5154.6177.70000106.6
240P48Very low39.1Very low120 Ų120143.2 Ų143.278%0.77980%0.796SS**  -147144.2103.833.6-15.5000116.3
241H41.2Very low39.9Very low175 Ų175145.1 Ų145.181%0.8180%0.795SS**  trans-65.4155.2154-90.2-63.4000110.7
242P50.8Low39.7Very low123 Ų123140.1 Ų140.180%0.79980%0.795SS**  -149.3-174.967.232.6-9000113.9
243A39.2Very low39.6Very low80 Ų80141 Ų14166%0.66180%0.804SS**  cis-179.9174.8-26.100000107.1
244M40.1Very low39.9Very low166 Ų166142.2 Ų142.282%0.81881%0.81SS**  trans69.8106.9163.4-57.1-61.4-179.100120.7
245M39.4Very low39.8Very low179 Ų179137.8 Ų137.888%0.88281%0.807SS**  -159.6137.7115.5-110.3-129171.800112
246H38.5Very low39.8Very low154 Ų154140.2 Ų140.271%0.71382%0.815SS**  trans-80.3142.8170.8-77.8-120.6000110.2
247H43.2Very low40.2Very low182 Ų182136.3 Ų136.384%0.84380%0.804SS**  trans-145.8134.9152.2-105.865.9000110.3
248Y35.4Very low40.4Very low217 Ų217140.2 Ų140.285%0.85181%0.807SS**  trans-85.8128.3172.3-88.3-104.8000109.7
249Q34.8Very low40.7Very low194 Ų194138.3 Ų138.391%0.90780%0.797SS**  trans-166.1130.8142.8-113.9162.212.900113.5
250T39.2Very low41.2Very low130 Ų130144.9 Ų144.980%0.79881%0.806SS**  trans-115171.8153.455.70000106.8
251P49.8Very low41Very low115 Ų115147.5 Ų147.575%0.74781%0.81SS**  cis-127.5167.2-3.140.3-26.5000113.9
252S32.8Very low41.4Very low129 Ų129148.7 Ų148.790%0.90281%0.813SS**  trans157.9139.6141.3-76.30000110.9
253G33.7Very low42.1Very low79 Ų79146.2 Ų146.281%0.81480%0.799SS**  trans137.6110.8167.500000114.9
254V43.8Very low43.2Very low161 Ų161148.2 Ų148.298%0.97680%0.797SS**  trans-73.4134.1170.8175.30000109.6
255G34.8Very low44.3Very low65 Ų65145.7 Ų145.767%0.6779%0.787SS**  trans-167.496.8-179.200000117.3
256Q37.8Very low45Very low190 Ų190142.8 Ų142.889%0.88878%0.775SS**  trans59.9152143.6-66-65.1-14.900121.1
257G47.1Very low46.1Very low66 Ų66141.3 Ų141.368%0.6877%0.771SS**  trans-78.6146.5-167.300000115.3
258Q40.5Very low46.8Very low171 Ų171138.3 Ų138.380%0.79976%0.76SS**  trans-114.4136.9166.1-72.4-68.2-1300109.8R260Q258-R260 PolarHBondContact O-N 3.29Å
259P43.4Very low47.4Very low104 Ų104131.9 Ų131.968%0.67575%0.746SS**  trans-70.2113.2175.629.3-31.9000109M261P259-M261 VanDerWaalsContact C-N 3.33Å; P259-M261 PolarHBondContact O-N 2.78Å
260R51.4Low48.1Very low243 Ų243130.8 Ų130.892%0.91774%0.741SS**  trans-66.791.4173.9-87.9-164.6-88.7-160.1-6.4110.4Q258 F262Q258-R260 PolarHBondContact O-N 3.29Å; R260-F262 PolarHBondContact O-N 2.71Å
261M45.3Very low48.7Very low174 Ų174132.8 Ų132.886%0.85774%0.742SS**  trans-62.3129.2160.2-73.5175.658.200108.7P259 S263P259-M261 VanDerWaalsContact C-N 3.33Å; P259-M261 PolarHBondContact O-N 2.78Å; M261-S263 PolarHBondContact O-N 2.87Å; M261-S263 VanDerWaalsContact O-N 3.14Å
262F48.9Very low48.3Very low201 Ų201133.2 Ų133.288%0.88274%0.743SS**  trans-67.6107.2173.8-84.7-100.9000109.4R260R260-F262 PolarHBondContact O-N 2.71Å
263S64.4Low48.6Very low71 Ų71133 Ų13350%0.49774%0.735SS.*  trans-87.4138.1160.3-155.80000110.8M261 D265M261-S263 PolarHBondContact O-N 2.87Å; M261-S263 VanDerWaalsContact O-N 3.14Å; S263-D265 VanDerWaalsContact C-N 3.28Å; S263-D265 PolarHBondContact O-N 2.8Å; S263-D265 PolarHBondContact OG-OD2 2.83Å
264I63.3Low48.6Very low122 Ų122136.5 Ų136.563%0.62674%0.741SS**THydrogen-bonded Turntrans-73.8-24.4-177.1-63.8170.2000110.9N266 I267 I268I264-N266 PolarHBondContact O-N 2.99Å; I264-I267 PolarHBondContact O-N 3.05Å; I264-I268 HydrophobicContact CG2-CD1 4.19Å
265D63.2Low48.1Very low112 Ų112137.7 Ų137.760%0.59974%0.736SS**Hα-helixtrans-60.4-32.1-174.3-45.3-53.7000112.7S263 I267 I268 S269S263-D265 VanDerWaalsContact C-N 3.28Å; S263-D265 PolarHBondContact O-N 2.8Å; S263-D265 PolarHBondContact OG-OD2 2.83Å; D265-I267 PolarHBondContact O-N 3.06Å; D265-I268 PolarHBondContact O-N 3.28Å; D265-S269 PolarHBondContact O-N 2.94Å; D265-S269 PolarHBondContact O-OG 3.04Å
266N53.9Low48Very low119 Ų119138.6 Ų138.664%0.63675%0.745SS**Hα-helixtrans-77.7-3.5-178.3-143.76.7000113.9I264I264-N266 PolarHBondContact O-N 2.99Å
267I60.6Low47.7Very low122 Ų122133 Ų13363%0.62674%0.738SS**Hα-helixtrans-95.2-30.5171.7-62.1174.7000110.4I264 D265I264-I267 PolarHBondContact O-N 3.05Å; D265-I267 PolarHBondContact O-N 3.06Å
268I57.9Low47.7Very low120 Ų120135.5 Ų135.562%0.61574%0.743SS**Hα-helixtrans-80.2-29.6-176.5-60.1175000110.9I264 D265 Q270I264-I268 HydrophobicContact CG2-CD1 4.19Å; D265-I268 PolarHBondContact O-N 3.28Å; I268-Q270 VanDerWaalsContact C-N 3.31Å; I268-Q270 PolarHBondContact O-N 2.92Å
269S48.2Very low47.6Very low81 Ų81134.4 Ų134.457%0.56675%0.747SS**THydrogen-bonded Turntrans-71.5-13.6178.553.20000115.6D265D265-S269 PolarHBondContact O-N 2.94Å; D265-S269 PolarHBondContact O-OG 3.04Å
270Q50.3Low47.1Very low171 Ų171133.1 Ų133.180%0.79975%0.753SS**THydrogen-bonded Turntrans-99.612.7-178.6-72.8-157.161.800114.8I268I268-Q270 VanDerWaalsContact C-N 3.31Å; I268-Q270 PolarHBondContact O-N 2.92Å
271Q51.3Low46.3Very low172 Ų172131.2 Ų131.280%0.80475%0.754SS**SBendtrans-14352.2-177.1-159.4160.850.700115.7
272T41.5Very low45.7Very low125 Ų125131.2 Ų131.277%0.76776%0.757SS**  trans-148.8152157.443.10000112.9
273V38.3Very low44.9Very low123 Ų123126.4 Ų126.475%0.74575%0.749SS**  trans77.687.5169.5-1610000117.4
274V33.9Very low43.4Very low154 Ų154128.7 Ų128.793%0.93376%0.759SS**  trans-115.298.1132.31780000106.7
275Q34.5Very low42Very low186 Ų186131.7 Ų131.787%0.86977%0.771SS**  trans-125.6129.9162.2-102.6-170.5-9.700106.8
276G33.1Very low40.7Very low84 Ų84130.5 Ų130.587%0.86678%0.776SS**  trans-97.5155.1-172.300000113.7
277G30.9Very low39.7Very low72 Ų72133.2 Ų133.274%0.74279%0.79SS**  trans136152.4168.200000112.7
278P47.5Very low38.3Very low119 Ų119130.2 Ų130.277%0.77379%0.79SS**  cis-130.1178.6-26.440.9-25.9000112.8
279V37.3Very low37.2Very low147 Ų147133.1 Ų133.189%0.89181%0.805SS**  trans8.4126.8163.8-59.60000120.5
280G34Very low36.5Very low78 Ų78134.6 Ų134.680%0.80482%0.816SS**  trans-169.3134.316500000110.4
281E34.2Very low35.7Very low202 Ų202130.5 Ų130.594%0.94482%0.82SS**  trans-64.7151.8-174-60177.2115.700113.5
282L33.2Very low34.8Very low174 Ų174125.8 Ų125.891%0.91182%0.817SS**  trans-143.3132.2154.2-170.358.7000112.1
283S30.3Very low34.5Very low101 Ų101128.3 Ų128.371%0.70683%0.826SS**  trans-74.1146.3177.5-84.80000114
284T34Very low34.4Very low118 Ų118130.6 Ų130.672%0.72483%0.833SS**  trans9.112014745.60000120.7
285Q34.6Very low34.3Very low185 Ų185126.8 Ų126.886%0.86483%0.825SS**  -177.1113.8117.3-96163.374.700108.2
286A35.7Very low34.4Very low87 Ų87122.3 Ų122.372%0.71981%0.814SS**  67.8120.784.500000112.9
287L33.3Very low34.3Very low176 Ų176126.5 Ų126.592%0.92181%0.813SS**  cis-150.5171.64.3-80.2139.4000108.7
288G30.1Very low34.5Very low60 Ų60129 Ų12962%0.61981%0.814SS**  cis149.7131-8.100000113.8
289L35.8Very low33.8Very low180 Ų180129.3 Ų129.394%0.94282%0.819SS**  trans71.8141.4171.8-47.1177.1000116.5
290S32.6Very low33.6Very low113 Ų113128.2 Ų128.279%0.7982%0.818SS**  cis-160.4146.615.252.60000113.7
291G32.8Very low33.5Very low85 Ų85130.5 Ų130.588%0.87682%0.82SS**  trans67.8131.9155.300000118.2
292G34.1Very low33.4Very low72 Ų72126.7 Ų126.774%0.74282%0.816SS**  cis115.397.44.400000111.9
293D34.1Very low33.3Very low178 Ų178124.9 Ų124.995%0.95281%0.812SS**  trans-164.2157.9134.7-113.4-33.7000113.8
294L36.7Very low33.5Very low171 Ų171126.6 Ų126.690%0.89582%0.818SS**  trans-105.6133-163.1-177.369.8000112.2
295G32.6Very low33.4Very low74 Ų74128.2 Ų128.276%0.76382%0.822SS**  trans-14784.617900000112.7
296S34.7Very low33.5Very low93 Ų93126.3 Ų126.365%0.6582%0.823SS**  trans-65.5148.1173-173.90000111.5
297M32.3Very low33.4Very low171 Ų171129.3 Ų129.384%0.84283%0.828SS**  179.9121.4119.9-90.5-60.115500110.1
298T33.8Very low34.1Very low125 Ų125126.3 Ų126.377%0.76782%0.818SS**  trans-72.1145.3173.350.10000111.7
299S34.4Very low34.2Very low125 Ų125128.8 Ų128.887%0.87483%0.827SS**  trans-147.595.6160.4-78.60000111.4
300S33.4Very low34.2Very low124 Ų124124.9 Ų124.987%0.86782%0.82SS**  trans-92.7137.1158.5-60.90000108.3
301C30.8Very low34.3Very low126 Ų126125.4 Ų125.485%0.85182%0.823SS**  trans-135.7121.1164.855.20000111.3
302S32.3Very low34.2Very low122 Ų122130 Ų13085%0.85382%0.819SS**  trans-91.3149.4173.1-61.20000109.8
303V31.1Very low34.3Very low136 Ų136134.5 Ų134.582%0.82482%0.82SS**  trans-99.8129.2-178-178.40000110.7
304T34.4Very low34.1Very low137 Ų137130.4 Ų130.484%0.8481%0.806SS**  trans-139135.5164.148.70000110.7
305N32.8Very low34Very low152 Ų152130.6 Ų130.681%0.81380%0.802SS**  trans-73.5150.5178.2-67.4-44.6000112.9
306T36Very low34.1Very low145 Ų145132.3 Ų132.389%0.8980%0.798SS**  -162.4127.1129.627.10000110.9
307D32.9Very low34Very low151 Ų151134.9 Ų134.981%0.80781%0.809SS**  trans-65.9169.9160.9-96.1-45.3000111.2
308P48.4Very low34.1Very low112 Ų112133.8 Ų133.873%0.72781%0.807SS**  cis-153.5160.140.341.7-19.3000121.6
309S33.2Very low35Very low113 Ų113133.7 Ų133.779%0.7981%0.809SS**  trans56.7129.1134.1-58.90000125.2
310A34.1Very low35Very low98 Ų98132.6 Ų132.681%0.8181%0.807SS**  trans92.6101134.500000122.8
311C35.1Very low35.2Very low124 Ų124130.9 Ų130.984%0.83880%0.8SS**  -174.9130123.353.60000108.9
312F32Very low35.6Very low181 Ų181131 Ų13179%0.79480%0.797SS**  86.3108.251.1-113.4-91.9000116.2
313Q34.4Very low35.7Very low166 Ų166132.5 Ų132.578%0.77679%0.793SS**  trans59.5160.6153.5-73.8178.2-2400119
314S30.6Very low35.9Very low93 Ų93134.1 Ų134.165%0.6580%0.796SS**  cis-162.2164.8-14.6-106.70000110.2
315Q33.9Very low35.7Very low174 Ų174130.9 Ų130.981%0.81379%0.79SS**  trans7.2159.8146.1-61.3-169.416.400121.9
316T35.1Very low35.8Very low111 Ų111135.6 Ų135.668%0.68180%0.796SS**  cis179.5141.8-12.8370000107.3
317V33.1Very low35.7Very low146 Ų146135.5 Ų135.589%0.88579%0.79SS**  trans-156.5138.8144-138.10000111.8
318N35.4Very low35.8Very low149 Ų149133.4 Ų133.480%0.79779%0.787SS**  trans-96.2-161.2167.3-58.2-47.9000109
319P51.8Low35Very low123 Ų123131.9 Ų131.980%0.79979%0.792SS**  cis-135.8167.4-15.937.9-20.1000115.8
320A33.3Very low35Very low102 Ų102133.3 Ų133.384%0.84379%0.791SS**  trans162.7147.614600000110.1
321A38.4Very low35Very low88 Ų88135 Ų13573%0.72779%0.785SS**  cis-159.7142.7-21.800000109.5
322T38.8Very low34.9Very low127 Ų127135 Ų13578%0.77978%0.781SS**  trans57.497.6139.7-48.60000121.8
323M34.9Very low35Very low155 Ų155130.8 Ų130.876%0.76478%0.775SS**  66.2128.2124.6-62.3-63.1-175.400123.8
324L34.7Very low34.8Very low170 Ų170129.8 Ų129.889%0.8978%0.775SS**  trans63.4148.4141.7-56.5165.5000118.3
325G31.4Very low35Very low69 Ų69132.8 Ų132.871%0.71178%0.783SS**  cis175146.5-6.300000111.9
326R34.2Very low35Very low250 Ų250128 Ų12894%0.94377%0.772SS**  trans27.6121.2158.4-89.3-178.3175.6175.8-0.8121.9
327N35Very low35.1Very low143 Ų143129.4 Ų129.477%0.76578%0.781SS**  98.1139.1117-16240.2000121
328S33.8Very low35Very low108 Ų108126 Ų12676%0.75578%0.775SS**  trans64149.1160.4-70.20000120.1
329G30.9Very low34.9Very low79 Ų79129.9 Ų129.981%0.81478%0.78SS**  trans134.380.6158.400000116.1
330N33.4Very low35Very low144 Ų144129.2 Ų129.277%0.7778%0.776SS**  trans-59.7146.6163.7-17522.2000111.9
331L35.4Very low34.9Very low132 Ų132135.3 Ų135.369%0.69178%0.779SS**  trans149.9133.6130.7-78.9163.4000116.1
332T31.8Very low34.8Very low124 Ų124136.2 Ų136.276%0.76178%0.78SS**  trans63.7153143.654.90000121.2
333S34.3Very low34.7Very low93 Ų93135 Ų13565%0.6578%0.783SS**  cis-176.9171.6-22.654.80000110
334N30.6Very low34.7Very low145 Ų145132.2 Ų132.278%0.77578%0.784SS**  trans108.5128.6174.8-64.8-48.8000112.5
335L35.6Very low34.7Very low157 Ų157129.7 Ų129.782%0.82278%0.781SS**  cis-140.3178.811.4-140.970.5000107.7
336A33.3Very low34.9Very low72 Ų72131.2 Ų131.260%0.59579%0.787SS**  cis-159.9173.78.700000113.7
337T37.5Very low35.1Very low142 Ų142124.6 Ų124.687%0.87178%0.779SS**  trans41.9115.9147.7-280000123
338G31Very low36Very low73 Ų73123.8 Ų123.875%0.75378%0.781SS**  97.794124.300000120.9
339Y33.5Very low37.1Very low232 Ų232124.6 Ų124.691%0.9178%0.784SS**  trans-84.1-178.2163.9-80.5-81.4000112.4
340P53.8Low37.6Very low108 Ų108128.5 Ų128.570%0.70179%0.786SS**  cis-133.6157.3-8.230-10.2000116.3
341Y29.7Very low37.9Very low230 Ų230129.2 Ų129.290%0.90279%0.789SS**  -160.5159.4123.2-136.5-103.1000112.5
342S37.8Very low39Very low108 Ų108128.6 Ų128.676%0.75579%0.793SS**  trans-83.5155.8-159.7-57.80000116.4
343A35.2Very low39.2Very low101 Ų101127.9 Ų127.984%0.83579%0.793SS**  trans-77.3155169.100000112.8
344A35.1Very low39.2Very low97 Ų97132 Ų13280%0.80280%0.804SS**  -179.7144122.900000113.3
345S35.5Very low39.6Very low116 Ų116128.9 Ų128.981%0.81179%0.794SS**  trans-43.8140.5167.448.60000116.4
346A35.4Very low39.6Very low102 Ų102129.9 Ų129.984%0.84380%0.795SS**  trans-92137.1166.500000112.4
347S37.8Very low39.6Very low111 Ų111131.3 Ų131.378%0.77681%0.806SS**  trans-134.6146.6158.8-720000107.8
348P53.7Low39.4Very low125 Ų125127.7 Ų127.781%0.81280%0.797SS**PPolyproline II helixtrans-80.6158.4-171.832.3-35.1000113.4
349P57Low39.5Very low126 Ų126134.7 Ų134.782%0.81881%0.807SS**PPolyproline II helixtrans-98.2161.2-163.837.8-36.5000116
350N41.5Very low39.7Very low161 Ų161128.7 Ų128.786%0.86180%0.799SS**PPolyproline II helixtrans-92.4164.8164.6-108-34.9000111.2
351L40.6Very low40.1Very low159 Ų159129.6 Ų129.683%0.83281%0.805SS**  trans-175.6156.9158.2-99.8160.5000109.7
352P57.5Low40.2Very low119 Ų119122.5 Ų122.577%0.77380%0.802SS**  cis-120.1179.8-22.213.711.1000114.2
353S36.4Very low40Very low109 Ų109121.1 Ų121.176%0.76280%0.804SS**  trans-92.7153.3-179171.20000113.9
354M34.6Very low40.1Very low178 Ų178121.7 Ų121.788%0.87780%0.803SS**  trans-144.4144.3141.7-83.4-13680.700112.9
355S39.3Very low40.1Very low81 Ų81125.2 Ų125.257%0.56680%0.802SS**  trans-64.8146.4-170.355.60000118.9
356Q35.2Very low40.2Very low178 Ų178124.4 Ų124.483%0.83279%0.792SS**  163.3154.6100.4-86.2-152.814.500112.7
357A33.3Very low40.4Very low102 Ų102130.6 Ų130.684%0.84380%0.796SS**  trans34.7143.2155.300000120.9
358G33.3Very low40.1Very low65 Ų65130.4 Ų130.467%0.6779%0.793SS**  cis160.31788.100000109.6
359F33.5Very low39.3Very low221 Ų221129.7 Ų129.797%0.96979%0.791SS**  trans76.6142.2-178.3-73-86.2000119.1
360S37.2Very low38.2Very low106 Ų106129.3 Ų129.374%0.74179%0.791SS**  trans-153.1-174.8-176.8-159.80000106.1
361P62.6Low38Very low126 Ų126129.8 Ų129.882%0.81879%0.794SS**  -120175-90.239.1-25.1000113.7
362G32.7Very low37.8Very low82 Ų82132.7 Ų132.785%0.84579%0.794SS**  trans147.4145.5169.200000112
363G31.8Very low36.9Very low78 Ų78134.2 Ų134.280%0.80480%0.795SS**  cis-166.2-178.5-2.200000111
364S38.3Very low36.8Very low114 Ų114134.7 Ų134.780%0.79780%0.798SS**  trans-60.5151.4-178.3-44.70000114
365Q35.3Very low37.2Very low171 Ų171134.1 Ų134.180%0.79980%0.797SS**  -168.5160.6114.2-93.7-46.8-4.100114.1
366V37.9Very low37.8Very low99 Ų99136.4 Ų136.460%0.681%0.81SS**  trans-38.8149.1175.5-139.80000116.7
367Y38.1Very low37.8Very low232 Ų232132.3 Ų132.391%0.9181%0.807SS**  -163.5135.9115.9-105.2-71.6000111.9
368C33.4Very low38.2Very low106 Ų106135.8 Ų135.872%0.71681%0.811SS**  trans-94.6144173-61.10000111.2
369S35.6Very low38.5Very low111 Ų111142.7 Ų142.778%0.77682%0.816SS**  trans-177.4114.4148.2-79.70000108.4
370S34.3Very low38.6Very low117 Ų117140.1 Ų140.182%0.81881%0.807SS**  58.583.869.8-65.40000114.1
371N36.5Very low38.4Very low172 Ų172138.6 Ų138.692%0.9281%0.808SS**  trans-104.198.9161-92.1-44.4000109.8
372R37.1Very low37.1Very low219 Ų219137.8 Ų137.883%0.82681%0.805SS**  trans-139.6138.9167.3-108.9-153.7-167.6-79.84110.2
373L38.3Very low37.1Very low152 Ų152139.7 Ų139.780%0.79681%0.805SS**  trans70.2120.4159.3-58.9164.8000118
374S34.3Very low37.1Very low118 Ų118141.2 Ų141.283%0.82581%0.809SS**  -169134.4102.635.10000112.3
375L43.3Very low37.1Very low166 Ų166144.1 Ų144.187%0.86981%0.81SS**  trans-90.3161.8153.5-71.5163000107.6
376P51.2Low37.2Very low129 Ų129143.7 Ų143.784%0.83881%0.808SS**  trans-108.1153.9139.433.4-28000110.9
377A35.7Very low37Very low93 Ų93144.6 Ų144.677%0.76981%0.814SS**  trans-114.7158.7-172.600000112.2
378L41.8Very low37.1Very low175 Ų175141.6 Ų141.692%0.91681%0.808SS**  trans-136.3119.4155-93.3167.4000110
379R38.9Very low37.7Very low209 Ų209141.4 Ų141.479%0.78981%0.806SS**  trans-106.5170.9157.3-78.3-170.2168-163-1106.9
380H37.3Very low37.7Very low167 Ų167142.7 Ų142.777%0.77380%0.803SS**  cis-137.6153.822-8285.9000109.4
381G31.3Very low37.7Very low75 Ų75145 Ų14577%0.77381%0.806SS**  103166.279.900000109.2
382S36Very low37.4Very low108 Ų108140.7 Ų140.776%0.75580%0.802SS**  cis-163.7149.6-10.8-174.60000108
383C32.5Very low37.7Very low123 Ų123138.3 Ų138.383%0.83180%0.804SS**  trans8.6135.7162.6-44.30000121.5
384A32.9Very low38.3Very low109 Ų109136.9 Ų136.990%0.90180%0.804SS**  -157.5139.3126.800000112
385E37.5Very low38.5Very low175 Ų175138.1 Ų138.182%0.81880%0.802SS**  trans-114.7143.1178.5169.5-177.8-176.300106.6
386H36.4Very low39Very low162 Ų162135.5 Ų135.575%0.7580%0.795SS**  trans168.9126143.7-106.7-94.3000116.3
387T34.3Very low38.2Very low118 Ų118137.6 Ų137.672%0.72480%0.795SS**  trans46125.3137.754.20000124.6
388E39.8Very low38.2Very low169 Ų169139 Ų13979%0.7979%0.79SS**  trans-30.5159.2141.6-73.1-75.3142.500115.5
389P46.1Very low37.8Very low103 Ų103135.3 Ų135.367%0.66978%0.779SS**  cis-156.4179.241.243.8-21.9000121.1
390L35.4Very low37.6Very low138 Ų138134.9 Ų134.972%0.72378%0.779SS**  trans83.6125.3139.4-111.678.8000124.3
391L34.8Very low37.6Very low165 Ų165132.9 Ų132.986%0.86477%0.774SS**  trans75.5131.4147.6-53.3-175.9000123.4
392G31.2Very low37.8Very low81 Ų81135.6 Ų135.684%0.83577%0.771SS**  trans156.167157.600000118.1
393L42.3Very low37.8Very low169 Ų169134.9 Ų134.989%0.88577%0.765SS**  trans-74.1165.8166.2-77.7172.5000111.2
394P51.5Low38.1Very low122 Ų122138.6 Ų138.679%0.79276%0.763SS**  cis-140.1170.822.242-23000119
395N38.8Very low38.6Very low145 Ų145140.9 Ų140.978%0.77576%0.757SS**  trans-71.8166.2163.5-124.622.6000110.9
396P53.6Low38.7Very low111 Ų111142.6 Ų142.672%0.72176%0.756SS**  -158.9172.677.643.1-23000118.9
397M33.7Very low38.6Very low172 Ų172142.5 Ų142.585%0.84776%0.756SS**  trans65140.7166.5-64.2-63.5177.800117
398N35.8Very low38.8Very low123 Ų123140 Ų14066%0.65875%0.754SS**  cis-140.4139.621.5-163.64.6000111.9Y400N398-Y400 VanDerWaalsContact OD1-CD2 3.31Å; N398-Y400 WeakPolarHBondContact OD1-CD2 3.43Å; N398-Y400 VanDerWaalsContact OD1-CE2 3.28Å; N398-Y400 WeakPolarHBondContact OD1-CE2 3.38Å
399S32.9Very low38.9Very low98 Ų98139.3 Ų139.369%0.68576%0.756SS**  trans-125.7118.8175.1178.20000108.8
400Y36.6Very low38.5Very low199 Ų199144.5 Ų144.578%0.7877%0.768SS**  trans-124.688.2167.5-88.1-77.1000111.2N398N398-Y400 VanDerWaalsContact OD1-CD2 3.31Å; N398-Y400 WeakPolarHBondContact OD1-CD2 3.43Å; N398-Y400 VanDerWaalsContact OD1-CE2 3.28Å; N398-Y400 WeakPolarHBondContact OD1-CE2 3.38Å
401N37.2Very low38.7Very low125 Ų125143.6 Ų143.667%0.66877%0.768SS**  trans-54.6143.3151.4-163.7-5.4000109.4
402N35.3Very low39.3Very low133 Ų133142.3 Ų142.371%0.71177%0.768SS**  trans-140.473.3169.4-134.4-26.8000111.4Y404N402-Y404 WeakPolarHBondContact OD1-CD2 3.38Å
403S35.9Very low39.7Very low92 Ų92142.4 Ų142.464%0.64377%0.769SS**  trans-90.3115.8164.254.40000109.5
404Y39Very low39.9Very low201 Ų201141.8 Ų141.879%0.78877%0.766SS**  trans-118.2112.9163.8-97-90000110.3N402N402-Y404 WeakPolarHBondContact OD1-CD2 3.38Å
405M43.5Very low39.7Very low158 Ų158144.1 Ų144.178%0.77877%0.766SS**  trans45123.6147.3-56.7-65.4-160.500119.1
406R38Very low39.9Very low211 Ų211148.4 Ų148.480%0.79677%0.771SS**  40.4133.278-73.3-175.4177.4-109.16.2112.7
407Q35.3Very low39.4Very low160 Ų160154.3 Ų154.375%0.74878%0.781SS**  cis-159.91713.7-107.5161.2-123.800107
408G37.8Very low39.7Very low66 Ų66158.4 Ų158.468%0.6880%0.801SS**  cis175.8-131.96.500000111.5
409N41.6Very low39.9Very low154 Ų154160.2 Ų160.282%0.82481%0.808SS**  trans-40.7131.9-179.3-60.9-8.1000116.9
410F38.2Very low40.3Very low211 Ų211163.4 Ų163.493%0.92582%0.815SS**  trans-145.6158.6133.7-96-66.7000112.1
411T39.4Very low40.5Very low119 Ų119161.4 Ų161.473%0.7382%0.816SS**  trans-89.7163.6-155.945.80000115.4G413T411-G413 PolarHBondContact O-N 3.44Å
412T48Very low40.7Very low138 Ų138163.6 Ų163.685%0.84783%0.825SS**  trans-34.1125.2159.447.20000114.4
413G38.3Very low41.1Very low84 Ų84165.5 Ų165.587%0.86683%0.832SS**  trans-115.793.5165.500000110.4T411T411-G413 PolarHBondContact O-N 3.44Å
414L47.9Very low41.4Very low155 Ų155170.4 Ų170.481%0.81285%0.845SS**  trans-79.4154.3169.5-125.9150.3000109
415E46.3Very low41.6Very low172 Ų172168.2 Ų168.280%0.80485%0.849SS**  trans60.796.6166.7-50.9-167.5156.700118.7
416R42.7Very low41.4Very low234 Ų234169 Ų16988%0.88385%0.854SS**  trans-160.870.3134.1-154.2175.2-63168.61.9114.5
417Y43.9Very low41.7Very low235 Ų235165.5 Ų165.592%0.92286%0.859SS**  trans-147.1107.5148.5-93-70.3000109.2
418M41Very low42.3Very low258 Ų258166 Ų166100%1.27187%0.869SS**  trans-76.70154.2-60.9179.474.900108.8

Retrieved 418 of 418 residues in 638.2 ms (Link to these results)