A0A096NR75_PAPAN Loading...

Sex comb on midleg-like protein 1

Putative Polycomb group (PcG) protein. PcG proteins act by forming multiprotein complexes, which are required to maintain the transcriptionally repressive state of homeotic genes throughout development. May be involved in spermatogenesis during sexual maturation.

AlphaFold DB (A0A2K6CQ55), UniProt , Accession A0A096NR75, Species PAPAN (Papio anubis, Olive baboon), Gene SCML4, Length 414 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M39.4Very low41.1Very low242 Ų242169.4 Ų169.4100%1.19283%0.827SS**  0-1760-65.31808000109.1
2Q38.5Very low40.6Very low188 Ų188162.2 Ų162.288%0.87983%0.829SS**  trans-56.3163.5177.8-67.31581.700113.9
3S37.4Very low40.7Very low104 Ų104169 Ų16973%0.72784%0.838SS**  cis-166.3145.2-20.8-174.80000112.5
4Q40.4Very low41.7Very low137 Ų137165.4 Ų165.464%0.6483%0.833SS**  trans23136.9154.4-63.7-165.921.200126.6
5R39.3Very low41.3Very low207 Ų207161.6 Ų161.678%0.78183%0.828SS**  trans67.4125.1136.6-67.8171.7179.8173.4-1.8119.7
6I43.4Very low41.2Very low158 Ų158161.9 Ų161.981%0.8183%0.831SS**  62.9112.656.1-55.7171.4000111.8
7P48.3Very low40.7Very low130 Ų130163.2 Ų163.284%0.84483%0.832SS**  -145.3-172.17139-18.1000114.5
8G38.8Very low40.4Very low77 Ų77158.3 Ų158.379%0.79482%0.815SS**  cis-170.5-176.47.400000116.1
9R40.4Very low40.4Very low227 Ų227156.8 Ų156.886%0.85782%0.815SS**  trans-96.5173.4-177.3-79.2170.3165.3176.2-3.1110.9
10K43.4Very low40.8Very low154 Ų154154.8 Ų154.867%0.6781%0.811SS**  cis-167.6154.58.5-129.1167.2-176.2-177.30111.2
11R42.8Very low40.7Very low239 Ų239156.5 Ų156.590%0.90282%0.817SS**  trans30.7134.1146.1-68.2178.3179.7-174.8-1.9122.9
12G34.8Very low40.8Very low83 Ų83154.5 Ų154.586%0.85680%0.802SS**  trans-161.4158.1154.200000112.4
13R41.7Very low41Very low251 Ų251155.1 Ų155.195%0.94781%0.807SS**  trans-124.3155.2176.5-131.1-153.4171.8-178.2-2.3110.2
14P54.9Low40.9Very low118 Ų118154.6 Ų154.677%0.76681%0.81SS**  trans-109.6170.2-163.541.3-35.3000115.9
15S35.8Very low40.6Very low109 Ų109154.4 Ų154.476%0.76282%0.818SS**  trans-160.8113.6165.3580000115.9
16L39.4Very low40.6Very low167 Ų167152.4 Ų152.487%0.87482%0.816SS**  trans52.1154.5135.7-56.7176000124.6
17H33.9Very low40Very low183 Ų183152.6 Ų152.685%0.84782%0.819SS**  trans74.3155.2167.2-100.8-93.5000117.4
18S34.1Very low39.4Very low75 Ų75154.3 Ų154.352%0.52482%0.821SS.*  cis-158.91515.1-165.10000115.3
19T40.7Very low39.2Very low131 Ų131161.3 Ų161.380%0.80483%0.825SS**  trans66.3160.1147.635.70000122.2
20P48Very low38.9Very low115 Ų115156.3 Ų156.375%0.74782%0.824SS**  trans-115165.8-161.742.3-33.8000116.8
21M39.7Very low38.6Very low191 Ų191153.3 Ų153.394%0.94183%0.828SS**  trans-129.7158.4159.3-69.6-162.285.100111.8
22K41.6Very low38Very low201 Ų201148 Ų14887%0.87483%0.827SS**  trans-104.5133.7176.1-67175.7177.7175.90111
23M41.9Very low38.1Very low200 Ų200149 Ų14999%0.98583%0.828SS**  trans-140.7161.4142.2-74.5-159175.300108.8
24A36Very low37.7Very low94 Ų94140.7 Ų140.778%0.77782%0.821SS**  trans-142.8157.9-179.200000109.1
25V34.5Very low36.7Very low133 Ų133140.6 Ų140.681%0.80682%0.822SS**  trans-165.1126.4154.5133.60000110.1
26H37.4Very low36.8Very low164 Ų164143.2 Ų143.276%0.75983%0.827SS**  trans50.9112.3153.7-68.6-115.3000121.8
27N32.5Very low37.1Very low162 Ų162141.1 Ų141.187%0.86682%0.823SS**  trans-81.1149.2142-77.7-30.2000109.8
28L34.9Very low37.2Very low167 Ų167136.9 Ų136.987%0.87482%0.82SS**  trans-97.2141.9164.6-71.2168.4000110
29Y34.8Very low37.4Very low224 Ų224140 Ų14088%0.87884%0.835SS**  trans-150.6133.1169.1-133.9-83.5000108.9
30S33.5Very low37.2Very low122 Ų122143.3 Ų143.385%0.85384%0.839SS**  trans-123.2142.5168.2-67.10000108.7
31A36.5Very low37.2Very low91 Ų91145.2 Ų145.275%0.75284%0.841SS**  trans-136.3151-177.500000110.3
32S30.6Very low37.3Very low126 Ų126142 Ų14288%0.88183%0.834SS**  trans-89.2166.3163.2560000110.5
33A37.8Very low37.1Very low106 Ų106142.1 Ų142.188%0.87684%0.835SS**  trans-131.1160.2-149.800000116.2
34G33.4Very low37.1Very low76 Ų76142.8 Ų142.878%0.78483%0.832SS**  trans131.6145.9163.600000114
35S32.9Very low37.3Very low115 Ų115150.1 Ų150.180%0.80484%0.84SS**  cis-160.5115.9-24.9-169.60000110
36L38.6Very low37.6Very low164 Ų164147.5 Ų147.586%0.85984%0.839SS**  trans20.2162.4153.6-59.3-178.7000123
37P44.7Very low38.1Very low123 Ų123151.7 Ų151.780%0.79985%0.849SS**  cis-123.6171.1-0.840.3-26.6000114.8
38A36Very low38.7Very low94 Ų94153.5 Ų153.578%0.77785%0.849SS**  trans-130.4154.7172.700000112.7
39V39.4Very low38.9Very low140 Ų140152 Ų15285%0.84885%0.849SS**  trans-73.1140.2-169.6179.20000113
40K36.6Very low39Very low201 Ų201144.4 Ų144.487%0.87484%0.839SS**  trans-87.2125178.4-64176.8-178.5173.90111.7
41I48.3Very low39.5Very low155 Ų155150.2 Ų150.280%0.79584%0.844SS**  trans-107.5120.1173.8-58.4176.5000110
42P41.3Very low39.7Very low123 Ų123155.8 Ų155.880%0.79985%0.852SS**PPolyproline II helixtrans-75.8130.6-178.1-1832.3000114.3
43K37.9Very low40.4Very low204 Ų204158.1 Ų158.189%0.88785%0.852SS**PPolyproline II helixtrans-81.9119.9167-70.5179.6176.9176.80110.4R45K43-R45 PolarHBondContact O-N 2.91Å
44K41.2Very low40.5Very low214 Ų214162.7 Ų162.793%0.9385%0.852SS**PPolyproline II helixtrans-70122.4171.5-76.5-174.5174.9178.60110.7
45R41.3Very low40.8Very low249 Ų249164.7 Ų164.794%0.9485%0.854SS**PPolyproline II helixtrans-77.9160168.9-89-178.2166.2-179-4.8111.1K43K43-R45 PolarHBondContact O-N 2.91Å
46G39.7Very low41.2Very low77 Ų77170.2 Ų170.279%0.79486%0.858SS**PPolyproline II helixtrans-70.8173.2-178.400000115.3
47R48.7Very low41.2Very low253 Ų253168 Ų16896%0.95585%0.851SS**PPolyproline II helixtrans-71146-179.4-63.8178.8176.7-178.3-2.1111.6
48K44.8Very low41.1Very low200 Ų200168.8 Ų168.887%0.8785%0.847SS**PPolyproline II helixtrans-78.2148.5171.6-70.7-176.3176.3-177.50111
49P39Very low41.2Very low134 Ų134171.4 Ų171.487%0.8785%0.845SS**PPolyproline II helixtrans-78.6160.4171.4-926.7000112.7
50G37.8Very low41.2Very low66 Ų66170.6 Ų170.668%0.6884%0.841SS**  trans111.864.9147.300000119.1
51Y42.2Very low41.7Very low243 Ų243165.9 Ų165.995%0.95383%0.831SS**  trans-137.8136.4144.9-89.1-80.1000109.3
52K41.3Very low41Very low209 Ų209166.9 Ų166.991%0.90984%0.837SS**  trans-108.2130.3179.4-69.9-172.1179.5-177.40110.4
53I45.3Very low41Very low174 Ų174165.3 Ų165.389%0.89283%0.834SS**  trans-135.8154158.4-102.2158.3000108.2
54K41.2Very low40.9Very low202 Ų202164 Ų16488%0.87884%0.836SS**  trans-93.5151.7-151.6-58.9173.7-175.6174.10113.1
55S38.1Very low40.9Very low119 Ų119158.8 Ų158.883%0.83283%0.827SS**  trans-76.3146.2169.5176.70000111.8
56R42.7Very low41.2Very low231 Ų231152.8 Ų152.887%0.87282%0.82SS**  trans-150.3103.4153.1-172.2172.8-72-139.42111.8
57V37.1Very low41.5Very low117 Ų117155.3 Ų155.371%0.70982%0.822SS**  trans42.4104.3136.5-171.70000118.5
58L42.5Very low41.2Very low140 Ų140154.8 Ų154.873%0.73382%0.82SS**  32.5120.2123.3-171.278.9000119.2
59M39Very low41Very low149 Ų149151 Ų15173%0.73482%0.819SS**  -167.9153.4127.3-107.3-65.2112.100112.9
60T38.7Very low41.3Very low122 Ų122150.9 Ų150.975%0.74882%0.816SS**  trans-161.3126.6173.8-57.80000103.5
61P47Very low41.8Very low103 Ų103153.8 Ų153.867%0.66982%0.823SS**  -155.3-163.377.440.3-18.1000116.3
62L34.7Very low42.1Very low175 Ų175151.1 Ų151.192%0.91682%0.819SS**  trans91149.9164.6-67162.6000117.5
63A41.8Very low42.8Very low91 Ų91146.4 Ų146.475%0.75281%0.81SS**  trans-123.3146.7-160.900000111.4
64L35.3Very low42.5Very low176 Ų176144.5 Ų144.592%0.92180%0.802SS**  trans-135.4153.9159.5-71.6177.2000108.6
65S40.4Very low42.8Very low105 Ų105142.4 Ų142.473%0.73480%0.799SS**PPolyproline II helixtrans-77.2156.9-170.838.70000113.7
66P48.6Very low43.4Very low123 Ų123141 Ų14180%0.79979%0.789SS**PPolyproline II helixtrans-63.5137170.5-1932.1000111.5
67P46.2Very low43.9Very low129 Ų129135.2 Ų135.284%0.83878%0.784SS**PPolyproline II helixtrans-73.5134.1177.529.4-34000111.9S69P67-S69 PolarHBondContact O-N 2.62Å
68R42.8Very low44.5Very low242 Ų242136.8 Ų136.891%0.91379%0.787SS**  trans-79.5103.2173175.2-172.6-172.9168.82.6109.9
69S38.7Very low44.6Very low120 Ų120135.6 Ų135.684%0.83979%0.788SS**  trans-176.7100.7158.1-83.90000113.8P67P67-S69 PolarHBondContact O-N 2.62Å
70T45.5Very low45.4Very low132 Ų132138.2 Ų138.281%0.8180%0.798SS**  trans-144.8129.415148.20000107.2
71P48.4Very low46.1Very low128 Ų128139.6 Ų139.683%0.83180%0.801SS**PPolyproline II helixtrans-72.8151-178.930.6-34.9000111.8
72E49.1Very low46.1Very low186 Ų186139.3 Ų139.387%0.86981%0.807SS**PPolyproline II helixtrans-75.8143.7173.2-63.4-176.4119.900110.9
73P56.1Low46.4Very low110 Ų110134.8 Ų134.871%0.71480%0.795SS**PPolyproline II helixtrans-76.2126166.231.4-31.4000109.9L75P73-L75 PolarHBondContact O-N 3.5Å
74D38.7Very low46.7Very low135 Ų135137.1 Ų137.172%0.72280%0.8SS**PPolyproline II helixtrans-68.9117-176.5-162.8-31.6000111.5S76D74-S76 VanDerWaalsContact C-N 3.35Å; D74-S76 VanDerWaalsContact CG-OG 3.27Å; D74-S76 PolarHBondContact O-N 3.45Å; D74-S76 WeakPolarHBondContact OD1-CB 3.42Å; D74-S76 PolarHBondContact OD1-N 3.08Å; D74-S76 PolarHBondContact OD1-OG 2.75Å
75L47.9Very low47.3Very low157 Ų157133.6 Ų133.682%0.82279%0.786SS**  trans-96.142.5-176.5-68.2179.7000112.8P73P73-L75 PolarHBondContact O-N 3.5Å
76S51.2Low47.6Very low90 Ų90133.7 Ų133.763%0.62978%0.784SS**  trans-97.633.4-173.650.90000115.5D74D74-S76 VanDerWaalsContact C-N 3.35Å; D74-S76 VanDerWaalsContact CG-OG 3.27Å; D74-S76 PolarHBondContact O-N 3.45Å; D74-S76 WeakPolarHBondContact OD1-CB 3.42Å; D74-S76 PolarHBondContact OD1-N 3.08Å; D74-S76 PolarHBondContact OD1-OG 2.75Å
77S52.1Low47.5Very low109 Ų109133.4 Ų133.476%0.76279%0.785SS**  trans-158.372.9170.642.40000115.4
78I50.4Low47.5Very low150 Ų150134.7 Ų134.777%0.76978%0.784SS**  trans-128.4123.4159.4-57179.4000108.1
79P44.4Very low48Very low116 Ų116126.9 Ų126.975%0.75377%0.771SS**  trans-69.3135.3179.928.2-33.9000111.4D81P79-D81 PolarHBondContact O-N 3.29Å; P79-D81 VanDerWaalsContact O-N 3.13Å
80Q54.7Low48.9Very low204 Ų204124.9 Ų124.995%0.95376%0.762SS**  trans-83.478177.1-68.4-174.1-8.100111.6
81D53.8Low49.4Very low151 Ų151124.7 Ų124.781%0.80776%0.763SS**  trans-151.5164.4162.3-150.3-14.2000112.2P79 A83P79-D81 PolarHBondContact O-N 3.29Å; P79-D81 VanDerWaalsContact O-N 3.13Å; D81-A83 PolarHBondContact O-N 3.18Å
82A46.5Very low50Low96 Ų96126.9 Ų126.979%0.79376%0.762SS**SBendtrans62.735.6170.100000117.6
83A41.2Very low51.2Low80 Ų80120.8 Ų120.866%0.66174%0.743SS**  trans-142.259167.800000114.3D81 V85D81-A83 PolarHBondContact O-N 3.18Å; A83-V85 PolarHBondContact O-N 2.89Å
84T47.9Very low52.7Low141 Ų141121.2 Ų121.287%0.86574%0.739SS**  trans-69.377.4163.4-54.60000109.7P86T84-P86 VanDerWaalsContact O-CD 3.23Å; T84-P86 WeakPolarHBondContact O-CD 3.41Å
85V49.6Very low55.3Low102 Ų102119 Ų11962%0.61873%0.731SS**  trans-66.9113.6165.2-1780000106.5A83 S87A83-V85 PolarHBondContact O-N 2.89Å; V85-S87 PolarHBondContact O-N 2.79Å
86P45Very low57.5Low107 Ų107112.2 Ų112.270%0.69570%0.696SS**  trans-60.4127.9171.1-15.730.6000106.8T84 L88T84-P86 VanDerWaalsContact O-CD 3.23Å; T84-P86 WeakPolarHBondContact O-CD 3.41Å; P86-L88 PolarHBondContact O-N 3.43Å
87S46.4Very low59.7Low116 Ų116109.5 Ų109.581%0.81168%0.676SS**  trans-42.9115.7-176.1-178.50000109.9V85 A89V85-S87 PolarHBondContact O-N 2.79Å; S87-A89 VanDerWaalsContact C-N 3.27Å; S87-A89 PolarHBondContact O-N 2.88Å
88L47.4Very low61.8Low156 Ų156104.3 Ų104.382%0.81764%0.64SS**  trans-63.692.8-175.4-100.4164.3000107.7P86 A90P86-L88 PolarHBondContact O-N 3.43Å; L88-A90 PolarHBondContact O-N 3.07Å
89A52.2Low64.1Low78 Ų78100.3 Ų100.365%0.64562%0.615SS**  trans-55.8107.5-174.300000108.2S87 P91S87-A89 VanDerWaalsContact C-N 3.27Å; S87-A89 PolarHBondContact O-N 2.88Å; A89-P91 VanDerWaalsContact O-N 3.15Å
90A57.3Low66.6Low79 Ų7995 Ų9565%0.65358%0.581SS**  trans-50.7125.8-176.500000107.9L88 Q92L88-A90 PolarHBondContact O-N 3.07Å; A90-Q92 PolarHBondContact O-N 2.67Å
91P56.2Low68.5Low127 Ų12786.9 Ų86.983%0.82554%0.544SS*.  trans-56.4111.6-163.919.8-32.6000109.1A89 A93A89-P91 VanDerWaalsContact O-N 3.15Å; P91-A93 PolarHBondContact O-N 2.63Å
92Q61.9Low70.4Confident175 Ų17582.1 Ų82.182%0.81852%0.516SS*.  trans-6497.8-169.5-67.2-178.57.400108.3A90 L94A90-Q92 PolarHBondContact O-N 2.67Å; Q92-L94 PolarHBondContact O-N 2.65Å
93A74.7Confident72.4Confident58 Ų5885 Ų8548%0.47951%0.513SS..  trans-59.5125.5-178.300000107.9P91 T95P91-A93 PolarHBondContact O-N 2.63Å; A93-T95 PolarHBondContact O-N 3.22Å
94L87.1Confident74.7Confident119 Ų11981.6 Ų81.662%0.62349%0.485SS*.  trans-51.5114.1-177.8-65.3174000109.6Q92 P127Q92-L94 PolarHBondContact O-N 2.65Å; L94-P127 WeakPolarHBondContact O-CD 3.49Å
95T93.1Very high76.8Confident89 Ų8979.7 Ų79.755%0.54647%0.47SS..  trans-101.2158.8173.5490000110.5A93 E125A93-T95 PolarHBondContact O-N 3.22Å; T95-E125 CarbonylContact C-O 3.59Å; T95-E125 VanDerWaalsContact CA-O 3.26Å; T95-E125 WeakPolarHBondContact CA-O 3.1Å
96V94.9Very high78.9Confident14 Ų1475.1 Ų75.19%0.08544%0.442CS..EExtended strand (participates in β ladder)trans-146.2149.1174.963.30000109.5P124 E125 P127 V130 V182V96-P124 WeakPolarHBondContact O-CA 3.38Å; V96-E125 PolarHBondContact N-O 3Å; V96-E125 PolarHBondContact O-N 2.89Å; V96-P127 HydrophobicContact CG1-CB 4.24Å; V96-P127 HydrophobicContact CG1-CG 4.01Å; V96-V130 HydrophobicContact CG1-CB 3.97Å; V96-V130 HydrophobicContact CG1-CG1 4.16Å; V96-V130 HydrophobicContact CG1-CG2 3.91Å; V96-V182 HydrophobicContact CB-CG2 3.85Å; V96-V182 HydrophobicContact CG2-CB 4.44Å; V96-V182 HydrophobicContact CG2-CG1 3.86Å; V96-V182 HydrophobicContact CG2-CG2 3.77Å
97C96.5Very high81.2Confident32 Ų3270.9 Ų70.922%0.21642%0.418CS..EExtended strand (participates in β ladder)trans-108.4141.6164.7-61.40000109.5Y99 F122C97-Y99 HydrophobicContact CB-CE2 4.04Å; C97-F122 CarbonylContact C-O 3.57Å; C97-F122 VanDerWaalsContact CA-O 3.25Å; C97-F122 WeakPolarHBondContact CA-O 3.33Å
98L97.3Very high83.5Confident0 Ų069.1 Ų69.10%040%0.404CS..EExtended strand (participates in β ladder)trans-119118164.4-73-176.2000109.7H121 F122 V130 A134 V185 L186 L189 S203 H204L98-H121 CarbonylContact O-C 3.57Å; L98-H121 WeakPolarHBondContact O-CA 3.18Å; L98-H121 VanDerWaalsContact O-CB 3.29Å; L98-H121 WeakPolarHBondContact O-CB 3.32Å; L98-F122 PolarHBondContact N-O 3.31Å; L98-F122 PolarHBondContact O-N 3.09Å; L98-V130 HydrophobicContact CB-CG1 3.91Å; L98-V130 HydrophobicContact CD1-CG1 3.62Å; L98-V130 HydrophobicContact CG-CG1 3.55Å; L98-A134 HydrophobicContact CD1-CB 4.3Å; L98-V185 HydrophobicContact CD1-CG1 3.96Å; L98-L186 HydrophobicContact CD2-CD2 3.9Å; L98-L189 HydrophobicContact CD1-CD1 3.25Å; L98-S203 CarbonylContact C-O 3.32Å; L98-S203 VanDerWaalsContact CA-O 3.32Å; L98-S203 WeakPolarHBondContact CA-O 3.37Å; L98-H204 HydrophobicContact CD2-CB 4.26Å
99Y97.5Very high85.9Confident66 Ų6665.6 Ų65.626%0.25938%0.38SS..EExtended strand (participates in β ladder)trans-82.1146.4173.9-58.8-87.8000110.2C97 E120 H121 F202 S203 Q205 P206C97-Y99 HydrophobicContact CB-CE2 4.04Å; Y99-E120 WeakPolarHBondContact CA-O 3.19Å; Y99-H121 HydrophobicContact CD1-CB 3.78Å; Y99-H121 HydrophobicContact CE1-CB 4.14Å; Y99-H121 HydrophobicContact CG-CB 4.3Å; Y99-F202 WeakPolarHBondContact O-CA 3.48Å; Y99-S203 PolarHBondContact N-O 3.37Å; Y99-S203 PolarHBondContact O-N 3.31Å; Y99-Q205 WeakPolarHBondContact CD2-O 3.36Å; Y99-P206 HydrophobicContact CD1-CB 4.1Å; Y99-P206 HydrophobicContact CD2-CB 4.31Å; Y99-P206 HydrophobicContact CE1-CB 3.96Å; Y99-P206 HydrophobicContact CE2-CB 4.17Å; Y99-P206 HydrophobicContact CG-CB 4.28Å
100I96.8Very high88Confident5 Ų562 Ų623%0.02635%0.35CS..EExtended strand (participates in β ladder)trans-109.5125.9-177.2-61.6167.2000109.5K102 L118 P119 E120 F122 L201 F202I100-K102 PolarHBondContact O-N 3.29Å; I100-L118 HydrophobicContact CD1-CB 4.09Å; I100-L118 HydrophobicContact CD1-CD1 4.37Å; I100-L118 HydrophobicContact CG2-CD1 4.24Å; I100-P119 HydrophobicContact CD1-CG 4.2Å; I100-P119 VanDerWaalsContact CD1-O 3.31Å; I100-P119 WeakPolarHBondContact CD1-O 3.45Å; I100-E120 PolarHBondContact N-O 3.18Å; I100-F122 HydrophobicContact CD1-CD2 4.01Å; I100-F122 HydrophobicContact CD1-CE1 4.38Å; I100-F122 HydrophobicContact CD1-CE2 3.58Å; I100-F122 HydrophobicContact CD1-CZ 3.77Å; I100-F122 HydrophobicContact CG1-CE2 4.37Å; I100-L201 WeakPolarHBondContact CA-O 3.47Å; I100-L201 HydrophobicContact CG2-CD1 4.17Å; I100-F202 HydrophobicContact CD1-CE1 4.4Å; I100-F202 HydrophobicContact CG1-CD1 3.95Å; I100-F202 HydrophobicContact CG1-CE1 3.91Å
101N95Very high89.9Confident34 Ų3460.8 Ų60.818%0.18233%0.331CS..  trans-84.892175.7-175.2-0.4000110.3Q103 A104 D200 L201 F207N101-Q103 PolarHBondContact O-N 2.99Å; N101-Q103 VanDerWaalsContact O-N 3.1Å; N101-Q103 PolarHBondContact OD1-N 3.3Å; N101-Q103 VanDerWaalsContact OD1-N 3.12Å; N101-A104 HydrophobicContact CB-CB 3.93Å; N101-A104 WeakPolarHBondContact O-CB 3.36Å; N101-A104 PolarHBondContact O-N 2.83Å; N101-A104 PolarHBondContact OD1-N 3.25Å; N101-D200 WeakPolarHBondContact CB-O 3.34Å; N101-D200 PolarHBondContact ND2-O 3.29Å; N101-L201 PolarHBondContact N-O 3.03Å; N101-F207 HydrophobicContact CB-CD1 4.4Å; N101-F207 HydrophobicContact CB-CD2 4.13Å; N101-F207 HydrophobicContact CB-CE1 3.95Å; N101-F207 HydrophobicContact CB-CE2 3.66Å; N101-F207 HydrophobicContact CB-CG 4.49Å; N101-F207 HydrophobicContact CB-CZ 3.56Å
102K93.1Very high91.8Very high51 Ų5161.6 Ų61.622%0.22232%0.318CS..THydrogen-bonded Turntrans-61.7-16.4176.9-67.5-175.5170.1-173.20114.4I100 Q116 L118 E120I100-K102 PolarHBondContact O-N 3.29Å; K102-Q116 WeakPolarHBondContact CE-O 3.38Å; K102-Q116 PolarHBondContact NZ-O 2.95Å; K102-L118 WeakPolarHBondContact CE-O 3.22Å; K102-L118 PolarHBondContact NZ-O 3.26Å; K102-E120 WeakPolarHBondContact CD-OE1 3.46Å; K102-E120 WeakPolarHBondContact CE-OE1 3.31Å; K102-E120 IonicContact NZ-OE1 2.67Å; K102-E120 PolarHBondContact NZ-OE1 3.34Å
103Q89.6Confident93.4Very high156 Ų15662 Ų6273%0.72931%0.312SS*.THydrogen-bonded Turntrans-97.60.8177.1-52.9-66.85000113N101N101-Q103 PolarHBondContact O-N 2.99Å; N101-Q103 VanDerWaalsContact O-N 3.1Å; N101-Q103 PolarHBondContact OD1-N 3.3Å; N101-Q103 VanDerWaalsContact OD1-N 3.12Å
104A88.9Confident94.5Very high9 Ų962.6 Ų62.67%0.07430%0.304CS..SBendtrans-61.4161.1177.300000112.5N101 A106 L201N101-A104 HydrophobicContact CB-CB 3.93Å; N101-A104 WeakPolarHBondContact O-CB 3.36Å; N101-A104 PolarHBondContact O-N 2.83Å; N101-A104 PolarHBondContact OD1-N 3.25Å; A104-A106 PolarHBondContact O-N 3.25Å; A104-L201 HydrophobicContact CB-CB 4.35Å; A104-L201 HydrophobicContact CB-CD1 4.28Å
105N92.5Very high95Very high101 Ų10157.1 Ų57.154%0.5428%0.275SS..  trans-68.5119.3164.5-173.28.5000108.8G107 C198N105-G107 PolarHBondContact O-N 2.98Å; N105-G107 PolarHBondContact OD1-N 3.43Å; N105-G107 VanDerWaalsContact OD1-N 3.08Å; N105-C198 WeakPolarHBondContact O-CA 3.32Å; N105-C198 WeakPolarHBondContact O-CB 3.37Å
106A93.1Very high95.1Very high5 Ų557 Ų574%0.04127%0.268CS..  trans-72.4-9.4176.500000112.9A104 L110 R112 V115 C198A104-A106 PolarHBondContact O-N 3.25Å; A106-L110 HydrophobicContact CB-CB 4.23Å; A106-L110 WeakPolarHBondContact O-CB 3.41Å; A106-R112 HydrophobicContact CB-CB 4.21Å; A106-V115 HydrophobicContact CB-CG2 4.31Å; A106-C198 WeakPolarHBondContact O-CB 3.3Å
107G93.2Very high95.2Very high19 Ų1963.7 Ų63.720%0.19630%0.299CS..THydrogen-bonded Turntrans67.1-171-172.300000112.1N105 L197N105-G107 PolarHBondContact O-N 2.98Å; N105-G107 PolarHBondContact OD1-N 3.43Å; N105-G107 VanDerWaalsContact OD1-N 3.08Å; G107-L197 VanDerWaalsContact CA-O 3.29Å; G107-L197 WeakPolarHBondContact CA-O 3.43Å
108P95.6Very high95.2Very high78 Ų7863.3 Ų63.351%0.50629%0.294SS..THydrogen-bonded Turntrans-81.4-19.4176.132.5-32.6000112.6H143 L197P108-H143 PolarHBondContact O-ND1 3.37Å; P108-L197 HydrophobicContact CG-CD1 4.2Å
109Y96.4Very high95.2Very high82 Ų8266.3 Ų66.332%0.32231%0.314SS..THydrogen-bonded Turntrans-88.2-26.2-172.2-61.3-75.9000114.1A142 H143 L147 L196Y109-A142 CarbonylContact O-C 3.58Å; Y109-A142 VanDerWaalsContact O-CA 3.32Å; Y109-A142 WeakPolarHBondContact O-CA 3.38Å; Y109-H143 PolarHBondContact O-N 3.1Å; Y109-L147 HydrophobicContact CE1-CD1 4.19Å; Y109-L196 HydrophobicContact CD2-CB 4.47Å; Y109-L196 HydrophobicContact CD2-CD2 4.26Å; Y109-L196 WeakPolarHBondContact CD2-O 3.36Å; Y109-L196 HydrophobicContact CG-CD2 4.15Å
110L97.2Very high95.1Very high3 Ų368.5 Ų68.52%0.01633%0.326CS..BIsolated β-bridgetrans-107.7141.4-178.6-48.8-178000111.9A106 R112 V115 C138 C141 A142 H143 L196 C198 L201A106-L110 HydrophobicContact CB-CB 4.23Å; A106-L110 WeakPolarHBondContact O-CB 3.41Å; L110-R112 PolarHBondContact O-N 3.45Å; L110-V115 HydrophobicContact CB-CG2 4.03Å; L110-V115 HydrophobicContact CD1-CG2 4.38Å; L110-C138 WeakPolarHBondContact CD2-O 3.3Å; L110-C141 HydrophobicContact CB-CB 4.37Å; L110-C141 HydrophobicContact CD2-CB 4.31Å; L110-A142 HydrophobicContact CD2-CB 4.39Å; L110-H143 VanDerWaalsContact C-CE1 3.48Å; L110-H143 PolarHBondContact O-CE1 2.78Å; L110-L196 HydrophobicContact CD2-CD1 4.37Å; L110-C198 HydrophobicContact CD1-CB 4.24Å; L110-L201 HydrophobicContact CD1-CD2 3.88Å
111E97.2Very high95.1Very high53 Ų5372.1 Ų72.125%0.24834%0.343CS..  trans-81.4111.5177-171.2-178161.900110.4R113 K114 V115 C141 H143E111-R113 HydrophobicContact CG-CB 4.33Å; E111-R113 PolarHBondContact O-N 2.97Å; E111-K114 HydrophobicContact CB-CB 4.39Å; E111-K114 HydrophobicContact CB-CD 4.26Å; E111-K114 HydrophobicContact CB-CG 4.26Å; E111-K114 HydrophobicContact CG-CG 4.44Å; E111-K114 PolarHBondContact O-N 2.89Å; E111-K114 WeakPolarHBondContact OE2-CE 3.29Å; E111-K114 IonicContact OE2-NZ 2.72Å; E111-K114 PolarHBondContact OE2-NZ 3.24Å; E111-V115 PolarHBondContact O-N 3.27Å; E111-C141 WeakPolarHBondContact CB-O 3.36Å; E111-C141 PolarHBondContact N-O 3.03Å; E111-H143 WeakPolarHBondContact CA-NE2 3.41Å
112R95.8Very high95.2Very high144 Ų14471.7 Ų71.754%0.54334%0.34SS..Hα-helixtrans-49.7-38-179.1175.1175.4-80.1160.3-5.2113.2A106 L110 K114 V115 Q116A106-R112 HydrophobicContact CB-CB 4.21Å; L110-R112 PolarHBondContact O-N 3.45Å; R112-K114 PolarHBondContact O-N 2.99Å; R112-V115 PolarHBondContact O-N 3.33Å; R112-Q116 HydrophobicContact CG-CG 4.4Å; R112-Q116 WeakPolarHBondContact O-CG 3.43Å; R112-Q116 PolarHBondContact O-N 3.49Å
113R96.7Very high95.3Very high183 Ų18370.1 Ų70.169%0.69134%0.338SS*.Hα-helixtrans-61.6-41.9178.2-70-178.9173-177.6-2.7112.4E111 Q117E111-R113 HydrophobicContact CG-CB 4.33Å; E111-R113 PolarHBondContact O-N 2.97Å; R113-Q117 VanDerWaalsContact O-CG 3.27Å; R113-Q117 WeakPolarHBondContact O-CG 3.42Å; R113-Q117 PolarHBondContact O-N 2.85Å
114K97.2Very high95.5Very high72 Ų7266.9 Ų66.931%0.31333%0.33SS..Hα-helixtrans-70.9-40.6175.8-66.1-178.3178.7129.80111.6E111 R112 Q116 Q117 L118 D140 C141E111-K114 HydrophobicContact CB-CB 4.39Å; E111-K114 HydrophobicContact CB-CD 4.26Å; E111-K114 HydrophobicContact CB-CG 4.26Å; E111-K114 HydrophobicContact CG-CG 4.44Å; E111-K114 PolarHBondContact O-N 2.89Å; E111-K114 WeakPolarHBondContact OE2-CE 3.29Å; E111-K114 IonicContact OE2-NZ 2.72Å; E111-K114 PolarHBondContact OE2-NZ 3.24Å; R112-K114 PolarHBondContact O-N 2.99Å; K114-Q116 VanDerWaalsContact C-N 3.27Å; K114-Q116 PolarHBondContact O-N 2.94Å; K114-Q117 WeakPolarHBondContact O-CA 3.41Å; K114-Q117 WeakPolarHBondContact O-CB 3.17Å; K114-Q117 PolarHBondContact O-N 3.38Å; K114-L118 PolarHBondContact O-N 3.02Å; K114-D140 WeakPolarHBondContact CD-O 3.3Å; K114-C141 HydrophobicContact CB-CB 4.07Å
115V96.7Very high95.9Very high4 Ų470.2 Ų70.22%0.02435%0.345CS..Hα-helixtrans-58.8-38.5175.8175.60000111.7A106 L110 E111 R112 Q117 L118 C141 L201A106-V115 HydrophobicContact CB-CG2 4.31Å; L110-V115 HydrophobicContact CB-CG2 4.03Å; L110-V115 HydrophobicContact CD1-CG2 4.38Å; E111-V115 PolarHBondContact O-N 3.27Å; R112-V115 PolarHBondContact O-N 3.33Å; V115-Q117 VanDerWaalsContact C-N 3.31Å; V115-Q117 PolarHBondContact O-N 3.09Å; V115-L118 WeakPolarHBondContact O-CB 3.48Å; V115-L118 PolarHBondContact O-N 3.46Å; V115-C141 HydrophobicContact CG2-CB 4.04Å; V115-L201 HydrophobicContact CG1-CD1 3.69Å
116Q96Very high96Very high85 Ų8573.4 Ų73.440%0.39735%0.349SS..Hα-helixtrans-70.4-24.6175.7-72.1171.9-34.200113.6K102 R112 K114K102-Q116 WeakPolarHBondContact CE-O 3.38Å; K102-Q116 PolarHBondContact NZ-O 2.95Å; R112-Q116 HydrophobicContact CG-CG 4.4Å; R112-Q116 WeakPolarHBondContact O-CG 3.43Å; R112-Q116 PolarHBondContact O-N 3.49Å; K114-Q116 VanDerWaalsContact C-N 3.27Å; K114-Q116 PolarHBondContact O-N 2.94Å
117Q96.9Very high96.2Very high155 Ų15573.3 Ų73.372%0.72435%0.348SS*.Hα-helixtrans-84.4-8.4177-69.2165.39.400113.9R113 K114 V115R113-Q117 VanDerWaalsContact O-CG 3.27Å; R113-Q117 WeakPolarHBondContact O-CG 3.42Å; R113-Q117 PolarHBondContact O-N 2.85Å; K114-Q117 WeakPolarHBondContact O-CA 3.41Å; K114-Q117 WeakPolarHBondContact O-CB 3.17Å; K114-Q117 PolarHBondContact O-N 3.38Å; V115-Q117 VanDerWaalsContact C-N 3.31Å; V115-Q117 PolarHBondContact O-N 3.09Å
118L96.8Very high96.3Very high25 Ų2573.1 Ų73.113%0.13134%0.344CS..SBendtrans-61.3161173.2-67.1179.5000111.6I100 K102 K114 V115 A137I100-L118 HydrophobicContact CD1-CB 4.09Å; I100-L118 HydrophobicContact CD1-CD1 4.37Å; I100-L118 HydrophobicContact CG2-CD1 4.24Å; K102-L118 WeakPolarHBondContact CE-O 3.22Å; K102-L118 PolarHBondContact NZ-O 3.26Å; K114-L118 PolarHBondContact O-N 3.02Å; V115-L118 WeakPolarHBondContact O-CB 3.48Å; V115-L118 PolarHBondContact O-N 3.46Å; L118-A137 HydrophobicContact CD1-CB 4.28Å; L118-A137 HydrophobicContact CD2-CB 3.86Å
119P96.6Very high96.3Very high63 Ų6370.3 Ų70.341%0.40933%0.327SS..  trans-62168.1168.827.3-35.6000111.9I100 H121 F122I100-P119 HydrophobicContact CD1-CG 4.2Å; I100-P119 VanDerWaalsContact CD1-O 3.31Å; I100-P119 WeakPolarHBondContact CD1-O 3.45Å; P119-H121 VanDerWaalsContact C-N 3.28Å; P119-F122 HydrophobicContact CG-CD1 4.02Å; P119-F122 HydrophobicContact CG-CE1 3.55Å; P119-F122 HydrophobicContact CG-CZ 4.2Å
120E95.3Very high96.4Very high111 Ų11166.4 Ų66.452%0.51931%0.312SS..SBendtrans-70-27.1173.6-60.7-56.6128.100112.3Y99 I100 K102Y99-E120 WeakPolarHBondContact CA-O 3.19Å; I100-E120 PolarHBondContact N-O 3.18Å; K102-E120 WeakPolarHBondContact CD-OE1 3.46Å; K102-E120 WeakPolarHBondContact CE-OE1 3.31Å; K102-E120 IonicContact NZ-OE1 2.67Å; K102-E120 PolarHBondContact NZ-OE1 3.34Å
121H96.9Very high96.3Very high82 Ų8266.3 Ų66.338%0.3831%0.311SS..EExtended strand (participates in β ladder)trans-157.6164.4179.559.3-77.7000112.6L98 Y99 P119 G123L98-H121 CarbonylContact O-C 3.57Å; L98-H121 WeakPolarHBondContact O-CA 3.18Å; L98-H121 VanDerWaalsContact O-CB 3.29Å; L98-H121 WeakPolarHBondContact O-CB 3.32Å; Y99-H121 HydrophobicContact CD1-CB 3.78Å; Y99-H121 HydrophobicContact CE1-CB 4.14Å; Y99-H121 HydrophobicContact CG-CB 4.3Å; P119-H121 VanDerWaalsContact C-N 3.28Å; H121-G123 PolarHBondContact CD2-O 3.2Å
122F97.6Very high96.4Very high24 Ų2466.5 Ų66.511%0.10531%0.312CS..EExtended strand (participates in β ladder)trans-111145.1165.9-65.2-50.3000109.9C97 L98 I100 P119 V130 Q133 A134 A137 F202C97-F122 CarbonylContact C-O 3.57Å; C97-F122 VanDerWaalsContact CA-O 3.25Å; C97-F122 WeakPolarHBondContact CA-O 3.33Å; L98-F122 PolarHBondContact N-O 3.31Å; L98-F122 PolarHBondContact O-N 3.09Å; I100-F122 HydrophobicContact CD1-CD2 4.01Å; I100-F122 HydrophobicContact CD1-CE1 4.38Å; I100-F122 HydrophobicContact CD1-CE2 3.58Å; I100-F122 HydrophobicContact CD1-CZ 3.77Å; I100-F122 HydrophobicContact CG1-CE2 4.37Å; P119-F122 HydrophobicContact CG-CD1 4.02Å; P119-F122 HydrophobicContact CG-CE1 3.55Å; P119-F122 HydrophobicContact CG-CZ 4.2Å; F122-V130 HydrophobicContact CB-CG1 4.05Å; F122-Q133 HydrophobicContact CB-CB 4.42Å; F122-Q133 HydrophobicContact CD1-CB 3.85Å; F122-Q133 HydrophobicContact CD1-CG 4.43Å; F122-Q133 HydrophobicContact CD2-CB 4.13Å; F122-Q133 HydrophobicContact CE1-CB 4.1Å; F122-Q133 HydrophobicContact CE2-CB 4.35Å; F122-Q133 HydrophobicContact CG-CB 3.88Å; F122-Q133 HydrophobicContact CZ-CB 4.36Å; F122-A134 HydrophobicContact CD2-CB 4.14Å; F122-A134 HydrophobicContact CE2-CB 4.17Å; F122-A137 HydrophobicContact CE2-CB 4.11Å; F122-A137 HydrophobicContact CZ-CB 3.74Å; F122-F202 HydrophobicContact CE2-CE1 4.12Å
123G94.9Very high96.5Very high19 Ų1962.3 Ų62.320%0.19630%0.299CS..EExtended strand (participates in β ladder)trans87.7-175.4-174.300000114.5H121 E125H121-G123 PolarHBondContact CD2-O 3.2Å; G123-E125 VanDerWaalsContact CA-N 3.25Å
124P94.9Very high96.5Very high87 Ų8753.6 Ų53.657%0.56527%0.266SS*.EExtended strand (participates in β ladder)cis-71.7111.39.827.4-34.7000113.3V96V96-P124 WeakPolarHBondContact O-CA 3.38Å
125E95.9Very high96.6Very high80 Ų8050.2 Ų50.237%0.37425%0.251SS..EExtended strand (participates in β ladder)trans-139.5173.2-177.6-87.2-170.9-112.100111.2T95 V96 G123 A129 V130 Q133T95-E125 CarbonylContact C-O 3.59Å; T95-E125 VanDerWaalsContact CA-O 3.26Å; T95-E125 WeakPolarHBondContact CA-O 3.1Å; V96-E125 PolarHBondContact N-O 3Å; V96-E125 PolarHBondContact O-N 2.89Å; G123-E125 VanDerWaalsContact CA-N 3.25Å; E125-A129 HydrophobicContact CB-CB 4.43Å; E125-A129 VanDerWaalsContact OE2-CB 3.29Å; E125-A129 WeakPolarHBondContact OE2-CB 3.24Å; E125-V130 HydrophobicContact CB-CG2 3.54Å; E125-Q133 PolarHBondContact OE1-NE2 3.05Å
126R95.8Very high96.6Very high168 Ų16851.7 Ų51.763%0.63426%0.258SS*.  trans-62.3143.8177-58.3-173.4-165.8121.41.6110.6S128 A129 V130R126-S128 PolarHBondContact O-N 3.06Å; R126-A129 PolarHBondContact O-N 3.32Å; R126-V130 PolarHBondContact O-N 2.95Å; R126-V130 VanDerWaalsContact O-N 3.09Å
127P96.1Very high96.7Very high3 Ų348.1 Ų48.12%0.01924%0.243CC..Hα-helixtrans-52.5-30.5179.8-3033.3000115.4L94 V96 L131 V182 V185L94-P127 WeakPolarHBondContact O-CD 3.49Å; V96-P127 HydrophobicContact CG1-CB 4.24Å; V96-P127 HydrophobicContact CG1-CG 4.01Å; P127-L131 WeakPolarHBondContact O-CB 3.4Å; P127-L131 PolarHBondContact O-N 3.49Å; P127-V182 HydrophobicContact CG-CG2 4.32Å; P127-V185 HydrophobicContact CB-CG2 3.74Å; P127-V185 WeakPolarHBondContact O-CG2 3.41Å
128S95.3Very high96.8Very high14 Ų1440.9 Ų40.910%0.09821%0.209CC..Hα-helixtrans-65.3-45173.150.50000113.7R126 Q132 V179R126-S128 PolarHBondContact O-N 3.06Å; S128-Q132 WeakPolarHBondContact O-CB 3.22Å; S128-Q132 PolarHBondContact O-N 3.07Å; S128-V179 PolarHBondContact N-O 3.11Å; S128-V179 VanDerWaalsContact N-O 3.15Å
129A96.4Very high96.8Very high19 Ų1939.7 Ų39.716%0.15720%0.203CC..Hα-helixtrans-71.7-43.5-179.100000111.2E125 R126 L131 Q132 Q133E125-A129 HydrophobicContact CB-CB 4.43Å; E125-A129 VanDerWaalsContact OE2-CB 3.29Å; E125-A129 WeakPolarHBondContact OE2-CB 3.24Å; R126-A129 PolarHBondContact O-N 3.32Å; A129-L131 VanDerWaalsContact C-N 3.3Å; A129-L131 PolarHBondContact O-N 2.98Å; A129-Q132 WeakPolarHBondContact O-CB 3.34Å; A129-Q132 PolarHBondContact O-N 3.04Å; A129-Q132 VanDerWaalsContact O-N 3.09Å; A129-Q133 WeakPolarHBondContact O-CB 3.45Å; A129-Q133 VanDerWaalsContact O-CG 3.31Å; A129-Q133 WeakPolarHBondContact O-CG 3.08Å; A129-Q133 PolarHBondContact O-N 3.42Å
130V97.3Very high96.9Very high0 Ų040.2 Ų40.20%020%0.202CC..Hα-helixtrans-63.9-35.4176.1178.70000111.8V96 L98 F122 E125 R126 A134V96-V130 HydrophobicContact CG1-CB 3.97Å; V96-V130 HydrophobicContact CG1-CG1 4.16Å; V96-V130 HydrophobicContact CG1-CG2 3.91Å; L98-V130 HydrophobicContact CB-CG1 3.91Å; L98-V130 HydrophobicContact CD1-CG1 3.62Å; L98-V130 HydrophobicContact CG-CG1 3.55Å; F122-V130 HydrophobicContact CB-CG1 4.05Å; E125-V130 HydrophobicContact CB-CG2 3.54Å; R126-V130 PolarHBondContact O-N 2.95Å; R126-V130 VanDerWaalsContact O-N 3.09Å; V130-A134 WeakPolarHBondContact O-CB 3.25Å; V130-A134 PolarHBondContact O-N 3.23Å
131L96.9Very high97Very high1 Ų135.1 Ų35.11%0.00518%0.179CC..Hα-helixtrans-65.9-44.1170.6177.561.8000112.1P127 A129 A134 V135 V179 Y184 V185 F188 L189P127-L131 WeakPolarHBondContact O-CB 3.4Å; P127-L131 PolarHBondContact O-N 3.49Å; A129-L131 VanDerWaalsContact C-N 3.3Å; A129-L131 PolarHBondContact O-N 2.98Å; L131-A134 PolarHBondContact O-N 3.34Å; L131-V135 HydrophobicContact CD1-CG2 3.97Å; L131-V135 WeakPolarHBondContact O-CB 3.11Å; L131-V135 VanDerWaalsContact O-CG2 3.27Å; L131-V135 WeakPolarHBondContact O-CG2 3.49Å; L131-V135 PolarHBondContact O-N 2.9Å; L131-V179 HydrophobicContact CD2-CG2 3.92Å; L131-Y184 HydrophobicContact CD2-CD1 4.38Å; L131-Y184 HydrophobicContact CD2-CE1 4.06Å; L131-V185 HydrophobicContact CB-CG1 4.13Å; L131-V185 HydrophobicContact CB-CG2 4.09Å; L131-V185 HydrophobicContact CD1-CG1 4.22Å; L131-F188 HydrophobicContact CD1-CB 4.15Å; L131-F188 HydrophobicContact CD1-CD1 3.64Å; L131-F188 HydrophobicContact CD1-CE1 4.22Å; L131-F188 HydrophobicContact CD1-CG 3.94Å; L131-L189 HydrophobicContact CD1-CD2 4.08Å; L131-L189 HydrophobicContact CD1-CG 4.08Å
132Q97.6Very high97Very high58 Ų5831.5 Ų31.527%0.27116%0.163SC..Hα-helixtrans-60.3-47.7177.1-172.9-173.72.300111.1S128 A129 V135 Q136 V161 S162 V163S128-Q132 WeakPolarHBondContact O-CB 3.22Å; S128-Q132 PolarHBondContact O-N 3.07Å; A129-Q132 WeakPolarHBondContact O-CB 3.34Å; A129-Q132 PolarHBondContact O-N 3.04Å; A129-Q132 VanDerWaalsContact O-N 3.09Å; Q132-V135 PolarHBondContact O-N 3.44Å; Q132-Q136 WeakPolarHBondContact O-CB 3.27Å; Q132-Q136 PolarHBondContact O-N 3.11Å; Q132-V161 HydrophobicContact CB-CG2 4.1Å; Q132-V161 HydrophobicContact CG-CB 4.42Å; Q132-V161 HydrophobicContact CG-CG2 4.26Å; Q132-S162 PolarHBondContact NE2-O 3.32Å; Q132-V163 HydrophobicContact CG-CG1 3.88Å
133Q98.1Very high96.9Very high56 Ų5635.4 Ų35.426%0.26218%0.181SC..Hα-helixtrans-57.8-50176.2-72.4166-19.600111.9F122 E125 A129 V135 Q136 A137F122-Q133 HydrophobicContact CB-CB 4.42Å; F122-Q133 HydrophobicContact CD1-CB 3.85Å; F122-Q133 HydrophobicContact CD1-CG 4.43Å; F122-Q133 HydrophobicContact CD2-CB 4.13Å; F122-Q133 HydrophobicContact CE1-CB 4.1Å; F122-Q133 HydrophobicContact CE2-CB 4.35Å; F122-Q133 HydrophobicContact CG-CB 3.88Å; F122-Q133 HydrophobicContact CZ-CB 4.36Å; E125-Q133 PolarHBondContact OE1-NE2 3.05Å; A129-Q133 WeakPolarHBondContact O-CB 3.45Å; A129-Q133 VanDerWaalsContact O-CG 3.31Å; A129-Q133 WeakPolarHBondContact O-CG 3.08Å; A129-Q133 PolarHBondContact O-N 3.42Å; Q133-V135 PolarHBondContact O-N 3.01Å; Q133-Q136 PolarHBondContact O-N 3.17Å; Q133-A137 WeakPolarHBondContact O-CB 3.42Å; Q133-A137 PolarHBondContact O-N 3.47Å
134A97.9Very high97Very high0 Ų040.2 Ų40.20%020%0.199CC..Hα-helixtrans-63.9-39.8179.700000113.1L98 F122 V130 L131 C138 L189 F202L98-A134 HydrophobicContact CD1-CB 4.3Å; F122-A134 HydrophobicContact CD2-CB 4.14Å; F122-A134 HydrophobicContact CE2-CB 4.17Å; V130-A134 WeakPolarHBondContact O-CB 3.25Å; V130-A134 PolarHBondContact O-N 3.23Å; L131-A134 PolarHBondContact O-N 3.34Å; A134-C138 PolarHBondContact O-N 3.32Å; A134-C138 PolarHBondContact O-SG 3.01Å; A134-L189 HydrophobicContact CB-CD1 3.8Å; A134-L189 HydrophobicContact CB-CD2 3.79Å; A134-L189 HydrophobicContact CB-CG 4.47Å; A134-F202 HydrophobicContact CB-CD1 4.46Å; A134-F202 HydrophobicContact CB-CE1 3.99Å; A134-F202 HydrophobicContact CB-CE2 4.31Å; A134-F202 HydrophobicContact CB-CZ 3.91Å
135V97.9Very high97Very high0 Ų038.1 Ų38.10%018%0.181CC..Hα-helixtrans-71.1-40.2176.7175.50000111.6L131 Q132 Q133 C138 I139 V152 V163 L176 F188 L189 L192L131-V135 HydrophobicContact CD1-CG2 3.97Å; L131-V135 WeakPolarHBondContact O-CB 3.11Å; L131-V135 VanDerWaalsContact O-CG2 3.27Å; L131-V135 WeakPolarHBondContact O-CG2 3.49Å; L131-V135 PolarHBondContact O-N 2.9Å; Q132-V135 PolarHBondContact O-N 3.44Å; Q133-V135 PolarHBondContact O-N 3.01Å; V135-C138 PolarHBondContact O-N 3.31Å; V135-I139 HydrophobicContact CG1-CD1 4.15Å; V135-I139 WeakPolarHBondContact O-CG1 3.48Å; V135-I139 PolarHBondContact O-N 2.91Å; V135-I139 VanDerWaalsContact O-N 3.16Å; V135-V152 HydrophobicContact CG1-CG1 4Å; V135-V152 HydrophobicContact CG1-CG2 3.7Å; V135-V163 HydrophobicContact CB-CG1 4.26Å; V135-V163 HydrophobicContact CG1-CG1 4.12Å; V135-V163 HydrophobicContact CG1-CG2 4.11Å; V135-L176 HydrophobicContact CB-CD1 4.05Å; V135-L176 HydrophobicContact CG1-CD1 4.14Å; V135-L176 HydrophobicContact CG2-CD1 4.12Å; V135-F188 HydrophobicContact CG2-CD1 4.27Å; V135-F188 HydrophobicContact CG2-CE1 3.67Å; V135-L189 HydrophobicContact CG2-CD2 4.11Å; V135-L192 HydrophobicContact CB-CD2 4.5Å; V135-L192 HydrophobicContact CG1-CD2 4.34Å; V135-L192 HydrophobicContact CG2-CD2 3.97Å
136Q98.2Very high97Very high36 Ų3638.9 Ų38.917%0.16818%0.184CC..Hα-helixtrans-62.3-46.2176.2-171.658.155.700110.9Q132 Q133 C138 I139 D140 V163 S164Q132-Q136 WeakPolarHBondContact O-CB 3.27Å; Q132-Q136 PolarHBondContact O-N 3.11Å; Q133-Q136 PolarHBondContact O-N 3.17Å; Q136-C138 VanDerWaalsContact C-N 3.3Å; Q136-C138 PolarHBondContact O-N 2.78Å; Q136-I139 WeakPolarHBondContact O-CA 2.92Å; Q136-I139 WeakPolarHBondContact O-CB 3.32Å; Q136-I139 PolarHBondContact O-N 3.02Å; Q136-D140 WeakPolarHBondContact CG-OD2 3.47Å; Q136-D140 PolarHBondContact NE2-OD1 2.7Å; Q136-D140 VanDerWaalsContact NE2-OD1 3.09Å; Q136-D140 PolarHBondContact NE2-OD2 2.94Å; Q136-D140 PolarHBondContact O-N 3.37Å; Q136-V163 HydrophobicContact CB-CG1 4.29Å; Q136-S164 PolarHBondContact NE2-O 3.21Å; Q136-S164 PolarHBondContact OE1-O 2.75Å
137A98.1Very high97Very high10 Ų1034.4 Ų34.48%0.08317%0.172CC..Hα-helixtrans-57.9-37.9175.400000113.2L118 F122 Q133 C141L118-A137 HydrophobicContact CD1-CB 4.28Å; L118-A137 HydrophobicContact CD2-CB 3.86Å; F122-A137 HydrophobicContact CE2-CB 4.11Å; F122-A137 HydrophobicContact CZ-CB 3.74Å; Q133-A137 WeakPolarHBondContact O-CB 3.42Å; Q133-A137 PolarHBondContact O-N 3.47Å; A137-C141 VanDerWaalsContact O-CB 3.24Å; A137-C141 WeakPolarHBondContact O-CB 3.28Å; A137-C141 PolarHBondContact O-N 3Å; A137-C141 PolarHBondContact O-SG 2.99Å
138C97.8Very high97Very high2 Ų234.2 Ų34.21%0.01417%0.171CC..Hα-helixtrans-65.2-35.9172.3-67.70000113L110 A134 V135 Q136 A142 V148 L192 L196L110-C138 WeakPolarHBondContact CD2-O 3.3Å; A134-C138 PolarHBondContact O-N 3.32Å; A134-C138 PolarHBondContact O-SG 3.01Å; V135-C138 PolarHBondContact O-N 3.31Å; Q136-C138 VanDerWaalsContact C-N 3.3Å; Q136-C138 PolarHBondContact O-N 2.78Å; C138-A142 PolarHBondContact O-N 2.93Å; C138-V148 HydrophobicContact CB-CG1 4.48Å; C138-L192 HydrophobicContact CB-CD2 4.41Å; C138-L196 HydrophobicContact CB-CD1 4.13Å
139I98Very high97.1Very high0 Ų034.1 Ų34.10%017%0.168CC..Hα-helixtrans-69.9-45.7176.5-65.8158.3000110.1V135 Q136 C141 A142 Q145 V148 F149 V163 S164 A165V135-I139 HydrophobicContact CG1-CD1 4.15Å; V135-I139 WeakPolarHBondContact O-CG1 3.48Å; V135-I139 PolarHBondContact O-N 2.91Å; V135-I139 VanDerWaalsContact O-N 3.16Å; Q136-I139 WeakPolarHBondContact O-CA 2.92Å; Q136-I139 WeakPolarHBondContact O-CB 3.32Å; Q136-I139 PolarHBondContact O-N 3.02Å; I139-C141 PolarHBondContact O-N 3.2Å; I139-A142 WeakPolarHBondContact O-CB 3.32Å; I139-A142 PolarHBondContact O-N 2.82Å; I139-A142 VanDerWaalsContact O-N 3.09Å; I139-Q145 HydrophobicContact CG2-CB 4.24Å; I139-Q145 HydrophobicContact CG2-CG 4.36Å; I139-Q145 WeakPolarHBondContact O-CG 3.44Å; I139-Q145 PolarHBondContact O-NE2 3.35Å; I139-V148 HydrophobicContact CG1-CG1 4.1Å; I139-F149 HydrophobicContact CD1-CD2 4Å; I139-V163 HydrophobicContact CD1-CB 3.98Å; I139-V163 HydrophobicContact CD1-CG2 3.87Å; I139-S164 WeakPolarHBondContact CG2-O 3.11Å; I139-A165 HydrophobicContact CG2-CB 3.68Å
140D97.4Very high97Very high75 Ų7536.7 Ų36.740%0.40119%0.185SC..Hα-helixtrans-69.9-34.4-176.9-63.3-32.8000112.5K114 Q136 A142K114-D140 WeakPolarHBondContact CD-O 3.3Å; Q136-D140 WeakPolarHBondContact CG-OD2 3.47Å; Q136-D140 PolarHBondContact NE2-OD1 2.7Å; Q136-D140 VanDerWaalsContact NE2-OD1 3.09Å; Q136-D140 PolarHBondContact NE2-OD2 2.94Å; Q136-D140 PolarHBondContact O-N 3.37Å; D140-A142 PolarHBondContact O-N 3.31Å
141C97.8Very high96.7Very high4 Ų440 Ų403%0.02720%0.202CC..THydrogen-bonded Turntrans-71.8-8.8171.4-67.10000114.1L110 E111 K114 V115 A137 I139L110-C141 HydrophobicContact CB-CB 4.37Å; L110-C141 HydrophobicContact CD2-CB 4.31Å; E111-C141 WeakPolarHBondContact CB-O 3.36Å; E111-C141 PolarHBondContact N-O 3.03Å; K114-C141 HydrophobicContact CB-CB 4.07Å; V115-C141 HydrophobicContact CG2-CB 4.04Å; A137-C141 VanDerWaalsContact O-CB 3.24Å; A137-C141 WeakPolarHBondContact O-CB 3.28Å; A137-C141 PolarHBondContact O-N 3Å; A137-C141 PolarHBondContact O-SG 2.99Å; I139-C141 PolarHBondContact O-N 3.2Å
142A97.4Very high96.6Very high5 Ų540 Ų404%0.04120%0.203CC..BIsolated β-bridgetrans-71.1139.8-17100000113.8Y109 L110 C138 I139 D140 Q144 Q145 V148Y109-A142 CarbonylContact O-C 3.58Å; Y109-A142 VanDerWaalsContact O-CA 3.32Å; Y109-A142 WeakPolarHBondContact O-CA 3.38Å; L110-A142 HydrophobicContact CD2-CB 4.39Å; C138-A142 PolarHBondContact O-N 2.93Å; I139-A142 WeakPolarHBondContact O-CB 3.32Å; I139-A142 PolarHBondContact O-N 2.82Å; I139-A142 VanDerWaalsContact O-N 3.09Å; D140-A142 PolarHBondContact O-N 3.31Å; A142-Q144 PolarHBondContact O-N 3.16Å; A142-Q145 HydrophobicContact CB-CG 4.36Å; A142-V148 HydrophobicContact CB-CB 4.04Å; A142-V148 HydrophobicContact CB-CG2 3.49Å; A142-V148 VanDerWaalsContact CB-CG2 3.49Å
143H96.1Very high95.9Very high107 Ų10744.8 Ų44.850%0.49522%0.223SC..SBendtrans-63.2-32.4164.7-64.4126.8000111.7P108 Y109 L110 E111P108-H143 PolarHBondContact O-ND1 3.37Å; Y109-H143 PolarHBondContact O-N 3.1Å; L110-H143 VanDerWaalsContact C-CE1 3.48Å; L110-H143 PolarHBondContact O-CE1 2.78Å; E111-H143 WeakPolarHBondContact CA-NE2 3.41Å
144Q95Very high95.2Very high120 Ų12045.6 Ų45.656%0.56123%0.226SC*.SBendtrans-139.385.8-179.8-67.3-175.3-11.100109.7A142 K146 L147 V148A142-Q144 PolarHBondContact O-N 3.16Å; Q144-K146 PolarHBondContact O-N 3.3Å; Q144-K146 VanDerWaalsContact O-N 3.1Å; Q144-L147 HydrophobicContact CB-CB 4.48Å; Q144-L147 HydrophobicContact CB-CD1 4.43Å; Q144-L147 HydrophobicContact CB-CG 4.28Å; Q144-L147 PolarHBondContact O-N 3.07Å; Q144-V148 PolarHBondContact O-N 3.23Å
145Q96.6Very high94.2Very high42 Ų4246.3 Ų46.320%0.19623%0.233CC..Hα-helixtrans-50.4-40.4-176.2-60.2-152.7-21.100112.8I139 A142 L147 V148 F149 A165 S166I139-Q145 HydrophobicContact CG2-CB 4.24Å; I139-Q145 HydrophobicContact CG2-CG 4.36Å; I139-Q145 WeakPolarHBondContact O-CG 3.44Å; I139-Q145 PolarHBondContact O-NE2 3.35Å; A142-Q145 HydrophobicContact CB-CG 4.36Å; Q145-L147 VanDerWaalsContact C-N 3.29Å; Q145-L147 PolarHBondContact O-N 3.31Å; Q145-V148 PolarHBondContact O-N 3.29Å; Q145-F149 WeakPolarHBondContact O-CB 3.45Å; Q145-F149 PolarHBondContact O-N 2.87Å; Q145-A165 HydrophobicContact CB-CB 4.26Å; Q145-S166 PolarHBondContact OE1-O 2.94Å
146K96.3Very high93.1Very high97 Ų9756.2 Ų56.242%0.42227%0.272SS..Hα-helixtrans-53.5-38.5177.6-167.6171.7-167.4171.20113.9Q144 S150 F167 D168Q144-K146 PolarHBondContact O-N 3.3Å; Q144-K146 VanDerWaalsContact O-N 3.1Å; K146-S150 WeakPolarHBondContact O-CB 3.37Å; K146-S150 PolarHBondContact O-N 3.05Å; K146-F167 HydrophobicContact CB-CB 4Å; K146-F167 HydrophobicContact CB-CD1 3.85Å; K146-F167 HydrophobicContact CB-CD2 4.05Å; K146-F167 HydrophobicContact CB-CE1 4.29Å; K146-F167 HydrophobicContact CB-CE2 4.47Å; K146-F167 HydrophobicContact CB-CG 3.71Å; K146-F167 HydrophobicContact CD-CB 4.46Å; K146-F167 HydrophobicContact CD-CD2 3.66Å; K146-F167 HydrophobicContact CD-CE2 4.06Å; K146-F167 HydrophobicContact CD-CG 4.14Å; K146-F167 HydrophobicContact CG-CB 4.49Å; K146-F167 HydrophobicContact CG-CD1 4.19Å; K146-F167 HydrophobicContact CG-CD2 3.66Å; K146-F167 HydrophobicContact CG-CE1 4.29Å; K146-F167 HydrophobicContact CG-CE2 3.77Å; K146-F167 HydrophobicContact CG-CG 3.88Å; K146-F167 HydrophobicContact CG-CZ 4.08Å; K146-D168 WeakPolarHBondContact CE-OD2 3.41Å; K146-D168 IonicContact NZ-OD1 2.75Å; K146-D168 PolarHBondContact NZ-OD1 3.35Å; K146-D168 IonicContact NZ-OD2 2.62Å; K146-D168 PolarHBondContact NZ-OD2 2.95Å
147L94.9Very high91.9Very high73 Ų7357.3 Ų57.338%0.38229%0.294SS..Hα-helixtrans-73.5-52.4176.6-68.2-170.1000111Y109 Q144 Q145 F149 S150 L151Y109-L147 HydrophobicContact CE1-CD1 4.19Å; Q144-L147 HydrophobicContact CB-CB 4.48Å; Q144-L147 HydrophobicContact CB-CD1 4.43Å; Q144-L147 HydrophobicContact CB-CG 4.28Å; Q144-L147 PolarHBondContact O-N 3.07Å; Q145-L147 VanDerWaalsContact C-N 3.29Å; Q145-L147 PolarHBondContact O-N 3.31Å; L147-F149 VanDerWaalsContact C-N 3.31Å; L147-F149 PolarHBondContact O-N 3.14Å; L147-S150 WeakPolarHBondContact O-CB 3.43Å; L147-S150 PolarHBondContact O-N 3.09Å; L147-S150 PolarHBondContact O-OG 3.12Å; L147-L151 PolarHBondContact O-N 2.88Å
148V96.4Very high91Very high0 Ų060.4 Ų60.40%033%0.327CS..Hα-helixtrans-57.5-45-179.71770000111.3C138 I139 A142 Q144 Q145 S150 L151 V152 L196C138-V148 HydrophobicContact CB-CG1 4.48Å; I139-V148 HydrophobicContact CG1-CG1 4.1Å; A142-V148 HydrophobicContact CB-CB 4.04Å; A142-V148 HydrophobicContact CB-CG2 3.49Å; A142-V148 VanDerWaalsContact CB-CG2 3.49Å; Q144-V148 PolarHBondContact O-N 3.23Å; Q145-V148 PolarHBondContact O-N 3.29Å; V148-S150 VanDerWaalsContact C-N 3.25Å; V148-S150 PolarHBondContact O-N 3.18Å; V148-L151 WeakPolarHBondContact O-CB 3.39Å; V148-L151 PolarHBondContact O-N 3.1Å; V148-L151 VanDerWaalsContact O-N 3.09Å; V148-V152 PolarHBondContact O-N 3.41Å; V148-L196 HydrophobicContact CB-CD2 4.25Å; V148-L196 HydrophobicContact CG1-CD1 4.31Å; V148-L196 HydrophobicContact CG1-CD2 4Å; V148-L196 HydrophobicContact CG2-CD2 3.66Å
149F96.1Very high90.5Very high11 Ų1167.3 Ų67.35%0.04836%0.359CS..Hα-helixtrans-64.3-24.8176.5-173.2-99000114I139 Q145 L147 A165 F167 H172 R174I139-F149 HydrophobicContact CD1-CD2 4Å; Q145-F149 WeakPolarHBondContact O-CB 3.45Å; Q145-F149 PolarHBondContact O-N 2.87Å; L147-F149 VanDerWaalsContact C-N 3.31Å; L147-F149 PolarHBondContact O-N 3.14Å; F149-A165 HydrophobicContact CB-CB 3.82Å; F149-A165 HydrophobicContact CD1-CB 4.29Å; F149-A165 HydrophobicContact CD2-CB 3.35Å; F149-A165 HydrophobicContact CE2-CB 3.85Å; F149-A165 HydrophobicContact CG-CB 3.58Å; F149-A165 HydrophobicContact CZ-CB 4.49Å; F149-F167 HydrophobicContact CB-CE1 4.34Å; F149-F167 AromaticContact CD1-CE1 3.67Å; F149-F167 HydrophobicContact CD1-CE1 3.67Å; F149-F167 HydrophobicContact CD1-CZ 4.02Å; F149-F167 HydrophobicContact CE1-CE1 4.16Å; F149-F167 HydrophobicContact CE1-CZ 4.3Å; F149-F167 HydrophobicContact CG-CE1 4.15Å; F149-H172 HydrophobicContact CD1-CB 4.45Å; F149-H172 HydrophobicContact CE1-CB 3.63Å; F149-H172 WeakPolarHBondContact CE2-O 3.13Å; F149-H172 VanDerWaalsContact CZ-C 3.43Å; F149-H172 HydrophobicContact CZ-CB 3.74Å; F149-H172 VanDerWaalsContact CZ-O 3.3Å; F149-H172 WeakPolarHBondContact CZ-O 3.41Å; F149-R174 HydrophobicContact CD1-CG 4.3Å; F149-R174 HydrophobicContact CD2-CG 4.26Å; F149-R174 HydrophobicContact CE1-CG 3.67Å; F149-R174 HydrophobicContact CE2-CB 3.71Å; F149-R174 HydrophobicContact CE2-CG 3.64Å; F149-R174 HydrophobicContact CZ-CB 3.76Å; F149-R174 HydrophobicContact CZ-CG 3.31Å
150S94.4Very high90.2Very high74 Ų7470.3 Ų70.352%0.51737%0.373SS..Hα-helixtrans-78.8-26.817377.70000113.4K146 L147 V148 V152K146-S150 WeakPolarHBondContact O-CB 3.37Å; K146-S150 PolarHBondContact O-N 3.05Å; L147-S150 WeakPolarHBondContact O-CB 3.43Å; L147-S150 PolarHBondContact O-N 3.09Å; L147-S150 PolarHBondContact O-OG 3.12Å; V148-S150 VanDerWaalsContact C-N 3.25Å; V148-S150 PolarHBondContact O-N 3.18Å; S150-V152 VanDerWaalsContact C-N 3.35Å
151L92.4Very high90Very high68 Ų6868.2 Ų68.236%0.35636%0.363SS..Hα-helixtrans-73-30.1172.2-62.4171.9000111.4L147 V148 K153 L196L147-L151 PolarHBondContact O-N 2.88Å; V148-L151 WeakPolarHBondContact O-CB 3.39Å; V148-L151 PolarHBondContact O-N 3.1Å; V148-L151 VanDerWaalsContact O-N 3.09Å; L151-K153 PolarHBondContact O-N 3.47Å; L151-L196 HydrophobicContact CD1-CD2 3.69Å; L151-L196 HydrophobicContact CD1-CG 4.49Å
152V93.1Very high89.8Confident2 Ų270.6 Ų70.61%0.01238%0.38CS..SBendtrans-67.899.6172.6179.40000110V135 V148 S150 V163 R174 L176 L192V135-V152 HydrophobicContact CG1-CG1 4Å; V135-V152 HydrophobicContact CG1-CG2 3.7Å; V148-V152 PolarHBondContact O-N 3.41Å; S150-V152 VanDerWaalsContact C-N 3.35Å; V152-V163 HydrophobicContact CG1-CG2 4.25Å; V152-R174 PolarHBondContact O-NE 2.78Å; V152-L176 HydrophobicContact CG1-CD2 3.75Å; V152-L192 HydrophobicContact CG2-CD1 4.27Å
153K84.5Confident89.8Confident159 Ų15970.4 Ų70.469%0.69138%0.378SS*.PPolyproline II helixtrans-71.5135.3177.7-63.6-156.9174.2-155.10111L151L151-K153 PolarHBondContact O-N 3.47Å
154Q82.7Confident89.8Confident73 Ų7367 Ų6734%0.34137%0.367SS..PPolyproline II helixtrans-67.1137.4175.5-167.9161.24.900111.2Y156 S175Q154-Y156 WeakPolarHBondContact O-CE2 3.46Å; Q154-S175 WeakPolarHBondContact CA-O 3.13Å; Q154-S175 PolarHBondContact NE2-OG 3.24Å
155G76.8Confident90Very high14 Ų1461.4 Ų61.414%0.14434%0.341CS..PPolyproline II helixtrans-72.1155.3169.800000112.4M160 S175G155-M160 VanDerWaalsContact C-CE 3.47Å; G155-S175 PolarHBondContact N-O 3.07Å
156Y74.9Confident90Very high208 Ų20862.9 Ų62.982%0.81636%0.356SS*.  trans-131.9125.8176.4-60.6-84.7000110Q154Q154-Y156 WeakPolarHBondContact O-CE2 3.46Å
157G72.8Confident89.9Confident60 Ų6059.9 Ų59.962%0.61934%0.343SS*.SBendtrans80.3148.7178.200000115M160G157-M160 WeakPolarHBondContact O-CE 3.42Å
158G80.3Confident89.8Confident75 Ų7561.6 Ų61.677%0.77335%0.352SS*.SBendtrans82.8-171.8-178.300000114.4
159E87.3Confident89.7Confident147 Ų14765.4 Ų65.469%0.68739%0.392SS*.  trans-68.8145.9171.2-168.2-168.7158.100110.2V178E159-V178 HydrophobicContact CB-CB 4.01Å; E159-V178 HydrophobicContact CB-CG2 3.97Å; E159-V178 HydrophobicContact CG-CB 4.3Å; E159-V178 HydrophobicContact CG-CG2 3.75Å; E159-V178 PolarHBondContact O-N 3Å
160M91Very high89.7Confident62 Ų6271.5 Ų71.531%0.30542%0.418SS..EExtended strand (participates in β ladder)trans-132.4137.7-172.4-66.9-75.2171.400111.3G155 G157 L176 P177G155-M160 VanDerWaalsContact C-CE 3.47Å; G157-M160 WeakPolarHBondContact O-CE 3.42Å; M160-L176 WeakPolarHBondContact CA-O 3.31Å; M160-L176 VanDerWaalsContact SD-O 3.41Å; M160-P177 HydrophobicContact SD-CB 4.48Å
161V93Very high89.8Confident31 Ų3175.5 Ų75.519%0.18843%0.429CS..EExtended strand (participates in β ladder)trans-103.5160.9162.4-68.70000109.9Q132 S175 L176 V178Q132-V161 HydrophobicContact CB-CG2 4.1Å; Q132-V161 HydrophobicContact CG-CB 4.42Å; Q132-V161 HydrophobicContact CG-CG2 4.26Å; V161-S175 CarbonylContact O-C 3.49Å; V161-S175 WeakPolarHBondContact O-CA 3.39Å; V161-L176 HydrophobicContact CG2-CB 4.1Å; V161-L176 PolarHBondContact N-O 3.3Å; V161-L176 PolarHBondContact O-N 3.18Å; V161-V178 HydrophobicContact CG1-CG2 3.93Å
162S94.4Very high90Very high55 Ų5575.1 Ų75.139%0.38543%0.425SS..EExtended strand (participates in β ladder)trans-118.9136.9-174.147.90000112.8Q132 R174Q132-S162 PolarHBondContact NE2-O 3.32Å; S162-R174 WeakPolarHBondContact CA-O 2.99Å
163V97.1Very high90.1Very high0 Ų080.6 Ų80.60%045%0.454CS..EExtended strand (participates in β ladder)trans-110.9147.3164.9-650000109.5Q132 V135 Q136 I139 V152 R174 L176Q132-V163 HydrophobicContact CG-CG1 3.88Å; V135-V163 HydrophobicContact CB-CG1 4.26Å; V135-V163 HydrophobicContact CG1-CG1 4.12Å; V135-V163 HydrophobicContact CG1-CG2 4.11Å; Q136-V163 HydrophobicContact CB-CG1 4.29Å; I139-V163 HydrophobicContact CD1-CB 3.98Å; I139-V163 HydrophobicContact CD1-CG2 3.87Å; V152-V163 HydrophobicContact CG1-CG2 4.25Å; V163-R174 HydrophobicContact CG2-CB 3.97Å; V163-R174 PolarHBondContact N-O 3.31Å; V163-R174 PolarHBondContact O-N 3.33Å; V163-L176 HydrophobicContact CG1-CD1 3.69Å; V163-L176 HydrophobicContact CG1-CG 4.43Å; V163-L176 HydrophobicContact CG2-CD1 4.29Å; V163-L176 HydrophobicContact CG2-CG 4.31Å
164S96.8Very high90.5Very high37 Ų3776.7 Ų76.726%0.25944%0.435SS..EExtended strand (participates in β ladder)trans-118152.8-176.564.60000112Q136 I139 H172Q136-S164 PolarHBondContact NE2-O 3.21Å; Q136-S164 PolarHBondContact OE1-O 2.75Å; I139-S164 WeakPolarHBondContact CG2-O 3.11Å; S164-H172 CarbonylContact C-O 3.52Å; S164-H172 VanDerWaalsContact CA-O 3.28Å; S164-H172 WeakPolarHBondContact CA-O 3.4Å
165A97.4Very high91Very high2 Ų274.9 Ų74.92%0.01743%0.43CS..EExtended strand (participates in β ladder)trans-136.7147169.200000109.6I139 Q145 F149 F167 Q171 H172I139-A165 HydrophobicContact CG2-CB 3.68Å; Q145-A165 HydrophobicContact CB-CB 4.26Å; F149-A165 HydrophobicContact CB-CB 3.82Å; F149-A165 HydrophobicContact CD1-CB 4.29Å; F149-A165 HydrophobicContact CD2-CB 3.35Å; F149-A165 HydrophobicContact CE2-CB 3.85Å; F149-A165 HydrophobicContact CG-CB 3.58Å; F149-A165 HydrophobicContact CZ-CB 4.49Å; A165-F167 HydrophobicContact CB-CD1 3.9Å; A165-F167 HydrophobicContact CB-CE1 3.87Å; A165-Q171 CarbonylContact O-C 3.48Å; A165-Q171 WeakPolarHBondContact O-CA 3.4Å; A165-H172 PolarHBondContact N-O 3.25Å; A165-H172 PolarHBondContact O-N 2.99Å
166S96.4Very high91.8Very high73 Ų7374.2 Ų74.251%0.5142%0.423SS..EExtended strand (participates in β ladder)trans-106115.6172.7-166.80000110Q145 K170Q145-S166 PolarHBondContact OE1-O 2.94Å; S166-K170 WeakPolarHBondContact CA-O 2.92Å
167F95.6Very high92.6Very high33 Ų3365.4 Ų65.415%0.14539%0.392CS..EExtended strand (participates in β ladder)trans-155.3162.1172.956.5-98.5000110.8K146 F149 A165 G169 K170 H172K146-F167 HydrophobicContact CB-CB 4Å; K146-F167 HydrophobicContact CB-CD1 3.85Å; K146-F167 HydrophobicContact CB-CD2 4.05Å; K146-F167 HydrophobicContact CB-CE1 4.29Å; K146-F167 HydrophobicContact CB-CE2 4.47Å; K146-F167 HydrophobicContact CB-CG 3.71Å; K146-F167 HydrophobicContact CD-CB 4.46Å; K146-F167 HydrophobicContact CD-CD2 3.66Å; K146-F167 HydrophobicContact CD-CE2 4.06Å; K146-F167 HydrophobicContact CD-CG 4.14Å; K146-F167 HydrophobicContact CG-CB 4.49Å; K146-F167 HydrophobicContact CG-CD1 4.19Å; K146-F167 HydrophobicContact CG-CD2 3.66Å; K146-F167 HydrophobicContact CG-CE1 4.29Å; K146-F167 HydrophobicContact CG-CE2 3.77Å; K146-F167 HydrophobicContact CG-CG 3.88Å; K146-F167 HydrophobicContact CG-CZ 4.08Å; F149-F167 HydrophobicContact CB-CE1 4.34Å; F149-F167 AromaticContact CD1-CE1 3.67Å; F149-F167 HydrophobicContact CD1-CE1 3.67Å; F149-F167 HydrophobicContact CD1-CZ 4.02Å; F149-F167 HydrophobicContact CE1-CE1 4.16Å; F149-F167 HydrophobicContact CE1-CZ 4.3Å; F149-F167 HydrophobicContact CG-CE1 4.15Å; A165-F167 HydrophobicContact CB-CD1 3.9Å; A165-F167 HydrophobicContact CB-CE1 3.87Å; F167-G169 PolarHBondContact O-N 3.28Å; F167-K170 PolarHBondContact N-O 3.01Å; F167-K170 PolarHBondContact O-N 2.68Å; F167-H172 AromaticContact CD2-CD2 3.63Å; F167-H172 AromaticContact CD2-NE2 3.71Å; F167-H172 HydrophobicContact CE1-CB 3.81Å; F167-H172 AromaticContact CE1-CD2 3.76Å; F167-H172 AromaticContact CE1-CG 3.84Å; F167-H172 AromaticContact CE2-CD2 3.3Å; F167-H172 WeakPolarHBondContact CE2-CD2 3.44Å; F167-H172 AromaticContact CE2-CE1 3.77Å; F167-H172 AromaticContact CE2-CG 3.7Å; F167-H172 AromaticContact CE2-ND1 3.97Å; F167-H172 AromaticContact CE2-NE2 3.36Å; F167-H172 WeakPolarHBondContact CE2-NE2 3.49Å; F167-H172 HydrophobicContact CZ-CB 3.74Å; F167-H172 AromaticContact CZ-CD2 3.38Å; F167-H172 WeakPolarHBondContact CZ-CD2 3.48Å; F167-H172 AromaticContact CZ-CG 3.36Å; F167-H172 AromaticContact CZ-ND1 3.86Å; F167-H172 AromaticContact CZ-NE2 3.9Å
168D93.3Very high93.5Very high109 Ų10964.9 Ų64.958%0.58338%0.376SS*.THydrogen-bonded Turntrans51.727.9-175.4-50.7-12.4000113.8K146 K170K146-D168 WeakPolarHBondContact CE-OD2 3.41Å; K146-D168 IonicContact NZ-OD1 2.75Å; K146-D168 PolarHBondContact NZ-OD1 3.35Å; K146-D168 IonicContact NZ-OD2 2.62Å; K146-D168 PolarHBondContact NZ-OD2 2.95Å; D168-K170 VanDerWaalsContact C-N 3.33Å; D168-K170 PolarHBondContact O-N 2.86Å
169G93.6Very high94.1Very high81 Ų8162.2 Ų62.284%0.83535%0.345SS*.THydrogen-bonded Turntrans73.913.9-175.600000115.4F167F167-G169 PolarHBondContact O-N 3.28Å
170K95.5Very high94.4Very high139 Ų13961.2 Ų61.260%0.60434%0.344SS*.EExtended strand (participates in β ladder)trans-134.3150.3-173.9-65.1176.2-175.2174.60111.6S166 F167 D168 H172S166-K170 WeakPolarHBondContact CA-O 2.92Å; F167-K170 PolarHBondContact N-O 3.01Å; F167-K170 PolarHBondContact O-N 2.68Å; D168-K170 VanDerWaalsContact C-N 3.33Å; D168-K170 PolarHBondContact O-N 2.86Å; K170-H172 PolarHBondContact O-CD2 2.95Å
171Q96.6Very high94.5Very high157 Ų15760.9 Ų60.973%0.73435%0.348SS*.EExtended strand (participates in β ladder)trans-82134164-72.9-165.3-4.700110.6A165A165-Q171 CarbonylContact O-C 3.48Å; A165-Q171 WeakPolarHBondContact O-CA 3.4Å
172H96.2Very high94.6Very high60 Ų6061.8 Ų61.828%0.27835%0.353SS..EExtended strand (participates in β ladder)trans-117.3139.5175-69-92.3000109F149 S164 A165 F167 K170F149-H172 HydrophobicContact CD1-CB 4.45Å; F149-H172 HydrophobicContact CE1-CB 3.63Å; F149-H172 WeakPolarHBondContact CE2-O 3.13Å; F149-H172 VanDerWaalsContact CZ-C 3.43Å; F149-H172 HydrophobicContact CZ-CB 3.74Å; F149-H172 VanDerWaalsContact CZ-O 3.3Å; F149-H172 WeakPolarHBondContact CZ-O 3.41Å; S164-H172 CarbonylContact C-O 3.52Å; S164-H172 VanDerWaalsContact CA-O 3.28Å; S164-H172 WeakPolarHBondContact CA-O 3.4Å; A165-H172 PolarHBondContact N-O 3.25Å; A165-H172 PolarHBondContact O-N 2.99Å; F167-H172 AromaticContact CD2-CD2 3.63Å; F167-H172 AromaticContact CD2-NE2 3.71Å; F167-H172 HydrophobicContact CE1-CB 3.81Å; F167-H172 AromaticContact CE1-CD2 3.76Å; F167-H172 AromaticContact CE1-CG 3.84Å; F167-H172 AromaticContact CE2-CD2 3.3Å; F167-H172 WeakPolarHBondContact CE2-CD2 3.44Å; F167-H172 AromaticContact CE2-CE1 3.77Å; F167-H172 AromaticContact CE2-CG 3.7Å; F167-H172 AromaticContact CE2-ND1 3.97Å; F167-H172 AromaticContact CE2-NE2 3.36Å; F167-H172 WeakPolarHBondContact CE2-NE2 3.49Å; F167-H172 HydrophobicContact CZ-CB 3.74Å; F167-H172 AromaticContact CZ-CD2 3.38Å; F167-H172 WeakPolarHBondContact CZ-CD2 3.48Å; F167-H172 AromaticContact CZ-CG 3.36Å; F167-H172 AromaticContact CZ-ND1 3.86Å; F167-H172 AromaticContact CZ-NE2 3.9Å; K170-H172 PolarHBondContact O-CD2 2.95Å
173L95.8Very high94.6Very high118 Ų11860.9 Ų60.962%0.61835%0.353SS*.EExtended strand (participates in β ladder)trans-119.8136.2-173.3-155.573000111.7
174R93.5Very high94.5Very high76 Ų7665.5 Ų65.529%0.28737%0.371SS..EExtended strand (participates in β ladder)trans-125.3129.3178.5-92.7-75.8-167-122.1-10.8110.9F149 V152 S162 V163F149-R174 HydrophobicContact CD1-CG 4.3Å; F149-R174 HydrophobicContact CD2-CG 4.26Å; F149-R174 HydrophobicContact CE1-CG 3.67Å; F149-R174 HydrophobicContact CE2-CB 3.71Å; F149-R174 HydrophobicContact CE2-CG 3.64Å; F149-R174 HydrophobicContact CZ-CB 3.76Å; F149-R174 HydrophobicContact CZ-CG 3.31Å; V152-R174 PolarHBondContact O-NE 2.78Å; S162-R174 WeakPolarHBondContact CA-O 2.99Å; V163-R174 HydrophobicContact CG2-CB 3.97Å; V163-R174 PolarHBondContact N-O 3.31Å; V163-R174 PolarHBondContact O-N 3.33Å
175S93.3Very high94.4Very high36 Ų3663.8 Ų63.825%0.25236%0.359SS..EExtended strand (participates in β ladder)trans-77.7126.8174.9-35.70000111.1Q154 G155 V161Q154-S175 WeakPolarHBondContact CA-O 3.13Å; Q154-S175 PolarHBondContact NE2-OG 3.24Å; G155-S175 PolarHBondContact N-O 3.07Å; V161-S175 CarbonylContact O-C 3.49Å; V161-S175 WeakPolarHBondContact O-CA 3.39Å
176L93.6Very high94.4Very high0 Ų065.9 Ų65.90%037%0.37CS..EExtended strand (participates in β ladder)trans-107.4142.7164.8-59.5179.1000108.7V135 V152 M160 V161 V163 F188V135-L176 HydrophobicContact CB-CD1 4.05Å; V135-L176 HydrophobicContact CG1-CD1 4.14Å; V135-L176 HydrophobicContact CG2-CD1 4.12Å; V152-L176 HydrophobicContact CG1-CD2 3.75Å; M160-L176 WeakPolarHBondContact CA-O 3.31Å; M160-L176 VanDerWaalsContact SD-O 3.41Å; V161-L176 HydrophobicContact CG2-CB 4.1Å; V161-L176 PolarHBondContact N-O 3.3Å; V161-L176 PolarHBondContact O-N 3.18Å; V163-L176 HydrophobicContact CG1-CD1 3.69Å; V163-L176 HydrophobicContact CG1-CG 4.43Å; V163-L176 HydrophobicContact CG2-CD1 4.29Å; V163-L176 HydrophobicContact CG2-CG 4.31Å; L176-F188 HydrophobicContact CD2-CE2 4.44Å; L176-F188 HydrophobicContact CD2-CZ 3.93Å
177P91.2Very high94.3Very high23 Ų2369.5 Ų69.515%0.14937%0.372CS..EExtended strand (participates in β ladder)trans-67.8141.3177.430-33.7000110.7M160 V179M160-P177 HydrophobicContact SD-CB 4.48Å; P177-V179 HydrophobicContact CB-CG1 4.46Å; P177-V179 HydrophobicContact CG-CG1 4.29Å; P177-V179 PolarHBondContact O-N 2.91Å
178V92.2Very high94.3Very high48 Ų4869.7 Ų69.729%0.29137%0.373SS..  trans-66.7129.4165.5169.40000108.9E159 V161E159-V178 HydrophobicContact CB-CB 4.01Å; E159-V178 HydrophobicContact CB-CG2 3.97Å; E159-V178 HydrophobicContact CG-CB 4.3Å; E159-V178 HydrophobicContact CG-CG2 3.75Å; E159-V178 PolarHBondContact O-N 3Å; V161-V178 HydrophobicContact CG1-CG2 3.93Å
179V92.6Very high94.4Very high19 Ų1964.7 Ų64.712%0.11535%0.347CS..  trans-133148.1-176.5-66.70000111.7S128 L131 P177 Y184 V185S128-V179 PolarHBondContact N-O 3.11Å; S128-V179 VanDerWaalsContact N-O 3.15Å; L131-V179 HydrophobicContact CD2-CG2 3.92Å; P177-V179 HydrophobicContact CB-CG1 4.46Å; P177-V179 HydrophobicContact CG-CG1 4.29Å; P177-V179 PolarHBondContact O-N 2.91Å; V179-Y184 HydrophobicContact CB-CD1 4.16Å; V179-Y184 HydrophobicContact CB-CG 4.5Å; V179-Y184 HydrophobicContact CG1-CD1 3.71Å; V179-Y184 HydrophobicContact CG1-CD2 4.42Å; V179-Y184 HydrophobicContact CG1-CE1 3.77Å; V179-Y184 HydrophobicContact CG1-CE2 4.45Å; V179-Y184 HydrophobicContact CG1-CG 4.07Å; V179-Y184 HydrophobicContact CG2-CD1 4.02Å; V179-Y184 HydrophobicContact CG2-CE1 4.46Å; V179-V185 HydrophobicContact CG2-CG2 4Å
180N93.1Very high94.5Very high127 Ų12763.9 Ų63.968%0.67933%0.332SS*.  trans-115.87179.762.2-8000112.9
181S93.8Very high94.5Very high55 Ų5563.6 Ų63.639%0.38533%0.331SS..  trans-114.6116.9-174.5177.60000111.8G183 Y184 V185S181-G183 PolarHBondContact O-N 3.38Å; S181-G183 PolarHBondContact OG-N 2.92Å; S181-Y184 WeakPolarHBondContact O-CB 3.21Å; S181-Y184 PolarHBondContact O-N 3.17Å; S181-Y184 PolarHBondContact OG-N 3.21Å; S181-V185 PolarHBondContact O-N 3.02Å; S181-V185 VanDerWaalsContact O-N 3.16Å
182V94.7Very high94.4Very high49 Ų4956.4 Ų56.430%0.29730%0.297SS..Hα-helixtrans-57.7-38.8172.4178.50000111.4V96 P127 Y184 V185 L186V96-V182 HydrophobicContact CB-CG2 3.85Å; V96-V182 HydrophobicContact CG2-CB 4.44Å; V96-V182 HydrophobicContact CG2-CG1 3.86Å; V96-V182 HydrophobicContact CG2-CG2 3.77Å; P127-V182 HydrophobicContact CG-CG2 4.32Å; V182-Y184 VanDerWaalsContact C-N 3.3Å; V182-Y184 PolarHBondContact O-N 2.92Å; V182-V185 PolarHBondContact O-N 3.2Å; V182-L186 HydrophobicContact CG1-CD1 4Å; V182-L186 HydrophobicContact CG1-CG 4.39Å; V182-L186 WeakPolarHBondContact O-CG 3.13Å; V182-L186 PolarHBondContact O-N 2.63Å
183G95.1Very high94.4Very high37 Ų3753.8 Ų53.838%0.38129%0.286SS..Hα-helixtrans-62.2-33.6175.100000113.3S181 R187S181-G183 PolarHBondContact O-N 3.38Å; S181-G183 PolarHBondContact OG-N 2.92Å; G183-R187 WeakPolarHBondContact O-CB 3.26Å; G183-R187 WeakPolarHBondContact O-CG 3.36Å; G183-R187 PolarHBondContact O-N 2.84Å; G183-R187 VanDerWaalsContact O-N 3.14Å
184Y94.4Very high94.4Very high96 Ų9655.9 Ų55.938%0.37629%0.285SS..Hα-helixtrans-66.4-49.5170.7-178.3-77.8000111.1L131 V179 S181 V182 L186 R187 F188L131-Y184 HydrophobicContact CD2-CD1 4.38Å; L131-Y184 HydrophobicContact CD2-CE1 4.06Å; V179-Y184 HydrophobicContact CB-CD1 4.16Å; V179-Y184 HydrophobicContact CB-CG 4.5Å; V179-Y184 HydrophobicContact CG1-CD1 3.71Å; V179-Y184 HydrophobicContact CG1-CD2 4.42Å; V179-Y184 HydrophobicContact CG1-CE1 3.77Å; V179-Y184 HydrophobicContact CG1-CE2 4.45Å; V179-Y184 HydrophobicContact CG1-CG 4.07Å; V179-Y184 HydrophobicContact CG2-CD1 4.02Å; V179-Y184 HydrophobicContact CG2-CE1 4.46Å; S181-Y184 WeakPolarHBondContact O-CB 3.21Å; S181-Y184 PolarHBondContact O-N 3.17Å; S181-Y184 PolarHBondContact OG-N 3.21Å; V182-Y184 VanDerWaalsContact C-N 3.3Å; V182-Y184 PolarHBondContact O-N 2.92Å; Y184-L186 VanDerWaalsContact C-N 3.33Å; Y184-L186 PolarHBondContact O-N 3.47Å; Y184-R187 PolarHBondContact O-N 3.41Å; Y184-F188 HydrophobicContact CD1-CB 4.37Å; Y184-F188 HydrophobicContact CE1-CB 4.1Å; Y184-F188 AromaticContact CE1-CD2 3.86Å; Y184-F188 HydrophobicContact CE1-CD2 3.86Å; Y184-F188 HydrophobicContact CE1-CG 4.37Å; Y184-F188 WeakPolarHBondContact O-CB 3.35Å; Y184-F188 PolarHBondContact O-N 3.19Å
185V95.6Very high94.6Very high1 Ų154.8 Ų54.81%0.00629%0.29CS..Hα-helixtrans-56.4-48.2-177.9176.70000110.8L98 P127 L131 V179 S181 V182 F188 L189L98-V185 HydrophobicContact CD1-CG1 3.96Å; P127-V185 HydrophobicContact CB-CG2 3.74Å; P127-V185 WeakPolarHBondContact O-CG2 3.41Å; L131-V185 HydrophobicContact CB-CG1 4.13Å; L131-V185 HydrophobicContact CB-CG2 4.09Å; L131-V185 HydrophobicContact CD1-CG1 4.22Å; V179-V185 HydrophobicContact CG2-CG2 4Å; S181-V185 PolarHBondContact O-N 3.02Å; S181-V185 VanDerWaalsContact O-N 3.16Å; V182-V185 PolarHBondContact O-N 3.2Å; V185-F188 PolarHBondContact O-N 3.4Å; V185-L189 HydrophobicContact CG1-CD1 3.89Å; V185-L189 HydrophobicContact CG1-CG 4.48Å; V185-L189 WeakPolarHBondContact O-CG 3.33Å; V185-L189 PolarHBondContact O-N 3.07Å
186L95.8Very high94.7Very high46 Ų4653.1 Ų53.124%0.24128%0.278CS..Hα-helixtrans-63.9-42.1177.6-67.9172000112.6L98 V182 Y184 F188 L189 A190 H204L98-L186 HydrophobicContact CD2-CD2 3.9Å; V182-L186 HydrophobicContact CG1-CD1 4Å; V182-L186 HydrophobicContact CG1-CG 4.39Å; V182-L186 WeakPolarHBondContact O-CG 3.13Å; V182-L186 PolarHBondContact O-N 2.63Å; Y184-L186 VanDerWaalsContact C-N 3.33Å; Y184-L186 PolarHBondContact O-N 3.47Å; L186-F188 VanDerWaalsContact C-N 3.31Å; L186-F188 PolarHBondContact O-N 3.11Å; L186-L189 PolarHBondContact O-N 2.81Å; L186-A190 VanDerWaalsContact O-CB 3.24Å; L186-A190 WeakPolarHBondContact O-CB 3.11Å; L186-A190 PolarHBondContact O-N 2.98Å; L186-H204 HydrophobicContact CD1-CB 4.08Å; L186-H204 WeakPolarHBondContact CD1-ND1 3.42Å; L186-H204 HydrophobicContact CD2-CB 4.14Å
187R94.9Very high94.8Very high149 Ų14957.6 Ų57.656%0.56230%0.301SS*.Hα-helixtrans-69-27176.4-69.9174.890.5135.310.4112.8G183 Y184 K191 D357G183-R187 WeakPolarHBondContact O-CB 3.26Å; G183-R187 WeakPolarHBondContact O-CG 3.36Å; G183-R187 PolarHBondContact O-N 2.84Å; G183-R187 VanDerWaalsContact O-N 3.14Å; Y184-R187 PolarHBondContact O-N 3.41Å; R187-K191 WeakPolarHBondContact O-CB 3.39Å; R187-D357 IonicContact CZ-OD2 2.71Å; R187-D357 VanDerWaalsContact CZ-OD2 3.24Å; R187-D357 PolarHBondContact NH1-O 2.96Å; R187-D357 IonicContact NH1-OD1 3.97Å; R187-D357 IonicContact NH1-OD2 2.66Å; R187-D357 PolarHBondContact NH1-OD2 2.78Å; R187-D357 IonicContact NH2-OD2 2.79Å; R187-D357 PolarHBondContact NH2-OD2 2.81Å
188F95.3Very high94.9Very high38 Ų3856.5 Ų56.517%0.16729%0.294CS..Hα-helixtrans-72.7-52.8172.2-171.3-73.1000110.6L131 V135 L176 Y184 V185 L186 K191 L192L131-F188 HydrophobicContact CD1-CB 4.15Å; L131-F188 HydrophobicContact CD1-CD1 3.64Å; L131-F188 HydrophobicContact CD1-CE1 4.22Å; L131-F188 HydrophobicContact CD1-CG 3.94Å; V135-F188 HydrophobicContact CG2-CD1 4.27Å; V135-F188 HydrophobicContact CG2-CE1 3.67Å; L176-F188 HydrophobicContact CD2-CE2 4.44Å; L176-F188 HydrophobicContact CD2-CZ 3.93Å; Y184-F188 HydrophobicContact CD1-CB 4.37Å; Y184-F188 HydrophobicContact CE1-CB 4.1Å; Y184-F188 AromaticContact CE1-CD2 3.86Å; Y184-F188 HydrophobicContact CE1-CD2 3.86Å; Y184-F188 HydrophobicContact CE1-CG 4.37Å; Y184-F188 WeakPolarHBondContact O-CB 3.35Å; Y184-F188 PolarHBondContact O-N 3.19Å; V185-F188 PolarHBondContact O-N 3.4Å; L186-F188 VanDerWaalsContact C-N 3.31Å; L186-F188 PolarHBondContact O-N 3.11Å; F188-K191 WeakPolarHBondContact O-CA 3.43Å; F188-K191 WeakPolarHBondContact O-CB 3.47Å; F188-K191 PolarHBondContact O-N 2.93Å; F188-K191 VanDerWaalsContact O-N 3.07Å; F188-L192 HydrophobicContact CE1-CD2 4.46Å; F188-L192 PolarHBondContact O-N 2.9Å
189L96.1Very high94.9Very high4 Ų458 Ų582%0.02130%0.3CS..Hα-helixtrans-66-43.4-176.5-68.6174.2000111.9L98 L131 A134 V135 V185 L186 K191 L192 C193 F202L98-L189 HydrophobicContact CD1-CD1 3.25Å; L131-L189 HydrophobicContact CD1-CD2 4.08Å; L131-L189 HydrophobicContact CD1-CG 4.08Å; A134-L189 HydrophobicContact CB-CD1 3.8Å; A134-L189 HydrophobicContact CB-CD2 3.79Å; A134-L189 HydrophobicContact CB-CG 4.47Å; V135-L189 HydrophobicContact CG2-CD2 4.11Å; V185-L189 HydrophobicContact CG1-CD1 3.89Å; V185-L189 HydrophobicContact CG1-CG 4.48Å; V185-L189 WeakPolarHBondContact O-CG 3.33Å; V185-L189 PolarHBondContact O-N 3.07Å; L186-L189 PolarHBondContact O-N 2.81Å; L189-K191 PolarHBondContact O-N 3.48Å; L189-K191 VanDerWaalsContact O-N 3.11Å; L189-L192 CarbonylContact O-C 3.43Å; L189-L192 PolarHBondContact O-N 2.99Å; L189-C193 WeakPolarHBondContact O-CB 3.37Å; L189-C193 PolarHBondContact O-N 3.46Å; L189-C193 PolarHBondContact O-SG 3.4Å; L189-C193 VanDerWaalsContact O-SG 3.37Å; L189-F202 HydrophobicContact CB-CD2 4.38Å; L189-F202 HydrophobicContact CD1-CB 4.47Å; L189-F202 HydrophobicContact CD1-CD2 4.27Å; L189-F202 HydrophobicContact CD1-CG 4.39Å; L189-F202 HydrophobicContact CD2-CD2 4.32Å; L189-F202 HydrophobicContact CD2-CE2 4.28Å
190A95.4Very high94.9Very high64 Ų6463 Ų6353%0.52933%0.327SS..Hα-helixtrans-59.1-26173.200000113.2L186 R194L186-A190 VanDerWaalsContact O-CB 3.24Å; L186-A190 WeakPolarHBondContact O-CB 3.11Å; L186-A190 PolarHBondContact O-N 2.98Å; A190-R194 WeakPolarHBondContact O-CB 3.24Å; A190-R194 PolarHBondContact O-N 2.87Å
191K95.3Very high95Very high133 Ų13357.1 Ų57.158%0.57830%0.295SS*.Hα-helixtrans-80.7-36.4173.1-176.2176.4178.6177.20112.6R187 F188 L189 S195R187-K191 WeakPolarHBondContact O-CB 3.39Å; F188-K191 WeakPolarHBondContact O-CA 3.43Å; F188-K191 WeakPolarHBondContact O-CB 3.47Å; F188-K191 PolarHBondContact O-N 2.93Å; F188-K191 VanDerWaalsContact O-N 3.07Å; L189-K191 PolarHBondContact O-N 3.48Å; L189-K191 VanDerWaalsContact O-N 3.11Å; K191-S195 PolarHBondContact O-N 3.37Å; K191-S195 PolarHBondContact O-OG 3.05Å
192L95.4Very high95.1Very high6 Ų655.7 Ų55.73%0.03128%0.282CS..Hα-helixtrans-68.5-52.6174.2-178.358.6000110.9V135 C138 V152 F188 L189 R194 S195 L196V135-L192 HydrophobicContact CB-CD2 4.5Å; V135-L192 HydrophobicContact CG1-CD2 4.34Å; V135-L192 HydrophobicContact CG2-CD2 3.97Å; C138-L192 HydrophobicContact CB-CD2 4.41Å; V152-L192 HydrophobicContact CG2-CD1 4.27Å; F188-L192 HydrophobicContact CE1-CD2 4.46Å; F188-L192 PolarHBondContact O-N 2.9Å; L189-L192 CarbonylContact O-C 3.43Å; L189-L192 PolarHBondContact O-N 2.99Å; L192-R194 VanDerWaalsContact C-N 3.33Å; L192-R194 PolarHBondContact O-N 2.86Å; L192-S195 CarbonylContact O-C 3.57Å; L192-S195 WeakPolarHBondContact O-CA 3.45Å; L192-S195 VanDerWaalsContact O-CB 3.31Å; L192-S195 WeakPolarHBondContact O-CB 3.27Å; L192-S195 PolarHBondContact O-N 2.82Å; L192-L196 HydrophobicContact CD1-CD1 3.92Å; L192-L196 HydrophobicContact CD1-CG 4.19Å; L192-L196 HydrophobicContact CG-CD1 3.84Å; L192-L196 HydrophobicContact CG-CG 4.47Å; L192-L196 WeakPolarHBondContact O-CG 3.2Å; L192-L196 PolarHBondContact O-N 2.89Å
193C96Very high95.1Very high5 Ų554.6 Ų54.63%0.03428%0.277CS..Hα-helixtrans-50.8-48.8176-71.40000112.4L189 S195 L196 L197 C198L189-C193 WeakPolarHBondContact O-CB 3.37Å; L189-C193 PolarHBondContact O-N 3.46Å; L189-C193 PolarHBondContact O-SG 3.4Å; L189-C193 VanDerWaalsContact O-SG 3.37Å; C193-S195 VanDerWaalsContact C-N 3.26Å; C193-S195 PolarHBondContact O-N 3.01Å; C193-L196 CarbonylContact O-C 3.6Å; C193-L196 WeakPolarHBondContact O-CA 3.47Å; C193-L196 PolarHBondContact O-N 2.91Å; C193-L197 PolarHBondContact O-N 2.85Å; C193-C198 VanDerWaalsContact CB-O 3.32Å; C193-C198 WeakPolarHBondContact CB-O 3.39Å; C193-C198 PolarHBondContact O-N 3.19Å
194R95.8Very high95Very high161 Ų16157 Ų5761%0.60828%0.277SS*.Hα-helixtrans-69.9-19.1176.8-167.8165.961106.3-0.7114.3A190 L192A190-R194 WeakPolarHBondContact O-CB 3.24Å; A190-R194 PolarHBondContact O-N 2.87Å; L192-R194 VanDerWaalsContact C-N 3.33Å; L192-R194 PolarHBondContact O-N 2.86Å
195S96.1Very high94.8Very high54 Ų5457.6 Ų57.638%0.37828%0.284SS..Hα-helixtrans-81.4-22.5169.2-53.40000112.3K191 L192 C193K191-S195 PolarHBondContact O-N 3.37Å; K191-S195 PolarHBondContact O-OG 3.05Å; L192-S195 CarbonylContact O-C 3.57Å; L192-S195 WeakPolarHBondContact O-CA 3.45Å; L192-S195 VanDerWaalsContact O-CB 3.31Å; L192-S195 WeakPolarHBondContact O-CB 3.27Å; L192-S195 PolarHBondContact O-N 2.82Å; C193-S195 VanDerWaalsContact C-N 3.26Å; C193-S195 PolarHBondContact O-N 3.01Å
196L95.9Very high94.5Very high0 Ų061.1 Ų61.10%031%0.307CS..Hα-helixtrans-98.7-1177.2-64.4174.4000113.1Y109 L110 C138 V148 L151 L192 C193 C198Y109-L196 HydrophobicContact CD2-CB 4.47Å; Y109-L196 HydrophobicContact CD2-CD2 4.26Å; Y109-L196 WeakPolarHBondContact CD2-O 3.36Å; Y109-L196 HydrophobicContact CG-CD2 4.15Å; L110-L196 HydrophobicContact CD2-CD1 4.37Å; C138-L196 HydrophobicContact CB-CD1 4.13Å; V148-L196 HydrophobicContact CB-CD2 4.25Å; V148-L196 HydrophobicContact CG1-CD1 4.31Å; V148-L196 HydrophobicContact CG1-CD2 4Å; V148-L196 HydrophobicContact CG2-CD2 3.66Å; L151-L196 HydrophobicContact CD1-CD2 3.69Å; L151-L196 HydrophobicContact CD1-CG 4.49Å; L192-L196 HydrophobicContact CD1-CD1 3.92Å; L192-L196 HydrophobicContact CD1-CG 4.19Å; L192-L196 HydrophobicContact CG-CD1 3.84Å; L192-L196 HydrophobicContact CG-CG 4.47Å; L192-L196 WeakPolarHBondContact O-CG 3.2Å; L192-L196 PolarHBondContact O-N 2.89Å; C193-L196 CarbonylContact O-C 3.6Å; C193-L196 WeakPolarHBondContact O-CA 3.47Å; C193-L196 PolarHBondContact O-N 2.91Å; L196-C198 HydrophobicContact CB-CB 4.47Å; L196-C198 VanDerWaalsContact CB-SG 3.52Å; L196-C198 PolarHBondContact O-N 3.31Å
197L95.8Very high93.8Very high95 Ų9562.2 Ų62.250%0.49731%0.31SS..THydrogen-bonded Turntrans52.934-173.7-50.3175.3000112.9G107 P108 C193G107-L197 VanDerWaalsContact CA-O 3.29Å; G107-L197 WeakPolarHBondContact CA-O 3.43Å; P108-L197 HydrophobicContact CG-CD1 4.2Å; C193-L197 PolarHBondContact O-N 2.85Å
198C94.6Very high92.9Very high0 Ų061 Ų610%032%0.321CS..  trans-120.658.2179.871.20000111N105 A106 L110 C193 L196 L201N105-C198 WeakPolarHBondContact O-CA 3.32Å; N105-C198 WeakPolarHBondContact O-CB 3.37Å; A106-C198 WeakPolarHBondContact O-CB 3.3Å; L110-C198 HydrophobicContact CD1-CB 4.24Å; C193-C198 VanDerWaalsContact CB-O 3.32Å; C193-C198 WeakPolarHBondContact CB-O 3.39Å; C193-C198 PolarHBondContact O-N 3.19Å; L196-C198 HydrophobicContact CB-CB 4.47Å; L196-C198 VanDerWaalsContact CB-SG 3.52Å; L196-C198 PolarHBondContact O-N 3.31Å; C198-L201 WeakPolarHBondContact O-CB 3.31Å
199D92.1Very high91.7Very high78 Ų7870.8 Ų70.842%0.41736%0.357SS..THydrogen-bonded Turntrans-62.3155179-61.7-61.2000112L201D199-L201 PolarHBondContact O-N 3.08Å; D199-L201 VanDerWaalsContact O-N 3.07Å
200D91.2Very high89.5Confident126 Ų12673.7 Ų73.767%0.67439%0.387SS*.THydrogen-bonded Turntrans55.518.2-177.7-56-34.5000116.8N101N101-D200 WeakPolarHBondContact CB-O 3.34Å; N101-D200 PolarHBondContact ND2-O 3.29Å
201L95.8Very high86.7Confident2 Ų276.5 Ų76.51%0.0140%0.402CS..SBendtrans-65.7-3217417961.1000113.7I100 N101 A104 L110 V115 C198 D199I100-L201 WeakPolarHBondContact CA-O 3.47Å; I100-L201 HydrophobicContact CG2-CD1 4.17Å; N101-L201 PolarHBondContact N-O 3.03Å; A104-L201 HydrophobicContact CB-CB 4.35Å; A104-L201 HydrophobicContact CB-CD1 4.28Å; L110-L201 HydrophobicContact CD1-CD2 3.88Å; V115-L201 HydrophobicContact CG1-CD1 3.69Å; C198-L201 WeakPolarHBondContact O-CB 3.31Å; D199-L201 PolarHBondContact O-N 3.08Å; D199-L201 VanDerWaalsContact O-N 3.07Å
202F96.8Very high84.2Confident25 Ų2575.4 Ų75.411%0.1141%0.411CS..EExtended strand (participates in β ladder)trans-127.6140-178.2-59.4-68.9000112.1Y99 I100 F122 A134 L189Y99-F202 WeakPolarHBondContact O-CA 3.48Å; I100-F202 HydrophobicContact CD1-CE1 4.4Å; I100-F202 HydrophobicContact CG1-CD1 3.95Å; I100-F202 HydrophobicContact CG1-CE1 3.91Å; F122-F202 HydrophobicContact CE2-CE1 4.12Å; A134-F202 HydrophobicContact CB-CD1 4.46Å; A134-F202 HydrophobicContact CB-CE1 3.99Å; A134-F202 HydrophobicContact CB-CE2 4.31Å; A134-F202 HydrophobicContact CB-CZ 3.91Å; L189-F202 HydrophobicContact CB-CD2 4.38Å; L189-F202 HydrophobicContact CD1-CB 4.47Å; L189-F202 HydrophobicContact CD1-CD2 4.27Å; L189-F202 HydrophobicContact CD1-CG 4.39Å; L189-F202 HydrophobicContact CD2-CD2 4.32Å; L189-F202 HydrophobicContact CD2-CE2 4.28Å
203S94.1Very high81.8Confident27 Ų2779.6 Ų79.619%0.18945%0.447CS..EExtended strand (participates in β ladder)trans-139.2149.8174.8175.30000111.3L98 Y99 Q205L98-S203 CarbonylContact C-O 3.32Å; L98-S203 VanDerWaalsContact CA-O 3.32Å; L98-S203 WeakPolarHBondContact CA-O 3.37Å; Y99-S203 PolarHBondContact N-O 3.37Å; Y99-S203 PolarHBondContact O-N 3.31Å; S203-Q205 VanDerWaalsContact C-N 3.31Å; S203-Q205 VanDerWaalsContact CB-O 3.3Å; S203-Q205 WeakPolarHBondContact CB-O 3.43Å; S203-Q205 PolarHBondContact OG-N 2.78Å; S203-Q205 PolarHBondContact OG-O 3.41Å
204H92.8Very high79.4Confident86 Ų8684.8 Ų84.840%0.39848%0.483SS..SBendtrans-85.1-7.5168.569.8-74.3000113L98 L186L98-H204 HydrophobicContact CD2-CB 4.26Å; L186-H204 HydrophobicContact CD1-CB 4.08Å; L186-H204 WeakPolarHBondContact CD1-ND1 3.42Å; L186-H204 HydrophobicContact CD2-CB 4.14Å
205Q90.9Very high76.7Confident110 Ų11086.1 Ų86.151%0.51450%0.496SS..SBendtrans-107.9143.3173.1-60.7-61.1-25.100109.4Y99 S203 F207Y99-Q205 WeakPolarHBondContact CD2-O 3.36Å; S203-Q205 VanDerWaalsContact C-N 3.31Å; S203-Q205 VanDerWaalsContact CB-O 3.3Å; S203-Q205 WeakPolarHBondContact CB-O 3.43Å; S203-Q205 PolarHBondContact OG-N 2.78Å; S203-Q205 PolarHBondContact OG-O 3.41Å; Q205-F207 PolarHBondContact O-N 3.05Å
206P88.8Confident73.8Confident74 Ų7493.2 Ų93.248%0.48152%0.52SS..PPolyproline II helixtrans-61.4137.6174.526.8-34.2000110.4Y99Y99-P206 HydrophobicContact CD1-CB 4.1Å; Y99-P206 HydrophobicContact CD2-CB 4.31Å; Y99-P206 HydrophobicContact CE1-CB 3.96Å; Y99-P206 HydrophobicContact CE2-CB 4.17Å; Y99-P206 HydrophobicContact CG-CB 4.28Å
207F81.7Confident70.9Confident70 Ų7099 Ų9931%0.30756%0.556SS.*PPolyproline II helixtrans-69.2134173-65.8-77.6000109.6N101 Q205 R209N101-F207 HydrophobicContact CB-CD1 4.4Å; N101-F207 HydrophobicContact CB-CD2 4.13Å; N101-F207 HydrophobicContact CB-CE1 3.95Å; N101-F207 HydrophobicContact CB-CE2 3.66Å; N101-F207 HydrophobicContact CB-CG 4.49Å; N101-F207 HydrophobicContact CB-CZ 3.56Å; Q205-F207 PolarHBondContact O-N 3.05Å; F207-R209 PolarHBondContact O-N 3.25Å
208P75.8Confident67.8Low123 Ų123102.7 Ų102.780%0.79957%0.57SS**PPolyproline II helixtrans-56.6124.3171.2-2333.4000109.3G210P208-G210 VanDerWaalsContact C-N 3.34Å; P208-G210 PolarHBondContact O-N 3.25Å
209R69.2Low64.9Low244 Ų244111.5 Ų111.592%0.92161%0.611SS**  trans-66.194.2174.8-76.2-173.5176.4-179.3-1.6109.2F207 C211F207-R209 PolarHBondContact O-N 3.25Å; R209-C211 PolarHBondContact O-N 2.96Å
210G51Low62Low64 Ų64116.9 Ų116.966%0.6663%0.631SS**  trans-56.1126.2160.100000108.2P208 S212P208-G210 VanDerWaalsContact C-N 3.34Å; P208-G210 PolarHBondContact O-N 3.25Å; G210-S212 PolarHBondContact O-N 2.9Å
211C36.8Very low59.2Low123 Ų123119.7 Ų119.783%0.83164%0.64SS**  trans-71.989.6-170.7-169.90000111.4R209 A213R209-C211 PolarHBondContact O-N 2.96Å; C211-A213 VanDerWaalsContact C-N 3.32Å; C211-A213 PolarHBondContact O-N 3.19Å
212S41.7Very low56.2Low110 Ų110128 Ų12877%0.76968%0.679SS**  trans-74.286.916555.90000109.1G210 S214G210-S212 PolarHBondContact O-N 2.9Å; S212-S214 PolarHBondContact O-N 2.87Å
213A45.9Very low53Low95 Ų95130.7 Ų130.779%0.78571%0.713SS**  trans-66.2100.1-179.800000111.6C211C211-A213 VanDerWaalsContact C-N 3.32Å; C211-A213 PolarHBondContact O-N 3.19Å
214S45.3Very low50Low114 Ų114139.6 Ų139.680%0.79774%0.743SS**  trans-157.935164.2-166.40000114.5S212S212-S214 PolarHBondContact O-N 2.87Å
215E39.3Very low47Very low189 Ų189144 Ų14488%0.88377%0.765SS**  trans-120.365.9162-74.9-169.1123.800110.4
216K34.2Very low44.1Very low202 Ų202147.1 Ų147.188%0.87878%0.78SS**  trans-91.791.1147.9-82.2-161.1171.2-168.30107.7Q218K216-Q218 VanDerWaalsContact C-N 3.3Å; K216-Q218 PolarHBondContact O-N 2.93Å
217V34.4Very low41.3Very low123 Ų123148.5 Ų148.575%0.74579%0.791SS**  trans-60.9102.8155.2174.30000105.8E219V217-E219 PolarHBondContact O-N 3.5Å
218Q32.6Very low38.9Very low172 Ų172149.7 Ų149.780%0.80481%0.814SS**  trans-85.990.9175.1-172168.8700107.3K216 K220K216-Q218 VanDerWaalsContact C-N 3.3Å; K216-Q218 PolarHBondContact O-N 2.93Å; Q218-K220 PolarHBondContact O-N 3.02Å
219E33Very low36.8Very low185 Ų185153.4 Ų153.486%0.86482%0.818SS**  trans-54.8107.6162.4-72.8-176.2115.500107.5V217V217-E219 PolarHBondContact O-N 3.5Å
220K30.8Very low35Very low191 Ų191148.1 Ų148.183%0.8381%0.813SS**  trans-100103177.6-174.3179.3176.8-176.40108.1Q218Q218-K220 PolarHBondContact O-N 3.02Å
221E33.3Very low33.9Very low184 Ų184151 Ų15186%0.8682%0.818SS**  trans-50.2139.4172.4-166.1174-175.500111.7G223E221-G223 PolarHBondContact O-N 3.34Å
222E31.3Very low33.5Very low178 Ų178151.2 Ų151.283%0.83282%0.815SS**  trans-81.985-171.3-167.4179.6165.400112.1
223G29.5Very low32.9Very low80 Ų80151.1 Ų151.183%0.82581%0.81SS**  trans-102.797.5174.200000112.8E221E221-G223 PolarHBondContact O-N 3.34Å
224R32Very low32.2Very low215 Ų215154.9 Ų154.981%0.81181%0.811SS**  trans-100116-173.5171.7-174.3169.5177.8-3.3113.5
225M30.4Very low31.4Very low178 Ų178156.8 Ų156.888%0.87781%0.807SS**  trans-162.1102.4152.5-96.1148.3-161.200106.5
226E28.8Very low30.9Very low176 Ų176156.1 Ų156.182%0.82280%0.798SS**  74107.790.9-169.3-174.2159.600114.2
227S29.9Very low30.8Very low102 Ų102153 Ų15371%0.71379%0.791SS**  178.8172.7101.1-156.30000112.7
228A31.4Very low30.6Very low96 Ų96153 Ų15379%0.79379%0.791SS**  trans57.3126.8164.100000120.9
229K32.6Very low30.6Very low201 Ų201152 Ų15287%0.87479%0.791SS**  trans-122.6133.8160.7-70.4176.5177.5176.50109.8
230T30.5Very low31.4Very low133 Ų133148.3 Ų148.382%0.81678%0.782SS**  trans-159.2131154.323.40000106.2
231V27.5Very low31.4Very low125 Ų125145.9 Ų145.976%0.75878%0.784SS**  cis87.1139.635.7-179.40000112.5
232T29.8Very low31.3Very low127 Ų127140.2 Ų140.278%0.77977%0.774SS**  trans71.9140-165.269.90000116.2
233T29.4Very low31.3Very low108 Ų108141 Ų14166%0.66378%0.781SS**  cis123109.8-4.6-690000112.2
234E30.6Very low31.5Very low173 Ų173144.3 Ų144.381%0.80878%0.779SS**  trans60.5164.4153.3-66.8169.2-166.300117.6
235E28.7Very low31.7Very low154 Ų154142.9 Ų142.972%0.7277%0.774SS**  cis-153.6-175-22.3-126-156.4147.300110.3
236Y27.8Very low31.9Very low176 Ų176144 Ų14469%0.6977%0.769SS**  trans71.9100.5148.7-106-110.5000123.5
237L33.4Very low32.2Very low137 Ų137139 Ų13972%0.71777%0.766SS**  63.1160.4109.2-127.6138.6000122.9
238V28.4Very low32.3Very low123 Ų123143.3 Ų143.375%0.74578%0.777SS**  trans97.399.7163.3-1690000118.8
239N34.5Very low32.5Very low151 Ų151145.5 Ų145.581%0.80778%0.775SS**  trans-82.7166.2144.7-81.1-57000108.7
240P47.8Very low33.7Very low106 Ų106141 Ų14169%0.68877%0.766SS**  cis-156.9-165.735.147.6-26.2000117.5
241V31.6Very low34.1Very low141 Ų141139.9 Ų139.986%0.85576%0.764SS**  trans58.4139.9157.4178.50000118.1
242G31.3Very low34.4Very low65 Ų65138.7 Ų138.767%0.6777%0.767SS**  cis126.4125.9-0.300000113.1
243M32.2Very low34.6Very low195 Ų195137.9 Ų137.996%0.96177%0.767SS**  trans-155.9168.6167.5-115.3170.973.100112.7
244N33.3Very low34.7Very low149 Ų149138.5 Ų138.580%0.79777%0.771SS**  trans-148.1-172.3-148.9-159.3-1.7000113.3
245R35.9Very low34.7Very low185 Ų185139.1 Ų139.170%0.69877%0.771SS**  trans91.9142.2168.9-47.7176.8-158-172.64.6115.5
246Y35.1Very low35Very low200 Ų200136.7 Ų136.778%0.78476%0.763SS**  cis-139168.2-0.8-56.7-94.2000109.2
247G33.8Very low35.3Very low72 Ų72136.6 Ų136.674%0.74277%0.769SS**  cis129.371.6-10.500000116.6
248M32.7Very low35.3Very low192 Ų192142.2 Ų142.295%0.94678%0.78SS**  trans-157.4145168.2-158.269.5159.800112.4
249D36.7Very low35.2Very low142 Ų142139.4 Ų139.476%0.75978%0.777SS**  trans-156.5158.6178.9-161.915.7000106.8
250P55.8Low34.9Very low106 Ų106138.4 Ų138.469%0.68878%0.781SS**  -157.4176.178.142.2-21.3000118.6
251S38.8Very low34.4Very low110 Ų110141.1 Ų141.177%0.76979%0.789SS**  trans79.3132.9152.2780000118
252A34.6Very low35.9Very low100 Ų100139.8 Ų139.883%0.82678%0.784SS**  cis-158.6-174.7-8.100000108.8
253S33.3Very low36.4Very low111 Ų111142.7 Ų142.778%0.77679%0.791SS**  cis-157.1-168.412.372.80000113.4
254T33.3Very low36.5Very low120 Ų120138.8 Ų138.874%0.73678%0.782SS**  trans-74.1170.1177.248.20000115
255F30.7Very low36.3Very low186 Ų186137.3 Ų137.382%0.81678%0.783SS**  cis-150.4-157.218.3-158.1-115000113.7
256N34.8Very low36.1Very low104 Ų104133.3 Ų133.356%0.55678%0.784SS**  trans-105.6156.7-149.4-75-80.2000119.8
257H32.7Very low35.9Very low174 Ų174130.7 Ų130.781%0.80678%0.783SS**  trans-4.8145.2155.4-54.9-75.1000123.7
258R33.3Very low35.6Very low254 Ų254134.9 Ų134.996%0.95878%0.778SS**  122.2117.3118.6-159.4-177.9-143.7-133.76.3117.8
259G27.7Very low35.5Very low65 Ų65131.2 Ų131.267%0.6777%0.77SS**  trans129.3139.6139.100000119.8
260S27.7Very low34.9Very low129 Ų129131.1 Ų131.190%0.90276%0.762SS**  trans71.7147149.8-58.90000122.7
261L36.5Very low33.7Very low164 Ų164135.3 Ų135.386%0.85976%0.764SS**  trans-100.7179.7163.3-59.9161.1000108.8
262P64.3Low33.3Very low113 Ų113136.6 Ų136.673%0.73476%0.758SS**  cis-112.4-161.5-49.834.8-18.1000109.5
263P41Very low33.2Very low126 Ų126138.7 Ų138.782%0.81876%0.756SS**  -151.2175.3100.139.7-22.8000115.7
264S33.7Very low33.2Very low112 Ų112139.6 Ų139.678%0.78376%0.762SS**  trans-90.7144.3171.9-51.20000112.5
265S30.6Very low33.4Very low118 Ų118137.1 Ų137.183%0.82576%0.76SS**  165.4142.9117.451.80000115.5
266S30.7Very low33.4Very low102 Ų102135.6 Ų135.671%0.71376%0.761SS**  trans29129.1142.5-156.20000121.9
267L31.6Very low33.5Very low145 Ų145135.6 Ų135.676%0.75977%0.769SS**  178.1146.9100.2-92.5172.7000113.9
268Y27.6Very low33.4Very low160 Ų160135.4 Ų135.463%0.62777%0.768SS**  trans63.7153.3165.7-87.8-120.2000117.3K270Y268-K270 HydrophobicContact CD1-CB 4.05Å; Y268-K270 HydrophobicContact CD1-CD 4.09Å; Y268-K270 HydrophobicContact CE1-CB 4.08Å; Y268-K270 HydrophobicContact CE1-CD 3.26Å; Y268-K270 HydrophobicContact CE1-CG 4.3Å; Y268-K270 PolarHBondContact OH-NZ 2.8Å
269C29.6Very low33.6Very low115 Ų115131 Ų13178%0.77776%0.763SS**  cis-113.2164.54.7-74.70000110.7
270K25.6Very low33.7Very low140 Ų140131.9 Ų131.961%0.60977%0.771SS**  cis73.697.414.5-154.1-177.7-166178.40116Y268Y268-K270 HydrophobicContact CD1-CB 4.05Å; Y268-K270 HydrophobicContact CD1-CD 4.09Å; Y268-K270 HydrophobicContact CE1-CB 4.08Å; Y268-K270 HydrophobicContact CE1-CD 3.26Å; Y268-K270 HydrophobicContact CE1-CG 4.3Å; Y268-K270 PolarHBondContact OH-NZ 2.8Å
271R28.6Very low33.7Very low193 Ų193129.7 Ų129.773%0.72877%0.769SS**  -170.5136.188.4167.7178.3-75.5-106.715.2112.3
272Q32.2Very low33.4Very low137 Ų137125.3 Ų125.364%0.6476%0.764SS**  trans33.7129.3149.5-62.1149.7200119.7
273N32.2Very low32.8Very low145 Ų145126 Ų12678%0.77577%0.769SS**  cis72.210548.3-173.493000114.8
274S33.7Very low32.5Very low129 Ų129124.9 Ų124.990%0.90277%0.77SS**  trans-136.1129145-69.30000107.8
275G36.4Very low32.5Very low69 Ų69124.1 Ų124.171%0.71177%0.77SS**  trans-130.1158.6162.800000107.7
276D30.3Very low32.6Very low154 Ų154124.9 Ų124.982%0.82477%0.77SS**  trans-140.8160.5167.6-152-17000109.3
277S36.9Very low32.7Very low104 Ų104125.1 Ų125.173%0.72778%0.778SS**  trans-151.9118.4-163.3-62.30000111.7
278H31.3Very low32.6Very low170 Ų170122.4 Ų122.479%0.78779%0.785SS**  trans-143.1106.1170.9-109.2-84.1000114.9
279L36.7Very low32.9Very low161 Ų161118.2 Ų118.284%0.84379%0.791SS**  trans32.3127.9137.8-50.8-179.7000121.4
280G30.4Very low34.1Very low83 Ų83118.2 Ų118.286%0.85679%0.79SS**  127.5134.7117.300000118.8
281G28.2Very low34.6Very low83 Ų83121.9 Ų121.986%0.85680%0.8SS**  trans108.5100.8150.700000118.5
282G29.1Very low34.8Very low73 Ų73118.5 Ų118.575%0.75380%0.8SS**  trans-99.8-166.1135.700000109.4
283P52.9Low35.1Very low128 Ų128117.1 Ų117.183%0.83181%0.806SS**  cis-143.5-154.31543.5-23.1000114.4
284A34.8Very low36.3Very low101 Ų101115.4 Ų115.484%0.83580%0.803SS**  trans87.2157.7156.800000119.1
285A32.6Very low36.4Very low97 Ų97117.4 Ų117.480%0.80280%0.8SS**  trans-151.7148.7-166.800000113.1
286T33.3Very low36.3Very low134 Ų134118.6 Ų118.682%0.82280%0.797SS**  trans-147.3116.6160.943.20000106.5
287A32.5Very low36.6Very low106 Ų106116.5 Ų116.588%0.87680%0.795SS**  76123.970.100000112.9
288G30.2Very low36.4Very low88 Ų88115.4 Ų115.491%0.90780%0.8SS**  trans126.6101.2173.700000115.3
289G33.8Very low36.5Very low73 Ų73111.2 Ų111.275%0.75380%0.802SS**  trans-142.8-161.4149.800000107.2
290P55.2Low37.5Very low115 Ų115109.3 Ų109.375%0.74780%0.8SS**  cis-113.5-175.2-32.839.2-27.5000110
291R35Very low37.7Very low217 Ų217111.4 Ų111.482%0.81980%0.801SS**  trans169.1130.7133.1-94.8160.4-165.6-77.6-0.5116.5
292T33.5Very low38.2Very low121 Ų121111.8 Ų111.874%0.74280%0.796SS**  trans47.5117.3134.663.20000122.8
293S38.8Very low39.2Very low108 Ų108114.5 Ų114.576%0.75580%0.801SS**  trans-69179.7137.258.80000110.6
294P56.1Low38.1Very low110 Ų110111.5 Ų111.571%0.71479%0.793SS**  cis-148.7-153.923.939.8-14.2000116.2
295M36.6Very low38.1Very low171 Ų171115.3 Ų115.384%0.84280%0.798SS**  trans83153.3169.2-42.1-161.78000115.6
296S34.8Very low38.3Very low93 Ų93122 Ų12265%0.6580%0.803SS**  cis-147.6165.712.9-167.50000114.2
297S35.9Very low39Very low111 Ų111121.3 Ų121.378%0.77680%0.801SS**  trans25.4141.5148.355.50000122.1
298G32.6Very low38.9Very low81 Ų81120.9 Ų120.984%0.83580%0.797SS**  cis133.4152.91.700000113.2
299G32.8Very low38.8Very low81 Ų81121.2 Ų121.284%0.83579%0.791SS**  trans122.6149170.400000115.7
300P57.4Low38.8Very low122 Ų122123.2 Ų123.279%0.79279%0.794SS**  trans-125.3169.3-168.742.7-30.1000115.9
301S36Very low38Very low127 Ų127123.4 Ų123.489%0.88880%0.798SS**  trans-171.2158.9140-85.30000113.8
302A39Very low38.5Very low90 Ų90119.1 Ų119.174%0.74480%0.798SS**  trans-139.7-171.9169.600000106.5
303P48.3Very low38.7Very low131 Ų131122.8 Ų122.885%0.85180%0.804SS**  cis-141-170.55.144.3-25.2000115.9
304G29.8Very low38.7Very low65 Ų65128.5 Ų128.567%0.6781%0.809SS**  trans103.6150.4164.100000115
305L36.8Very low37.6Very low180 Ų180130.4 Ų130.494%0.94281%0.813SS**  cis-142.4172.3-5-75.5173.1000110.3
306R36.7Very low37.3Very low238 Ų238126.6 Ų126.690%0.89881%0.809SS**  trans-97.7-175.4170-60.9-179160.9-166.3-3.7109.8
307P47.8Very low37.2Very low120 Ų120128.6 Ų128.678%0.77982%0.817SS**  cis-140.6-172.6-0.540.7-20.3000117.1
308A30.7Very low36.9Very low96 Ų96128.3 Ų128.379%0.79382%0.815SS**  trans108.8123.5136.400000121.6
309A28.2Very low37.3Very low96 Ų96131.6 Ų131.679%0.79381%0.813SS**  trans22.6133145.200000120.4
310S33.3Very low37.3Very low114 Ų114136.2 Ų136.280%0.79781%0.813SS**  -177.5166.169.546.10000112.7
311S37.7Very low36.2Very low120 Ų120134.1 Ų134.184%0.83981%0.813SS**  trans-113.6151.2171.4-48.70000110.8
312P46.8Very low36.4Very low126 Ų126134.9 Ų134.982%0.81881%0.807SS**  trans-129.2139.9144.834-22.6000113.7
313K36.8Very low36.4Very low199 Ų199141.9 Ų141.987%0.86581%0.814SS**  trans-79.1147.2161.2-82.2173.8167.3175.60109.8
314R39.5Very low35.7Very low227 Ų227141.1 Ų141.186%0.85781%0.811SS**  175.1119.6116.954.8-160.5-68.5-165.9-4.1116
315N32.1Very low36.2Very low150 Ų150142.5 Ų142.580%0.80282%0.816SS**  trans50127.3132-53.110.9000123.2
316A29.9Very low36.1Very low92 Ų92139.7 Ų139.776%0.7681%0.811SS**  trans68.1149.9139.800000117.7
317T33.2Very low36Very low135 Ų135133.2 Ų133.283%0.82880%0.803SS**  cis-162.3171.53.8-5.20000107.5
318S30.6Very low35.7Very low104 Ų104134 Ų13473%0.72781%0.808SS**  cis-161.4-158.81.1-162.40000109.4
319L39.2Very low36.1Very low150 Ų150133.9 Ų133.979%0.78580%0.801SS**  trans70.985.7157.4-66.2170.8000119.7
320E33.2Very low37Very low178 Ų178136.7 Ų136.783%0.83280%0.798SS**  44124.6112-164.9164177.600121.4
321G34.6Very low37.2Very low78 Ų78139 Ų13980%0.80480%0.802SS**  trans-167.179.9172.200000113.5
322N40.2Very low37.2Very low144 Ų144137.3 Ų137.377%0.7780%0.795SS**  trans-75.4127.6179.8-88.4-27.5000113.3
323R39.5Very low37.2Very low236 Ų236139.8 Ų139.889%0.89180%0.795SS**  trans-170.4126.5137.7-104.3156.5-152.1-100.43.1114.7
324C33.3Very low37.7Very low116 Ų116135.5 Ų135.578%0.78478%0.782SS**  trans53.9114.5144.8-60.20000122
325A40.5Very low38.2Very low94 Ų94128.1 Ų128.178%0.77777%0.769SS**  61.690.9128.300000120.2
326S34.5Very low39.5Very low120 Ų120129 Ų12984%0.83976%0.761SS**  -166.4104.1123.3-83.90000110.6P328S326-P328 WeakPolarHBondContact O-CD 3.31Å
327S33.6Very low41.4Very low103 Ų103134.2 Ų134.272%0.7276%0.761SS**  trans-77.1117.3170.6-590000109.5S329S327-S329 PolarHBondContact O-N 3.24Å; S327-S329 PolarHBondContact O-OG 3.12Å
328P41.6Very low43.5Very low137 Ų137129.1 Ų129.189%0.8973%0.731SS**  trans-64.2104.4175.127-33.4000108.7S326S326-P328 WeakPolarHBondContact O-CD 3.31Å
329S40.1Very low45.2Very low92 Ų92135 Ų13564%0.64374%0.737SS**  trans-106.3123.2-164.5-65.90000110.7S327S327-S329 PolarHBondContact O-N 3.24Å; S327-S329 PolarHBondContact O-OG 3.12Å
330Q46.3Very low46.9Very low156 Ų156129.5 Ų129.573%0.72971%0.711SS**  trans65.780.5169.8-51.7-177.14300116.1
331D37.3Very low49.2Very low163 Ų163128 Ų12887%0.87270%0.698SS**  trans-127.566.3142.6-143.1-16.9000111.1
332A39.1Very low51.8Low84 Ų84127.7 Ų127.769%0.69468%0.678SS**  trans-131.556.9179.300000109.5D334A332-D334 PolarHBondContact O-N 3Å
333Q46.5Very low54.3Low178 Ų178120.9 Ų120.983%0.83264%0.641SS**  trans-89.876.8174.6-69.1-154.312.800112.4
334D46.3Very low56.9Low109 Ų109112.1 Ų112.158%0.58362%0.616SS**SBendtrans-136156.5147.5-156.2-11.8000109.4A332 R336 K356A332-D334 PolarHBondContact O-N 3Å; D334-R336 PolarHBondContact O-N 3.47Å; D334-K356 IonicContact OD1-NZ 3.79Å; D334-K356 PolarHBondContact OD1-NZ 2.77Å; D334-K356 IonicContact OD2-NZ 3.37Å; D334-K356 PolarHBondContact OD2-NZ 3.49Å
335A49.7Very low59.7Low72 Ų72109.4 Ų109.460%0.59560%0.602SS**  trans61.520.3170.900000119.6R337A335-R337 PolarHBondContact O-N 3.14Å
336R60.7Low62.4Low168 Ų168106 Ų10663%0.63457%0.569SS**PPolyproline II helixtrans-70.4123.6160.2-73.6-170.1-179.3170.84.8109.9D334 W353D334-R336 PolarHBondContact O-N 3.47Å; R336-W353 VanDerWaalsContact O-CD1 3.3Å
337R70.1Confident65.3Low201 Ų201104 Ų10476%0.75855%0.552SS**PPolyproline II helixtrans-64.6151.9175.6-71.3-177.5175.8160.42.9111.4A335 R339 W353A335-R337 PolarHBondContact O-N 3.14Å; R337-R339 PolarHBondContact O-N 3.41Å; R337-W353 HydrophobicContact CB-CZ2 4.49Å; R337-W353 HydrophobicContact CG-CH2 3.94Å; R337-W353 HydrophobicContact CG-CZ2 3.63Å
338P75.8Confident68.4Low28 Ų28100.5 Ų100.518%0.18253%0.526CS..PPolyproline II helixtrans-52.8132.7176.6-31.635.9000114D350 W353P338-D350 WeakPolarHBondContact CA-OD1 3.42Å; P338-D350 HydrophobicContact CB-CB 3.95Å; P338-D350 WeakPolarHBondContact CB-OD1 3.47Å; P338-D350 HydrophobicContact CG-CB 4.01Å; P338-W353 HydrophobicContact CG-CD2 4.33Å; P338-W353 HydrophobicContact CG-CE3 3.8Å
339R67.1Low71Confident228 Ų22898.2 Ų98.286%0.8650%0.504SS*.SBendtrans-73.9-39-176.7-60.9-168.9-169-1579.8112.1R337R337-R339 PolarHBondContact O-N 3.41Å
340S74.9Confident73.7Confident35 Ų3595 Ų9525%0.24548%0.479CS..  trans-82.4134.4173.2176.30000110.2N342 W346S340-N342 PolarHBondContact OG-N 2.86Å; S340-N342 PolarHBondContact OG-O 3.04Å; S340-W346 PolarHBondContact O-NE1 2.87Å
341R81.9Confident76.2Confident147 Ų14787.5 Ų87.556%0.55544%0.444SS*.SBendtrans-79-22167.4-171.7169.5171.3-103.9-26.7112.3K413 F414R341-K413 PolarHBondContact NH2-O 3.33Å; R341-F414 HydrophobicContact CG-CD1 4.22Å; R341-F414 PolarHBondContact NH1-OXT 2.59Å; R341-F414 WeakPolarHBondContact O-CD1 3.18Å; R341-F414 WeakPolarHBondContact O-CE1 3.3Å
342N89.8Confident79Confident71 Ų7180.1 Ų80.138%0.3841%0.405SS..SBendtrans-88.7121.1176.7173.517.7000110.8S340 S344 A345S340-N342 PolarHBondContact OG-N 2.86Å; S340-N342 PolarHBondContact OG-O 3.04Å; N342-S344 VanDerWaalsContact C-N 3.31Å; N342-S344 PolarHBondContact ND2-OG 2.89Å; N342-S344 PolarHBondContact O-N 2.91Å; N342-S344 PolarHBondContact OD1-N 3.41Å; N342-S344 VanDerWaalsContact OD1-N 3.11Å; N342-S344 PolarHBondContact OD1-OG 3.25Å; N342-A345 PolarHBondContact O-N 2.81Å
343P92.4Very high81.7Confident1 Ų178.6 Ų78.61%0.00638%0.381CS..G310 helixtrans-63.4-24.7179.5-23.434.3000115.7A345 W346 G377 L381 L409 F414P343-A345 PolarHBondContact O-N 2.76Å; P343-W346 HydrophobicContact CB-CD2 4Å; P343-W346 HydrophobicContact CB-CE3 4.03Å; P343-W346 HydrophobicContact CB-CZ3 4.31Å; P343-W346 HydrophobicContact CG-CH2 4.3Å; P343-W346 HydrophobicContact CG-CZ2 4.17Å; P343-W346 WeakPolarHBondContact O-CB 3.42Å; P343-W346 PolarHBondContact O-N 2.95Å; P343-W346 VanDerWaalsContact O-N 3.11Å; P343-G377 CarbonylContact O-C 3.54Å; P343-G377 WeakPolarHBondContact O-CA 3.5Å; P343-L381 HydrophobicContact CB-CD1 4.26Å; P343-L381 HydrophobicContact CB-CD2 4.43Å; P343-L381 HydrophobicContact CB-CG 4.49Å; P343-L409 HydrophobicContact CB-CD2 3.93Å; P343-L409 HydrophobicContact CB-CG 4.47Å; P343-L409 HydrophobicContact CG-CD1 3.96Å; P343-L409 HydrophobicContact CG-CD2 3.74Å; P343-L409 HydrophobicContact CG-CG 3.75Å; P343-F414 HydrophobicContact CG-CD2 4.1Å; P343-F414 HydrophobicContact CG-CE1 4.04Å; P343-F414 HydrophobicContact CG-CE2 3.47Å; P343-F414 VanDerWaalsContact CG-CE2 3.47Å; P343-F414 HydrophobicContact CG-CZ 3.44Å; P343-F414 VanDerWaalsContact CG-CZ 3.44Å
344S92.9Very high84.1Confident51 Ų5171.2 Ų71.236%0.35735%0.347SS..G310 helixtrans-69.2-4.2177.880.90000113.7N342 N378N342-S344 VanDerWaalsContact C-N 3.31Å; N342-S344 PolarHBondContact ND2-OG 2.89Å; N342-S344 PolarHBondContact O-N 2.91Å; N342-S344 PolarHBondContact OD1-N 3.41Å; N342-S344 VanDerWaalsContact OD1-N 3.11Å; N342-S344 PolarHBondContact OD1-OG 3.25Å; S344-N378 WeakPolarHBondContact CB-OD1 3.31Å; S344-N378 PolarHBondContact O-ND2 2.89Å; S344-N378 PolarHBondContact O-OD1 3.46Å
345A93.5Very high86.5Confident60 Ų6066 Ų6650%0.49632%0.319SS..G310 helixtrans-122.628.4175.200000111.7N342 P343N342-A345 PolarHBondContact O-N 2.81Å; P343-A345 PolarHBondContact O-N 2.76Å
346W95.9Very high88.6Confident22 Ų2266.4 Ų66.48%0.08331%0.307CS..  trans-90131.9171.9-76.4-0.8000111.3S340 P343 D350 V351 F354 G377 L380 L409S340-W346 PolarHBondContact O-NE1 2.87Å; P343-W346 HydrophobicContact CB-CD2 4Å; P343-W346 HydrophobicContact CB-CE3 4.03Å; P343-W346 HydrophobicContact CB-CZ3 4.31Å; P343-W346 HydrophobicContact CG-CH2 4.3Å; P343-W346 HydrophobicContact CG-CZ2 4.17Å; P343-W346 WeakPolarHBondContact O-CB 3.42Å; P343-W346 PolarHBondContact O-N 2.95Å; P343-W346 VanDerWaalsContact O-N 3.11Å; W346-D350 HydrophobicContact CB-CB 3.67Å; W346-D350 HydrophobicContact CD2-CB 4.3Å; W346-D350 HydrophobicContact CG-CB 3.75Å; W346-V351 HydrophobicContact CB-CG2 4.2Å; W346-V351 HydrophobicContact CE3-CG2 4.26Å; W346-F354 HydrophobicContact CE3-CB 4.36Å; W346-F354 HydrophobicContact CH2-CB 3.97Å; W346-F354 AromaticContact CH2-CD2 3.73Å; W346-F354 HydrophobicContact CH2-CD2 3.73Å; W346-F354 HydrophobicContact CH2-CE2 4.39Å; W346-F354 AromaticContact CH2-CG 3.85Å; W346-F354 HydrophobicContact CH2-CG 3.85Å; W346-F354 HydrophobicContact CZ3-CB 3.6Å; W346-F354 AromaticContact CZ3-CD1 3.92Å; W346-F354 HydrophobicContact CZ3-CD1 3.92Å; W346-F354 AromaticContact CZ3-CD2 3.85Å; W346-F354 HydrophobicContact CZ3-CD2 3.85Å; W346-F354 AromaticContact CZ3-CG 3.5Å; W346-F354 HydrophobicContact CZ3-CG 3.5Å; W346-F354 VanDerWaalsContact CZ3-CG 3.5Å; W346-G377 PolarHBondContact O-N 2.71Å; W346-L380 HydrophobicContact CE3-CD2 4.15Å; W346-L380 HydrophobicContact CZ3-CD2 4.11Å; W346-L409 HydrophobicContact CE3-CD2 4.42Å; W346-L409 HydrophobicContact CH2-CD1 3.53Å; W346-L409 HydrophobicContact CH2-CD2 3.84Å; W346-L409 HydrophobicContact CH2-CG 4.33Å; W346-L409 HydrophobicContact CZ2-CD1 4.29Å; W346-L409 HydrophobicContact CZ3-CD1 4.15Å; W346-L409 HydrophobicContact CZ3-CD2 3.56Å
347T96.9Very high90.2Very high78 Ų7860.9 Ų60.948%0.47929%0.29SS..  trans-71.7169.4166.563.10000111.2E349 D350 V351T347-E349 PolarHBondContact O-N 2.94Å; T347-D350 WeakPolarHBondContact CB-OD2 3.46Å; T347-D350 PolarHBondContact N-OD2 3.25Å; T347-D350 WeakPolarHBondContact O-CB 3.47Å; T347-D350 PolarHBondContact O-N 3.14Å; T347-D350 VanDerWaalsContact O-N 3.12Å; T347-D350 VanDerWaalsContact OG1-CG 3.25Å; T347-D350 PolarHBondContact OG1-N 2.82Å; T347-D350 PolarHBondContact OG1-OD2 3.25Å; T347-V351 WeakPolarHBondContact O-CG2 3.49Å; T347-V351 PolarHBondContact O-N 3.17Å
348V97.7Very high91.4Very high29 Ų2952.1 Ų52.118%0.17626%0.261CS..Hα-helixtrans-56.3-40173-175.70000111.1V351 V352 F370 R371V348-V351 WeakPolarHBondContact O-CB 3.32Å; V348-V351 PolarHBondContact O-N 3.45Å; V348-V352 HydrophobicContact CG1-CG2 4.46Å; V348-V352 WeakPolarHBondContact O-CB 3.47Å; V348-V352 VanDerWaalsContact O-CG2 3.3Å; V348-V352 WeakPolarHBondContact O-CG2 3.44Å; V348-V352 PolarHBondContact O-N 3.38Å; V348-F370 WeakPolarHBondContact CG1-O 3.25Å; V348-R371 HydrophobicContact CG1-CG 4.31Å
349E96.9Very high92.3Very high89 Ų8952 Ų5242%0.41626%0.259SS..Hα-helixtrans-64-39.4174.4-90.734.8-112.200113.5T347 V351 V352 W353 R371T347-E349 PolarHBondContact O-N 2.94Å; E349-V351 VanDerWaalsContact C-N 3.33Å; E349-V352 PolarHBondContact O-N 3.16Å; E349-W353 WeakPolarHBondContact O-CB 3.35Å; E349-W353 PolarHBondContact O-N 2.99Å; E349-R371 IonicContact OE1-CZ 3.25Å; E349-R371 IonicContact OE1-NE 3.5Å; E349-R371 PolarHBondContact OE1-NE 2.91Å; E349-R371 IonicContact OE1-NH2 2.81Å; E349-R371 PolarHBondContact OE1-NH2 3.45Å; E349-R371 VanDerWaalsContact OE1-NH2 3.07Å
350D96.6Very high93.6Very high24 Ų2445.4 Ų45.413%0.12825%0.245CC..Hα-helixtrans-64.6-39.3173.7-63.5-63.4000110.9P338 W346 T347 F354P338-D350 WeakPolarHBondContact CA-OD1 3.42Å; P338-D350 HydrophobicContact CB-CB 3.95Å; P338-D350 WeakPolarHBondContact CB-OD1 3.47Å; P338-D350 HydrophobicContact CG-CB 4.01Å; W346-D350 HydrophobicContact CB-CB 3.67Å; W346-D350 HydrophobicContact CD2-CB 4.3Å; W346-D350 HydrophobicContact CG-CB 3.75Å; T347-D350 WeakPolarHBondContact CB-OD2 3.46Å; T347-D350 PolarHBondContact N-OD2 3.25Å; T347-D350 WeakPolarHBondContact O-CB 3.47Å; T347-D350 PolarHBondContact O-N 3.14Å; T347-D350 VanDerWaalsContact O-N 3.12Å; T347-D350 VanDerWaalsContact OG1-CG 3.25Å; T347-D350 PolarHBondContact OG1-N 2.82Å; T347-D350 PolarHBondContact OG1-OD2 3.25Å; D350-F354 WeakPolarHBondContact O-CB 3.34Å; D350-F354 PolarHBondContact O-N 3.06Å
351V97.3Very high94.4Very high0 Ų052 Ų520%027%0.272CS..Hα-helixtrans-66.4-47174.9169.90000111.4W346 T347 V348 E349 W353 F354 V355 F370 I375 L380W346-V351 HydrophobicContact CB-CG2 4.2Å; W346-V351 HydrophobicContact CE3-CG2 4.26Å; T347-V351 WeakPolarHBondContact O-CG2 3.49Å; T347-V351 PolarHBondContact O-N 3.17Å; V348-V351 WeakPolarHBondContact O-CB 3.32Å; V348-V351 PolarHBondContact O-N 3.45Å; E349-V351 VanDerWaalsContact C-N 3.33Å; V351-W353 VanDerWaalsContact C-N 3.3Å; V351-W353 PolarHBondContact O-N 2.81Å; V351-F354 WeakPolarHBondContact O-CB 3.46Å; V351-F354 PolarHBondContact O-N 3.37Å; V351-F354 VanDerWaalsContact O-N 3.14Å; V351-V355 HydrophobicContact CG1-CG2 4.32Å; V351-V355 VanDerWaalsContact O-CG2 3.32Å; V351-V355 WeakPolarHBondContact O-CG2 3.19Å; V351-V355 PolarHBondContact O-N 2.98Å; V351-F370 HydrophobicContact CG1-CD1 3.77Å; V351-F370 HydrophobicContact CG1-CE1 4.5Å; V351-F370 HydrophobicContact CG1-CG 4.48Å; V351-I375 WeakPolarHBondContact CB-O 3.47Å; V351-I375 HydrophobicContact CG1-CG2 4.46Å; V351-I375 WeakPolarHBondContact CG1-O 3.44Å; V351-I375 WeakPolarHBondContact CG2-O 3.32Å; V351-L380 HydrophobicContact CG1-CB 4.35Å; V351-L380 HydrophobicContact CG1-CD1 4.01Å; V351-L380 HydrophobicContact CG1-CD2 4.06Å; V351-L380 HydrophobicContact CG1-CG 4.36Å; V351-L380 HydrophobicContact CG2-CB 4.19Å; V351-L380 HydrophobicContact CG2-CD2 3.95Å
352V97.4Very high95Very high8 Ų846 Ų465%0.04825%0.254CS..Hα-helixtrans-56.7-45174.9160.40000110.7V348 E349 V355 K356 V367 F370 R371V348-V352 HydrophobicContact CG1-CG2 4.46Å; V348-V352 WeakPolarHBondContact O-CB 3.47Å; V348-V352 VanDerWaalsContact O-CG2 3.3Å; V348-V352 WeakPolarHBondContact O-CG2 3.44Å; V348-V352 PolarHBondContact O-N 3.38Å; E349-V352 PolarHBondContact O-N 3.16Å; V352-V355 PolarHBondContact O-N 2.92Å; V352-K356 VanDerWaalsContact O-CB 3.31Å; V352-K356 WeakPolarHBondContact O-CB 3.47Å; V352-K356 PolarHBondContact O-N 3.17Å; V352-V367 HydrophobicContact CG1-CB 4.11Å; V352-V367 HydrophobicContact CG1-CG2 4.33Å; V352-F370 HydrophobicContact CG2-CB 4.02Å; V352-R371 HydrophobicContact CG2-CG 3.74Å
353W95.4Very high95.3Very high52 Ų5242.6 Ų42.620%0.19724%0.236CC..Hα-helixtrans-61.7-46.2175.1-17297.3000111.6R336 R337 P338 E349 V351 V355 K356 D357R336-W353 VanDerWaalsContact O-CD1 3.3Å; R337-W353 HydrophobicContact CB-CZ2 4.49Å; R337-W353 HydrophobicContact CG-CH2 3.94Å; R337-W353 HydrophobicContact CG-CZ2 3.63Å; P338-W353 HydrophobicContact CG-CD2 4.33Å; P338-W353 HydrophobicContact CG-CE3 3.8Å; E349-W353 WeakPolarHBondContact O-CB 3.35Å; E349-W353 PolarHBondContact O-N 2.99Å; V351-W353 VanDerWaalsContact C-N 3.3Å; V351-W353 PolarHBondContact O-N 2.81Å; W353-V355 PolarHBondContact O-N 2.84Å; W353-K356 PolarHBondContact O-N 3.09Å; W353-D357 HydrophobicContact CE3-CB 4.06Å; W353-D357 HydrophobicContact CH2-CB 3.54Å; W353-D357 VanDerWaalsContact CH2-CG 3.48Å; W353-D357 WeakPolarHBondContact CH2-OD1 3.45Å; W353-D357 HydrophobicContact CZ2-CB 4.05Å; W353-D357 HydrophobicContact CZ3-CB 3.57Å; W353-D357 PolarHBondContact O-N 3.46Å
354F96.1Very high95.5Very high23 Ų2343.4 Ų43.410%0.10125%0.245CC..Hα-helixtrans-59.3-44.5177.5164.7-103.5000112.3W346 D350 V351 K356 D357 A358 L380 H405 L409W346-F354 HydrophobicContact CE3-CB 4.36Å; W346-F354 HydrophobicContact CH2-CB 3.97Å; W346-F354 AromaticContact CH2-CD2 3.73Å; W346-F354 HydrophobicContact CH2-CD2 3.73Å; W346-F354 HydrophobicContact CH2-CE2 4.39Å; W346-F354 AromaticContact CH2-CG 3.85Å; W346-F354 HydrophobicContact CH2-CG 3.85Å; W346-F354 HydrophobicContact CZ3-CB 3.6Å; W346-F354 AromaticContact CZ3-CD1 3.92Å; W346-F354 HydrophobicContact CZ3-CD1 3.92Å; W346-F354 AromaticContact CZ3-CD2 3.85Å; W346-F354 HydrophobicContact CZ3-CD2 3.85Å; W346-F354 AromaticContact CZ3-CG 3.5Å; W346-F354 HydrophobicContact CZ3-CG 3.5Å; W346-F354 VanDerWaalsContact CZ3-CG 3.5Å; D350-F354 WeakPolarHBondContact O-CB 3.34Å; D350-F354 PolarHBondContact O-N 3.06Å; V351-F354 WeakPolarHBondContact O-CB 3.46Å; V351-F354 PolarHBondContact O-N 3.37Å; V351-F354 VanDerWaalsContact O-N 3.14Å; F354-K356 VanDerWaalsContact C-N 3.35Å; F354-D357 PolarHBondContact O-N 3.38Å; F354-A358 WeakPolarHBondContact O-CB 3.44Å; F354-A358 PolarHBondContact O-N 2.78Å; F354-L380 HydrophobicContact CD1-CD2 3.82Å; F354-L380 HydrophobicContact CE1-CD2 3.96Å; F354-H405 HydrophobicContact CZ-CB 4.07Å; F354-L409 HydrophobicContact CD2-CD1 4.4Å; F354-L409 HydrophobicContact CE1-CD2 4.19Å; F354-L409 HydrophobicContact CE2-CB 4.42Å; F354-L409 HydrophobicContact CE2-CD1 3.89Å; F354-L409 HydrophobicContact CE2-CD2 4.27Å; F354-L409 HydrophobicContact CE2-CG 4.43Å; F354-L409 HydrophobicContact CZ-CB 4.1Å; F354-L409 HydrophobicContact CZ-CD1 4.31Å; F354-L409 HydrophobicContact CZ-CD2 3.96Å; F354-L409 HydrophobicContact CZ-CG 4.36Å
355V96.6Very high95.7Very high0 Ų045.8 Ų45.80%026%0.259CS..Hα-helixtrans-66.5-37.4178.4176.60000111.1V351 V352 W353 L363 V367 F370 L402V351-V355 HydrophobicContact CG1-CG2 4.32Å; V351-V355 VanDerWaalsContact O-CG2 3.32Å; V351-V355 WeakPolarHBondContact O-CG2 3.19Å; V351-V355 PolarHBondContact O-N 2.98Å; V352-V355 PolarHBondContact O-N 2.92Å; W353-V355 PolarHBondContact O-N 2.84Å; V355-L363 HydrophobicContact CG1-CB 3.71Å; V355-L363 HydrophobicContact CG1-CD1 4.39Å; V355-V367 HydrophobicContact CB-CG1 4.23Å; V355-V367 HydrophobicContact CG1-CG1 3.9Å; V355-F370 HydrophobicContact CG1-CD2 4.38Å; V355-F370 HydrophobicContact CG1-CE2 3.85Å; V355-F370 HydrophobicContact CG1-CZ 4.03Å; V355-F370 HydrophobicContact CG2-CD1 4.07Å; V355-F370 HydrophobicContact CG2-CE1 3.74Å; V355-F370 HydrophobicContact CG2-CE2 4.27Å; V355-F370 HydrophobicContact CG2-CG 4.49Å; V355-F370 HydrophobicContact CG2-CZ 3.84Å; V355-L402 HydrophobicContact CG1-CD1 4.46Å; V355-L402 HydrophobicContact CG2-CD1 4.03Å
356K95.1Very high95.8Very high79 Ų7945.5 Ų45.534%0.34325%0.247SC..Hα-helixtrans-65.9-42.3174.6-163.5178.6177.6-178.40112.3D334 V352 W353 F354 P360 V367D334-K356 IonicContact OD1-NZ 3.79Å; D334-K356 PolarHBondContact OD1-NZ 2.77Å; D334-K356 IonicContact OD2-NZ 3.37Å; D334-K356 PolarHBondContact OD2-NZ 3.49Å; V352-K356 VanDerWaalsContact O-CB 3.31Å; V352-K356 WeakPolarHBondContact O-CB 3.47Å; V352-K356 PolarHBondContact O-N 3.17Å; W353-K356 PolarHBondContact O-N 3.09Å; F354-K356 VanDerWaalsContact C-N 3.35Å; K356-P360 WeakPolarHBondContact O-CA 3.48Å; K356-P360 WeakPolarHBondContact O-CD 3.38Å; K356-P360 VanDerWaalsContact O-CG 3.26Å; K356-P360 WeakPolarHBondContact O-CG 3.17Å; K356-V367 HydrophobicContact CB-CG1 4.18Å
357D94.5Very high95.9Very high52 Ų5245.4 Ų45.428%0.27825%0.249SC..Hα-helixtrans-74.4-31.8177176.988000113.6R187 W353 F354R187-D357 IonicContact CZ-OD2 2.71Å; R187-D357 VanDerWaalsContact CZ-OD2 3.24Å; R187-D357 PolarHBondContact NH1-O 2.96Å; R187-D357 IonicContact NH1-OD1 3.97Å; R187-D357 IonicContact NH1-OD2 2.66Å; R187-D357 PolarHBondContact NH1-OD2 2.78Å; R187-D357 IonicContact NH2-OD2 2.79Å; R187-D357 PolarHBondContact NH2-OD2 2.81Å; W353-D357 HydrophobicContact CE3-CB 4.06Å; W353-D357 HydrophobicContact CH2-CB 3.54Å; W353-D357 VanDerWaalsContact CH2-CG 3.48Å; W353-D357 WeakPolarHBondContact CH2-OD1 3.45Å; W353-D357 HydrophobicContact CZ2-CB 4.05Å; W353-D357 HydrophobicContact CZ3-CB 3.57Å; W353-D357 PolarHBondContact O-N 3.46Å; F354-D357 PolarHBondContact O-N 3.38Å
358A94.7Very high95.9Very high18 Ų1846.9 Ų46.915%0.14925%0.25CS..Hα-helixtrans-63.5-52-175.300000112.7F354 L363 H405F354-A358 WeakPolarHBondContact O-CB 3.44Å; F354-A358 PolarHBondContact O-N 2.78Å; A358-L363 HydrophobicContact CB-CD1 4.47Å; A358-H405 HydrophobicContact CB-CB 4.14Å; A358-H405 PolarHBondContact O-CE1 3.46Å; A358-H405 PolarHBondContact O-NE2 3.27Å
359D94.6Very high95.9Very high26 Ų2647.8 Ų47.814%0.13925%0.254CS..  trans-150.589.1173.3-170.9-35.7000109.8Q361 A362 L363 G364 K401D359-Q361 PolarHBondContact O-N 2.9Å; D359-Q361 VanDerWaalsContact O-N 3.15Å; D359-Q361 PolarHBondContact OD1-N 2.74Å; D359-A362 PolarHBondContact O-N 3.14Å; D359-A362 PolarHBondContact OD1-N 2.94Å; D359-L363 HydrophobicContact CB-CB 4.4Å; D359-L363 HydrophobicContact CB-CD1 4.03Å; D359-L363 HydrophobicContact CB-CG 4.05Å; D359-L363 WeakPolarHBondContact O-CA 3.31Å; D359-L363 WeakPolarHBondContact O-CB 3.49Å; D359-L363 PolarHBondContact O-N 3.19Å; D359-G364 PolarHBondContact O-N 2.94Å; D359-K401 IonicContact OD1-NZ 2.78Å; D359-K401 WeakPolarHBondContact OD2-CD 3.44Å; D359-K401 WeakPolarHBondContact OD2-CE 3.46Å; D359-K401 IonicContact OD2-NZ 3.07Å; D359-K401 PolarHBondContact OD2-NZ 3.21Å
360P94.1Very high95.9Very high88 Ų8843.5 Ų43.557%0.57123%0.234SC*.THydrogen-bonded Turntrans-57.7-30-178.3-21.727.7000113.7K356 G364K356-P360 WeakPolarHBondContact O-CA 3.48Å; K356-P360 WeakPolarHBondContact O-CD 3.38Å; K356-P360 VanDerWaalsContact O-CG 3.26Å; K356-P360 WeakPolarHBondContact O-CG 3.17Å; P360-G364 WeakPolarHBondContact O-CA 3.39Å; P360-G364 PolarHBondContact O-N 2.9Å
361Q93Very high96Very high173 Ų17347 Ų4781%0.80825%0.245SC*.THydrogen-bonded Turntrans-79.4-40.7-173.8-164.681.110.200112.1D359D359-Q361 PolarHBondContact O-N 2.9Å; D359-Q361 VanDerWaalsContact O-N 3.15Å; D359-Q361 PolarHBondContact OD1-N 2.74Å
362A93.6Very high95.9Very high21 Ų2154.9 Ų54.917%0.17428%0.279CS..THydrogen-bonded Turntrans-112.3-13.4-171.400000114.8D359 H366 K401D359-A362 PolarHBondContact O-N 3.14Å; D359-A362 PolarHBondContact OD1-N 2.94Å; A362-H366 PolarHBondContact O-CD2 3.33Å; A362-K401 HydrophobicContact CB-CD 3.67Å; A362-K401 VanDerWaalsContact CB-NZ 3.3Å
363L96.8Very high96Very high0 Ų058.5 Ų58.50%030%0.296CS..THydrogen-bonded Turntrans-117.4-26.7174.7-59.9177.1000112.5V355 A358 D359 H366 V367 L394 P398 L402V355-L363 HydrophobicContact CG1-CB 3.71Å; V355-L363 HydrophobicContact CG1-CD1 4.39Å; A358-L363 HydrophobicContact CB-CD1 4.47Å; D359-L363 HydrophobicContact CB-CB 4.4Å; D359-L363 HydrophobicContact CB-CD1 4.03Å; D359-L363 HydrophobicContact CB-CG 4.05Å; D359-L363 WeakPolarHBondContact O-CA 3.31Å; D359-L363 WeakPolarHBondContact O-CB 3.49Å; D359-L363 PolarHBondContact O-N 3.19Å; L363-H366 WeakPolarHBondContact O-CA 3.45Å; L363-H366 WeakPolarHBondContact O-CB 3.32Å; L363-H366 PolarHBondContact O-N 3.16Å; L363-V367 PolarHBondContact O-N 3.15Å; L363-L394 HydrophobicContact CD2-CD2 4.41Å; L363-P398 HydrophobicContact CD2-CB 4.27Å; L363-P398 WeakPolarHBondContact CD2-O 3.46Å; L363-L402 HydrophobicContact CD1-CB 4.42Å; L363-L402 HydrophobicContact CD1-CD1 4.26Å; L363-L402 HydrophobicContact CD2-CB 4.03Å
364G95.4Very high96.1Very high19 Ų1963.8 Ų63.820%0.19632%0.323CS..G310 helixtrans-48.5-47.317400000114.8D359 P360 H366 V367D359-G364 PolarHBondContact O-N 2.94Å; P360-G364 WeakPolarHBondContact O-CA 3.39Å; P360-G364 PolarHBondContact O-N 2.9Å; G364-H366 PolarHBondContact O-N 3.2Å; G364-V367 WeakPolarHBondContact O-CG2 3.1Å; G364-V367 PolarHBondContact O-N 3.05Å
365P97.1Very high96.2Very high100 Ų10063 Ų6365%0.64932%0.319SS*.G310 helixtrans-65.6-5176-23.535.2000115.6
366H96.5Very high96.2Very high55 Ų5565.4 Ų65.426%0.25533%0.332SS..G310 helixtrans-115.2-2-175.3-64.3-43.7000113.5A362 L363 G364 E368 L369 F370 L394A362-H366 PolarHBondContact O-CD2 3.33Å; L363-H366 WeakPolarHBondContact O-CA 3.45Å; L363-H366 WeakPolarHBondContact O-CB 3.32Å; L363-H366 PolarHBondContact O-N 3.16Å; G364-H366 PolarHBondContact O-N 3.2Å; H366-E368 VanDerWaalsContact C-N 3.25Å; H366-E368 PolarHBondContact O-N 3.45Å; H366-L369 HydrophobicContact CB-CD1 4.13Å; H366-L369 VanDerWaalsContact O-CB 3.32Å; H366-L369 WeakPolarHBondContact O-CB 3.49Å; H366-L369 PolarHBondContact O-N 3.16Å; H366-L369 VanDerWaalsContact O-N 3.1Å; H366-F370 WeakPolarHBondContact O-CD2 3.05Å; H366-L394 HydrophobicContact CB-CD1 4.29Å
367V96.7Very high96.3Very high19 Ų1961.6 Ų61.612%0.11532%0.316CS..Hα-helixtrans-61.9-30.3-173.9-60.40000113.8V352 V355 K356 L363 G364 L369 F370V352-V367 HydrophobicContact CG1-CB 4.11Å; V352-V367 HydrophobicContact CG1-CG2 4.33Å; V355-V367 HydrophobicContact CB-CG1 4.23Å; V355-V367 HydrophobicContact CG1-CG1 3.9Å; K356-V367 HydrophobicContact CB-CG1 4.18Å; L363-V367 PolarHBondContact O-N 3.15Å; G364-V367 WeakPolarHBondContact O-CG2 3.1Å; G364-V367 PolarHBondContact O-N 3.05Å; V367-L369 PolarHBondContact O-N 3.01Å; V367-F370 WeakPolarHBondContact O-CB 3.29Å; V367-F370 PolarHBondContact O-N 3.37Å
368E97.4Very high96.4Very high110 Ų11062.6 Ų62.651%0.51432%0.321SS..Hα-helixtrans-67.5-19.1-179.9-156.654.7-144.100112.9H366 F370 R371 K372H366-E368 VanDerWaalsContact C-N 3.25Å; H366-E368 PolarHBondContact O-N 3.45Å; E368-F370 VanDerWaalsContact C-N 3.32Å; E368-R371 PolarHBondContact O-N 3.05Å; E368-R371 VanDerWaalsContact OE1-CD 3.32Å; E368-R371 WeakPolarHBondContact OE1-CD 3.46Å; E368-R371 IonicContact OE2-CZ 3.24Å; E368-R371 IonicContact OE2-NH1 2.76Å; E368-R371 PolarHBondContact OE2-NH1 3.12Å; E368-K372 WeakPolarHBondContact O-CB 3.29Å; E368-K372 PolarHBondContact O-N 3.45Å
369L97.4Very high96.5Very high47 Ų4763.5 Ų63.525%0.24633%0.328CS..Hα-helixtrans-68.6-32.7170.2-61.3164000111.2H366 V367 R371 K372 H373 L392 L394H366-L369 HydrophobicContact CB-CD1 4.13Å; H366-L369 VanDerWaalsContact O-CB 3.32Å; H366-L369 WeakPolarHBondContact O-CB 3.49Å; H366-L369 PolarHBondContact O-N 3.16Å; H366-L369 VanDerWaalsContact O-N 3.1Å; V367-L369 PolarHBondContact O-N 3.01Å; L369-R371 VanDerWaalsContact C-N 3.33Å; L369-K372 PolarHBondContact O-N 3.42Å; L369-H373 WeakPolarHBondContact O-CB 3.34Å; L369-H373 PolarHBondContact O-CD2 3.07Å; L369-H373 PolarHBondContact O-N 3.48Å; L369-L392 WeakPolarHBondContact CD1-O 3.14Å; L369-L394 HydrophobicContact CD1-CD1 3.65Å
370F97.8Very high96.7Very high0 Ų062.2 Ų62.20%032%0.322CS..Hα-helixtrans-70.1-33.5177.9-65-105.3000111.1V348 V351 V352 V355 H366 V367 E368 E374 I375 L380 L383 L402V348-F370 WeakPolarHBondContact CG1-O 3.25Å; V351-F370 HydrophobicContact CG1-CD1 3.77Å; V351-F370 HydrophobicContact CG1-CE1 4.5Å; V351-F370 HydrophobicContact CG1-CG 4.48Å; V352-F370 HydrophobicContact CG2-CB 4.02Å; V355-F370 HydrophobicContact CG1-CD2 4.38Å; V355-F370 HydrophobicContact CG1-CE2 3.85Å; V355-F370 HydrophobicContact CG1-CZ 4.03Å; V355-F370 HydrophobicContact CG2-CD1 4.07Å; V355-F370 HydrophobicContact CG2-CE1 3.74Å; V355-F370 HydrophobicContact CG2-CE2 4.27Å; V355-F370 HydrophobicContact CG2-CG 4.49Å; V355-F370 HydrophobicContact CG2-CZ 3.84Å; H366-F370 WeakPolarHBondContact O-CD2 3.05Å; V367-F370 WeakPolarHBondContact O-CB 3.29Å; V367-F370 PolarHBondContact O-N 3.37Å; E368-F370 VanDerWaalsContact C-N 3.32Å; F370-E374 PolarHBondContact O-N 2.78Å; F370-I375 HydrophobicContact CB-CB 4.3Å; F370-I375 HydrophobicContact CB-CD1 4.42Å; F370-I375 HydrophobicContact CD1-CB 4.05Å; F370-I375 HydrophobicContact CD1-CD1 3.76Å; F370-I375 HydrophobicContact CD1-CG1 4.4Å; F370-I375 HydrophobicContact CD1-CG2 4.09Å; F370-I375 HydrophobicContact CE1-CD1 4.25Å; F370-I375 HydrophobicContact CG-CD1 4.19Å; F370-I375 PolarHBondContact O-N 2.72Å; F370-L380 HydrophobicContact CE1-CD1 4.21Å; F370-L383 HydrophobicContact CE1-CD1 4.4Å; F370-L402 HydrophobicContact CE1-CD1 4.1Å; F370-L402 HydrophobicContact CE1-CD2 4.11Å; F370-L402 HydrophobicContact CZ-CD1 3.71Å; F370-L402 HydrophobicContact CZ-CD2 3.63Å; F370-L402 HydrophobicContact CZ-CG 4.33Å
371R97.7Very high96.7Very high97 Ų9760.1 Ų60.137%0.36631%0.306SS..Hα-helixtrans-65.7-54.9168-65.8-168.7173.7120.9-5112.2V348 E349 V352 E368 L369 H373 E374V348-R371 HydrophobicContact CG1-CG 4.31Å; E349-R371 IonicContact OE1-CZ 3.25Å; E349-R371 IonicContact OE1-NE 3.5Å; E349-R371 PolarHBondContact OE1-NE 2.91Å; E349-R371 IonicContact OE1-NH2 2.81Å; E349-R371 PolarHBondContact OE1-NH2 3.45Å; E349-R371 VanDerWaalsContact OE1-NH2 3.07Å; V352-R371 HydrophobicContact CG2-CG 3.74Å; E368-R371 PolarHBondContact O-N 3.05Å; E368-R371 VanDerWaalsContact OE1-CD 3.32Å; E368-R371 WeakPolarHBondContact OE1-CD 3.46Å; E368-R371 IonicContact OE2-CZ 3.24Å; E368-R371 IonicContact OE2-NH1 2.76Å; E368-R371 PolarHBondContact OE2-NH1 3.12Å; L369-R371 VanDerWaalsContact C-N 3.33Å; R371-H373 PolarHBondContact O-N 3.44Å; R371-H373 VanDerWaalsContact O-N 3.16Å; R371-E374 PolarHBondContact O-N 3.4Å
372K97.2Very high96.9Very high165 Ų16557.8 Ų57.872%0.71730%0.298SS*.Hα-helixtrans-59-28.9-177.3-176.8177177.5-177.20113.8E368 L369E368-K372 WeakPolarHBondContact O-CB 3.29Å; E368-K372 PolarHBondContact O-N 3.45Å; L369-K372 PolarHBondContact O-N 3.42Å
373H97.7Very high97Very high84 Ų8457.8 Ų57.839%0.38930%0.295SS..THydrogen-bonded Turntrans-103.414177-68.2-85.3000113.2L369 R371 I375 Y391 L392L369-H373 WeakPolarHBondContact O-CB 3.34Å; L369-H373 PolarHBondContact O-CD2 3.07Å; L369-H373 PolarHBondContact O-N 3.48Å; R371-H373 PolarHBondContact O-N 3.44Å; R371-H373 VanDerWaalsContact O-N 3.16Å; H373-I375 HydrophobicContact CB-CD1 4.04Å; H373-I375 HydrophobicContact CB-CG1 3.82Å; H373-I375 WeakPolarHBondContact O-CG1 3.44Å; H373-I375 PolarHBondContact O-N 3.07Å; H373-I375 VanDerWaalsContact O-N 3.14Å; H373-Y391 PolarHBondContact CE1-O 3.19Å; H373-L392 HydrophobicContact CB-CD2 3.87Å
374E97.7Very high96.8Very high163 Ų16363.4 Ų63.476%0.76232%0.319SS*.THydrogen-bonded Turntrans47.842.4175-58.7-174.2123.200113.9F370 R371 D376F370-E374 PolarHBondContact O-N 2.78Å; R371-E374 PolarHBondContact O-N 3.4Å; E374-D376 PolarHBondContact O-N 2.96Å
375I98.1Very high96.8Very high7 Ų765.1 Ų65.14%0.03633%0.328CS..  trans-78.890.8-171.5-50.7-173.8000109.9V351 F370 H373 A379 L380 L383 L392V351-I375 WeakPolarHBondContact CB-O 3.47Å; V351-I375 HydrophobicContact CG1-CG2 4.46Å; V351-I375 WeakPolarHBondContact CG1-O 3.44Å; V351-I375 WeakPolarHBondContact CG2-O 3.32Å; F370-I375 HydrophobicContact CB-CB 4.3Å; F370-I375 HydrophobicContact CB-CD1 4.42Å; F370-I375 HydrophobicContact CD1-CB 4.05Å; F370-I375 HydrophobicContact CD1-CD1 3.76Å; F370-I375 HydrophobicContact CD1-CG1 4.4Å; F370-I375 HydrophobicContact CD1-CG2 4.09Å; F370-I375 HydrophobicContact CE1-CD1 4.25Å; F370-I375 HydrophobicContact CG-CD1 4.19Å; F370-I375 PolarHBondContact O-N 2.72Å; H373-I375 HydrophobicContact CB-CD1 4.04Å; H373-I375 HydrophobicContact CB-CG1 3.82Å; H373-I375 WeakPolarHBondContact O-CG1 3.44Å; H373-I375 PolarHBondContact O-N 3.07Å; H373-I375 VanDerWaalsContact O-N 3.14Å; I375-A379 HydrophobicContact CG2-CB 3.92Å; I375-L380 HydrophobicContact CG2-CB 4.22Å; I375-L383 HydrophobicContact CD1-CD1 4.35Å; I375-L383 HydrophobicContact CG2-CD1 4.22Å; I375-L392 HydrophobicContact CD1-CD1 3.74Å; I375-L392 HydrophobicContact CD1-CD2 3.74Å; I375-L392 HydrophobicContact CD1-CG 4.4Å
376D97.4Very high96.7Very high50 Ų5064.8 Ų64.827%0.26732%0.321SS..  trans-69.9175.7169.895.5-51.9000112.3E374 N378 A379 L380E374-D376 PolarHBondContact O-N 2.96Å; D376-N378 VanDerWaalsContact C-N 3.27Å; D376-N378 VanDerWaalsContact CG-N 3.3Å; D376-N378 PolarHBondContact O-N 2.79Å; D376-N378 PolarHBondContact OD1-N 3.43Å; D376-N378 WeakPolarHBondContact OD2-CB 3.11Å; D376-N378 PolarHBondContact OD2-N 2.92Å; D376-N378 VanDerWaalsContact OD2-N 3.07Å; D376-N378 PolarHBondContact OD2-ND2 3.06Å; D376-A379 PolarHBondContact O-N 3.45Å; D376-A379 WeakPolarHBondContact OD1-CB 3.42Å; D376-A379 PolarHBondContact OD1-N 3.35Å; D376-L380 WeakPolarHBondContact O-CB 3.48Å; D376-L380 PolarHBondContact O-N 3.09Å
377G96.8Very high96.7Very high0 Ų065.1 Ų65.10%032%0.324CS..Hα-helixtrans-59.3-32.217800000115P343 W346 L381P343-G377 CarbonylContact O-C 3.54Å; P343-G377 WeakPolarHBondContact O-CA 3.5Å; W346-G377 PolarHBondContact O-N 2.71Å; G377-L381 VanDerWaalsContact O-CG 3.31Å; G377-L381 WeakPolarHBondContact O-CG 3.37Å; G377-L381 PolarHBondContact O-N 2.86Å
378N96.5Very high96.7Very high72 Ų7264.2 Ų64.239%0.38532%0.318SS..Hα-helixtrans-75.2-44.3178.8-62.2-75.2000111.3S344 D376 L381 L382S344-N378 WeakPolarHBondContact CB-OD1 3.31Å; S344-N378 PolarHBondContact O-ND2 2.89Å; S344-N378 PolarHBondContact O-OD1 3.46Å; D376-N378 VanDerWaalsContact C-N 3.27Å; D376-N378 VanDerWaalsContact CG-N 3.3Å; D376-N378 PolarHBondContact O-N 2.79Å; D376-N378 PolarHBondContact OD1-N 3.43Å; D376-N378 WeakPolarHBondContact OD2-CB 3.11Å; D376-N378 PolarHBondContact OD2-N 2.92Å; D376-N378 VanDerWaalsContact OD2-N 3.07Å; D376-N378 PolarHBondContact OD2-ND2 3.06Å; N378-L381 PolarHBondContact O-N 3.32Å; N378-L382 WeakPolarHBondContact O-CG 3.26Å; N378-L382 PolarHBondContact O-N 3.38Å
379A97.7Very high96.7Very high37 Ų3762.7 Ų62.731%0.30631%0.312SS..Hα-helixtrans-59.1-45.5171.700000111.6I375 D376 L381 L382 L383I375-A379 HydrophobicContact CG2-CB 3.92Å; D376-A379 PolarHBondContact O-N 3.45Å; D376-A379 WeakPolarHBondContact OD1-CB 3.42Å; D376-A379 PolarHBondContact OD1-N 3.35Å; A379-L381 VanDerWaalsContact C-N 3.3Å; A379-L381 PolarHBondContact O-N 3.15Å; A379-L382 PolarHBondContact O-N 2.95Å; A379-L383 PolarHBondContact O-N 3.03Å; A379-L383 VanDerWaalsContact O-N 3.08Å
380L97.5Very high96.6Very high0 Ų067.5 Ų67.50%033%0.331CS..Hα-helixtrans-54.6-43.1176.7-18071.6000112.2W346 V351 F354 F370 I375 D376 L382 L383 I406 L409W346-L380 HydrophobicContact CE3-CD2 4.15Å; W346-L380 HydrophobicContact CZ3-CD2 4.11Å; V351-L380 HydrophobicContact CG1-CB 4.35Å; V351-L380 HydrophobicContact CG1-CD1 4.01Å; V351-L380 HydrophobicContact CG1-CD2 4.06Å; V351-L380 HydrophobicContact CG1-CG 4.36Å; V351-L380 HydrophobicContact CG2-CB 4.19Å; V351-L380 HydrophobicContact CG2-CD2 3.95Å; F354-L380 HydrophobicContact CD1-CD2 3.82Å; F354-L380 HydrophobicContact CE1-CD2 3.96Å; F370-L380 HydrophobicContact CE1-CD1 4.21Å; I375-L380 HydrophobicContact CG2-CB 4.22Å; D376-L380 WeakPolarHBondContact O-CB 3.48Å; D376-L380 PolarHBondContact O-N 3.09Å; L380-L382 VanDerWaalsContact C-N 3.28Å; L380-L382 PolarHBondContact O-N 3.42Å; L380-L383 HydrophobicContact CD1-CD1 4.31Å; L380-I406 HydrophobicContact CD1-CD1 3.72Å; L380-I406 HydrophobicContact CD1-CG1 3.83Å; L380-I406 HydrophobicContact CG-CD1 4.35Å; L380-I406 HydrophobicContact CG-CG1 4.16Å; L380-L409 HydrophobicContact CD2-CD2 4.14Å
381L95.5Very high96.5Very high44 Ų4473.7 Ų73.723%0.2336%0.355CS..Hα-helixtrans-68.5-26.1179.2-70.8171.2000113.1P343 G377 N378 A379 K410P343-L381 HydrophobicContact CB-CD1 4.26Å; P343-L381 HydrophobicContact CB-CD2 4.43Å; P343-L381 HydrophobicContact CB-CG 4.49Å; G377-L381 VanDerWaalsContact O-CG 3.31Å; G377-L381 WeakPolarHBondContact O-CG 3.37Å; G377-L381 PolarHBondContact O-N 2.86Å; N378-L381 PolarHBondContact O-N 3.32Å; A379-L381 VanDerWaalsContact C-N 3.3Å; A379-L381 PolarHBondContact O-N 3.15Å; L381-K410 HydrophobicContact CD2-CG 3.72Å; L381-K410 WeakPolarHBondContact O-CE 3.43Å; L381-K410 PolarHBondContact O-NZ 3.18Å
382L95.8Very high96.4Very high123 Ų12369.6 Ų69.664%0.64434%0.341SS*.Hα-helixtrans-91.1-15.1-178.3-66.1173.8000114.3N378 A379 L380 K384N378-L382 WeakPolarHBondContact O-CG 3.26Å; N378-L382 PolarHBondContact O-N 3.38Å; A379-L382 PolarHBondContact O-N 2.95Å; L380-L382 VanDerWaalsContact C-N 3.28Å; L380-L382 PolarHBondContact O-N 3.42Å; L382-K384 PolarHBondContact O-NZ 3.12Å
383L95.9Very high96.3Very high22 Ų2264.6 Ų64.612%0.11534%0.336CS..  trans-55.5139.6176.9-76.3179.5000112.2F370 I375 A379 L380 M387 V388 L392 L402 I406F370-L383 HydrophobicContact CE1-CD1 4.4Å; I375-L383 HydrophobicContact CD1-CD1 4.35Å; I375-L383 HydrophobicContact CG2-CD1 4.22Å; A379-L383 PolarHBondContact O-N 3.03Å; A379-L383 VanDerWaalsContact O-N 3.08Å; L380-L383 HydrophobicContact CD1-CD1 4.31Å; L383-M387 HydrophobicContact CD2-CB 4.48Å; L383-V388 HydrophobicContact CB-CG2 4.1Å; L383-V388 HydrophobicContact CD1-CG2 4.12Å; L383-V388 HydrophobicContact CD2-CG2 4.2Å; L383-V388 HydrophobicContact CG-CG2 4.38Å; L383-L392 HydrophobicContact CD1-CD1 4.41Å; L383-L402 HydrophobicContact CD1-CD2 4.46Å; L383-I406 HydrophobicContact CB-CD1 4.22Å; L383-I406 HydrophobicContact CD1-CD1 4.38Å
384K94Very high96.2Very high117 Ų11760.9 Ų60.951%0.50932%0.319SS..  trans-125.7161174.6-63.1176.8-159.463.90109.6L382 D386 M387 V388L382-K384 PolarHBondContact O-NZ 3.12Å; K384-D386 VanDerWaalsContact C-N 3.31Å; K384-D386 WeakPolarHBondContact CB-OD1 3.26Å; K384-D386 PolarHBondContact O-N 2.87Å; K384-M387 HydrophobicContact CB-CG 4.29Å; K384-M387 HydrophobicContact CB-SD 4.28Å; K384-M387 HydrophobicContact CG-SD 4.42Å; K384-M387 PolarHBondContact O-N 3.33Å; K384-M387 VanDerWaalsContact O-N 3.12Å; K384-V388 VanDerWaalsContact O-CG2 3.29Å; K384-V388 WeakPolarHBondContact O-CG2 3.29Å; K384-V388 PolarHBondContact O-N 2.91Å
385S94Very high96.2Very high56 Ų5661.3 Ų61.339%0.39232%0.318SS..Hα-helixtrans-58.9-38.5-175.947.60000113.4M389S385-M389 WeakPolarHBondContact O-CB 3.15Å; S385-M389 VanDerWaalsContact O-CG 3.26Å; S385-M389 WeakPolarHBondContact O-CG 3.38Å; S385-M389 PolarHBondContact O-N 3.38Å
386D94.9Very high96.1Very high93 Ų9365.7 Ų65.750%0.49734%0.341SS..Hα-helixtrans-63.9-44.8174.667.4-52.6000111.9K384 M389 K390K384-D386 VanDerWaalsContact C-N 3.31Å; K384-D386 WeakPolarHBondContact CB-OD1 3.26Å; K384-D386 PolarHBondContact O-N 2.87Å; D386-M389 PolarHBondContact O-N 3.43Å; D386-K390 WeakPolarHBondContact O-CB 3.34Å; D386-K390 PolarHBondContact O-N 3.32Å
387M96.6Very high96Very high62 Ų6265.4 Ų65.431%0.30535%0.35SS..Hα-helixtrans-64.1-43.5177.9-59.5177.369.800111.3L383 K384 Y391L383-M387 HydrophobicContact CD2-CB 4.48Å; K384-M387 HydrophobicContact CB-CG 4.29Å; K384-M387 HydrophobicContact CB-SD 4.28Å; K384-M387 HydrophobicContact CG-SD 4.42Å; K384-M387 PolarHBondContact O-N 3.33Å; K384-M387 VanDerWaalsContact O-N 3.12Å; M387-Y391 HydrophobicContact CB-CD2 4.16Å; M387-Y391 WeakPolarHBondContact O-CB 3.48Å; M387-Y391 PolarHBondContact O-N 3.48Å
388V96.4Very high96Very high0 Ų066.7 Ų66.70%036%0.359CS..Hα-helixtrans-64-42.5178.51700000111.4L383 K384 L392 G393 L394 A399 L402L383-V388 HydrophobicContact CB-CG2 4.1Å; L383-V388 HydrophobicContact CD1-CG2 4.12Å; L383-V388 HydrophobicContact CD2-CG2 4.2Å; L383-V388 HydrophobicContact CG-CG2 4.38Å; K384-V388 VanDerWaalsContact O-CG2 3.29Å; K384-V388 WeakPolarHBondContact O-CG2 3.29Å; K384-V388 PolarHBondContact O-N 2.91Å; V388-L392 HydrophobicContact CG2-CD1 4.34Å; V388-L392 WeakPolarHBondContact O-CB 3.46Å; V388-L392 PolarHBondContact O-N 2.94Å; V388-G393 PolarHBondContact O-N 3.45Å; V388-L394 HydrophobicContact CG1-CB 3.84Å; V388-L394 HydrophobicContact CG1-CD2 3.85Å; V388-L394 HydrophobicContact CG1-CG 4.34Å; V388-L394 PolarHBondContact O-N 2.98Å; V388-A399 HydrophobicContact CB-CB 4.42Å; V388-A399 HydrophobicContact CG1-CB 3.66Å; V388-L402 HydrophobicContact CB-CD2 4.48Å; V388-L402 HydrophobicContact CG1-CD2 3.79Å; V388-L402 HydrophobicContact CG2-CD2 3.78Å
389M97.4Very high96.1Very high78 Ų7863.3 Ų63.338%0.38434%0.341SS..Hα-helixtrans-72.4-41.8177.5-69.6174.761.100112.5S385 D386 G393 L394 L396 A399S385-M389 WeakPolarHBondContact O-CB 3.15Å; S385-M389 VanDerWaalsContact O-CG 3.26Å; S385-M389 WeakPolarHBondContact O-CG 3.38Å; S385-M389 PolarHBondContact O-N 3.38Å; D386-M389 PolarHBondContact O-N 3.43Å; M389-G393 WeakPolarHBondContact O-CA 3.37Å; M389-G393 PolarHBondContact O-N 3.42Å; M389-L394 WeakPolarHBondContact CA-O 3.26Å; M389-L394 WeakPolarHBondContact CG-O 3.44Å; M389-L396 HydrophobicContact CE-CB 4.07Å; M389-L396 HydrophobicContact CE-CD1 4.09Å; M389-L396 HydrophobicContact SD-CB 4.34Å; M389-L396 HydrophobicContact SD-CD1 3.63Å; M389-A399 HydrophobicContact CG-CB 3.53Å; M389-A399 HydrophobicContact SD-CB 4.26Å
390K96.4Very high96.1Very high147 Ų14766.1 Ų66.164%0.63935%0.35SS*.Hα-helixtrans-79.6-43.3-173-173.8-178.1173.8-163.40113.8D386D386-K390 WeakPolarHBondContact O-CB 3.34Å; D386-K390 PolarHBondContact O-N 3.32Å
391Y95.4Very high96Very high130 Ų13070.2 Ų70.251%0.5137%0.368SS..Hα-helixtrans-103.3-28.6-170.3-56.7-61.8000113.6H373 M387H373-Y391 PolarHBondContact CE1-O 3.19Å; M387-Y391 HydrophobicContact CB-CD2 4.16Å; M387-Y391 WeakPolarHBondContact O-CB 3.48Å; M387-Y391 PolarHBondContact O-N 3.48Å
392L95.8Very high96.1Very high12 Ų1268.2 Ų68.26%0.06336%0.357CS..SBendtrans-95.6-8.2173.3-46.1-179.6000112.4L369 H373 I375 L383 V388 L394L369-L392 WeakPolarHBondContact CD1-O 3.14Å; H373-L392 HydrophobicContact CB-CD2 3.87Å; I375-L392 HydrophobicContact CD1-CD1 3.74Å; I375-L392 HydrophobicContact CD1-CD2 3.74Å; I375-L392 HydrophobicContact CD1-CG 4.4Å; L383-L392 HydrophobicContact CD1-CD1 4.41Å; V388-L392 HydrophobicContact CG2-CD1 4.34Å; V388-L392 WeakPolarHBondContact O-CB 3.46Å; V388-L392 PolarHBondContact O-N 2.94Å; L392-L394 HydrophobicContact CB-CD1 3.79Å; L392-L394 PolarHBondContact O-N 2.97Å
393G94.8Very high96.2Very high60 Ų6063.3 Ų63.362%0.61933%0.333SS*.  trans69.413.8178.700000115V388 M389 K395V388-G393 PolarHBondContact O-N 3.45Å; M389-G393 WeakPolarHBondContact O-CA 3.37Å; M389-G393 PolarHBondContact O-N 3.42Å; G393-K395 PolarHBondContact O-N 2.93Å
394L96.3Very high96.2Very high5 Ų568.6 Ų68.63%0.02635%0.353CS..  trans-67.6134.1179.1-93.471.5000110.6L363 H366 L369 V388 M389 L392 P398 A399 L402L363-L394 HydrophobicContact CD2-CD2 4.41Å; H366-L394 HydrophobicContact CB-CD1 4.29Å; L369-L394 HydrophobicContact CD1-CD1 3.65Å; V388-L394 HydrophobicContact CG1-CB 3.84Å; V388-L394 HydrophobicContact CG1-CD2 3.85Å; V388-L394 HydrophobicContact CG1-CG 4.34Å; V388-L394 PolarHBondContact O-N 2.98Å; M389-L394 WeakPolarHBondContact CA-O 3.26Å; M389-L394 WeakPolarHBondContact CG-O 3.44Å; L392-L394 HydrophobicContact CB-CD1 3.79Å; L392-L394 PolarHBondContact O-N 2.97Å; L394-P398 HydrophobicContact CB-CB 4.47Å; L394-P398 HydrophobicContact CD2-CB 3.91Å; L394-P398 HydrophobicContact CG-CB 4.19Å; L394-A399 HydrophobicContact CB-CB 4.27Å; L394-L402 HydrophobicContact CD2-CD2 4.41Å
395K96.4Very high96.3Very high172 Ų17264.5 Ų64.575%0.74834%0.335SS*.  trans-64.8155.8170.3-65.8179-179.1176.50110.1G393 G397 P398 A399G393-K395 PolarHBondContact O-N 2.93Å; K395-G397 VanDerWaalsContact C-N 3.25Å; K395-G397 PolarHBondContact O-N 3.33Å; K395-G397 VanDerWaalsContact O-N 3.09Å; K395-P398 VanDerWaalsContact O-CD 3.26Å; K395-P398 WeakPolarHBondContact O-CD 3.28Å; K395-A399 WeakPolarHBondContact O-CB 3.37Å; K395-A399 PolarHBondContact O-N 3.07Å
396L95.9Very high96.4Very high99 Ų9961.9 Ų61.952%0.51832%0.317SS..Hα-helixtrans-49.5-41-175.1-179.463.9000113.8M389 A399 L400M389-L396 HydrophobicContact CE-CB 4.07Å; M389-L396 HydrophobicContact CE-CD1 4.09Å; M389-L396 HydrophobicContact SD-CB 4.34Å; M389-L396 HydrophobicContact SD-CD1 3.63Å; L396-A399 PolarHBondContact O-N 3.33Å; L396-L400 HydrophobicContact CD1-CD1 3.84Å; L396-L400 HydrophobicContact CD1-CD2 4.43Å; L396-L400 HydrophobicContact CD1-CG 3.9Å; L396-L400 HydrophobicContact CG-CD1 3.88Å; L396-L400 HydrophobicContact CG-CG 4.33Å; L396-L400 WeakPolarHBondContact O-CB 3.32Å; L396-L400 VanDerWaalsContact O-CG 3.28Å; L396-L400 WeakPolarHBondContact O-CG 3.45Å; L396-L400 PolarHBondContact O-N 3.34Å
397G96.4Very high96.4Very high45 Ų4561 Ų6146%0.46431%0.312SS..Hα-helixtrans-59.5-63.617800000113.4K395 A399 L400 K401K395-G397 VanDerWaalsContact C-N 3.25Å; K395-G397 PolarHBondContact O-N 3.33Å; K395-G397 VanDerWaalsContact O-N 3.09Å; G397-A399 VanDerWaalsContact C-N 3.28Å; G397-A399 PolarHBondContact O-N 2.92Å; G397-L400 PolarHBondContact O-N 3.42Å; G397-K401 PolarHBondContact O-N 2.96Å; G397-K401 VanDerWaalsContact O-N 3.07Å
398P96.9Very high96.3Very high27 Ų2763.3 Ų63.318%0.17532%0.32CS..Hα-helixtrans-51.9-40.9170.9-31.136.6000114.1L363 L394 K395 K401 L402L363-P398 HydrophobicContact CD2-CB 4.27Å; L363-P398 WeakPolarHBondContact CD2-O 3.46Å; L394-P398 HydrophobicContact CB-CB 4.47Å; L394-P398 HydrophobicContact CD2-CB 3.91Å; L394-P398 HydrophobicContact CG-CB 4.19Å; K395-P398 VanDerWaalsContact O-CD 3.26Å; K395-P398 WeakPolarHBondContact O-CD 3.28Å; P398-K401 PolarHBondContact O-N 3.2Å; P398-L402 WeakPolarHBondContact O-CB 3.39Å; P398-L402 PolarHBondContact O-N 3.39Å
399A97.6Very high96.1Very high1 Ų164.1 Ų64.11%0.00832%0.324CS..Hα-helixtrans-62.7-45.4179.600000112.9V388 M389 L394 K395 L396 G397 L402 C403V388-A399 HydrophobicContact CB-CB 4.42Å; V388-A399 HydrophobicContact CG1-CB 3.66Å; M389-A399 HydrophobicContact CG-CB 3.53Å; M389-A399 HydrophobicContact SD-CB 4.26Å; L394-A399 HydrophobicContact CB-CB 4.27Å; K395-A399 WeakPolarHBondContact O-CB 3.37Å; K395-A399 PolarHBondContact O-N 3.07Å; L396-A399 PolarHBondContact O-N 3.33Å; G397-A399 VanDerWaalsContact C-N 3.28Å; G397-A399 PolarHBondContact O-N 2.92Å; A399-L402 PolarHBondContact O-N 3.42Å; A399-C403 PolarHBondContact O-N 2.91Å; A399-C403 PolarHBondContact O-SG 3.41Å
400L97.1Very high95.8Very high96 Ų9664.9 Ų64.950%0.50333%0.325SS..Hα-helixtrans-65.8-38.7176.2-71.6173000112.1L396 G397 C403 Y404L396-L400 HydrophobicContact CD1-CD1 3.84Å; L396-L400 HydrophobicContact CD1-CD2 4.43Å; L396-L400 HydrophobicContact CD1-CG 3.9Å; L396-L400 HydrophobicContact CG-CD1 3.88Å; L396-L400 HydrophobicContact CG-CG 4.33Å; L396-L400 WeakPolarHBondContact O-CB 3.32Å; L396-L400 VanDerWaalsContact O-CG 3.28Å; L396-L400 WeakPolarHBondContact O-CG 3.45Å; L396-L400 PolarHBondContact O-N 3.34Å; G397-L400 PolarHBondContact O-N 3.42Å; L400-C403 PolarHBondContact O-N 2.88Å; L400-Y404 PolarHBondContact O-N 3.24Å
401K97.1Very high95.3Very high86 Ų8665.3 Ų65.337%0.37433%0.33SS..Hα-helixtrans-59.4-51.4172.9-76.4-177163.3-1590111.1D359 A362 G397 P398 C403 Y404 H405D359-K401 IonicContact OD1-NZ 2.78Å; D359-K401 WeakPolarHBondContact OD2-CD 3.44Å; D359-K401 WeakPolarHBondContact OD2-CE 3.46Å; D359-K401 IonicContact OD2-NZ 3.07Å; D359-K401 PolarHBondContact OD2-NZ 3.21Å; A362-K401 HydrophobicContact CB-CD 3.67Å; A362-K401 VanDerWaalsContact CB-NZ 3.3Å; G397-K401 PolarHBondContact O-N 2.96Å; G397-K401 VanDerWaalsContact O-N 3.07Å; P398-K401 PolarHBondContact O-N 3.2Å; K401-C403 VanDerWaalsContact C-N 3.32Å; K401-C403 PolarHBondContact O-N 2.66Å; K401-Y404 WeakPolarHBondContact O-CB 3.42Å; K401-Y404 PolarHBondContact O-N 2.87Å; K401-Y404 VanDerWaalsContact O-N 3.16Å; K401-H405 PolarHBondContact O-CD2 3.1Å; K401-H405 PolarHBondContact O-N 3.19Å
402L97.6Very high94.5Very high1 Ų161 Ų611%0.00532%0.321CS..Hα-helixtrans-55.3-47.5178.3-17868.5000111.6V355 L363 F370 L383 V388 L394 P398 A399 Y404 H405 I406V355-L402 HydrophobicContact CG1-CD1 4.46Å; V355-L402 HydrophobicContact CG2-CD1 4.03Å; L363-L402 HydrophobicContact CD1-CB 4.42Å; L363-L402 HydrophobicContact CD1-CD1 4.26Å; L363-L402 HydrophobicContact CD2-CB 4.03Å; F370-L402 HydrophobicContact CE1-CD1 4.1Å; F370-L402 HydrophobicContact CE1-CD2 4.11Å; F370-L402 HydrophobicContact CZ-CD1 3.71Å; F370-L402 HydrophobicContact CZ-CD2 3.63Å; F370-L402 HydrophobicContact CZ-CG 4.33Å; L383-L402 HydrophobicContact CD1-CD2 4.46Å; V388-L402 HydrophobicContact CB-CD2 4.48Å; V388-L402 HydrophobicContact CG1-CD2 3.79Å; V388-L402 HydrophobicContact CG2-CD2 3.78Å; L394-L402 HydrophobicContact CD2-CD2 4.41Å; P398-L402 WeakPolarHBondContact O-CB 3.39Å; P398-L402 PolarHBondContact O-N 3.39Å; A399-L402 PolarHBondContact O-N 3.42Å; L402-Y404 PolarHBondContact O-N 3.42Å; L402-H405 PolarHBondContact O-N 3.15Å; L402-H405 VanDerWaalsContact O-N 3.15Å; L402-I406 HydrophobicContact CD1-CD1 4.19Å; L402-I406 HydrophobicContact CD2-CD1 4.33Å; L402-I406 HydrophobicContact CG-CD1 3.78Å; L402-I406 HydrophobicContact CG-CG1 4.49Å; L402-I406 WeakPolarHBondContact O-CG1 3.36Å; L402-I406 PolarHBondContact O-N 3.49Å
403C96.6Very high92.7Very high21 Ų2169.8 Ų69.814%0.14236%0.359CS..Hα-helixtrans-59.6-44.8177.4-63.90000112.1A399 L400 K401 H405 I406 D407A399-C403 PolarHBondContact O-N 2.91Å; A399-C403 PolarHBondContact O-SG 3.41Å; L400-C403 PolarHBondContact O-N 2.88Å; K401-C403 VanDerWaalsContact C-N 3.32Å; K401-C403 PolarHBondContact O-N 2.66Å; C403-H405 VanDerWaalsContact C-N 3.29Å; C403-H405 PolarHBondContact O-N 2.97Å; C403-I406 PolarHBondContact O-N 3.09Å; C403-D407 PolarHBondContact O-N 3.05Å
404Y96.8Very high90.8Very high133 Ų13372.1 Ų72.152%0.52235%0.352SS..Hα-helixtrans-56.5-41.7174.5166.2-94.1000112.5L400 K401 L402 K408L400-Y404 PolarHBondContact O-N 3.24Å; K401-Y404 WeakPolarHBondContact O-CB 3.42Å; K401-Y404 PolarHBondContact O-N 2.87Å; K401-Y404 VanDerWaalsContact O-N 3.16Å; L402-Y404 PolarHBondContact O-N 3.42Å; Y404-K408 HydrophobicContact CE1-CD 3.95Å; Y404-K408 WeakPolarHBondContact O-CB 3.46Å; Y404-K408 PolarHBondContact O-N 3.48Å; Y404-K408 PolarHBondContact OH-NZ 2.79Å
405H96.5Very high90.5Very high31 Ų3175.5 Ų75.514%0.14437%0.368CS..Hα-helixtrans-70.2-38.7177.5-73.8-80.5000112.5F354 A358 K401 L402 C403 K408 L409F354-H405 HydrophobicContact CZ-CB 4.07Å; A358-H405 HydrophobicContact CB-CB 4.14Å; A358-H405 PolarHBondContact O-CE1 3.46Å; A358-H405 PolarHBondContact O-NE2 3.27Å; K401-H405 PolarHBondContact O-CD2 3.1Å; K401-H405 PolarHBondContact O-N 3.19Å; L402-H405 PolarHBondContact O-N 3.15Å; L402-H405 VanDerWaalsContact O-N 3.15Å; C403-H405 VanDerWaalsContact C-N 3.29Å; C403-H405 PolarHBondContact O-N 2.97Å; H405-K408 PolarHBondContact O-N 3.21Å; H405-L409 WeakPolarHBondContact O-CB 3.48Å; H405-L409 PolarHBondContact O-N 3.41Å
406I95.6Very high90.2Very high1 Ų170.4 Ų70.41%0.00535%0.348CS..Hα-helixtrans-64.8-42.1175.1-68.2166.6000111.4L380 L383 L402 C403 L409 K410L380-I406 HydrophobicContact CD1-CD1 3.72Å; L380-I406 HydrophobicContact CD1-CG1 3.83Å; L380-I406 HydrophobicContact CG-CD1 4.35Å; L380-I406 HydrophobicContact CG-CG1 4.16Å; L383-I406 HydrophobicContact CB-CD1 4.22Å; L383-I406 HydrophobicContact CD1-CD1 4.38Å; L402-I406 HydrophobicContact CD1-CD1 4.19Å; L402-I406 HydrophobicContact CD2-CD1 4.33Å; L402-I406 HydrophobicContact CG-CD1 3.78Å; L402-I406 HydrophobicContact CG-CG1 4.49Å; L402-I406 WeakPolarHBondContact O-CG1 3.36Å; L402-I406 PolarHBondContact O-N 3.49Å; C403-I406 PolarHBondContact O-N 3.09Å; I406-L409 VanDerWaalsContact O-CB 3.31Å; I406-L409 WeakPolarHBondContact O-CB 3.36Å; I406-L409 PolarHBondContact O-N 2.89Å; I406-K410 HydrophobicContact CG2-CD 4.27Å; I406-K410 VanDerWaalsContact CG2-CE 3.48Å; I406-K410 WeakPolarHBondContact O-CG 3.41Å; I406-K410 PolarHBondContact O-N 2.97Å
407D95.1Very high89.9Confident74 Ų7468.8 Ų68.840%0.39634%0.339SS..Hα-helixtrans-72.6-34.5179.4-68.7-22.9000112.1C403 L409 K410 Q411C403-D407 PolarHBondContact O-N 3.05Å; D407-L409 VanDerWaalsContact C-N 3.28Å; D407-L409 PolarHBondContact O-N 2.87Å; D407-K410 PolarHBondContact O-N 3.22Å; D407-K410 IonicContact OD1-NZ 2.68Å; D407-K410 PolarHBondContact OD1-NZ 3.4Å; D407-Q411 VanDerWaalsContact O-CG 3.26Å; D407-Q411 WeakPolarHBondContact O-CG 3.43Å; D407-Q411 PolarHBondContact O-N 2.8Å
408K93.8Very high89.5Confident111 Ų11170.2 Ų70.248%0.48333%0.332SS..Hα-helixtrans-64.8-31.8169.4-174.2177.7-170.9168.50112.5Y404 H405 A412Y404-K408 HydrophobicContact CE1-CD 3.95Å; Y404-K408 WeakPolarHBondContact O-CB 3.46Å; Y404-K408 PolarHBondContact O-N 3.48Å; Y404-K408 PolarHBondContact OH-NZ 2.79Å; H405-K408 PolarHBondContact O-N 3.21Å; K408-A412 PolarHBondContact O-N 3.13Å
409L92.7Very high89.1Confident16 Ų1672.9 Ų72.98%0.08434%0.341CS..Hα-helixtrans-68-52.4172-171.471.9000110.1P343 W346 F354 L380 H405 I406 D407 Q411 A412 F414P343-L409 HydrophobicContact CB-CD2 3.93Å; P343-L409 HydrophobicContact CB-CG 4.47Å; P343-L409 HydrophobicContact CG-CD1 3.96Å; P343-L409 HydrophobicContact CG-CD2 3.74Å; P343-L409 HydrophobicContact CG-CG 3.75Å; W346-L409 HydrophobicContact CE3-CD2 4.42Å; W346-L409 HydrophobicContact CH2-CD1 3.53Å; W346-L409 HydrophobicContact CH2-CD2 3.84Å; W346-L409 HydrophobicContact CH2-CG 4.33Å; W346-L409 HydrophobicContact CZ2-CD1 4.29Å; W346-L409 HydrophobicContact CZ3-CD1 4.15Å; W346-L409 HydrophobicContact CZ3-CD2 3.56Å; F354-L409 HydrophobicContact CD2-CD1 4.4Å; F354-L409 HydrophobicContact CE1-CD2 4.19Å; F354-L409 HydrophobicContact CE2-CB 4.42Å; F354-L409 HydrophobicContact CE2-CD1 3.89Å; F354-L409 HydrophobicContact CE2-CD2 4.27Å; F354-L409 HydrophobicContact CE2-CG 4.43Å; F354-L409 HydrophobicContact CZ-CB 4.1Å; F354-L409 HydrophobicContact CZ-CD1 4.31Å; F354-L409 HydrophobicContact CZ-CD2 3.96Å; F354-L409 HydrophobicContact CZ-CG 4.36Å; L380-L409 HydrophobicContact CD2-CD2 4.14Å; H405-L409 WeakPolarHBondContact O-CB 3.48Å; H405-L409 PolarHBondContact O-N 3.41Å; I406-L409 VanDerWaalsContact O-CB 3.31Å; I406-L409 WeakPolarHBondContact O-CB 3.36Å; I406-L409 PolarHBondContact O-N 2.89Å; D407-L409 VanDerWaalsContact C-N 3.28Å; D407-L409 PolarHBondContact O-N 2.87Å; L409-Q411 PolarHBondContact O-N 2.74Å; L409-A412 WeakPolarHBondContact O-CB 3.38Å; L409-A412 PolarHBondContact O-N 3.38Å; L409-F414 HydrophobicContact CD1-CE1 4.21Å; L409-F414 HydrophobicContact CD1-CZ 3.66Å; L409-F414 HydrophobicContact CG-CZ 3.89Å; L409-F414 VanDerWaalsContact O-CE2 3.25Å; L409-F414 WeakPolarHBondContact O-CE2 3.23Å; L409-F414 WeakPolarHBondContact O-CZ 3.12Å
410K90.6Very high88.5Confident94 Ų9477.7 Ų77.741%0.40936%0.364SS..Hα-helixtrans-54.8-34176.1-69.9165.6-174.1163.80113.8L381 I406 D407L381-K410 HydrophobicContact CD2-CG 3.72Å; L381-K410 WeakPolarHBondContact O-CE 3.43Å; L381-K410 PolarHBondContact O-NZ 3.18Å; I406-K410 HydrophobicContact CG2-CD 4.27Å; I406-K410 VanDerWaalsContact CG2-CE 3.48Å; I406-K410 WeakPolarHBondContact O-CG 3.41Å; I406-K410 PolarHBondContact O-N 2.97Å; D407-K410 PolarHBondContact O-N 3.22Å; D407-K410 IonicContact OD1-NZ 2.68Å; D407-K410 PolarHBondContact OD1-NZ 3.4Å
411Q86.9Confident87.9Confident157 Ų15776.4 Ų76.473%0.73435%0.354SS*.THydrogen-bonded Turntrans-77.2-17.1178.3-72.6171.536.300114.2D407 L409 K413D407-Q411 VanDerWaalsContact O-CG 3.26Å; D407-Q411 WeakPolarHBondContact O-CG 3.43Å; D407-Q411 PolarHBondContact O-N 2.8Å; L409-Q411 PolarHBondContact O-N 2.74Å; Q411-K413 PolarHBondContact O-N 3.48Å
412A78.1Confident87.2Confident40 Ų4075.6 Ų75.633%0.33135%0.352SS..SBendtrans-76.5112.6173.700000109.1K408 L409 F414K408-A412 PolarHBondContact O-N 3.13Å; L409-A412 WeakPolarHBondContact O-CB 3.38Å; L409-A412 PolarHBondContact O-N 3.38Å; A412-F414 HydrophobicContact CB-CE1 3.94Å; A412-F414 HydrophobicContact CB-CE2 4.46Å; A412-F414 HydrophobicContact CB-CZ 3.83Å; A412-F414 WeakPolarHBondContact O-CD2 3.26Å; A412-F414 WeakPolarHBondContact O-CE2 3.17Å; A412-F414 WeakPolarHBondContact O-CZ 3.4Å; A412-F414 PolarHBondContact O-N 3.39Å
413K57.5Low86.3Confident195 Ų19581.8 Ų81.885%0.84838%0.381SS*.  trans-63.8118.7169.3-65.7-172.5177.2-1720108.8R341 Q411R341-K413 PolarHBondContact NH2-O 3.33Å; Q411-K413 PolarHBondContact O-N 3.48Å
414F55.5Low85.4Confident109 Ų10987.4 Ų87.448%0.47840%0.403SS..  trans-870-177.8-63.2-64.8000110.8R341 P343 L409 A412R341-F414 HydrophobicContact CG-CD1 4.22Å; R341-F414 PolarHBondContact NH1-OXT 2.59Å; R341-F414 WeakPolarHBondContact O-CD1 3.18Å; R341-F414 WeakPolarHBondContact O-CE1 3.3Å; P343-F414 HydrophobicContact CG-CD2 4.1Å; P343-F414 HydrophobicContact CG-CE1 4.04Å; P343-F414 HydrophobicContact CG-CE2 3.47Å; P343-F414 VanDerWaalsContact CG-CE2 3.47Å; P343-F414 HydrophobicContact CG-CZ 3.44Å; P343-F414 VanDerWaalsContact CG-CZ 3.44Å; L409-F414 HydrophobicContact CD1-CE1 4.21Å; L409-F414 HydrophobicContact CD1-CZ 3.66Å; L409-F414 HydrophobicContact CG-CZ 3.89Å; L409-F414 VanDerWaalsContact O-CE2 3.25Å; L409-F414 WeakPolarHBondContact O-CE2 3.23Å; L409-F414 WeakPolarHBondContact O-CZ 3.12Å; A412-F414 HydrophobicContact CB-CE1 3.94Å; A412-F414 HydrophobicContact CB-CE2 4.46Å; A412-F414 HydrophobicContact CB-CZ 3.83Å; A412-F414 WeakPolarHBondContact O-CD2 3.26Å; A412-F414 WeakPolarHBondContact O-CE2 3.17Å; A412-F414 WeakPolarHBondContact O-CZ 3.4Å; A412-F414 PolarHBondContact O-N 3.39Å

Retrieved 414 of 414 residues in 1287.8 ms (Link to these results)