A0A087Y732_POEFO Loading...

Visual system homeobox 2

AlphaFold DB , UniProt , Accession A0A087Y732, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 397 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
1M33.6Very low40.6Very low224 Ų224146 Ų146100%1.10384%0.843SS**  0145.90-70.785.484.500109.4
2T42.3Very low40.6Very low139 Ų139142.8 Ų142.885%0.85384%0.835SS**  trans39.2126.4147.958.80000119.6
3G40.7Very low40.2Very low71 Ų71144.3 Ų144.373%0.73284%0.837SS**  cis102.1116.814.500000112.9
4K45Very low40.2Very low198 Ų198144.4 Ų144.486%0.86183%0.832SS**  trans168.7146164.9-101.7161.5-178.8-177.20110.4
5E47.5Very low39.8Very low182 Ų182146.8 Ų146.885%0.8583%0.833SS**  cis75.9126.924.9-52.1-61.9166.300115.8
6G41.4Very low39.5Very low63 Ų63144.1 Ų144.165%0.64983%0.826SS**  cis176.1-163.60.500000112.2
7A37.3Very low39.1Very low99 Ų99144.2 Ų144.282%0.81882%0.817SS**  trans74.2140.4174.300000117.3
8V40Very low39Very low128 Ų128145.7 Ų145.778%0.77681%0.813SS**  cis79.5112.327.9-174.50000115
9L39.6Very low38.6Very low176 Ų176144.9 Ų144.992%0.92181%0.813SS**  trans-141.1141.7155.9-80.1179.8000110.6
10T41.5Very low38.4Very low128 Ų128142.5 Ų142.579%0.78581%0.806SS**  trans-133.3136.1172.648.30000107.9
11E37.9Very low38.2Very low198 Ų198144.2 Ų144.293%0.92581%0.812SS**  trans-149.5152.7160.7-139.5173.6166.800111.8
12S40.7Very low38.1Very low107 Ų107137.4 Ų137.475%0.74880%0.799SS**  trans-121.2154.3-167-580000110.5
13L35.8Very low37.8Very low163 Ų163135.2 Ų135.285%0.85380%0.795SS**  trans-162.3145.5144-111.3148.4000113.4
14N39.3Very low37.5Very low145 Ų145139.6 Ų139.678%0.77580%0.802SS**  trans-118165.1178.1-91.4-54.1000109.6
15H35.1Very low36.8Very low181 Ų181134.1 Ų134.184%0.83880%0.802SS**  trans157.9152.2150.6-79.2-1.2000107.4
16S34Very low36Very low103 Ų103129 Ų12972%0.7280%0.797SS**  cis-166.7149.4-8.644.70000106.8
17E32.4Very low35.6Very low146 Ų146131.5 Ų131.568%0.68281%0.805SS**  174.5139.691.6-81.4-155.198.200109.3
18K37.8Very low35.3Very low171 Ų171134.3 Ų134.374%0.74381%0.806SS**  47.2136.4107.5-49.6179.9-166.2139.40115.6
19T31.9Very low35Very low132 Ų132133.9 Ų133.981%0.8181%0.809SS**  cis-152.9-178.830.746.70000110.7
20S34Very low34.9Very low95 Ų95134.2 Ų134.266%0.66481%0.805SS**  cis-170.2147-35.658.20000111.9
21L34.8Very low34.8Very low180 Ų180136.6 Ų136.694%0.94281%0.807SS**  trans61128.2151.1-68.3164.6000122.4
22G31.2Very low35.1Very low81 Ų81132.2 Ų132.284%0.83580%0.796SS**  trans167.3114.7161.200000111.8
23A36.3Very low34.8Very low92 Ų92137.3 Ų137.376%0.7681%0.805SS**  trans-116177.6-16600000115
24N34Very low34.7Very low164 Ų164134.9 Ų134.988%0.87780%0.802SS**  trans79.6134.3-179-54.6-17000115
25G31.4Very low34.6Very low83 Ų83133 Ų13386%0.85680%0.799SS**  cis126.7113.3-000000111.7
26G29.5Very low34.8Very low73 Ų73129.4 Ų129.475%0.75379%0.79SS**  trans156.987.2174.700000117.7
27S33.5Very low34.8Very low117 Ų117131.3 Ų131.382%0.81879%0.792SS**  52.8120.9129.5-51.40000123.6
28N31.7Very low35.2Very low157 Ų157132 Ų13284%0.8480%0.795SS**  trans43.9121.8135-82.2-6.5000121.4
29S33.5Very low35.6Very low120 Ų120129.1 Ų129.184%0.83979%0.794SS**  171.515186.548.40000113.4
30H35.9Very low36.1Very low183 Ų183128.6 Ų128.685%0.84779%0.793SS**  trans-88.6134.8172-71.4-91.1000111.9
31Q39.9Very low36.8Very low177 Ų177130.8 Ų130.883%0.82780%0.802SS**  trans-162.3156.8137.5-94.4-41.5-75.100109.9
32P44.1Very low37.1Very low107 Ų107133.5 Ų133.570%0.69580%0.8SS**PPolyproline II helixtrans-87.9158.3-163.335.4-36.6000113.8
33K34.3Very low37.7Very low214 Ų214135.5 Ų135.593%0.9380%0.8SS**PPolyproline II helixtrans-102131.1165.6-73.4-174.9177.4178.50110.6
34S33.9Very low38.7Very low112 Ų112135.5 Ų135.578%0.78379%0.791SS**PPolyproline II helixtrans-71.8146-17339.40000113.3V36S34-V36 PolarHBondContact O-N 2.64Å
35S38.3Very low39.5Very low104 Ų104130.4 Ų130.473%0.72778%0.777SS**  trans-76.7115.1171.645.20000111.2
36V38.1Very low40.5Very low106 Ų106135.7 Ų135.764%0.64278%0.777SS**  trans-96.196163.4179.80000108S34 H38S34-V36 PolarHBondContact O-N 2.64Å; V36-H38 PolarHBondContact O-N 3.16Å
37N34.3Very low42.1Very low144 Ų144133.3 Ų133.377%0.7775%0.752SS**  trans-73.8102.7172.7-80.4-34.4000109.8
38H41.7Very low43.5Very low160 Ų160133.7 Ų133.774%0.74174%0.744SS**PPolyproline II helixtrans-74.8125.4160.5-58.1-68.7000108.7V36V36-H38 PolarHBondContact O-N 3.16Å
39P46Very low45Very low110 Ų110132.6 Ų132.671%0.71473%0.734SS**PPolyproline II helixtrans-66.5142.7172.328.4-33.4000109.5T41P39-T41 PolarHBondContact O-N 3.26Å
40P42.3Very low46.5Very low121 Ų121131.5 Ų131.579%0.78672%0.715SS**PPolyproline II helixtrans-64127.8-178.625.7-33.6000110.4R42P40-R42 PolarHBondContact O-N 2.74Å
41T47.1Very low48Very low141 Ų141128.9 Ų128.987%0.86571%0.706SS**PPolyproline II helixtrans-58.5121.6170.841.20000108.8P39 C43P39-T41 PolarHBondContact O-N 3.26Å; T41-C43 PolarHBondContact O-N 2.83Å; T41-C43 VanDerWaalsContact O-N 3.16Å
42R41.7Very low49.2Very low237 Ų237125.9 Ų125.989%0.89470%0.695SS**PPolyproline II helixtrans-67.1118.5177.6-63.4-175.3-173.9-160.82.5107.8P40 T44P40-R42 PolarHBondContact O-N 2.74Å; R42-T44 VanDerWaalsContact C-N 3.3Å; R42-T44 PolarHBondContact O-N 3.25Å
43C44.8Very low50.1Low124 Ų124122.7 Ų122.784%0.83868%0.682SS**  trans-63.894169.8-177.10000108.9T41 G45T41-C43 PolarHBondContact O-N 2.83Å; T41-C43 VanDerWaalsContact O-N 3.16Å; C43-G45 PolarHBondContact O-N 3.19Å
44T56.2Low51.4Low91 Ų91118.5 Ų118.556%0.55867%0.669SS**  trans-67.2114.4160.9163.60000106.7R42 F46 E50R42-T44 VanDerWaalsContact C-N 3.3Å; R42-T44 PolarHBondContact O-N 3.25Å; T44-F46 PolarHBondContact O-N 2.97Å; T44-E50 VanDerWaalsContact CG2-OE1 3.29Å; T44-E50 WeakPolarHBondContact CG2-OE1 3.49Å; T44-E50 PolarHBondContact OG1-OE2 3.17Å
45G50.9Low52.5Low57 Ų57119.3 Ų119.359%0.58867%0.665SS**  trans-86.4112.5-169.800000111.7C43 G47C43-G45 PolarHBondContact O-N 3.19Å; G45-G47 PolarHBondContact O-N 3.03Å
46F51.9Low53.6Low194 Ų194123.4 Ų123.485%0.85167%0.669SS**  trans35.250.6163-73.2-82000115T44 I48T44-F46 PolarHBondContact O-N 2.97Å; F46-I48 PolarHBondContact O-N 2.65Å
47G63.2Low54.4Low24 Ų24127.2 Ų127.225%0.24768%0.68CS.*  trans-71.8125.1174.700000109.8G45 Q49 E50 I51G45-G47 PolarHBondContact O-N 3.03Å; G47-Q49 PolarHBondContact O-N 2.96Å; G47-E50 PolarHBondContact O-N 2.85Å; G47-I51 PolarHBondContact O-N 3.33Å
48I64.2Low54.9Low125 Ų125125.4 Ų125.464%0.64168%0.676SS**Hα-helixtrans-55.9-27.7175.9-66.9169.5000111.1F46 E50 I51 L52F46-I48 PolarHBondContact O-N 2.65Å; I48-E50 PolarHBondContact O-N 2.7Å; I48-I51 PolarHBondContact O-N 3.43Å; I48-L52 HydrophobicContact CG2-CD1 3.68Å; I48-L52 HydrophobicContact CG2-CG 4.1Å; I48-L52 WeakPolarHBondContact O-CB 3.08Å; I48-L52 VanDerWaalsContact O-CG 3.31Å; I48-L52 WeakPolarHBondContact O-CG 3.45Å; I48-L52 PolarHBondContact O-N 2.89Å
49Q62.1Low54.8Low133 Ų133124.1 Ų124.162%0.62168%0.682SS**Hα-helixtrans-64.6-29.8174.2-74164-29.600114.6G47 G53 L54G47-Q49 PolarHBondContact O-N 2.96Å; Q49-G53 PolarHBondContact O-N 3.05Å; Q49-L54 PolarHBondContact O-N 3.4Å
50E65.4Low54.5Low97 Ų97124.5 Ų124.545%0.45369%0.687SS.*Hα-helixtrans-75.3-41.5173.1-71.2177.9130.600110.8T44 G47 I48 L52 G53T44-E50 VanDerWaalsContact CG2-OE1 3.29Å; T44-E50 WeakPolarHBondContact CG2-OE1 3.49Å; T44-E50 PolarHBondContact OG1-OE2 3.17Å; G47-E50 PolarHBondContact O-N 2.85Å; I48-E50 PolarHBondContact O-N 2.7Å; E50-L52 VanDerWaalsContact C-N 3.28Å; E50-L52 PolarHBondContact O-N 2.94Å; E50-G53 PolarHBondContact O-N 2.89Å; E50-G53 VanDerWaalsContact O-N 3.1Å
51I67.3Low54.4Low128 Ų128126.2 Ų126.266%0.65669%0.688SS**Hα-helixtrans-63.9-35.2177.4-57.9174.1000111.1G47 I48G47-I51 PolarHBondContact O-N 3.33Å; I48-I51 PolarHBondContact O-N 3.43Å
52L65.9Low54.2Low114 Ų114125.2 Ų125.260%0.59768%0.684SS**THydrogen-bonded Turntrans-87.11176.4-63.4177.7000113.9I48 E50 L54I48-L52 HydrophobicContact CG2-CD1 3.68Å; I48-L52 HydrophobicContact CG2-CG 4.1Å; I48-L52 WeakPolarHBondContact O-CB 3.08Å; I48-L52 VanDerWaalsContact O-CG 3.31Å; I48-L52 WeakPolarHBondContact O-CG 3.45Å; I48-L52 PolarHBondContact O-N 2.89Å; E50-L52 VanDerWaalsContact C-N 3.28Å; E50-L52 PolarHBondContact O-N 2.94Å; L52-L54 HydrophobicContact CB-CD1 4.16Å; L52-L54 HydrophobicContact CB-CG 3.98Å; L52-L54 PolarHBondContact O-N 2.92Å
53G63.5Low53.9Low40 Ų40125.7 Ų125.741%0.41269%0.686SS.*THydrogen-bonded Turntrans62.923172.900000115.7Q49 E50 N55Q49-G53 PolarHBondContact O-N 3.05Å; E50-G53 PolarHBondContact O-N 2.89Å; E50-G53 VanDerWaalsContact O-N 3.1Å; G53-N55 VanDerWaalsContact C-N 3.34Å; G53-N55 PolarHBondContact O-N 3.19Å
54L60.9Low53.6Low126 Ų126125 Ų12566%0.6668%0.682SS**  trans-79.8-10.3-170.4-63.6178.6000114.5Q49 L52 K56Q49-L54 PolarHBondContact O-N 3.4Å; L52-L54 HydrophobicContact CB-CD1 4.16Å; L52-L54 HydrophobicContact CB-CG 3.98Å; L52-L54 PolarHBondContact O-N 2.92Å; L54-K56 VanDerWaalsContact C-N 3.35Å; L54-K56 PolarHBondContact O-N 2.7Å
55N56.6Low52.9Low130 Ų130126.6 Ų126.670%0.69569%0.694SS**  trans-78.284.4172-75.9-49.2000110.7G53G53-N55 VanDerWaalsContact C-N 3.34Å; G53-N55 PolarHBondContact O-N 3.19Å
56K61.5Low52.1Low190 Ų190131.3 Ų131.383%0.82671%0.705SS**  trans-133.179167.3-63.7-177.9-168.5-65.20109.3L54L54-K56 VanDerWaalsContact C-N 3.35Å; L54-K56 PolarHBondContact O-N 2.7Å
57E55.1Low51.3Low185 Ų185127.7 Ų127.786%0.86470%0.704SS**  trans-121.7133.4173-156.7165-148.200108.7
58P45Very low50.1Low107 Ų107131.4 Ų131.470%0.69573%0.726SS**PPolyproline II helixtrans-73.6156.9-171.429.4-35.2000112.6S60P58-S60 PolarHBondContact O-N 2.85Å
59P39.9Very low48.7Very low132 Ų132132.9 Ų132.986%0.85774%0.735SS**PPolyproline II helixtrans-68.5119.8-171.727.2-34.9000112.4
60S39Very low47.9Very low118 Ų118132.2 Ų132.283%0.82574%0.742SS**PPolyproline II helixtrans-87.7134173.656.60000112P58P58-S60 PolarHBondContact O-N 2.85Å
61I39.6Very low46.8Very low157 Ų157132.8 Ų132.881%0.80576%0.763SS**PPolyproline II helixtrans-66.5138.4179.9-63.9164.3000110
62P43.3Very low45.5Very low120 Ų120130.6 Ų130.678%0.77977%0.772SS**PPolyproline II helixtrans-69.7138.2-178.828.8-35.6000112.2
63R36.2Very low44.2Very low247 Ų247129.8 Ų129.893%0.93278%0.782SS**  trans-110.9141.2165.6-83-171.3151.1105.1-0.6111
64S38.1Very low43.4Very low109 Ų109136.9 Ų136.976%0.76280%0.804SS**  trans-74.1159.2-176.8410000113.1
65P41.7Very low42.8Very low125 Ų125139.1 Ų139.181%0.81282%0.815SS**  trans-82.9143.5-177.933.7-34.4000112
66L33.7Very low42.3Very low157 Ų157140.9 Ų140.982%0.82282%0.823SS**  trans-123118.6170.1-75.1178.7000111.6
67S35.5Very low41.2Very low118 Ų118136.4 Ų136.483%0.82582%0.821SS**  trans44.1146.6140.854.80000122.3
68S37.9Very low40.4Very low102 Ų102132 Ų13271%0.71382%0.817SS**  trans-107.3171.2-165.8530000115.3
69L34.3Very low40Very low156 Ų156138.5 Ų138.582%0.81783%0.828SS**  trans75.9157.5164.6-91.775.3000118.9
70P45.3Very low39.9Very low119 Ų119138.3 Ų138.377%0.77383%0.83SS**  cis-127.4179-25.832.8-14.2000113.4
71A41.5Very low40.1Very low109 Ų109139.1 Ų139.190%0.90183%0.829SS**  trans-89.6146.6179.800000113.4
72G41.5Very low40.3Very low81 Ų81139.9 Ų139.984%0.83583%0.834SS**  trans146.995.5159.900000116.1
73A37.8Very low40Very low98 Ų98136.8 Ų136.881%0.8182%0.824SS**  trans-164.7122.5153.100000110.5
74H47.5Very low40.7Very low189 Ų189131.4 Ų131.488%0.87582%0.821SS**  trans-86.5138.9163.1-73-106.3000108.9
75L46.7Very low40.5Very low172 Ų172130.7 Ų130.790%0.90182%0.822SS**  trans-137130158.5-76.5179.8000111.1
76I46.6Very low40.2Very low168 Ų168128.8 Ų128.886%0.86282%0.816SS**  trans-99.6133.1168.3-65.6170.1000106.9
77A38.3Very low40.5Very low95 Ų95128.6 Ų128.679%0.78582%0.821SS**  trans-145.3103.3163.400000107
78A39Very low40.5Very low94 Ų94126.5 Ų126.578%0.77782%0.819SS**  93.21237100000111
79R37.6Very low40.6Very low243 Ų243129.2 Ų129.292%0.91783%0.83SS**  trans-91.2133-175.6-61.8162.671.9-179.64109
80S37.4Very low40.7Very low128 Ų128125.1 Ų125.190%0.89583%0.826SS**  trans-85.1123.2171.1-60.80000110.9
81V43.5Very low40.4Very low135 Ų135126.5 Ų126.582%0.81883%0.832SS**  trans-116.8131.1164.3170.40000106.7
82L42.3Very low40.1Very low172 Ų172124.5 Ų124.590%0.90182%0.822SS**  trans-146.6102.1173.2-163.867.2000110.7
83G37.4Very low40.5Very low55 Ų55129.3 Ų129.357%0.56783%0.825SS**  trans-92.1-167.9146.500000109.2
84P50.7Low40.6Very low134 Ų134128 Ų12887%0.8782%0.821SS**  cis-122.417620.637-19000112.6
85A35Very low40.5Very low95 Ų95127.2 Ų127.279%0.78582%0.822SS**  159.3163.972.900000106.5
86A33.8Very low40.7Very low84 Ų84127.3 Ų127.369%0.69482%0.822SS**  cis-165.8162.1-2400000108.8
87V40.2Very low40.1Very low153 Ų153122.6 Ų122.693%0.92781%0.814SS**  trans60123.5163.7-1550000119.2
88G35.7Very low40.6Very low75 Ų75124.1 Ų124.177%0.77382%0.817SS**  trans173.597.7165.500000114
89V41.3Very low40.8Very low158 Ų158123.7 Ų123.796%0.95882%0.821SS**  trans-81134.1173.31760000109.3
90G35.2Very low40.8Very low71 Ų71115.5 Ų115.573%0.73281%0.813SS**  trans-164.8110.6-178.800000114.9
91V40.1Very low41.6Very low148 Ų148117.3 Ų117.390%0.89781%0.81SS**  trans-47.2143.5173.4-175.80000113
92G34.3Very low41.8Very low66 Ų66115.9 Ų115.968%0.6880%0.804SS**  trans-78.7168.8179.500000114.8
93M49.7Very low41.8Very low183 Ų183113.6 Ų113.690%0.90180%0.802SS**  trans-151.2127.3156.4-157.676.190.700108
94G39.3Very low42.1Very low70 Ų70119.8 Ų119.872%0.72281%0.814SS**  trans-83.5139.1170.700000110.4
95L46.2Very low41.6Very low172 Ų172123.7 Ų123.790%0.90181%0.813SS**  trans-134.3119.7158.6-80.2179.6000110
96I50.9Low42.1Very low174 Ų174124.5 Ų124.589%0.89281%0.813SS**  trans-77.2123.2173.9-69.9161000107.9
97G34.9Very low42.9Very low69 Ų69128.4 Ų128.471%0.71182%0.817SS**  trans-121.6120.9171.800000110.3
98P47.1Very low43.1Very low128 Ų128127 Ų12783%0.83181%0.811SS**  trans-88.2133.3-176.833-32.5000112.5
99G45Very low43.6Very low85 Ų85128.4 Ų128.488%0.87682%0.815SS**  trans102.6105.1163.600000115.5
100G37.4Very low43.5Very low71 Ų71129.7 Ų129.773%0.73281%0.808SS**  trans178.9102.8171.700000113.6
101I53.3Low43.9Very low165 Ų165133.6 Ų133.685%0.84681%0.812SS**  trans42.2107157.750.1170000119.9S103I101-S103 PolarHBondContact O-N 3.43Å
102P47Very low43.9Very low105 Ų105135.5 Ų135.568%0.68281%0.81SS**  trans-74.3124161.331.5-32.2000110.8F104P102-F104 VanDerWaalsContact C-N 3.33Å; P102-F104 HydrophobicContact CB-CD2 3.92Å; P102-F104 HydrophobicContact CB-CE2 4.18Å; P102-F104 HydrophobicContact CG-CD2 4.09Å; P102-F104 HydrophobicContact CG-CE2 4.42Å; P102-F104 PolarHBondContact O-N 3.09Å
103S43.3Very low44.1Very low124 Ų124138.5 Ų138.587%0.86782%0.816SS**  trans-74.280176.7-170.40000111.7I101 Y105I101-S103 PolarHBondContact O-N 3.43Å; S103-Y105 PolarHBondContact O-N 3.42Å; S103-Y105 VanDerWaalsContact O-N 3.1Å
104F43.9Very low43.6Very low186 Ų186136.3 Ų136.382%0.81681%0.813SS**  trans-82.571.9178.3-99.7-81.3000112.8P102P102-F104 VanDerWaalsContact C-N 3.33Å; P102-F104 HydrophobicContact CB-CD2 3.92Å; P102-F104 HydrophobicContact CB-CE2 4.18Å; P102-F104 HydrophobicContact CG-CD2 4.09Å; P102-F104 HydrophobicContact CG-CE2 4.42Å; P102-F104 PolarHBondContact O-N 3.09Å
105Y40.5Very low43.4Very low215 Ų215140.4 Ų140.484%0.84382%0.817SS**  trans-157.667.7143.7-138.1-95.1000112.5S103S103-Y105 PolarHBondContact O-N 3.42Å; S103-Y105 VanDerWaalsContact O-N 3.1Å
106S45.3Very low43.1Very low112 Ų112138.5 Ų138.578%0.78382%0.818SS**  trans-72.9137.1165.8-170.70000110.1
107Q49.7Very low42.3Very low166 Ų166137.6 Ų137.678%0.77682%0.815SS**  trans-72.1138.3176.1-65.3-166.7-15.800111A109Q107-A109 PolarHBondContact O-N 3.45Å
108P45.7Very low42.5Very low125 Ų125136.8 Ų136.881%0.81281%0.806SS**  trans-79.384.7176.832.3-34000111.1F110P108-F110 PolarHBondContact O-N 2.97Å
109A44.4Very low41.9Very low104 Ų104139.9 Ų139.986%0.8681%0.81SS**  trans-78.386.2160.100000108.8Q107Q107-A109 PolarHBondContact O-N 3.45Å
110F39.7Very low41.4Very low184 Ų184143.1 Ų143.181%0.80781%0.807SS**  trans-93.6127179.7-152-105.3000111P108P108-F110 PolarHBondContact O-N 2.97Å
111L43.6Very low41.3Very low154 Ų154146.5 Ų146.581%0.80681%0.813SS**SBendtrans74.273.3174.5-63.2166000118.1
112E41.5Very low40.5Very low187 Ų187146 Ų14687%0.87481%0.807SS**  trans-144.4141.9142.2-154.5164.6-159.700109.6
113T37.2Very low39.9Very low130 Ų130148.4 Ų148.480%0.79881%0.813SS**  trans8559.8169.8-28.90000120.4
114V40.1Very low39.5Very low137 Ų137148.9 Ų148.983%0.8380%0.802SS**SBendtrans-157108.9143.7-174.50000106.2
115L35.6Very low38.8Very low156 Ų156148.9 Ų148.982%0.81780%0.804SS**  cis-132.4147.39.9-64.5101.3000111.5
116S38.7Very low38.5Very low131 Ų131145.4 Ų145.492%0.91680%0.795SS**  trans-136.394.4153.6-80.70000108.7
117D34.5Very low38Very low155 Ų155145.3 Ų145.383%0.82979%0.794SS**  trans-163.3130.4158.1-148.723.2000106.2
118G39Very low37.1Very low52 Ų52148.3 Ų148.354%0.53680%0.799SS.*  cis145.379.3-1.200000111.3
119Q34.1Very low36.4Very low194 Ų194147.5 Ų147.591%0.90780%0.796SS**  trans-166.8146.7163.7-106.9135.94500114.5
120D35.2Very low36Very low153 Ų153148.6 Ų148.682%0.81879%0.791SS**  trans-50.3145.6171.7-68.8-90.3000115
121V34.6Very low35.7Very low142 Ų142148.6 Ų148.686%0.86179%0.786SS**  -149.2132.8113.5-160.90000110.7
122H36.8Very low35.9Very low154 Ų154145.9 Ų145.971%0.71378%0.778SS**  trans-75.2132167.2160.2104.6000111.9
123L34.4Very low35.9Very low155 Ų155143.9 Ų143.981%0.81277%0.773SS**  trans-169.7140141.7-108.1147.9000113.4
124Q34.8Very low35.9Very low135 Ų135143.2 Ų143.263%0.63176%0.764SS**  trans-76.6156.7169.9-73.3-132.434.200111.8H126Q124-H126 PolarHBondContact OE1-CE1 3.47Å; Q124-H126 PolarHBondContact OE1-ND1 3.03Å
125H29.6Very low36.4Very low186 Ų186142.2 Ų142.286%0.86176%0.761SS**  trans-139.6131144.5-145.7-87.5000112.1
126H35.1Very low36.4Very low142 Ų142138.8 Ų138.866%0.65775%0.749SS**  trans-85.4172.3177.1-87.213.4000112.1Q124Q124-H126 PolarHBondContact OE1-CE1 3.47Å; Q124-H126 PolarHBondContact OE1-ND1 3.03Å
127S33.5Very low36.6Very low109 Ų109141.2 Ų141.276%0.76275%0.746SS**  trans-60.5164.6-178.250.20000115.7
128R31Very low36.8Very low230 Ų230138.7 Ų138.787%0.86874%0.741SS**  147.7124.3111.2-177169.1-164-1545.4115.9
129S31.4Very low37.1Very low108 Ų108141.1 Ų141.176%0.75576%0.755SS**  trans62.2160.3153.2-137.10000116.6
130V35.2Very low37.7Very low126 Ų126137.2 Ų137.276%0.76475%0.75SS**  cis-148.2150331740000111.4
131R34Very low38.7Very low184 Ų184135.6 Ų135.669%0.69475%0.75SS**  trans-114.1142.9165.4179.9-171.6168.3169-0.9109.5D134R131-D134 IonicContact CZ-OD2 3.94Å; R131-D134 IonicContact NH2-OD2 2.87Å; R131-D134 PolarHBondContact NH2-OD2 3.1Å
132P47Very low39.3Very low98 Ų98134.7 Ų134.764%0.63674%0.741SS**  -139.3127.3129.812.211000113.5
133L41.5Very low40.1Very low145 Ų145132.9 Ų132.976%0.75975%0.745SS**  93.9115.5107.3-69.1169.9000111.2
134D37.2Very low41Very low115 Ų115133.3 Ų133.362%0.61574%0.743SS**  55.6143.557.3-95-52000114.1R131R131-D134 IonicContact CZ-OD2 3.94Å; R131-D134 IonicContact NH2-OD2 2.87Å; R131-D134 PolarHBondContact NH2-OD2 3.1Å
135P50.7Low41.4Very low117 Ų117133 Ų13376%0.7675%0.746SS**  cis-128.4-178.232.744.9-28.9000114.1
136S35.2Very low42.2Very low83 Ų83131.4 Ų131.458%0.5874%0.743SS**  cis-171.3142.635.650.50000115.7
137Q43.1Very low42.5Very low183 Ų183129.5 Ų129.586%0.85575%0.745SS**  trans69.2139.4141-66.6177.991.500119.9
138S39.4Very low42.8Very low102 Ų102129.6 Ų129.671%0.71375%0.746SS**  cis-169.7152.91.638.20000114.3
139A44.9Very low43.2Very low102 Ų102126 Ų12684%0.84374%0.744SS**  trans62.8144.6156.200000118.9
140S47.6Very low43.7Very low113 Ų113126.9 Ų126.979%0.7974%0.736SS**  cis-148.7-170.3-6.557.80000107.9
141S55.2Low44.3Very low118 Ų118131.8 Ų131.883%0.82574%0.741SS**  cis-154.7-162.111.3-152.50000111.2
142D48.7Very low45Very low124 Ų124132.6 Ų132.666%0.66374%0.744SS**  trans-120.1152.3-169.1174.542.1000114.6
143S52.8Low44.8Very low115 Ų115136.2 Ų136.280%0.80475%0.752SS**  trans-179138.6136.538.60000115
144E54Low44.6Very low164 Ų164135.8 Ų135.877%0.76676%0.756SS**  trans-69139.7-174.8-58.8-79.389.100114.5
145D43.3Very low45.1Very low130 Ų130140 Ų14070%0.69577%0.769SS**  74.6141.894-160.528.7000117.8
146L45.8Very low44.9Very low151 Ų151139.4 Ų139.479%0.79177%0.767SS**  trans152.3101.7140.2-78.2-173.4000114.3
147S40.5Very low45.1Very low102 Ų102141 Ų14171%0.71378%0.778SS**  75.2109.5126.3-1540000122.9
148S40.2Very low45.5Very low111 Ų111140.2 Ų140.278%0.77678%0.778SS**  65.8118126.6-160.80000122.4
149N39.7Very low45.8Very low154 Ų154140.3 Ų140.382%0.82478%0.779SS**  -151.3163119.8-155.18.2000113
150E41.5Very low46.1Very low127 Ų127143.3 Ų143.359%0.59378%0.775SS**  trans-55.5145.7-161.6-82-167.196.200119.1R152E150-R152 HydrophobicContact CB-CG 4.48Å; E150-R152 IonicContact OE1-CZ 3.86Å; E150-R152 VanDerWaalsContact OE1-CZ 3.23Å; E150-R152 IonicContact OE1-NE 2.64Å; E150-R152 PolarHBondContact OE1-NE 3.12Å; E150-R152 IonicContact OE1-NH2 3.23Å; E150-R152 PolarHBondContact OE1-NH2 2.81Å
151R48.6Very low45.9Very low229 Ų229145.5 Ų145.586%0.86478%0.778SS**  trans-78115.1150.4-58.3177.1-168.5171.44.5109.8
152R47.4Very low45.7Very low202 Ų202148.1 Ų148.176%0.76278%0.775SS**  trans-127.7119.8158.4-71.6-68.1172166.7-3111E150E150-R152 HydrophobicContact CB-CG 4.48Å; E150-R152 IonicContact OE1-CZ 3.86Å; E150-R152 VanDerWaalsContact OE1-CZ 3.23Å; E150-R152 IonicContact OE1-NE 2.64Å; E150-R152 PolarHBondContact OE1-NE 3.12Å; E150-R152 IonicContact OE1-NH2 3.23Å; E150-R152 PolarHBondContact OE1-NH2 2.81Å
153H44.4Very low46.1Very low174 Ų174152.6 Ų152.681%0.80679%0.788SS**  trans-81.8126177.4-66.6-88.5000111.1
154T36.8Very low46.6Very low136 Ų136158.1 Ų158.183%0.83479%0.791SS**  trans-131.782.6155.445.10000110.1S156T154-S156 PolarHBondContact O-N 2.96Å
155K47.3Very low47.4Very low204 Ų204160.1 Ų160.189%0.88780%0.798SS**  trans-87.381.7176.9-174.7177.1176.8176.60110.7
156S46Very low48.9Very low103 Ų103161.9 Ų161.972%0.7280%0.799SS**  trans-161.198.5165.546.10000109.3T154T154-S156 PolarHBondContact O-N 2.96Å
157S40.6Very low50.5Low116 Ų116165.3 Ų165.381%0.81180%0.802SS**  -174.381.778.9380000111S159S157-S159 PolarHBondContact O-N 3.18Å
158I50.8Low52.5Low168 Ų168171.8 Ų171.886%0.86281%0.81SS**  trans-85.783.1171-159.772.5000109.6
159S46.6Very low54.6Low103 Ų103173.4 Ų173.472%0.7281%0.805SS**  trans-159.9134.4174.4-84.50000111.6S157S157-S159 PolarHBondContact O-N 3.18Å
160Q50.4Low57.1Low166 Ų166176.6 Ų176.678%0.77681%0.806SS**  trans61.264.3167-50.3-55.9-32.100117.2
161N43.7Very low59.5Low159 Ų159172.4 Ų172.485%0.8579%0.789SS**  trans-129112.1143.1-131.3-34.6000111.7
162K51.4Low61.7Low172 Ų172168.7 Ų168.775%0.74879%0.785SS**  trans-61.7149.9-173.2-65.6166.4-179.5174.20109.8R164K162-R164 PolarHBondContact O-N 3.41Å
163K56.8Low64.1Low219 Ų219161.6 Ų161.695%0.95276%0.76SS**  trans-57.960.3-170.6-60.6173.8179.8173.70115.5K165K163-K165 PolarHBondContact O-N 2.98Å
164R63.5Low66.6Low230 Ų230157 Ų15787%0.86874%0.744SS**  trans-71.595.9168.1-84.7-174.7155.1-168.9-5.9108.4K162 K166K162-R164 PolarHBondContact O-N 3.41Å; R164-K166 PolarHBondContact O-N 3.23Å
165K69.3Low69.5Low206 Ų206154.5 Ų154.590%0.89673%0.732SS**  trans-48.7102.4177.8-161.1167.8-170.6168.30109.7K163 R167K163-K165 PolarHBondContact O-N 2.98Å; K165-R167 PolarHBondContact O-N 3.36Å
166K74.8Confident71.9Confident167 Ų167150.1 Ų150.173%0.72671%0.71SS**  trans-56.4115.9-176.1-173.3172.2179.5176.90108.3R164 R168 H169R164-K166 PolarHBondContact O-N 3.23Å; K166-R168 PolarHBondContact O-N 3.06Å; K166-H169 WeakPolarHBondContact CE-NE2 3.29Å
167R79.7Confident74.4Confident224 Ų224146.4 Ų146.485%0.84568%0.682SS**PPolyproline II helixtrans-56.1126.7-179.9-173.1176.9-177.1177.21.8107.8K165 H169K165-R167 PolarHBondContact O-N 3.36Å; R167-H169 PolarHBondContact O-N 3.46Å
168R82.3Confident77.2Confident238 Ų238144 Ų14490%0.89866%0.659SS**PPolyproline II helixtrans-55.1134.2-179.1-56.1-170.5-157.4-154.67.4109K166 R170K166-R168 PolarHBondContact O-N 3.06Å; R168-R170 PolarHBondContact O-N 3.34Å
169H85.6Confident79.4Confident144 Ų144141.3 Ų141.367%0.66764%0.643SS**PPolyproline II helixtrans-59.4132.3176.6-53.8112.4000109.4K166 R167K166-H169 WeakPolarHBondContact CE-NE2 3.29Å; R167-H169 PolarHBondContact O-N 3.46Å
170R91.3Very high81.9Confident221 Ų221137.8 Ų137.883%0.83462%0.615SS**PPolyproline II helixtrans-96.4128.2-178.9-179.2-179.7179.5179.61.4108.6R168 I172R168-R170 PolarHBondContact O-N 3.34Å; R170-I172 PolarHBondContact O-N 3.3Å
171T92.6Very high84.2Confident39 Ų39129.9 Ų129.924%0.23958%0.578CS.*PPolyproline II helixtrans-62.3129.8169.1-48.10000109.5F173 L205 R209T171-F173 HydrophobicContact CG2-CD1 4.08Å; T171-F173 HydrophobicContact CG2-CE1 3.7Å; T171-F173 HydrophobicContact CG2-CZ 4.06Å; T171-L205 HydrophobicContact CG2-CD2 4.29Å; T171-R209 WeakPolarHBondContact OG1-CD 3.42Å; T171-R209 PolarHBondContact OG1-NE 2.8Å; T171-R209 PolarHBondContact OG1-NH1 2.87Å
172I94.4Very high86.8Confident152 Ų152126.1 Ų126.178%0.77956%0.556SS**  trans-104.4132167.5-55.4177.5000105.3R170R170-I172 PolarHBondContact O-N 3.3Å
173F97.2Very high89Confident53 Ų53123.3 Ų123.323%0.23254%0.543CS..  trans-98.1143.5179.6-56.7-73.4000109.4T171 Q177 L178 L205 R209 W213T171-F173 HydrophobicContact CG2-CD1 4.08Å; T171-F173 HydrophobicContact CG2-CE1 3.7Å; T171-F173 HydrophobicContact CG2-CZ 4.06Å; F173-Q177 HydrophobicContact CB-CB 4.42Å; F173-L178 HydrophobicContact CB-CD1 4.4Å; F173-L178 HydrophobicContact CB-CD2 3.76Å; F173-L178 HydrophobicContact CB-CG 3.81Å; F173-L178 HydrophobicContact CD2-CD2 4.18Å; F173-L178 HydrophobicContact CG-CD2 4.16Å; F173-L205 HydrophobicContact CD1-CD1 3.63Å; F173-L205 HydrophobicContact CD1-CD2 3.98Å; F173-L205 HydrophobicContact CD1-CG 4.49Å; F173-L205 HydrophobicContact CE1-CD1 3.73Å; F173-L205 HydrophobicContact CE1-CD2 4.03Å; F173-R209 HydrophobicContact CE1-CB 4.41Å; F173-W213 AromaticContact CE2-CD1 3.68Å; F173-W213 HydrophobicContact CZ-CB 4.36Å; F173-W213 AromaticContact CZ-CD1 3.96Å
174T98.3Very high90.9Very high77 Ų77113.6 Ų113.647%0.47250%0.504SS..  trans-76.2167.9171.570.10000110.9Q177 L178T174-Q177 PolarHBondContact O-N 3.06Å; T174-Q177 VanDerWaalsContact OG1-CG 3.27Å; T174-Q177 WeakPolarHBondContact OG1-CG 3.39Å; T174-Q177 PolarHBondContact OG1-N 2.91Å; T174-L178 WeakPolarHBondContact O-CG 3.32Å; T174-L178 PolarHBondContact O-N 3.04Å; T174-L178 VanDerWaalsContact O-N 3.1Å
175S97.8Very high92.6Very high83 Ų83102.8 Ų102.858%0.5846%0.463SS*.Hα-helixtrans-58.9-51.4176.2-158.80000111.1Q177 L178 E179S175-Q177 VanDerWaalsContact C-N 3.32Å; S175-Q177 PolarHBondContact O-N 3.35Å; S175-L178 CarbonylContact O-C 3.59Å; S175-L178 WeakPolarHBondContact O-CA 3.38Å; S175-L178 WeakPolarHBondContact O-CB 3.32Å; S175-L178 PolarHBondContact O-N 3.41Å; S175-E179 VanDerWaalsContact CB-OE1 3.27Å; S175-E179 WeakPolarHBondContact CB-OE1 3.48Å; S175-E179 WeakPolarHBondContact O-CG 3.46Å; S175-E179 PolarHBondContact O-N 2.99Å; S175-E179 PolarHBondContact OG-OE1 3.37Å
176Y98Very high93.9Very high112 Ų11298.6 Ų98.644%0.43945%0.451SS..Hα-helixtrans-52.1-46.1176.6177-108.8000113.4L178 E179 E180Y176-L178 VanDerWaalsContact C-N 3.33Å; Y176-L178 PolarHBondContact O-N 3.37Å; Y176-E179 PolarHBondContact O-N 3.26Å; Y176-E180 HydrophobicContact CD2-CG 4.41Å; Y176-E180 HydrophobicContact CE1-CG 4.32Å; Y176-E180 HydrophobicContact CE2-CG 3.81Å; Y176-E180 PolarHBondContact O-N 2.8Å; Y176-E180 PolarHBondContact OH-OE1 3.1Å
177Q98.1Very high94.9Very high25 Ų2597.5 Ų97.512%0.11745%0.448CS..Hα-helixtrans-62.5-40176.9-72.1173.3-21.400112F173 T174 S175 L181 T203 L205F173-Q177 HydrophobicContact CB-CB 4.42Å; T174-Q177 PolarHBondContact O-N 3.06Å; T174-Q177 VanDerWaalsContact OG1-CG 3.27Å; T174-Q177 WeakPolarHBondContact OG1-CG 3.39Å; T174-Q177 PolarHBondContact OG1-N 2.91Å; S175-Q177 VanDerWaalsContact C-N 3.32Å; S175-Q177 PolarHBondContact O-N 3.35Å; Q177-L181 WeakPolarHBondContact O-CB 3.25Å; Q177-L181 WeakPolarHBondContact O-CD1 3.15Å; Q177-L181 WeakPolarHBondContact O-CG 3.45Å; Q177-L181 PolarHBondContact O-N 3.37Å; Q177-L181 VanDerWaalsContact O-N 3.12Å; Q177-T203 PolarHBondContact NE2-O 3.22Å; Q177-L205 HydrophobicContact CB-CD1 4.16Å; Q177-L205 HydrophobicContact CG-CD1 4.16Å; Q177-L205 HydrophobicContact CG-CG 4.45Å
178L98.3Very high95.7Very high66 Ų6688.9 Ų88.935%0.34643%0.425SS..Hα-helixtrans-68.3-41176.5-68.1173000111.7F173 T174 S175 Y176 L181 E182 W213F173-L178 HydrophobicContact CB-CD1 4.4Å; F173-L178 HydrophobicContact CB-CD2 3.76Å; F173-L178 HydrophobicContact CB-CG 3.81Å; F173-L178 HydrophobicContact CD2-CD2 4.18Å; F173-L178 HydrophobicContact CG-CD2 4.16Å; T174-L178 WeakPolarHBondContact O-CG 3.32Å; T174-L178 PolarHBondContact O-N 3.04Å; T174-L178 VanDerWaalsContact O-N 3.1Å; S175-L178 CarbonylContact O-C 3.59Å; S175-L178 WeakPolarHBondContact O-CA 3.38Å; S175-L178 WeakPolarHBondContact O-CB 3.32Å; S175-L178 PolarHBondContact O-N 3.41Å; Y176-L178 VanDerWaalsContact C-N 3.33Å; Y176-L178 PolarHBondContact O-N 3.37Å; L178-L181 PolarHBondContact O-N 2.8Å; L178-E182 WeakPolarHBondContact O-CB 3.2Å; L178-E182 VanDerWaalsContact O-CG 3.3Å; L178-E182 WeakPolarHBondContact O-CG 3.41Å; L178-E182 PolarHBondContact O-N 3.05Å; L178-W213 VanDerWaalsContact CD2-NE1 3.33Å
179E98.1Very high96.4Very high111 Ų11180.1 Ų80.152%0.51939%0.394SS..Hα-helixtrans-60.3-47.4178.2-71.1155.2-137.800111.7S175 Y176 E182 K183S175-E179 VanDerWaalsContact CB-OE1 3.27Å; S175-E179 WeakPolarHBondContact CB-OE1 3.48Å; S175-E179 WeakPolarHBondContact O-CG 3.46Å; S175-E179 PolarHBondContact O-N 2.99Å; S175-E179 PolarHBondContact OG-OE1 3.37Å; Y176-E179 PolarHBondContact O-N 3.26Å; E179-E182 PolarHBondContact O-N 2.86Å; E179-K183 WeakPolarHBondContact O-CB 3.36Å; E179-K183 PolarHBondContact O-N 2.89Å
180E98.3Very high97Very high30 Ų3080.8 Ų80.814%0.1439%0.392CS..Hα-helixtrans-65.8-40.1176.5-72.2-68178.300112.6Y176 K183 A184 K202 T203Y176-E180 HydrophobicContact CD2-CG 4.41Å; Y176-E180 HydrophobicContact CE1-CG 4.32Å; Y176-E180 HydrophobicContact CE2-CG 3.81Å; Y176-E180 PolarHBondContact O-N 2.8Å; Y176-E180 PolarHBondContact OH-OE1 3.1Å; E180-K183 PolarHBondContact O-N 2.83Å; E180-A184 PolarHBondContact O-N 3.43Å; E180-K202 WeakPolarHBondContact OE1-CE 3.42Å; E180-K202 IonicContact OE1-NZ 2.7Å; E180-K202 PolarHBondContact OE1-NZ 3.27Å; E180-K202 WeakPolarHBondContact OE2-CE 3.48Å; E180-K202 IonicContact OE2-NZ 3.13Å; E180-K202 PolarHBondContact OE2-NZ 2.87Å; E180-T203 HydrophobicContact CB-CG2 3.87Å
181L98.3Very high97.3Very high0 Ų071 Ų710%036%0.357CS..Hα-helixtrans-67.9-36.6175.8-70.5170.1000112.4Q177 L178 F185 L199 L205 I210 W213 F214Q177-L181 WeakPolarHBondContact O-CB 3.25Å; Q177-L181 WeakPolarHBondContact O-CD1 3.15Å; Q177-L181 WeakPolarHBondContact O-CG 3.45Å; Q177-L181 PolarHBondContact O-N 3.37Å; Q177-L181 VanDerWaalsContact O-N 3.12Å; L178-L181 PolarHBondContact O-N 2.8Å; L181-F185 VanDerWaalsContact O-CB 3.3Å; L181-F185 WeakPolarHBondContact O-CB 3.36Å; L181-F185 PolarHBondContact O-N 3.27Å; L181-L199 HydrophobicContact CD2-CD1 4.5Å; L181-L205 HydrophobicContact CD1-CD1 4.06Å; L181-I210 HydrophobicContact CD2-CB 4.45Å; L181-I210 HydrophobicContact CD2-CG1 4.09Å; L181-I210 HydrophobicContact CD2-CG2 3.89Å; L181-W213 VanDerWaalsContact C-CH2 3.48Å; L181-W213 HydrophobicContact CB-CD2 4.04Å; L181-W213 HydrophobicContact CB-CE3 4Å; L181-W213 HydrophobicContact CB-CH2 3.7Å; L181-W213 HydrophobicContact CB-CZ2 3.71Å; L181-W213 HydrophobicContact CB-CZ3 3.84Å; L181-W213 HydrophobicContact CD1-CD2 3.97Å; L181-W213 HydrophobicContact CD1-CG 3.94Å; L181-W213 HydrophobicContact CD2-CE3 4.49Å; L181-W213 HydrophobicContact CG-CD2 4.47Å; L181-W213 WeakPolarHBondContact O-CH2 3.39Å; L181-W213 WeakPolarHBondContact O-CZ3 3.32Å; L181-F214 HydrophobicContact CD2-CE2 3.88Å
182E98.1Very high97.5Very high80 Ų8073.6 Ų73.637%0.37437%0.369SS..Hα-helixtrans-72.8-37.3175-69.1-148.5141.300112.2L178 E179 F185 N186 W213 R217L178-E182 WeakPolarHBondContact O-CB 3.2Å; L178-E182 VanDerWaalsContact O-CG 3.3Å; L178-E182 WeakPolarHBondContact O-CG 3.41Å; L178-E182 PolarHBondContact O-N 3.05Å; E179-E182 PolarHBondContact O-N 2.86Å; E182-F185 PolarHBondContact O-N 2.87Å; E182-N186 PolarHBondContact O-N 3.39Å; E182-N186 VanDerWaalsContact O-N 3.08Å; E182-N186 PolarHBondContact O-ND2 2.63Å; E182-W213 HydrophobicContact CG-CH2 3.82Å; E182-W213 HydrophobicContact CG-CZ2 3.75Å; E182-R217 IonicContact OE1-CZ 2.7Å; E182-R217 VanDerWaalsContact OE1-CZ 3.27Å; E182-R217 IonicContact OE1-NE 2.67Å; E182-R217 PolarHBondContact OE1-NE 3.47Å; E182-R217 IonicContact OE1-NH2 3.27Å; E182-R217 PolarHBondContact OE1-NH2 2.85Å; E182-R217 IonicContact OE2-NH2 2.71Å
183K97.9Very high97.7Very high112 Ų11270.1 Ų70.149%0.48736%0.355SS..Hα-helixtrans-56.6-55.4171-179-176.5173.6-176.40110.9E179 E180 F185 N186 E187E179-K183 WeakPolarHBondContact O-CB 3.36Å; E179-K183 PolarHBondContact O-N 2.89Å; E180-K183 PolarHBondContact O-N 2.83Å; K183-F185 VanDerWaalsContact C-N 3.25Å; K183-F185 PolarHBondContact O-N 2.83Å; K183-N186 WeakPolarHBondContact O-CB 3.46Å; K183-N186 PolarHBondContact O-N 3.5Å; K183-N186 VanDerWaalsContact O-N 3.08Å; K183-E187 VanDerWaalsContact CE-OE1 3.22Å; K183-E187 WeakPolarHBondContact CE-OE1 3.25Å; K183-E187 PolarHBondContact O-N 2.89Å
184A97.8Very high97.7Very high16 Ų1674.5 Ų74.513%0.13237%0.371CS..Hα-helixtrans-63.9-29.3179.100000113.1E180 E187 A188 L199 F214E180-A184 PolarHBondContact O-N 3.43Å; A184-E187 PolarHBondContact O-N 2.77Å; A184-A188 PolarHBondContact O-N 2.96Å; A184-L199 HydrophobicContact CB-CD1 3.75Å; A184-L199 HydrophobicContact CB-CD2 3.86Å; A184-L199 HydrophobicContact CB-CG 4.37Å; A184-F214 HydrophobicContact CB-CZ 4.22Å
185F97.8Very high97.7Very high2 Ų272.5 Ų72.51%0.00936%0.362CS..Hα-helixtrans-66.4-36.1173.3-173.1-87.4000113L181 E182 K183 E187 A188 H189 W213 F214 R217 R218 W221L181-F185 VanDerWaalsContact O-CB 3.3Å; L181-F185 WeakPolarHBondContact O-CB 3.36Å; L181-F185 PolarHBondContact O-N 3.27Å; E182-F185 PolarHBondContact O-N 2.87Å; K183-F185 VanDerWaalsContact C-N 3.25Å; K183-F185 PolarHBondContact O-N 2.83Å; F185-E187 VanDerWaalsContact C-N 3.34Å; F185-A188 CarbonylContact O-C 3.42Å; F185-H189 AromaticContact CE1-CD2 3.49Å; F185-H189 VanDerWaalsContact CE1-CD2 3.49Å; F185-H189 WeakPolarHBondContact CE1-CD2 3.45Å; F185-H189 AromaticContact CE1-CE1 3.92Å; F185-H189 AromaticContact CE1-CG 3.98Å; F185-H189 AromaticContact CE1-NE2 3.46Å; F185-H189 WeakPolarHBondContact CE1-NE2 3.32Å; F185-H189 HydrophobicContact CE2-CB 4.45Å; F185-H189 HydrophobicContact CZ-CB 4.38Å; F185-H189 AromaticContact CZ-CD2 3.46Å; F185-H189 VanDerWaalsContact CZ-CD2 3.46Å; F185-H189 WeakPolarHBondContact CZ-CD2 3.49Å; F185-H189 AromaticContact CZ-CG 3.93Å; F185-H189 AromaticContact CZ-NE2 3.93Å; F185-H189 PolarHBondContact O-ND1 3.44Å; F185-W213 HydrophobicContact CB-CH2 4.25Å; F185-W213 HydrophobicContact CB-CZ3 4.14Å; F185-W213 HydrophobicContact CD2-CZ3 4.14Å; F185-W213 HydrophobicContact CG-CZ3 4.45Å; F185-F214 HydrophobicContact CB-CE1 3.97Å; F185-F214 HydrophobicContact CB-CZ 4.35Å; F185-F214 AromaticContact CD2-CD1 3.72Å; F185-F214 HydrophobicContact CD2-CD1 3.72Å; F185-F214 AromaticContact CD2-CE1 3.74Å; F185-F214 HydrophobicContact CD2-CE1 3.74Å; F185-F214 HydrophobicContact CE2-CD1 4.4Å; F185-F214 HydrophobicContact CG-CE1 4.33Å; F185-R217 HydrophobicContact CD1-CG 4.12Å; F185-R217 HydrophobicContact CD2-CB 3.92Å; F185-R217 HydrophobicContact CD2-CG 3.51Å; F185-R217 HydrophobicContact CE1-CG 4.1Å; F185-R217 HydrophobicContact CE2-CB 3.72Å; F185-R217 HydrophobicContact CE2-CG 3.48Å; F185-R217 VanDerWaalsContact CE2-CG 3.48Å; F185-R217 HydrophobicContact CG-CG 3.85Å; F185-R217 HydrophobicContact CZ-CB 4.37Å; F185-R217 HydrophobicContact CZ-CG 3.79Å; F185-R218 HydrophobicContact CE2-CG 3.75Å; F185-R218 HydrophobicContact CZ-CG 4.19Å; F185-W221 HydrophobicContact CE1-CB 4.48Å; F185-W221 HydrophobicContact CE1-CG 4.4Å; F185-W221 HydrophobicContact CZ-CB 4.07Å; F185-W221 HydrophobicContact CZ-CG 4.25Å
186N96.8Very high97.7Very high119 Ų11970.4 Ų70.464%0.63634%0.342SS*.Hα-helixtrans-69.2-34.8176-62.1-29.1000111.5E182 K183E182-N186 PolarHBondContact O-N 3.39Å; E182-N186 VanDerWaalsContact O-N 3.08Å; E182-N186 PolarHBondContact O-ND2 2.63Å; K183-N186 WeakPolarHBondContact O-CB 3.46Å; K183-N186 PolarHBondContact O-N 3.5Å; K183-N186 VanDerWaalsContact O-N 3.08Å
187E96.6Very high97.7Very high143 Ų14369.7 Ų69.767%0.66834%0.342SS*.Hα-helixtrans-69.5-51.8173-65.4168.7-164.500111.3K183 A184 F185K183-E187 VanDerWaalsContact CE-OE1 3.22Å; K183-E187 WeakPolarHBondContact CE-OE1 3.25Å; K183-E187 PolarHBondContact O-N 2.89Å; A184-E187 PolarHBondContact O-N 2.77Å; F185-E187 VanDerWaalsContact C-N 3.34Å
188A96.9Very high97.7Very high43 Ų4373.6 Ų73.636%0.35536%0.362SS..  trans-144116.8179.500000112.5A184 F185 Y190A184-A188 PolarHBondContact O-N 2.96Å; F185-A188 CarbonylContact O-C 3.42Å; A188-Y190 PolarHBondContact O-N 3.35Å
189H96.4Very high97.7Very high54 Ų5471.1 Ų71.125%0.2535%0.349CS..SBendtrans-68.8-21.3177.8-70.847.1000113.2F185 R218 W221F185-H189 AromaticContact CE1-CD2 3.49Å; F185-H189 VanDerWaalsContact CE1-CD2 3.49Å; F185-H189 WeakPolarHBondContact CE1-CD2 3.45Å; F185-H189 AromaticContact CE1-CE1 3.92Å; F185-H189 AromaticContact CE1-CG 3.98Å; F185-H189 AromaticContact CE1-NE2 3.46Å; F185-H189 WeakPolarHBondContact CE1-NE2 3.32Å; F185-H189 HydrophobicContact CE2-CB 4.45Å; F185-H189 HydrophobicContact CZ-CB 4.38Å; F185-H189 AromaticContact CZ-CD2 3.46Å; F185-H189 VanDerWaalsContact CZ-CD2 3.46Å; F185-H189 WeakPolarHBondContact CZ-CD2 3.49Å; F185-H189 AromaticContact CZ-CG 3.93Å; F185-H189 AromaticContact CZ-NE2 3.93Å; F185-H189 PolarHBondContact O-ND1 3.44Å; H189-R218 VanDerWaalsContact O-CD 3.27Å; H189-R218 WeakPolarHBondContact O-CD 3.36Å; H189-R218 PolarHBondContact O-NH1 3.26Å; H189-W221 AromaticContact CD2-CD2 3.92Å; H189-W221 AromaticContact CD2-CE2 3.83Å; H189-W221 AromaticContact NE2-CD1 3.94Å; H189-W221 AromaticContact NE2-CE2 3.56Å; H189-W221 AromaticContact NE2-CZ2 3.93Å; H189-W221 AromaticContact NE2-NE1 3.51Å
190Y97.8Very high97.7Very high159 Ų15966.2 Ų66.262%0.62433%0.327SS*.SBendtrans-128.477178.4-67.1-94.6000109.3A188A188-Y190 PolarHBondContact O-N 3.35Å
191P97.2Very high97.7Very high14 Ų1471.9 Ų71.99%0.09136%0.356CS..  trans-64.9142.6174.929.4-36.3000110.2A195 R196 F214P191-A195 HydrophobicContact CB-CB 3.96Å; P191-R196 HydrophobicContact CB-CG 4.03Å; P191-R196 HydrophobicContact CG-CG 3.8Å; P191-R196 PolarHBondContact O-NH1 3.15Å; P191-F214 VanDerWaalsContact CD-CE1 3.46Å; P191-F214 HydrophobicContact CG-CD1 3.64Å; P191-F214 HydrophobicContact CG-CD2 4.15Å; P191-F214 HydrophobicContact CG-CE1 3.56Å; P191-F214 HydrophobicContact CG-CE2 4.09Å; P191-F214 HydrophobicContact CG-CG 3.94Å; P191-F214 HydrophobicContact CG-CZ 3.81Å
192D97.8Very high97.6Very high95 Ų9576.6 Ų76.651%0.50838%0.376SS..  trans-72.5-171.4175.575.2-30.6000111.4A195 R196D192-A195 WeakPolarHBondContact OD1-CB 3.38Å; D192-A195 PolarHBondContact OD1-N 3.49Å; D192-R196 VanDerWaalsContact C-NH1 3.26Å; D192-R196 VanDerWaalsContact O-CG 3.29Å; D192-R196 WeakPolarHBondContact O-CG 3.48Å; D192-R196 PolarHBondContact O-N 3.47Å; D192-R196 PolarHBondContact O-NH1 3.12Å
193V97.4Very high97.6Very high78 Ų7873 Ų7347%0.47336%0.359SS..Hα-helixtrans-66-49.8179.5-176.70000110A195 R196 E197V193-A195 PolarHBondContact O-N 2.81Å; V193-R196 PolarHBondContact O-N 2.67Å; V193-E197 HydrophobicContact CG1-CG 4.38Å; V193-E197 PolarHBondContact O-N 3.01Å
194Y97.8Very high97.6Very high146 Ų14676 Ų7657%0.57338%0.375SS*.Hα-helixtrans-61.8-44.5-175.6-179.8-103.7000112.8R196 E197 M198Y194-R196 VanDerWaalsContact C-N 3.27Å; Y194-R196 PolarHBondContact O-N 2.71Å; Y194-E197 PolarHBondContact O-N 3.29Å; Y194-M198 HydrophobicContact CD1-CG 4.35Å; Y194-M198 HydrophobicContact CD1-SD 4.29Å; Y194-M198 HydrophobicContact CE1-CG 3.91Å; Y194-M198 HydrophobicContact CE1-SD 3.45Å; Y194-M198 WeakPolarHBondContact CE1-SD 3.39Å; Y194-M198 HydrophobicContact CE2-CG 4.31Å; Y194-M198 WeakPolarHBondContact O-CG 3.27Å; Y194-M198 PolarHBondContact O-N 3.38Å
195A97.8Very high97.5Very high35 Ų3575.9 Ų75.929%0.28937%0.372SS..Hα-helixtrans-63.2-32.6175.400000112.5P191 D192 V193 L199P191-A195 HydrophobicContact CB-CB 3.96Å; D192-A195 WeakPolarHBondContact OD1-CB 3.38Å; D192-A195 PolarHBondContact OD1-N 3.49Å; V193-A195 PolarHBondContact O-N 2.81Å; A195-L199 WeakPolarHBondContact O-CB 3.12Å; A195-L199 WeakPolarHBondContact O-CD1 3.48Å; A195-L199 VanDerWaalsContact O-CG 3.25Å; A195-L199 WeakPolarHBondContact O-CG 3.43Å; A195-L199 PolarHBondContact O-N 3.03Å
196R98.3Very high97.5Very high39 Ų3979.7 Ų79.715%0.14740%0.397CS..Hα-helixtrans-72.9-35.7174.3-68.1-171.4-45.7-90.6-2.4112.4P191 D192 V193 Y194 L199 A200 E207 I210P191-R196 HydrophobicContact CB-CG 4.03Å; P191-R196 HydrophobicContact CG-CG 3.8Å; P191-R196 PolarHBondContact O-NH1 3.15Å; D192-R196 VanDerWaalsContact C-NH1 3.26Å; D192-R196 VanDerWaalsContact O-CG 3.29Å; D192-R196 WeakPolarHBondContact O-CG 3.48Å; D192-R196 PolarHBondContact O-N 3.47Å; D192-R196 PolarHBondContact O-NH1 3.12Å; V193-R196 PolarHBondContact O-N 2.67Å; Y194-R196 VanDerWaalsContact C-N 3.27Å; Y194-R196 PolarHBondContact O-N 2.71Å; R196-L199 PolarHBondContact O-N 3.44Å; R196-A200 WeakPolarHBondContact O-CB 3.21Å; R196-A200 PolarHBondContact O-N 2.77Å; R196-E207 HydrophobicContact CB-CG 3.73Å; R196-E207 IonicContact CZ-OE1 2.74Å; R196-E207 IonicContact NE-OE1 3.33Å; R196-E207 PolarHBondContact NE-OE1 2.85Å; R196-E207 IonicContact NH2-OE1 2.83Å; R196-E207 PolarHBondContact NH2-OE1 3.35Å; R196-I210 HydrophobicContact CB-CG2 4.31Å; R196-I210 HydrophobicContact CG-CG2 4.09Å
197E98.1Very high97.5Very high96 Ų9676.7 Ų76.745%0.44938%0.379SS..Hα-helixtrans-65.1-44.3172.4-70.3175.7161.800111.6V193 Y194 L199 A200 M201V193-E197 HydrophobicContact CG1-CG 4.38Å; V193-E197 PolarHBondContact O-N 3.01Å; Y194-E197 PolarHBondContact O-N 3.29Å; E197-L199 VanDerWaalsContact C-N 3.33Å; E197-L199 PolarHBondContact O-N 3.1Å; E197-A200 VanDerWaalsContact O-CB 3.32Å; E197-A200 WeakPolarHBondContact O-CB 3.37Å; E197-A200 PolarHBondContact O-N 2.96Å; E197-A200 VanDerWaalsContact O-N 3.09Å; E197-M201 WeakPolarHBondContact O-CG 3.22Å; E197-M201 PolarHBondContact O-N 3.05Å
198M97.9Very high97.5Very high107 Ų10774.9 Ų74.953%0.52737%0.374SS..Hα-helixtrans-60-42.6173.6-71.2-156.678.200112.1Y194 A200 M201 K202Y194-M198 HydrophobicContact CD1-CG 4.35Å; Y194-M198 HydrophobicContact CD1-SD 4.29Å; Y194-M198 HydrophobicContact CE1-CG 3.91Å; Y194-M198 HydrophobicContact CE1-SD 3.45Å; Y194-M198 WeakPolarHBondContact CE1-SD 3.39Å; Y194-M198 HydrophobicContact CE2-CG 4.31Å; Y194-M198 WeakPolarHBondContact O-CG 3.27Å; Y194-M198 PolarHBondContact O-N 3.38Å; M198-A200 VanDerWaalsContact C-N 3.33Å; M198-M201 PolarHBondContact O-N 3.3Å; M198-K202 WeakPolarHBondContact O-CB 3.27Å; M198-K202 PolarHBondContact O-N 3.43Å
199L98Very high97.6Very high15 Ų1577.9 Ų77.98%0.07938%0.376CS..Hα-helixtrans-65.7-34.6173.6-72.8167.7000112.2L181 A184 A195 R196 E197 K202 T203 I210 F214L181-L199 HydrophobicContact CD2-CD1 4.5Å; A184-L199 HydrophobicContact CB-CD1 3.75Å; A184-L199 HydrophobicContact CB-CD2 3.86Å; A184-L199 HydrophobicContact CB-CG 4.37Å; A195-L199 WeakPolarHBondContact O-CB 3.12Å; A195-L199 WeakPolarHBondContact O-CD1 3.48Å; A195-L199 VanDerWaalsContact O-CG 3.25Å; A195-L199 WeakPolarHBondContact O-CG 3.43Å; A195-L199 PolarHBondContact O-N 3.03Å; R196-L199 PolarHBondContact O-N 3.44Å; E197-L199 VanDerWaalsContact C-N 3.33Å; E197-L199 PolarHBondContact O-N 3.1Å; L199-K202 PolarHBondContact O-N 3.4Å; L199-T203 WeakPolarHBondContact O-CB 3.43Å; L199-T203 PolarHBondContact O-N 3.04Å; L199-T203 PolarHBondContact O-OG1 3.08Å; L199-I210 VanDerWaalsContact C-CD1 3.45Å; L199-I210 HydrophobicContact CB-CD1 3.77Å; L199-I210 HydrophobicContact CB-CG2 4.44Å; L199-I210 HydrophobicContact CD1-CG2 4.35Å; L199-F214 HydrophobicContact CD1-CE2 3.99Å; L199-F214 HydrophobicContact CD1-CZ 4.19Å
200A98.2Very high97.6Very high7 Ų775.3 Ų75.36%0.05836%0.364CS..Hα-helixtrans-61.4-45.9176.600000111.2R196 E197 M198 E204 L205 I210R196-A200 WeakPolarHBondContact O-CB 3.21Å; R196-A200 PolarHBondContact O-N 2.77Å; E197-A200 VanDerWaalsContact O-CB 3.32Å; E197-A200 WeakPolarHBondContact O-CB 3.37Å; E197-A200 PolarHBondContact O-N 2.96Å; E197-A200 VanDerWaalsContact O-N 3.09Å; M198-A200 VanDerWaalsContact C-N 3.33Å; A200-E204 WeakPolarHBondContact O-CA 3.39Å; A200-E204 PolarHBondContact O-N 3.08Å; A200-L205 WeakPolarHBondContact CA-O 3.43Å; A200-L205 WeakPolarHBondContact CB-O 3.3Å; A200-L205 PolarHBondContact O-N 3.29Å; A200-I210 HydrophobicContact CB-CD1 3.88Å
201M97.9Very high97.6Very high150 Ų15071.5 Ų71.574%0.73935%0.352SS*.Hα-helixtrans-64.6-45.5174.5-61-57.9100.100111.5E197 M198 T203E197-M201 WeakPolarHBondContact O-CG 3.22Å; E197-M201 PolarHBondContact O-N 3.05Å; M198-M201 PolarHBondContact O-N 3.3Å; M201-T203 PolarHBondContact O-N 3.28Å
202K97.1Very high97.7Very high98 Ų9874 Ų7443%0.42637%0.367SS..Hα-helixtrans-68.9-32.5-176.3-169.9176.2-176-168.70114.2E180 M198 L199E180-K202 WeakPolarHBondContact OE1-CE 3.42Å; E180-K202 IonicContact OE1-NZ 2.7Å; E180-K202 PolarHBondContact OE1-NZ 3.27Å; E180-K202 WeakPolarHBondContact OE2-CE 3.48Å; E180-K202 IonicContact OE2-NZ 3.13Å; E180-K202 PolarHBondContact OE2-NZ 2.87Å; M198-K202 WeakPolarHBondContact O-CB 3.27Å; M198-K202 PolarHBondContact O-N 3.43Å; L199-K202 PolarHBondContact O-N 3.4Å
203T97.2Very high97.7Very high4 Ų470.6 Ų70.63%0.02535%0.347CS..Hα-helixtrans-104.1-2.8-17561.70000113.8Q177 E180 L199 M201 L205Q177-T203 PolarHBondContact NE2-O 3.22Å; E180-T203 HydrophobicContact CB-CG2 3.87Å; L199-T203 WeakPolarHBondContact O-CB 3.43Å; L199-T203 PolarHBondContact O-N 3.04Å; L199-T203 PolarHBondContact O-OG1 3.08Å; M201-T203 PolarHBondContact O-N 3.28Å; T203-L205 PolarHBondContact O-N 3.07Å
204E97.8Very high97.7Very high177 Ų17767 Ų6783%0.82733%0.325SS*.THydrogen-bonded Turntrans54.437.8-172.8-60.3179.1-161.200112.9A200A200-E204 WeakPolarHBondContact O-CA 3.39Å; A200-E204 PolarHBondContact O-N 3.08Å
205L96.8Very high97.7Very high13 Ų1364.3 Ų64.37%0.06832%0.318CS..  trans-116138.3180-68.2172000110.5T171 F173 Q177 L181 A200 T203 I210T171-L205 HydrophobicContact CG2-CD2 4.29Å; F173-L205 HydrophobicContact CD1-CD1 3.63Å; F173-L205 HydrophobicContact CD1-CD2 3.98Å; F173-L205 HydrophobicContact CD1-CG 4.49Å; F173-L205 HydrophobicContact CE1-CD1 3.73Å; F173-L205 HydrophobicContact CE1-CD2 4.03Å; Q177-L205 HydrophobicContact CB-CD1 4.16Å; Q177-L205 HydrophobicContact CG-CD1 4.16Å; Q177-L205 HydrophobicContact CG-CG 4.45Å; L181-L205 HydrophobicContact CD1-CD1 4.06Å; A200-L205 WeakPolarHBondContact CA-O 3.43Å; A200-L205 WeakPolarHBondContact CB-O 3.3Å; A200-L205 PolarHBondContact O-N 3.29Å; T203-L205 PolarHBondContact O-N 3.07Å; L205-I210 HydrophobicContact CB-CD1 4.23Å; L205-I210 HydrophobicContact CB-CG1 4.12Å
206P97.4Very high97.7Very high82 Ų8267.2 Ų67.253%0.53233%0.329SS..  trans-58.6142171.2-21.431.3000111.4D208 R209 I210P206-D208 VanDerWaalsContact C-N 3.25Å; P206-D208 PolarHBondContact O-N 3.36Å; P206-R209 HydrophobicContact CB-CG 4.17Å; P206-R209 HydrophobicContact CG-CG 4.17Å; P206-R209 WeakPolarHBondContact O-CA 3.45Å; P206-R209 VanDerWaalsContact O-CB 3.32Å; P206-R209 WeakPolarHBondContact O-CB 3.38Å; P206-R209 PolarHBondContact O-N 3.49Å; P206-I210 PolarHBondContact O-N 2.89Å
207E97.6Very high97.6Very high55 Ų5566.8 Ų66.826%0.25733%0.327SS..Hα-helixtrans-52.8-42.1-177.9-162.5-133.4148.500112.1R196 R209 I210 Q211R196-E207 HydrophobicContact CB-CG 3.73Å; R196-E207 IonicContact CZ-OE1 2.74Å; R196-E207 IonicContact NE-OE1 3.33Å; R196-E207 PolarHBondContact NE-OE1 2.85Å; R196-E207 IonicContact NH2-OE1 2.83Å; R196-E207 PolarHBondContact NH2-OE1 3.35Å; E207-R209 PolarHBondContact O-N 3.3Å; E207-R209 VanDerWaalsContact O-N 3.12Å; E207-I210 CarbonylContact O-C 3.56Å; E207-I210 WeakPolarHBondContact O-CA 3.36Å; E207-I210 WeakPolarHBondContact O-CB 3.33Å; E207-I210 PolarHBondContact O-N 3.42Å; E207-Q211 PolarHBondContact O-N 2.94Å
208D96.9Very high97.5Very high106 Ų10664 Ų6457%0.56731%0.313SS*.Hα-helixtrans-46.3-41.1170.8-775000113.7P206 V212P206-D208 VanDerWaalsContact C-N 3.25Å; P206-D208 PolarHBondContact O-N 3.36Å; D208-V212 WeakPolarHBondContact O-CB 3.11Å; D208-V212 VanDerWaalsContact O-CG2 3.25Å; D208-V212 WeakPolarHBondContact O-CG2 3.34Å; D208-V212 PolarHBondContact O-N 2.99Å
209R97.4Very high97.3Very high105 Ų10560.9 Ų60.940%0.39630%0.303SS..Hα-helixtrans-73.1-35.9-178.3-57.4-55.2176.2165.5-5.7111.2T171 F173 P206 E207 W213T171-R209 WeakPolarHBondContact OG1-CD 3.42Å; T171-R209 PolarHBondContact OG1-NE 2.8Å; T171-R209 PolarHBondContact OG1-NH1 2.87Å; F173-R209 HydrophobicContact CE1-CB 4.41Å; P206-R209 HydrophobicContact CB-CG 4.17Å; P206-R209 HydrophobicContact CG-CG 4.17Å; P206-R209 WeakPolarHBondContact O-CA 3.45Å; P206-R209 VanDerWaalsContact O-CB 3.32Å; P206-R209 WeakPolarHBondContact O-CB 3.38Å; P206-R209 PolarHBondContact O-N 3.49Å; E207-R209 PolarHBondContact O-N 3.3Å; E207-R209 VanDerWaalsContact O-N 3.12Å; R209-W213 WeakPolarHBondContact O-CB 3.44Å; R209-W213 PolarHBondContact O-N 2.57Å
210I97.9Very high97Very high0 Ų066.9 Ų66.90%033%0.329CS..Hα-helixtrans-68.7-48.4174.2-62.1175.8000109.4L181 R196 L199 A200 L205 P206 E207 V212 W213 F214L181-I210 HydrophobicContact CD2-CB 4.45Å; L181-I210 HydrophobicContact CD2-CG1 4.09Å; L181-I210 HydrophobicContact CD2-CG2 3.89Å; R196-I210 HydrophobicContact CB-CG2 4.31Å; R196-I210 HydrophobicContact CG-CG2 4.09Å; L199-I210 VanDerWaalsContact C-CD1 3.45Å; L199-I210 HydrophobicContact CB-CD1 3.77Å; L199-I210 HydrophobicContact CB-CG2 4.44Å; L199-I210 HydrophobicContact CD1-CG2 4.35Å; A200-I210 HydrophobicContact CB-CD1 3.88Å; L205-I210 HydrophobicContact CB-CD1 4.23Å; L205-I210 HydrophobicContact CB-CG1 4.12Å; P206-I210 PolarHBondContact O-N 2.89Å; E207-I210 CarbonylContact O-C 3.56Å; E207-I210 WeakPolarHBondContact O-CA 3.36Å; E207-I210 WeakPolarHBondContact O-CB 3.33Å; E207-I210 PolarHBondContact O-N 3.42Å; I210-V212 PolarHBondContact O-N 3.18Å; I210-W213 WeakPolarHBondContact O-CB 3.44Å; I210-W213 PolarHBondContact O-N 2.86Å; I210-W213 VanDerWaalsContact O-N 3.1Å; I210-F214 HydrophobicContact CG2-CD2 3.72Å; I210-F214 HydrophobicContact CG2-CE2 3.82Å; I210-F214 WeakPolarHBondContact O-CD2 3.46Å; I210-F214 PolarHBondContact O-N 2.86Å
211Q97.8Very high96.6Very high79 Ų7968.8 Ų68.837%0.36934%0.335SS..Hα-helixtrans-54.6-49.5175.8-165.8-159.729.900111.5E207 F214 Q215E207-Q211 PolarHBondContact O-N 2.94Å; Q211-F214 PolarHBondContact O-N 2.9Å; Q211-Q215 VanDerWaalsContact O-CG 3.32Å; Q211-Q215 WeakPolarHBondContact O-CG 3.36Å; Q211-Q215 PolarHBondContact O-N 3.23Å
212V97.7Very high96.2Very high67 Ų6767.3 Ų67.341%0.40632%0.321SS..Hα-helixtrans-66.6-36.7176.6170.70000111.9D208 I210 N216D208-V212 WeakPolarHBondContact O-CB 3.11Å; D208-V212 VanDerWaalsContact O-CG2 3.25Å; D208-V212 WeakPolarHBondContact O-CG2 3.34Å; D208-V212 PolarHBondContact O-N 2.99Å; I210-V212 PolarHBondContact O-N 3.18Å; V212-N216 WeakPolarHBondContact CG1-ND2 3.49Å; V212-N216 WeakPolarHBondContact O-CB 3.46Å; V212-N216 PolarHBondContact O-N 3.45Å; V212-N216 PolarHBondContact O-ND2 3.39Å
213W97.9Very high95.5Very high23 Ų2369.3 Ų69.39%0.08733%0.329CS..Hα-helixtrans-62.4-48.3174.5-175.4105.9000110.8F173 L178 L181 E182 F185 R209 I210 Q215 N216 R217F173-W213 AromaticContact CE2-CD1 3.68Å; F173-W213 HydrophobicContact CZ-CB 4.36Å; F173-W213 AromaticContact CZ-CD1 3.96Å; L178-W213 VanDerWaalsContact CD2-NE1 3.33Å; L181-W213 VanDerWaalsContact C-CH2 3.48Å; L181-W213 HydrophobicContact CB-CD2 4.04Å; L181-W213 HydrophobicContact CB-CE3 4Å; L181-W213 HydrophobicContact CB-CH2 3.7Å; L181-W213 HydrophobicContact CB-CZ2 3.71Å; L181-W213 HydrophobicContact CB-CZ3 3.84Å; L181-W213 HydrophobicContact CD1-CD2 3.97Å; L181-W213 HydrophobicContact CD1-CG 3.94Å; L181-W213 HydrophobicContact CD2-CE3 4.49Å; L181-W213 HydrophobicContact CG-CD2 4.47Å; L181-W213 WeakPolarHBondContact O-CH2 3.39Å; L181-W213 WeakPolarHBondContact O-CZ3 3.32Å; E182-W213 HydrophobicContact CG-CH2 3.82Å; E182-W213 HydrophobicContact CG-CZ2 3.75Å; F185-W213 HydrophobicContact CB-CH2 4.25Å; F185-W213 HydrophobicContact CB-CZ3 4.14Å; F185-W213 HydrophobicContact CD2-CZ3 4.14Å; F185-W213 HydrophobicContact CG-CZ3 4.45Å; R209-W213 WeakPolarHBondContact O-CB 3.44Å; R209-W213 PolarHBondContact O-N 2.57Å; I210-W213 WeakPolarHBondContact O-CB 3.44Å; I210-W213 PolarHBondContact O-N 2.86Å; I210-W213 VanDerWaalsContact O-N 3.1Å; W213-Q215 PolarHBondContact O-N 2.79Å; W213-N216 CarbonylContact O-C 3.58Å; W213-N216 PolarHBondContact O-N 2.99Å; W213-N216 VanDerWaalsContact O-N 3.15Å; W213-R217 HydrophobicContact CD2-CB 4.44Å; W213-R217 HydrophobicContact CE3-CB 3.98Å; W213-R217 HydrophobicContact CE3-CG 4.49Å; W213-R217 HydrophobicContact CH2-CB 4Å; W213-R217 HydrophobicContact CH2-CG 3.61Å; W213-R217 HydrophobicContact CZ2-CB 4.47Å; W213-R217 HydrophobicContact CZ2-CG 4.22Å; W213-R217 HydrophobicContact CZ3-CB 3.73Å; W213-R217 HydrophobicContact CZ3-CG 3.77Å; W213-R217 WeakPolarHBondContact O-CB 3.37Å; W213-R217 PolarHBondContact O-N 2.92Å
214F98.3Very high94.5Very high2 Ų276.5 Ų76.51%0.00936%0.356CS..Hα-helixtrans-63.1-40.1178.6-91.9-93.2000112.3L181 A184 F185 P191 L199 I210 Q211 N216 R217 R218L181-F214 HydrophobicContact CD2-CE2 3.88Å; A184-F214 HydrophobicContact CB-CZ 4.22Å; F185-F214 HydrophobicContact CB-CE1 3.97Å; F185-F214 HydrophobicContact CB-CZ 4.35Å; F185-F214 AromaticContact CD2-CD1 3.72Å; F185-F214 HydrophobicContact CD2-CD1 3.72Å; F185-F214 AromaticContact CD2-CE1 3.74Å; F185-F214 HydrophobicContact CD2-CE1 3.74Å; F185-F214 HydrophobicContact CE2-CD1 4.4Å; F185-F214 HydrophobicContact CG-CE1 4.33Å; P191-F214 VanDerWaalsContact CD-CE1 3.46Å; P191-F214 HydrophobicContact CG-CD1 3.64Å; P191-F214 HydrophobicContact CG-CD2 4.15Å; P191-F214 HydrophobicContact CG-CE1 3.56Å; P191-F214 HydrophobicContact CG-CE2 4.09Å; P191-F214 HydrophobicContact CG-CG 3.94Å; P191-F214 HydrophobicContact CG-CZ 3.81Å; L199-F214 HydrophobicContact CD1-CE2 3.99Å; L199-F214 HydrophobicContact CD1-CZ 4.19Å; I210-F214 HydrophobicContact CG2-CD2 3.72Å; I210-F214 HydrophobicContact CG2-CE2 3.82Å; I210-F214 WeakPolarHBondContact O-CD2 3.46Å; I210-F214 PolarHBondContact O-N 2.86Å; Q211-F214 PolarHBondContact O-N 2.9Å; F214-N216 PolarHBondContact O-N 3.16Å; F214-R217 PolarHBondContact O-N 3.21Å; F214-R218 WeakPolarHBondContact O-CB 3.3Å; F214-R218 WeakPolarHBondContact O-CG 3.37Å; F214-R218 PolarHBondContact O-N 3.45Å
215Q97.8Very high93Very high91 Ų9173.5 Ų73.543%0.42534%0.342SS..Hα-helixtrans-57.8-48171.7-72.7174.823.800111.7Q211 W213 R218 A219Q211-Q215 VanDerWaalsContact O-CG 3.32Å; Q211-Q215 WeakPolarHBondContact O-CG 3.36Å; Q211-Q215 PolarHBondContact O-N 3.23Å; W213-Q215 PolarHBondContact O-N 2.79Å; Q215-R218 PolarHBondContact O-N 2.71Å; Q215-A219 WeakPolarHBondContact O-CB 3.39Å; Q215-A219 PolarHBondContact O-N 3.32Å
216N96.9Very high90.9Very high95 Ų9578.5 Ų78.551%0.50836%0.363SS..Hα-helixtrans-66.5-38.2177.8-76.4-59.3000112.5V212 W213 F214 A219 K220V212-N216 WeakPolarHBondContact CG1-ND2 3.49Å; V212-N216 WeakPolarHBondContact O-CB 3.46Å; V212-N216 PolarHBondContact O-N 3.45Å; V212-N216 PolarHBondContact O-ND2 3.39Å; W213-N216 CarbonylContact O-C 3.58Å; W213-N216 PolarHBondContact O-N 2.99Å; W213-N216 VanDerWaalsContact O-N 3.15Å; F214-N216 PolarHBondContact O-N 3.16Å; N216-A219 PolarHBondContact O-N 3.29Å; N216-K220 PolarHBondContact O-N 3.1Å
217R97.3Very high88.7Confident30 Ų3079.7 Ų79.711%0.11337%0.373CS..Hα-helixtrans-66.6-43.3177.9-166.464.6173.767.2-3110.9E182 F185 W213 F214 A219 K220 W221E182-R217 IonicContact OE1-CZ 2.7Å; E182-R217 VanDerWaalsContact OE1-CZ 3.27Å; E182-R217 IonicContact OE1-NE 2.67Å; E182-R217 PolarHBondContact OE1-NE 3.47Å; E182-R217 IonicContact OE1-NH2 3.27Å; E182-R217 PolarHBondContact OE1-NH2 2.85Å; E182-R217 IonicContact OE2-NH2 2.71Å; F185-R217 HydrophobicContact CD1-CG 4.12Å; F185-R217 HydrophobicContact CD2-CB 3.92Å; F185-R217 HydrophobicContact CD2-CG 3.51Å; F185-R217 HydrophobicContact CE1-CG 4.1Å; F185-R217 HydrophobicContact CE2-CB 3.72Å; F185-R217 HydrophobicContact CE2-CG 3.48Å; F185-R217 VanDerWaalsContact CE2-CG 3.48Å; F185-R217 HydrophobicContact CG-CG 3.85Å; F185-R217 HydrophobicContact CZ-CB 4.37Å; F185-R217 HydrophobicContact CZ-CG 3.79Å; W213-R217 HydrophobicContact CD2-CB 4.44Å; W213-R217 HydrophobicContact CE3-CB 3.98Å; W213-R217 HydrophobicContact CE3-CG 4.49Å; W213-R217 HydrophobicContact CH2-CB 4Å; W213-R217 HydrophobicContact CH2-CG 3.61Å; W213-R217 HydrophobicContact CZ2-CB 4.47Å; W213-R217 HydrophobicContact CZ2-CG 4.22Å; W213-R217 HydrophobicContact CZ3-CB 3.73Å; W213-R217 HydrophobicContact CZ3-CG 3.77Å; W213-R217 WeakPolarHBondContact O-CB 3.37Å; W213-R217 PolarHBondContact O-N 2.92Å; F214-R217 PolarHBondContact O-N 3.21Å; R217-A219 PolarHBondContact O-N 3.19Å; R217-K220 PolarHBondContact O-N 2.95Å; R217-W221 VanDerWaalsContact O-CB 3.32Å; R217-W221 WeakPolarHBondContact O-CB 3.11Å; R217-W221 PolarHBondContact O-N 3.01Å
218R96.4Very high86.4Confident39 Ų3986.5 Ų86.515%0.14740%0.396CS..Hα-helixtrans-62.5-37.6171-73.7-164.2-65.5-87.74.5112.9F185 H189 F214 Q215 W221 R222F185-R218 HydrophobicContact CE2-CG 3.75Å; F185-R218 HydrophobicContact CZ-CG 4.19Å; H189-R218 VanDerWaalsContact O-CD 3.27Å; H189-R218 WeakPolarHBondContact O-CD 3.36Å; H189-R218 PolarHBondContact O-NH1 3.26Å; F214-R218 WeakPolarHBondContact O-CB 3.3Å; F214-R218 WeakPolarHBondContact O-CG 3.37Å; F214-R218 PolarHBondContact O-N 3.45Å; Q215-R218 PolarHBondContact O-N 2.71Å; R218-W221 PolarHBondContact O-N 3.37Å; R218-R222 WeakPolarHBondContact O-CB 3.26Å; R218-R222 WeakPolarHBondContact O-CG 3.38Å; R218-R222 PolarHBondContact O-N 3.38Å
219A93.4Very high84.3Confident40 Ų4084.7 Ų84.733%0.33140%0.402SS..Hα-helixtrans-64.4-44.7175.800000111.9Q215 N216 R217 K223Q215-A219 WeakPolarHBondContact O-CB 3.39Å; Q215-A219 PolarHBondContact O-N 3.32Å; N216-A219 PolarHBondContact O-N 3.29Å; R217-A219 PolarHBondContact O-N 3.19Å; A219-K223 PolarHBondContact O-N 2.89Å; A219-K223 VanDerWaalsContact O-N 3.07Å
220K91.3Very high81.9Confident141 Ų14190.1 Ų90.161%0.61342%0.423SS*.Hα-helixtrans-63.1-42.6172.7-72.5-178.4178-176.40112.5N216 R217 K223 R224N216-K220 PolarHBondContact O-N 3.1Å; R217-K220 PolarHBondContact O-N 2.95Å; K220-K223 PolarHBondContact O-N 3.04Å; K220-R224 PolarHBondContact O-N 3.47Å
221W90.3Very high79.8Confident48 Ų4893.2 Ų93.218%0.18244%0.444CS..Hα-helixtrans-60.3-49.3177.4178.577.5000111.4F185 H189 R217 R218 K223 R224 E225 K226F185-W221 HydrophobicContact CE1-CB 4.48Å; F185-W221 HydrophobicContact CE1-CG 4.4Å; F185-W221 HydrophobicContact CZ-CB 4.07Å; F185-W221 HydrophobicContact CZ-CG 4.25Å; H189-W221 AromaticContact CD2-CD2 3.92Å; H189-W221 AromaticContact CD2-CE2 3.83Å; H189-W221 AromaticContact NE2-CD1 3.94Å; H189-W221 AromaticContact NE2-CE2 3.56Å; H189-W221 AromaticContact NE2-CZ2 3.93Å; H189-W221 AromaticContact NE2-NE1 3.51Å; R217-W221 VanDerWaalsContact O-CB 3.32Å; R217-W221 WeakPolarHBondContact O-CB 3.11Å; R217-W221 PolarHBondContact O-N 3.01Å; R218-W221 PolarHBondContact O-N 3.37Å; W221-K223 VanDerWaalsContact C-N 3.27Å; W221-K223 PolarHBondContact O-N 3.49Å; W221-R224 PolarHBondContact O-N 3.38Å; W221-R224 VanDerWaalsContact O-N 3.1Å; W221-E225 PolarHBondContact NE1-OE1 3.14Å; W221-E225 PolarHBondContact NE1-OE2 3.42Å; W221-E225 PolarHBondContact O-N 3.15Å; W221-K226 VanDerWaalsContact CH2-NZ 3.27Å
222R89Confident77.9Confident118 Ų11892.4 Ų92.445%0.44545%0.445SS..Hα-helixtrans-58.1-36.3173.2-75.5-172.4-73.1101.2-5.5112.8R218 K226R218-R222 WeakPolarHBondContact O-CB 3.26Å; R218-R222 WeakPolarHBondContact O-CG 3.38Å; R218-R222 PolarHBondContact O-N 3.38Å; R222-K226 PolarHBondContact O-N 2.85Å
223K81.7Confident75.9Confident140 Ų14093.8 Ų93.861%0.60945%0.453SS*.Hα-helixtrans-72.8-29.8176.1-170.8173.5-178.5-179.70113.4A219 K220 W221A219-K223 PolarHBondContact O-N 2.89Å; A219-K223 VanDerWaalsContact O-N 3.07Å; K220-K223 PolarHBondContact O-N 3.04Å; W221-K223 VanDerWaalsContact C-N 3.27Å; W221-K223 PolarHBondContact O-N 3.49Å
224R77.1Confident73.8Confident156 Ų15695.3 Ų95.359%0.58946%0.462SS*.Hα-helixtrans-87.9-45.1-179.2-81.4-159.4-76.9117.4-13.1114.2K220 W221K220-R224 PolarHBondContact O-N 3.47Å; W221-R224 PolarHBondContact O-N 3.38Å; W221-R224 VanDerWaalsContact O-N 3.1Å
225E65.1Low72Confident113 Ų11397.7 Ų97.753%0.52848%0.482SS..Hα-helixtrans-104-18.7-166.5-71.8175.2-138.200113.8W221W221-E225 PolarHBondContact NE1-OE1 3.14Å; W221-E225 PolarHBondContact NE1-OE2 3.42Å; W221-E225 PolarHBondContact O-N 3.15Å
226K53.4Low69.8Low118 Ų118100.1 Ų100.151%0.51349%0.493SS..SBendtrans-102.2100.5157.1-84.271.4177.2173.90106.9W221 R222 W228W221-K226 VanDerWaalsContact CH2-NZ 3.27Å; R222-K226 PolarHBondContact O-N 2.85Å; K226-W228 VanDerWaalsContact C-N 3.28Å; K226-W228 PolarHBondContact O-N 3.27Å
227C50.7Low68Low108 Ų108104.4 Ų104.473%0.7350%0.503SS*.  trans-52.6103.9151.8-65.80000106.4G229C227-G229 VanDerWaalsContact O-CA 3.29Å; C227-G229 WeakPolarHBondContact O-CA 3.27Å; C227-G229 PolarHBondContact O-N 3.19Å
228W50.5Low66.6Low198 Ų198104.9 Ų104.975%0.7552%0.518SS*.  trans-51.7113.8175.9-148.6-50.3000105.8K226 R230 S231K226-W228 VanDerWaalsContact C-N 3.28Å; K226-W228 PolarHBondContact O-N 3.27Å; W228-R230 PolarHBondContact O-N 3Å; W228-S231 VanDerWaalsContact O-CB 3.32Å; W228-S231 WeakPolarHBondContact O-CB 3.43Å; W228-S231 PolarHBondContact O-N 3.26Å; W228-S231 PolarHBondContact O-OG 3.44Å
229G51.4Low65.1Low68 Ų68106.7 Ų106.770%0.70153%0.53SS*.THydrogen-bonded Turntrans-43.898.5-14300000115.9C227 S231C227-G229 VanDerWaalsContact O-CA 3.29Å; C227-G229 WeakPolarHBondContact O-CA 3.27Å; C227-G229 PolarHBondContact O-N 3.19Å; G229-S231 PolarHBondContact O-N 2.95Å
230R49Very low63.7Low219 Ų219109.6 Ų109.683%0.82653%0.533SS*.THydrogen-bonded Turntrans46.426.5-175-66.8-174.1-69.8-159.7-2.6114.9W228 T232W228-R230 PolarHBondContact O-N 3Å; R230-T232 PolarHBondContact O-N 3.21Å
231S52.3Low62.7Low64 Ų64104.7 Ų104.745%0.44852%0.522SS..  trans-71.579.8171.3-57.40000109.4W228 G229W228-S231 VanDerWaalsContact O-CB 3.32Å; W228-S231 WeakPolarHBondContact O-CB 3.43Å; W228-S231 PolarHBondContact O-N 3.26Å; W228-S231 PolarHBondContact O-OG 3.44Å; G229-S231 PolarHBondContact O-N 2.95Å
232T57.9Low61.6Low63 Ų63104 Ų10439%0.38753%0.527SS..  trans3.4130162.355.90000116.4R230 M234 A235R230-T232 PolarHBondContact O-N 3.21Å; T232-M234 CarbonylContact O-C 3.56Å; T232-M234 WeakPolarHBondContact O-CA 3.36Å; T232-M234 PolarHBondContact O-N 3.35Å; T232-A235 PolarHBondContact O-N 3.28Å
233V55.9Low60.7Low95 Ų9599.5 Ų99.558%0.57651%0.511SS*.G310 helixtrans10.1-50.5144.6-173.80000117.4A235 E236 Y237V233-A235 PolarHBondContact O-N 3.19Å; V233-E236 WeakPolarHBondContact O-CB 3.46Å; V233-E236 PolarHBondContact O-N 3.27Å; V233-Y237 HydrophobicContact CG1-CD2 3.71Å; V233-Y237 HydrophobicContact CG1-CE2 3.44Å; V233-Y237 VanDerWaalsContact CG1-CE2 3.44Å; V233-Y237 WeakPolarHBondContact O-CD2 3.33Å; V233-Y237 PolarHBondContact O-N 3.46Å; V233-Y237 VanDerWaalsContact O-N 3.17Å
234M54.8Low60.1Low56 Ų5697 Ų9728%0.27651%0.508SS..G310 helixtrans-51.3-33.4170.6-55.8-168.285.300115.1T232 G238 L239 Y240 M243T232-M234 CarbonylContact O-C 3.56Å; T232-M234 WeakPolarHBondContact O-CA 3.36Å; T232-M234 PolarHBondContact O-N 3.35Å; M234-G238 PolarHBondContact O-N 3.38Å; M234-L239 HydrophobicContact CB-CB 4.34Å; M234-L239 HydrophobicContact CE-CD2 3.57Å; M234-L239 HydrophobicContact CE-CG 3.87Å; M234-L239 HydrophobicContact CG-CD2 4.41Å; M234-L239 PolarHBondContact O-N 2.84Å; M234-Y240 PolarHBondContact O-N 3.21Å; M234-M243 HydrophobicContact CE-CE 4.28Å; M234-M243 HydrophobicContact CE-SD 3.44Å; M234-M243 WeakPolarHBondContact CE-SD 3.49Å
235A59.6Low59.6Low51 Ų5199.3 Ų99.342%0.42152%0.516SS..G310 helixtrans-77.6-26.1176.200000112.9T232 V233T232-A235 PolarHBondContact O-N 3.28Å; V233-A235 PolarHBondContact O-N 3.19Å
236E52.6Low59.6Low142 Ų142100.6 Ų100.666%0.66452%0.522SS*.THydrogen-bonded Turntrans-71-49.7175.8-172.3172.8-175.900110.7V233 G238V233-E236 WeakPolarHBondContact O-CB 3.46Å; V233-E236 PolarHBondContact O-N 3.27Å; E236-G238 PolarHBondContact O-N 3.47Å
237Y58.5Low59.8Low185 Ų185100 Ų10073%0.72553%0.533SS*.THydrogen-bonded Turntrans-73.7-2.4175.5-65.1-63.9000114.6V233 L239V233-Y237 HydrophobicContact CG1-CD2 3.71Å; V233-Y237 HydrophobicContact CG1-CE2 3.44Å; V233-Y237 VanDerWaalsContact CG1-CE2 3.44Å; V233-Y237 WeakPolarHBondContact O-CD2 3.33Å; V233-Y237 PolarHBondContact O-N 3.46Å; V233-Y237 VanDerWaalsContact O-N 3.17Å; Y237-L239 PolarHBondContact O-N 3.18Å
238G68.3Low60.4Low40 Ų4098.8 Ų98.841%0.41252%0.518SS..THydrogen-bonded Turntrans68.210.8-176.800000114.4M234 E236 Y240 G241 A242M234-G238 PolarHBondContact O-N 3.38Å; E236-G238 PolarHBondContact O-N 3.47Å; G238-Y240 VanDerWaalsContact C-N 3.34Å; G238-Y240 PolarHBondContact O-N 3.32Å; G238-G241 WeakPolarHBondContact O-CA 3.29Å; G238-G241 PolarHBondContact O-N 2.98Å; G238-A242 PolarHBondContact O-N 2.82Å
239L64.5Low60.8Low77 Ų7794.7 Ų94.740%0.40352%0.517SS..Hα-helixtrans-62.7-37.7-173.5-175.457.2000112.2M234 Y237 G241 A242 M243M234-L239 HydrophobicContact CB-CB 4.34Å; M234-L239 HydrophobicContact CE-CD2 3.57Å; M234-L239 HydrophobicContact CE-CG 3.87Å; M234-L239 HydrophobicContact CG-CD2 4.41Å; M234-L239 PolarHBondContact O-N 2.84Å; Y237-L239 PolarHBondContact O-N 3.18Å; L239-G241 PolarHBondContact O-N 3.06Å; L239-A242 WeakPolarHBondContact O-CB 3.29Å; L239-A242 PolarHBondContact O-N 3.28Å; L239-M243 HydrophobicContact CD1-CG 4.48Å; L239-M243 HydrophobicContact CG-SD 4.08Å; L239-M243 WeakPolarHBondContact O-CG 3.32Å; L239-M243 PolarHBondContact O-N 2.87Å
240Y64.8Low61.1Low102 Ų10294.1 Ų94.140%0.450%0.498SS..Hα-helixtrans-60.4-44.3171.8175.9-117000112.2M234 G238 A242 M243 V244 W269 L270M234-Y240 PolarHBondContact O-N 3.21Å; G238-Y240 VanDerWaalsContact C-N 3.34Å; G238-Y240 PolarHBondContact O-N 3.32Å; Y240-A242 VanDerWaalsContact C-N 3.27Å; Y240-A242 PolarHBondContact O-N 2.99Å; Y240-M243 PolarHBondContact O-N 2.77Å; Y240-V244 HydrophobicContact CD2-CG2 3.82Å; Y240-V244 HydrophobicContact CE1-CG2 4.38Å; Y240-V244 HydrophobicContact CE2-CG2 3.36Å; Y240-V244 HydrophobicContact CG-CG2 4.49Å; Y240-V244 WeakPolarHBondContact O-CG2 3.44Å; Y240-V244 PolarHBondContact O-N 2.9Å; Y240-W269 AromaticContact CD2-CH2 3.72Å; Y240-W269 HydrophobicContact CD2-CH2 3.72Å; Y240-W269 AromaticContact CD2-CZ3 4Å; Y240-W269 HydrophobicContact CD2-CZ3 4Å; Y240-W269 AromaticContact CE2-CH2 3.74Å; Y240-W269 HydrophobicContact CE2-CH2 3.74Å; Y240-W269 AromaticContact CE2-CZ3 3.5Å; Y240-W269 HydrophobicContact CE2-CZ3 3.5Å; Y240-W269 VanDerWaalsContact CE2-CZ3 3.5Å; Y240-W269 HydrophobicContact CG-CH2 4.46Å; Y240-W269 AromaticContact CZ-CZ3 3.99Å; Y240-L270 HydrophobicContact CE2-CD1 4.34Å
241G68.7Low62Low37 Ų3786.9 Ų86.938%0.38148%0.479SS..Hα-helixtrans-65.2-30.217600000113G238 L239 R245G238-G241 WeakPolarHBondContact O-CA 3.29Å; G238-G241 PolarHBondContact O-N 2.98Å; L239-G241 PolarHBondContact O-N 3.06Å; G241-R245 VanDerWaalsContact O-CB 3.26Å; G241-R245 WeakPolarHBondContact O-CB 3.44Å; G241-R245 WeakPolarHBondContact O-CD 3.33Å; G241-R245 WeakPolarHBondContact O-CG 3.36Å; G241-R245 PolarHBondContact O-N 2.67Å
242A67.4Low62.2Low34 Ų3490.7 Ų90.728%0.28149%0.49SS..Hα-helixtrans-72.6-50.9172.400000111.6G238 L239 Y240 V244 R245 H246G238-A242 PolarHBondContact O-N 2.82Å; L239-A242 WeakPolarHBondContact O-CB 3.29Å; L239-A242 PolarHBondContact O-N 3.28Å; Y240-A242 VanDerWaalsContact C-N 3.27Å; Y240-A242 PolarHBondContact O-N 2.99Å; A242-V244 PolarHBondContact O-N 3.3Å; A242-R245 PolarHBondContact O-N 3.01Å; A242-H246 WeakPolarHBondContact O-CB 3.32Å; A242-H246 PolarHBondContact O-CD2 3.22Å; A242-H246 VanDerWaalsContact O-CD2 3.27Å; A242-H246 PolarHBondContact O-N 3.35Å
243M70.9Confident62.2Low24 Ų2491.8 Ų91.812%0.11850%0.5CS..Hα-helixtrans-56-49.5179.7-73.2164.15300112.3M234 L239 Y240 R245 S247 I248 L250M234-M243 HydrophobicContact CE-CE 4.28Å; M234-M243 HydrophobicContact CE-SD 3.44Å; M234-M243 WeakPolarHBondContact CE-SD 3.49Å; L239-M243 HydrophobicContact CD1-CG 4.48Å; L239-M243 HydrophobicContact CG-SD 4.08Å; L239-M243 WeakPolarHBondContact O-CG 3.32Å; L239-M243 PolarHBondContact O-N 2.87Å; Y240-M243 PolarHBondContact O-N 2.77Å; M243-R245 VanDerWaalsContact C-N 3.34Å; M243-R245 PolarHBondContact O-N 3.17Å; M243-S247 WeakPolarHBondContact O-CA 3.31Å; M243-S247 PolarHBondContact O-N 3.32Å; M243-I248 HydrophobicContact CG-CB 4.32Å; M243-I248 PolarHBondContact O-N 3.44Å; M243-I248 VanDerWaalsContact O-N 3.15Å; M243-L250 HydrophobicContact CE-CD2 3.46Å; M243-L250 VanDerWaalsContact CE-CD2 3.46Å
244V69.4Low62.4Low88 Ų8888.3 Ų88.353%0.53348%0.478SS..Hα-helixtrans-66.8-34.1-179.2174.10000112.2Y240 A242Y240-V244 HydrophobicContact CD2-CG2 3.82Å; Y240-V244 HydrophobicContact CE1-CG2 4.38Å; Y240-V244 HydrophobicContact CE2-CG2 3.36Å; Y240-V244 HydrophobicContact CG-CG2 4.49Å; Y240-V244 WeakPolarHBondContact O-CG2 3.44Å; Y240-V244 PolarHBondContact O-N 2.9Å; A242-V244 PolarHBondContact O-N 3.3Å
245R65.2Low62.8Low203 Ų20389.2 Ų89.277%0.76648%0.484SS*.Hα-helixtrans-83.5-25.5-178.9-71.4-177.961.870.311.7114.3G241 A242 M243G241-R245 VanDerWaalsContact O-CB 3.26Å; G241-R245 WeakPolarHBondContact O-CB 3.44Å; G241-R245 WeakPolarHBondContact O-CD 3.33Å; G241-R245 WeakPolarHBondContact O-CG 3.36Å; G241-R245 PolarHBondContact O-N 2.67Å; A242-R245 PolarHBondContact O-N 3.01Å; M243-R245 VanDerWaalsContact C-N 3.34Å; M243-R245 PolarHBondContact O-N 3.17Å
246H64.9Low62.8Low140 Ų14093.8 Ų93.865%0.64849%0.494SS*.Hα-helixtrans-107.76.5-178.9-65.8-71.1000112.7A242 I248A242-H246 WeakPolarHBondContact O-CB 3.32Å; A242-H246 PolarHBondContact O-CD2 3.22Å; A242-H246 VanDerWaalsContact O-CD2 3.27Å; A242-H246 PolarHBondContact O-N 3.35Å; H246-I248 HydrophobicContact CB-CD1 4.2Å; H246-I248 HydrophobicContact CB-CG1 3.86Å; H246-I248 PolarHBondContact O-N 3.05Å; H246-I248 VanDerWaalsContact O-N 3.14Å
247S58.3Low63Low106 Ų10688.3 Ų88.374%0.74147%0.472SS*.THydrogen-bonded Turntrans47.240.5-178-54.80000112.8M243M243-S247 WeakPolarHBondContact O-CA 3.31Å; M243-S247 PolarHBondContact O-N 3.32Å
248I64.3Low63.1Low83 Ų8380.9 Ų80.943%0.42645%0.448SS..PPolyproline II helixtrans-67123-177.9-58.6176.4000107.2M243 H246M243-I248 HydrophobicContact CG-CB 4.32Å; M243-I248 PolarHBondContact O-N 3.44Å; M243-I248 VanDerWaalsContact O-N 3.15Å; H246-I248 HydrophobicContact CB-CD1 4.2Å; H246-I248 HydrophobicContact CB-CG1 3.86Å; H246-I248 PolarHBondContact O-N 3.05Å; H246-I248 VanDerWaalsContact O-N 3.14Å
249P58.3Low62.5Low112 Ų11287.7 Ų87.773%0.72747%0.466SS*.PPolyproline II helixtrans-59.4142.8-177.424.8-34.2000110.1
250L58.5Low62.4Low56 Ų5690.2 Ų90.229%0.29348%0.48SS..PPolyproline II helixtrans-68.5136.9-176.3-66.9167.5000110.2M243 E252 L255 L270M243-L250 HydrophobicContact CE-CD2 3.46Å; M243-L250 VanDerWaalsContact CE-CD2 3.46Å; L250-E252 PolarHBondContact O-N 2.94Å; L250-L255 HydrophobicContact CB-CD2 4.38Å; L250-L255 HydrophobicContact CB-CG 4.42Å; L250-L270 HydrophobicContact CD1-CD2 3.44Å; L250-L270 VanDerWaalsContact CD1-CD2 3.44Å; L250-L270 HydrophobicContact CD1-CG 4.29Å; L250-L270 HydrophobicContact CD2-CD2 3.4Å; L250-L270 VanDerWaalsContact CD2-CD2 3.4Å; L250-L270 HydrophobicContact CG-CD2 4.03Å
251P66.1Low62.1Low67 Ų6786.9 Ų86.944%0.43548%0.477SS..PPolyproline II helixtrans-60.6134.6178.324.3-32.5000109.7S253 I254P251-S253 PolarHBondContact O-N 3.24Å; P251-I254 HydrophobicContact CG-CD1 3.82Å; P251-I254 HydrophobicContact CG-CG1 4.12Å; P251-I254 PolarHBondContact O-N 3.46Å
252E57.7Low61.6Low143 Ų14390.4 Ų90.467%0.66849%0.486SS*.Hα-helixtrans-52.8-23.7-175.6-72.3-67.9171.200114.1L250 I254 L255 K256L250-E252 PolarHBondContact O-N 2.94Å; E252-I254 VanDerWaalsContact C-N 3.3Å; E252-I254 PolarHBondContact O-N 2.92Å; E252-L255 PolarHBondContact O-N 3.2Å; E252-K256 VanDerWaalsContact O-CB 3.27Å; E252-K256 WeakPolarHBondContact O-CB 3.43Å; E252-K256 PolarHBondContact O-N 3.01Å
253S58.2Low61.1Low87 Ų8797 Ų9761%0.60851%0.513SS*.Hα-helixtrans-60.8-35172.551.70000113.5P251 S257P251-S253 PolarHBondContact O-N 3.24Å; S253-S257 WeakPolarHBondContact O-CB 3.2Å; S253-S257 PolarHBondContact O-N 3.02Å
254I60.1Low60.2Low21 Ų21103.4 Ų103.411%0.10854%0.542CS..Hα-helixtrans-76.6-41176.5-59.9178.3000110.1P251 E252 A258 A267P251-I254 HydrophobicContact CG-CD1 3.82Å; P251-I254 HydrophobicContact CG-CG1 4.12Å; P251-I254 PolarHBondContact O-N 3.46Å; E252-I254 VanDerWaalsContact C-N 3.3Å; E252-I254 PolarHBondContact O-N 2.92Å; I254-A258 WeakPolarHBondContact O-CB 3.15Å; I254-A258 PolarHBondContact O-N 3.4Å; I254-A267 HydrophobicContact CG2-CB 4.42Å
255L62.6Low59.6Low75 Ų7599.7 Ų99.739%0.39352%0.52SS..Hα-helixtrans-65.8-40.9178.6-62.7176.8000112.1L250 E252 A258 K259L250-L255 HydrophobicContact CB-CD2 4.38Å; L250-L255 HydrophobicContact CB-CG 4.42Å; E252-L255 PolarHBondContact O-N 3.2Å; L255-A258 WeakPolarHBondContact O-CB 3.34Å; L255-A258 PolarHBondContact O-N 3.2Å; L255-K259 PolarHBondContact O-N 2.99Å
256K59.3Low59.1Low147 Ų14795.2 Ų95.264%0.63952%0.519SS*.Hα-helixtrans-68.9-44.8177.2-159.7173.3-172.7-177.80111.6E252 A258 K259 D260E252-K256 VanDerWaalsContact O-CB 3.27Å; E252-K256 WeakPolarHBondContact O-CB 3.43Å; E252-K256 PolarHBondContact O-N 3.01Å; K256-A258 VanDerWaalsContact C-N 3.27Å; K256-A258 PolarHBondContact O-N 2.78Å; K256-K259 WeakPolarHBondContact O-CA 3.27Å; K256-K259 VanDerWaalsContact O-CB 3.27Å; K256-K259 WeakPolarHBondContact O-CB 3.5Å; K256-K259 PolarHBondContact O-N 3.47Å; K256-D260 PolarHBondContact O-N 3.47Å
257S57.4Low58.8Low28 Ų2888.9 Ų88.920%0.19649%0.491CS..Hα-helixtrans-63.3-30.5176.1178.60000113.2S253 K259 D260 G261 E264 S265S253-S257 WeakPolarHBondContact O-CB 3.2Å; S253-S257 PolarHBondContact O-N 3.02Å; S257-K259 VanDerWaalsContact C-N 3.27Å; S257-K259 PolarHBondContact O-N 3.15Å; S257-D260 PolarHBondContact O-N 3.31Å; S257-G261 PolarHBondContact O-N 3.41Å; S257-E264 PolarHBondContact OG-O 3.39Å; S257-S265 WeakPolarHBondContact OG-CA 3.38Å
258A59.7Low58.9Low28 Ų2886.1 Ų86.123%0.23147%0.471CS..Hα-helixtrans-60.8-35.6170.400000113.3I254 L255 K256 L271I254-A258 WeakPolarHBondContact O-CB 3.15Å; I254-A258 PolarHBondContact O-N 3.4Å; L255-A258 WeakPolarHBondContact O-CB 3.34Å; L255-A258 PolarHBondContact O-N 3.2Å; K256-A258 VanDerWaalsContact C-N 3.27Å; K256-A258 PolarHBondContact O-N 2.78Å; A258-L271 HydrophobicContact CB-CD1 3.35Å; A258-L271 HydrophobicContact CB-CD2 3.45Å; A258-L271 VanDerWaalsContact CB-CD2 3.45Å; A258-L271 HydrophobicContact CB-CG 4.01Å
259K57.1Low58.6Low183 Ų18388.2 Ų88.280%0.79647%0.473SS*.Hα-helixtrans-76.1-29.9-178.2-165176.1-178.6177.70112.5L255 K256 S257L255-K259 PolarHBondContact O-N 2.99Å; K256-K259 WeakPolarHBondContact O-CA 3.27Å; K256-K259 VanDerWaalsContact O-CB 3.27Å; K256-K259 WeakPolarHBondContact O-CB 3.5Å; K256-K259 PolarHBondContact O-N 3.47Å; S257-K259 VanDerWaalsContact C-N 3.27Å; S257-K259 PolarHBondContact O-N 3.15Å
260D61.2Low58.7Low131 Ų13184.4 Ų84.470%0.70145%0.446SS*.Hα-helixtrans-85-14.2-179.9-60.4-30.4000113.1K256 S257K256-D260 PolarHBondContact O-N 3.47Å; S257-D260 PolarHBondContact O-N 3.31Å
261G58.5Low58.9Low31 Ų3184.3 Ų84.332%0.3245%0.446SS..  trans143.8128.6169.900000113.7S257 M263 E264S257-G261 PolarHBondContact O-N 3.41Å; G261-M263 PolarHBondContact O-N 3.32Å; G261-E264 PolarHBondContact O-N 2.98Å; G261-E264 VanDerWaalsContact O-N 3.15Å
262I59.5Low58.5Low112 Ų11286.9 Ų86.957%0.57446%0.46SS*.G310 helixtrans-55.7-29-174-60.4172.1000113.1P268I262-P268 HydrophobicContact CG2-CB 4.26Å
263M57.1Low58.1Low171 Ų17187.5 Ų87.584%0.84246%0.463SS*.G310 helixtrans-69.7-29.8-178-81.8167.149.100114.7G261G261-M263 PolarHBondContact O-N 3.32Å
264E51.2Low57.3Low159 Ų15990.2 Ų90.274%0.74347%0.471SS*.G310 helixtrans-99.55.1-179.8-59.1-53.6139.200112.8S257 G261 C266S257-E264 PolarHBondContact OG-O 3.39Å; G261-E264 PolarHBondContact O-N 2.98Å; G261-E264 VanDerWaalsContact O-N 3.15Å; E264-C266 PolarHBondContact O-N 2.84Å
265S57.6Low56.7Low10 Ų1093.3 Ų93.37%0.0751%0.508CS..  trans-67.9134.2177.3-171.40000111.7S257 A267 P268S257-S265 WeakPolarHBondContact OG-CA 3.38Å; S265-A267 PolarHBondContact O-N 3.34Å; S265-A267 PolarHBondContact OG-N 2.94Å; S265-P268 WeakPolarHBondContact O-CD 3.49Å; S265-P268 WeakPolarHBondContact O-CG 3.27Å
266C53.8Low55.6Low109 Ų10996.8 Ų96.874%0.73653%0.526SS*.SBendtrans-66.8-15.4174.1-161.70000112.7E264E264-C266 PolarHBondContact O-N 2.84Å
267A58.7Low54.8Low8 Ų895.6 Ų95.67%0.06653%0.533CS..  trans-142.566.2175.700000112.6I254 S265 W269 L270I254-A267 HydrophobicContact CG2-CB 4.42Å; S265-A267 PolarHBondContact O-N 3.34Å; S265-A267 PolarHBondContact OG-N 2.94Å; A267-W269 HydrophobicContact CB-CZ2 4.14Å; A267-W269 PolarHBondContact O-N 3.39Å; A267-L270 HydrophobicContact CB-CB 4.16Å; A267-L270 VanDerWaalsContact O-CB 3.32Å; A267-L270 WeakPolarHBondContact O-CB 3.2Å; A267-L270 PolarHBondContact O-N 3.18Å
268P59.4Low54Low48 Ų48100.8 Ų100.831%0.31256%0.563SS.*G310 helixtrans-62.5-31.2-174.7-18.632.2000112.6I262 S265 L270 L271I262-P268 HydrophobicContact CG2-CB 4.26Å; S265-P268 WeakPolarHBondContact O-CD 3.49Å; S265-P268 WeakPolarHBondContact O-CG 3.27Å; P268-L270 PolarHBondContact O-N 3.41Å; P268-L271 PolarHBondContact O-N 2.86Å
269W58.9Low52.8Low126 Ų126103.8 Ų103.848%0.47758%0.583SS.*G310 helixtrans-63.3-17.917854.2-92.1000114.1Y240 A267Y240-W269 AromaticContact CD2-CH2 3.72Å; Y240-W269 HydrophobicContact CD2-CH2 3.72Å; Y240-W269 AromaticContact CD2-CZ3 4Å; Y240-W269 HydrophobicContact CD2-CZ3 4Å; Y240-W269 AromaticContact CE2-CH2 3.74Å; Y240-W269 HydrophobicContact CE2-CH2 3.74Å; Y240-W269 AromaticContact CE2-CZ3 3.5Å; Y240-W269 HydrophobicContact CE2-CZ3 3.5Å; Y240-W269 VanDerWaalsContact CE2-CZ3 3.5Å; Y240-W269 HydrophobicContact CG-CH2 4.46Å; Y240-W269 AromaticContact CZ-CZ3 3.99Å; A267-W269 HydrophobicContact CB-CZ2 4.14Å; A267-W269 PolarHBondContact O-N 3.39Å
270L60.2Low51.9Low32 Ų32106.9 Ų106.917%0.16859%0.589CS.*G310 helixtrans-88.9-22.4-178.4-161.881.6000112.6Y240 L250 A267 P268 V272Y240-L270 HydrophobicContact CE2-CD1 4.34Å; L250-L270 HydrophobicContact CD1-CD2 3.44Å; L250-L270 VanDerWaalsContact CD1-CD2 3.44Å; L250-L270 HydrophobicContact CD1-CG 4.29Å; L250-L270 HydrophobicContact CD2-CD2 3.4Å; L250-L270 VanDerWaalsContact CD2-CD2 3.4Å; L250-L270 HydrophobicContact CG-CD2 4.03Å; A267-L270 HydrophobicContact CB-CB 4.16Å; A267-L270 VanDerWaalsContact O-CB 3.32Å; A267-L270 WeakPolarHBondContact O-CB 3.2Å; A267-L270 PolarHBondContact O-N 3.18Å; P268-L270 PolarHBondContact O-N 3.41Å; L270-V272 VanDerWaalsContact C-N 3.29Å; L270-V272 PolarHBondContact O-N 3.44Å
271L62.8Low51Low55 Ų55110.5 Ų110.529%0.28859%0.593SS.*THydrogen-bonded Turntrans-87.52.2-174.9-61.3166.6000113.2A258 P268 Q273A258-L271 HydrophobicContact CB-CD1 3.35Å; A258-L271 HydrophobicContact CB-CD2 3.45Å; A258-L271 VanDerWaalsContact CB-CD2 3.45Å; A258-L271 HydrophobicContact CB-CG 4.01Å; P268-L271 PolarHBondContact O-N 2.86Å; L271-Q273 VanDerWaalsContact C-N 3.33Å
272V57.2Low50.1Low120 Ų120119.8 Ų119.873%0.72762%0.62SS**THydrogen-bonded Turntrans-89.6-1-178.7-173.70000111.6L270L270-V272 VanDerWaalsContact C-N 3.29Å; L270-V272 PolarHBondContact O-N 3.44Å
273Q48.9Very low49Very low156 Ų156119.8 Ų119.873%0.72963%0.63SS**  trans-84.5-17.5-167.6-152.978.274.900114.5L271L271-Q273 VanDerWaalsContact C-N 3.33Å
274D42.1Very low48.2Very low145 Ų145121.7 Ų121.778%0.77563%0.634SS**SBendtrans-103.7113.9-177.8-66.2-39.1000111.8L276D274-L276 PolarHBondContact O-N 3.1Å
275G47.5Very low47.5Very low85 Ų85119 Ų11988%0.87663%0.632SS**  trans-75.468.7-163.500000116.5
276L40.3Very low46.3Very low148 Ų148127.3 Ų127.378%0.77567%0.67SS**  trans-83.8133.7162.3-74.5170.4000110.8D274 V278D274-L276 PolarHBondContact O-N 3.1Å; L276-V278 PolarHBondContact O-N 3.31Å
277P41.6Very low45.3Very low122 Ų122133 Ų13379%0.79268%0.678SS**  trans-78.882.8-176.532.5-35.5000111.2S279P277-S279 PolarHBondContact O-N 2.76Å
278V41.3Very low44.3Very low137 Ų137137.8 Ų137.883%0.8371%0.708SS**  trans-68.3104.2168.2-179.70000108.6L276 R280L276-V278 PolarHBondContact O-N 3.31Å; V278-R280 PolarHBondContact O-N 2.97Å
279S33.9Very low43.7Very low92 Ų92142.9 Ų142.964%0.64373%0.728SS**  trans-52.1127.8176.4-84.80000111.7P277 R281P277-S279 PolarHBondContact O-N 2.76Å; S279-R281 PolarHBondContact O-N 3.25Å
280R38.3Very low43Very low247 Ų247144.3 Ų144.393%0.93274%0.744SS**  trans-66.376.8166.1-176-172.4-70.3-119.4-0.7109.6V278V278-R280 PolarHBondContact O-N 2.97Å
281R43Very low42.2Very low208 Ų208151.9 Ų151.979%0.78578%0.776SS**  trans-132.740.2-173.8-74.2-74.4-78.6-156.4-5.7114.1S279S279-R281 PolarHBondContact O-N 3.25Å
282Y38.4Very low41.3Very low226 Ų226154.2 Ų154.289%0.88679%0.793SS**  trans-135108.9151.6-73.8-81.1000105.6
283S36.8Very low40.5Very low112 Ų112151.9 Ų151.978%0.78379%0.793SS**  6213265-158.40000112.7
284K41.3Very low40.3Very low210 Ų210153.2 Ų153.291%0.91380%0.801SS**SBendtrans-93.5101.8-163.3177.6-172.4180-176.20110.6
285S35.6Very low40.7Very low102 Ų102155.4 Ų155.471%0.71381%0.806SS**  trans-161.8129.9163.450.70000111.8
286E32.6Very low40.7Very low186 Ų186161.3 Ų161.387%0.86981%0.808SS**  trans40.5101.3158.2-82.1168.6134.100120.4
287Y31.6Very low40.7Very low229 Ų229164.6 Ų164.690%0.89882%0.816SS**  trans-81.6127.9143.6-92.5-93.1000109.4Q289Y287-Q289 PolarHBondContact O-N 3.45Å
288P39.1Very low40.4Very low107 Ų107164.2 Ų164.270%0.69582%0.816SS**  trans-61.4123.6162.1-21.833.9000110.2L290P288-L290 PolarHBondContact O-N 3.49Å
289Q46.5Very low40.4Very low156 Ų156165.9 Ų165.973%0.72982%0.818SS**  trans-68.896.3174.8-78.9-160.513.500111Y287 T292Y287-Q289 PolarHBondContact O-N 3.45Å; Q289-T292 PolarHBondContact OE1-OG1 3.21Å
290L45Very low40.3Very low155 Ų155170.7 Ų170.781%0.81283%0.831SS**  trans-116.413.4167.3-66177.6000113.2P288P288-L290 PolarHBondContact O-N 3.49Å
291F42.8Very low40Very low192 Ų192162.6 Ų162.684%0.84282%0.824SS**SBendtrans-115.213177.8-89.6-76.7000115
292T43.5Very low39.4Very low104 Ų104157.6 Ų157.664%0.63883%0.828SS**  trans-116.354.7178.240.20000111.3Q289Q289-T292 PolarHBondContact OE1-OG1 3.21Å
293G39.8Very low39.3Very low71 Ų71153.4 Ų153.473%0.73283%0.826SS**  trans-121.617.2-169.700000117.1
294M45Very low39.7Very low183 Ų183153.3 Ų153.390%0.90182%0.823SS**SBendtrans-146.367.7178.9-77.8-163.469.700114.1
295H51Low39.8Very low191 Ų191149 Ų14988%0.88482%0.816SS**  trans-167.969155.1-126.7-83.8000114.8
296K46.8Very low40Very low210 Ų210150.2 Ų150.291%0.91382%0.821SS**  trans-15678.8163.8-74.1-155.6-179.2-173.90114.5
297K40Very low40.1Very low217 Ų217148.4 Ų148.494%0.94382%0.823SS**  trans-162.4131.6150.6-56.4-169.9-176.2-178.60105.3
298S36.9Very low40.1Very low114 Ų114141.2 Ų141.280%0.79782%0.819SS**  cis-147.2132.9-2.4-177.50000108
299I40.6Very low39.6Very low171 Ų171145.7 Ų145.788%0.87783%0.827SS**  trans-154.585.1167.2-170.470.3000109.8
300E32.3Very low38.6Very low193 Ų193143.3 Ų143.390%0.90283%0.826SS**  trans-134.4142161.1-87.3-179154.600107.1
301G31.8Very low37.8Very low77 Ų77143.3 Ų143.379%0.79483%0.827SS**  cis-144.7168.9400000113.3
302A31.1Very low37.1Very low104 Ų104138.5 Ų138.586%0.8682%0.823SS**  trans-135.1129.216700000108.7
303T35.6Very low37.2Very low138 Ų138139.1 Ų139.185%0.84783%0.829SS**PPolyproline II helixtrans-102.4149.3175.3-440000107
304P44.9Very low36.7Very low110 Ų110145.5 Ų145.571%0.71484%0.84SS**PPolyproline II helixtrans-81.6166.1-148.432.4-36.8000115.3
305P43Very low36Very low120 Ų120146.1 Ų146.178%0.77984%0.841SS**PPolyproline II helixtrans-84.7162.2-176.535.6-36.9000113.1
306P40.3Very low34.8Very low126 Ų126141.7 Ų141.782%0.81884%0.837SS**  trans-120.8159.3139.835.6-27.8000112.9
307T34.5Very low33.9Very low149 Ų149139 Ų13991%0.91483%0.832SS**  trans-69.9144.4-178.150.40000114.3
308G30.7Very low33.5Very low78 Ų78132.5 Ų132.580%0.80482%0.819SS**  trans-176.4150167.500000112.2
309K30Very low33.2Very low201 Ų201135 Ų13587%0.87482%0.818SS**  trans-115.5171.5-177.1-64.9177.4176.8176.90111.6
310C24.7Very low32.7Very low105 Ų105134.2 Ų134.271%0.70981%0.814SS**  trans92.8120.2150.9-71.30000119.8
311D27.4Very low33.5Very low155 Ų155129.9 Ų129.983%0.82980%0.803SS**  trans67.8144.3134.4-51.6-41.5000122.3
312A28.4Very low33.4Very low92 Ų92133.8 Ų133.876%0.7680%0.8SS**  trans-109.4-168.9174.300000109.1
313P47.2Very low33.3Very low116 Ų116135.6 Ų135.675%0.75380%0.795SS**  cis-126.8169-2438.7-25.5000112.5
314Q28.3Very low33.3Very low206 Ų206133.7 Ų133.796%0.96379%0.794SS**  trans-159.5151.3153.7-124.6154.8-6.600116.9
315Q29.4Very low32.7Very low196 Ų196137 Ų13792%0.91680%0.799SS**  trans-99.6148.8177.8-61.9168.3-43.700112
316A27.7Very low32.4Very low97 Ų97137.1 Ų137.180%0.80280%0.798SS**  trans173.3124.5141.300000107.5
317N26.1Very low32.1Very low154 Ų154139 Ų13982%0.82480%0.796SS**  cis85.6103.849.8-173.236.8000115
318A32.7Very low32.5Very low80 Ų80139.5 Ų139.566%0.66179%0.788SS**  trans168.9111.314600000109.4
319Q29.8Very low32.7Very low166 Ų166144.5 Ų144.578%0.77679%0.787SS**  74.1113.2102.3-67.6173.2700114.9
320I30.2Very low33.5Very low155 Ų155146 Ų14680%0.79579%0.787SS**  81.4138.160.2-71.9169.8000111.7
321P48.7Very low34.1Very low102 Ų102146.2 Ų146.266%0.66279%0.791SS**  cis-140.5-157.2-25.434.9-10.5000114.8
322E29.9Very low34.7Very low159 Ų159147.9 Ų147.974%0.74379%0.793SS**  trans113.9101.5147.4-49.2-140.9163.600122
323D29Very low35.2Very low142 Ų142147.1 Ų147.176%0.75979%0.794SS**  71.7138.3114.4-62.38000126
324A35.3Very low35.1Very low98 Ų98150.7 Ų150.781%0.8180%0.798SS**  trans65.2150.1152.700000119.8
325E33.8Very low36.2Very low179 Ų179146.1 Ų146.184%0.83679%0.786SS**  cis-161.3159.9-33.4-127.9-170.4178.600107.5
326V35.9Very low37.6Very low123 Ų123143.6 Ų143.675%0.74578%0.784SS**  trans42.5117.5157.3-174.80000120.7
327E35Very low39.5Very low167 Ų167143.2 Ų143.278%0.7877%0.767SS**  trans-152.1125.8135.5-117.3-85128.600110.3
328E41.8Very low42.1Very low159 Ų159138.5 Ų138.574%0.74375%0.747SS**  trans-86.5109.7-174.9-178.5-167.5143.600110.9
329K36Very low44.5Very low182 Ų182142.4 Ų142.479%0.79175%0.749SS**  trans-121.388.6163.2-82.6-168.7176.8174.70114.1S331K329-S331 PolarHBondContact O-N 3.33Å
330R45.8Very low47.1Very low232 Ų232139.2 Ų139.288%0.87573%0.734SS**  trans-35.695152.7-170.7-179.1-166.51724111.6
331S38.5Very low49.7Very low111 Ų111136.1 Ų136.178%0.77672%0.716SS**  trans-96.9124.3170.852.70000109.3K329 G333K329-S331 PolarHBondContact O-N 3.33Å; S331-G333 PolarHBondContact O-N 3.39Å
332E39Very low51.5Low189 Ų189136.3 Ų136.388%0.88371%0.711SS**  trans-60.9127.5-174.5-61.6178.2137.200111.4K334E332-K334 PolarHBondContact O-N 2.89Å
333G38.6Very low54.4Low76 Ų76135 Ų13578%0.78470%0.699SS**  trans-65.9104.2174.500000110.7S331S331-G333 PolarHBondContact O-N 3.39Å
334K46.6Very low57.5Low191 Ų191134.1 Ų134.183%0.8369%0.69SS**  trans-53.1125.4162.1-86.2171.6173.8166.90108.4E332 V336E332-K334 PolarHBondContact O-N 2.89Å; K334-V336 PolarHBondContact O-N 3.49Å; K334-V336 VanDerWaalsContact O-N 3.11Å
335P51.1Low60.2Low110 Ų110134.8 Ų134.871%0.71468%0.68SS**  trans-63.5119.217425.9-32.3000108.3I337P335-I337 PolarHBondContact O-N 3.13Å
336V59.2Low63.1Low143 Ų143129.5 Ų129.587%0.86766%0.663SS**  trans-74.284.2170.3-179.90000106.6K334 S338K334-V336 PolarHBondContact O-N 3.49Å; K334-V336 VanDerWaalsContact O-N 3.11Å; V336-S338 PolarHBondContact O-N 3.34Å; V336-S338 VanDerWaalsContact O-N 3.14Å
337I66.8Low65.9Low89 Ų89127.3 Ų127.346%0.45665%0.646SS.*  trans-50120.9-179.7-59.3174.3000108.2P335 E341 L342P335-I337 PolarHBondContact O-N 3.13Å; I337-E341 WeakPolarHBondContact CA-OE2 3.31Å; I337-E341 HydrophobicContact CG2-CB 4.02Å; I337-E341 HydrophobicContact CG2-CG 3.87Å; I337-L342 HydrophobicContact CG2-CD2 3.82Å; I337-L342 HydrophobicContact CG2-CG 3.82Å
338S80.6Confident68.7Low56 Ų56121.7 Ų121.739%0.39263%0.629SS.*  trans-70.9155.6-171.976.90000111V336 E340 E341 L342V336-S338 PolarHBondContact O-N 3.34Å; V336-S338 VanDerWaalsContact O-N 3.14Å; S338-E340 PolarHBondContact O-N 3.11Å; S338-E340 VanDerWaalsContact O-N 3.15Å; S338-E341 PolarHBondContact N-OE2 3.16Å; S338-E341 VanDerWaalsContact N-OE2 3.09Å; S338-E341 WeakPolarHBondContact O-CB 3.38Å; S338-E341 PolarHBondContact O-N 3Å; S338-E341 VanDerWaalsContact O-N 3.16Å; S338-E341 VanDerWaalsContact OG-CB 3.26Å; S338-E341 WeakPolarHBondContact OG-CB 3.35Å; S338-E341 PolarHBondContact OG-N 3.15Å; S338-E341 VanDerWaalsContact OG-N 3.11Å; S338-L342 PolarHBondContact O-N 3.45Å
339K82.6Confident71.3Confident161 Ų161116.9 Ų116.970%0.762%0.616SS**Hα-helixtrans-59.9-26176.8-176.6174.5178.2177.90112.6R343K339-R343 WeakPolarHBondContact O-CD 3.34Å; K339-R343 VanDerWaalsContact O-CG 3.31Å; K339-R343 WeakPolarHBondContact O-CG 3.5Å; K339-R343 PolarHBondContact O-N 3.05Å
340E84.5Confident74.1Confident99 Ų99113.7 Ų113.746%0.46361%0.607SS.*Hα-helixtrans-80.3-41.7176.5-155.856.8-147.800111.4S338 L342 R343 E344S338-E340 PolarHBondContact O-N 3.11Å; S338-E340 VanDerWaalsContact O-N 3.15Å; E340-L342 VanDerWaalsContact C-N 3.31Å; E340-L342 PolarHBondContact O-N 3.25Å; E340-R343 CarbonylContact O-C 3.57Å; E340-R343 WeakPolarHBondContact O-CA 3.28Å; E340-R343 VanDerWaalsContact O-CB 3.27Å; E340-R343 WeakPolarHBondContact O-CB 3.26Å; E340-R343 PolarHBondContact O-N 3.43Å; E340-R343 WeakPolarHBondContact OE2-CD 3.42Å; E340-R343 IonicContact OE2-NH1 2.8Å; E340-R343 PolarHBondContact OE2-NH1 2.96Å; E340-E344 PolarHBondContact O-N 2.9Å
341E86.1Confident76.4Confident90 Ų90110.7 Ų110.742%0.42160%0.596SS.*Hα-helixtrans-59.6-38.5173.8-171.4179.3-17600112.3I337 S338 R343 E344 N345I337-E341 WeakPolarHBondContact CA-OE2 3.31Å; I337-E341 HydrophobicContact CG2-CB 4.02Å; I337-E341 HydrophobicContact CG2-CG 3.87Å; S338-E341 PolarHBondContact N-OE2 3.16Å; S338-E341 VanDerWaalsContact N-OE2 3.09Å; S338-E341 WeakPolarHBondContact O-CB 3.38Å; S338-E341 PolarHBondContact O-N 3Å; S338-E341 VanDerWaalsContact O-N 3.16Å; S338-E341 VanDerWaalsContact OG-CB 3.26Å; S338-E341 WeakPolarHBondContact OG-CB 3.35Å; S338-E341 PolarHBondContact OG-N 3.15Å; S338-E341 VanDerWaalsContact OG-N 3.11Å; E341-R343 VanDerWaalsContact C-N 3.29Å; E341-R343 PolarHBondContact O-N 2.85Å; E341-E344 PolarHBondContact O-N 3.11Å; E341-N345 VanDerWaalsContact O-CB 3.22Å; E341-N345 WeakPolarHBondContact O-CB 3.44Å; E341-N345 PolarHBondContact O-N 3.09Å
342L85.6Confident79.1Confident106 Ų106108 Ų10856%0.55558%0.581SS**Hα-helixtrans-62.3-33170.2-72.6176.2000113.2I337 S338 E340 S346I337-L342 HydrophobicContact CG2-CD2 3.82Å; I337-L342 HydrophobicContact CG2-CG 3.82Å; S338-L342 PolarHBondContact O-N 3.45Å; E340-L342 VanDerWaalsContact C-N 3.31Å; E340-L342 PolarHBondContact O-N 3.25Å; L342-S346 VanDerWaalsContact O-CB 3.28Å; L342-S346 WeakPolarHBondContact O-CB 3.27Å; L342-S346 PolarHBondContact O-N 2.86Å; L342-S346 VanDerWaalsContact O-N 3.13Å
343R91.4Very high81.8Confident133 Ų133106 Ų10650%0.50257%0.569SS.*Hα-helixtrans-74.1-46.6176.5-71.7163.9159.4-155.1-10.4110.9K339 E340 E341 N345 S346 I347K339-R343 WeakPolarHBondContact O-CD 3.34Å; K339-R343 VanDerWaalsContact O-CG 3.31Å; K339-R343 WeakPolarHBondContact O-CG 3.5Å; K339-R343 PolarHBondContact O-N 3.05Å; E340-R343 CarbonylContact O-C 3.57Å; E340-R343 WeakPolarHBondContact O-CA 3.28Å; E340-R343 VanDerWaalsContact O-CB 3.27Å; E340-R343 WeakPolarHBondContact O-CB 3.26Å; E340-R343 PolarHBondContact O-N 3.43Å; E340-R343 WeakPolarHBondContact OE2-CD 3.42Å; E340-R343 IonicContact OE2-NH1 2.8Å; E340-R343 PolarHBondContact OE2-NH1 2.96Å; E341-R343 VanDerWaalsContact C-N 3.29Å; E341-R343 PolarHBondContact O-N 2.85Å; R343-N345 VanDerWaalsContact C-N 3.34Å; R343-N345 PolarHBondContact O-N 3.47Å; R343-S346 PolarHBondContact O-N 3.31Å; R343-I347 WeakPolarHBondContact O-CB 3.37Å; R343-I347 WeakPolarHBondContact O-CD1 3.47Å; R343-I347 WeakPolarHBondContact O-CG1 3.33Å; R343-I347 PolarHBondContact O-N 3.43Å
344E92.8Very high84.4Confident123 Ų123105.3 Ų105.358%0.57556%0.556SS**Hα-helixtrans-59.8-44.1177-69.3-177.3164.300111.6E340 E341 I347 A348E340-E344 PolarHBondContact O-N 2.9Å; E341-E344 PolarHBondContact O-N 3.11Å; E344-I347 PolarHBondContact O-N 3.38Å; E344-A348 WeakPolarHBondContact O-CB 3.2Å; E344-A348 PolarHBondContact O-N 2.92Å
345N93Very high86.7Confident112 Ų112102.7 Ų102.760%0.59955%0.546SS*.Hα-helixtrans-65.5-42.3177.5-158.1-38.1000111.7E341 R343 I347 A348 A349E341-N345 VanDerWaalsContact O-CB 3.22Å; E341-N345 WeakPolarHBondContact O-CB 3.44Å; E341-N345 PolarHBondContact O-N 3.09Å; R343-N345 VanDerWaalsContact C-N 3.34Å; R343-N345 PolarHBondContact O-N 3.47Å; N345-I347 PolarHBondContact O-N 3.03Å; N345-A348 PolarHBondContact O-N 3.28Å; N345-A349 WeakPolarHBondContact O-CB 3.44Å; N345-A349 PolarHBondContact O-N 2.82Å
346S95.3Very high88.5Confident68 Ų68102.9 Ų102.948%0.47654%0.538SS..Hα-helixtrans-61.1-40.8172-176.60000112.9L342 R343 L350L342-S346 VanDerWaalsContact O-CB 3.28Å; L342-S346 WeakPolarHBondContact O-CB 3.27Å; L342-S346 PolarHBondContact O-N 2.86Å; L342-S346 VanDerWaalsContact O-N 3.13Å; R343-S346 PolarHBondContact O-N 3.31Å; S346-L350 WeakPolarHBondContact O-CG 3.46Å; S346-L350 PolarHBondContact O-N 3.14Å
347I93.5Very high90Very high76 Ų76102.3 Ų102.339%0.3953%0.525SS..Hα-helixtrans-66.3-41.7175.7-70162.3000111R343 E344 N345 L350 R351R343-I347 WeakPolarHBondContact O-CB 3.37Å; R343-I347 WeakPolarHBondContact O-CD1 3.47Å; R343-I347 WeakPolarHBondContact O-CG1 3.33Å; R343-I347 PolarHBondContact O-N 3.43Å; E344-I347 PolarHBondContact O-N 3.38Å; N345-I347 PolarHBondContact O-N 3.03Å; I347-L350 PolarHBondContact O-N 2.93Å; I347-R351 VanDerWaalsContact CG2-CZ 3.45Å; I347-R351 WeakPolarHBondContact O-CG 3.4Å; I347-R351 PolarHBondContact O-N 3.49Å
348A94.1Very high90.7Very high50 Ų50100.8 Ų100.841%0.41352%0.523SS..Hα-helixtrans-62.9-45.8176.800000111.6E344 N345 L350 R351 A352E344-A348 WeakPolarHBondContact O-CB 3.2Å; E344-A348 PolarHBondContact O-N 2.92Å; N345-A348 PolarHBondContact O-N 3.28Å; A348-L350 VanDerWaalsContact C-N 3.34Å; A348-L350 PolarHBondContact O-N 3.28Å; A348-R351 PolarHBondContact O-N 2.93Å; A348-A352 PolarHBondContact O-N 3.43Å
349A96.3Very high90.9Very high58 Ų58101 Ų10148%0.47953%0.528SS..Hα-helixtrans-60.1-41.4175.500000112.5N345 A352 K353N345-A349 WeakPolarHBondContact O-CB 3.44Å; N345-A349 PolarHBondContact O-N 2.82Å; A349-A352 PolarHBondContact O-N 2.9Å; A349-K353 WeakPolarHBondContact O-CB 3.36Å; A349-K353 PolarHBondContact O-N 3.34Å
350L94.5Very high91Very high114 Ų11499.6 Ų99.660%0.59752%0.522SS*.Hα-helixtrans-65.3-40.1174.8-73.6170.5000112.5S346 I347 A348 K353 A354S346-L350 WeakPolarHBondContact O-CG 3.46Å; S346-L350 PolarHBondContact O-N 3.14Å; I347-L350 PolarHBondContact O-N 2.93Å; A348-L350 VanDerWaalsContact C-N 3.34Å; A348-L350 PolarHBondContact O-N 3.28Å; L350-K353 PolarHBondContact O-N 3Å; L350-A354 WeakPolarHBondContact O-CB 3.47Å; L350-A354 PolarHBondContact O-N 3.24Å
351R95.5Very high90.8Very high169 Ų16998.2 Ų98.264%0.63852%0.52SS*.Hα-helixtrans-63.5-46.1175.2-73.9171.3-179.5160.71.6111.8I347 A348 K353 A354 Q355I347-R351 VanDerWaalsContact CG2-CZ 3.45Å; I347-R351 WeakPolarHBondContact O-CG 3.4Å; I347-R351 PolarHBondContact O-N 3.49Å; A348-R351 PolarHBondContact O-N 2.93Å; R351-K353 VanDerWaalsContact C-N 3.35Å; R351-K353 PolarHBondContact O-N 3.47Å; R351-A354 PolarHBondContact O-N 2.94Å; R351-Q355 WeakPolarHBondContact O-CG 3.22Å; R351-Q355 PolarHBondContact O-N 3.24Å
352A94.8Very high90.1Very high56 Ų5699.3 Ų99.346%0.46353%0.528SS..Hα-helixtrans-59.6-44.7176.700000111.5A348 A349 A354 Q355 E356A348-A352 PolarHBondContact O-N 3.43Å; A349-A352 PolarHBondContact O-N 2.9Å; A352-A354 PolarHBondContact O-N 3.47Å; A352-Q355 PolarHBondContact O-N 2.95Å; A352-E356 PolarHBondContact O-N 3.46Å
353K95.9Very high89Confident147 Ų14796.2 Ų96.264%0.63952%0.522SS*.Hα-helixtrans-67.2-33.3177.3-165.6167.3-172.4168.50113.3A349 L350 R351 H357A349-K353 WeakPolarHBondContact O-CB 3.36Å; A349-K353 PolarHBondContact O-N 3.34Å; L350-K353 PolarHBondContact O-N 3Å; R351-K353 VanDerWaalsContact C-N 3.35Å; R351-K353 PolarHBondContact O-N 3.47Å; K353-H357 WeakPolarHBondContact O-CB 3.4Å; K353-H357 PolarHBondContact O-N 2.92Å
354A93.3Very high87.4Confident61 Ų6196.4 Ų96.450%0.50453%0.526SS..Hα-helixtrans-68-38.7172.600000112L350 R351 A352 H357 S358L350-A354 WeakPolarHBondContact O-CB 3.47Å; L350-A354 PolarHBondContact O-N 3.24Å; R351-A354 PolarHBondContact O-N 2.94Å; A352-A354 PolarHBondContact O-N 3.47Å; A354-H357 PolarHBondContact O-N 3.2Å; A354-S358 PolarHBondContact O-N 3.2Å; A354-S358 PolarHBondContact O-OG 3.46Å
355Q92.9Very high85.6Confident135 Ų13594.6 Ų94.663%0.63152%0.523SS*.Hα-helixtrans-66.5-41.4172.9-73.1176.2-30.300112.1R351 A352 H357 S358 A359R351-Q355 WeakPolarHBondContact O-CG 3.22Å; R351-Q355 PolarHBondContact O-N 3.24Å; A352-Q355 PolarHBondContact O-N 2.95Å; Q355-H357 VanDerWaalsContact C-N 3.34Å; Q355-H357 PolarHBondContact O-N 2.9Å; Q355-S358 PolarHBondContact O-N 2.88Å; Q355-S358 PolarHBondContact O-OG 2.87Å; Q355-A359 VanDerWaalsContact O-CB 3.32Å; Q355-A359 WeakPolarHBondContact O-CB 3.44Å; Q355-A359 PolarHBondContact O-N 2.88Å
356E90.6Very high83.9Confident115 Ų11593.2 Ų93.254%0.53752%0.522SS..Hα-helixtrans-59-46.3172.8-167.7-155.7148.800110.8A352 A359 K360A352-E356 PolarHBondContact O-N 3.46Å; E356-A359 PolarHBondContact O-N 3.45Å; E356-K360 VanDerWaalsContact O-CB 3.29Å; E356-K360 WeakPolarHBondContact O-CB 3.38Å; E356-K360 PolarHBondContact O-N 3.41Å
357H90.5Very high82.1Confident130 Ų13095.4 Ų95.460%0.60253%0.525SS*.Hα-helixtrans-63.2-43177.7-172.7-87.9000112.3K353 A354 Q355 K360 V361K353-H357 WeakPolarHBondContact O-CB 3.4Å; K353-H357 PolarHBondContact O-N 2.92Å; A354-H357 PolarHBondContact O-N 3.2Å; Q355-H357 VanDerWaalsContact C-N 3.34Å; Q355-H357 PolarHBondContact O-N 2.9Å; H357-K360 PolarHBondContact O-N 3.33Å; H357-V361 WeakPolarHBondContact O-CG2 3.35Å; H357-V361 PolarHBondContact O-N 2.99Å
358S81.1Confident80.3Confident58 Ų5896.1 Ų96.141%0.40653%0.53SS..Hα-helixtrans-66.1-40.9177.669.70000112.1A354 Q355 K360 V361 L362A354-S358 PolarHBondContact O-N 3.2Å; A354-S358 PolarHBondContact O-OG 3.46Å; Q355-S358 PolarHBondContact O-N 2.88Å; Q355-S358 PolarHBondContact O-OG 2.87Å; S358-K360 VanDerWaalsContact C-N 3.32Å; S358-K360 PolarHBondContact O-N 3.01Å; S358-V361 PolarHBondContact O-N 3.45Å; S358-L362 WeakPolarHBondContact O-CB 3.44Å; S358-L362 WeakPolarHBondContact O-CG 3.43Å; S358-L362 PolarHBondContact O-N 3.41Å
359A84.2Confident78.5Confident60 Ų60103 Ų10350%0.49655%0.545SS..Hα-helixtrans-62.6-37.5173.100000112.1Q355 E356 G363Q355-A359 VanDerWaalsContact O-CB 3.32Å; Q355-A359 WeakPolarHBondContact O-CB 3.44Å; Q355-A359 PolarHBondContact O-N 2.88Å; E356-A359 PolarHBondContact O-N 3.45Å; A359-G363 PolarHBondContact O-N 3.29Å
360K85.9Confident76.5Confident131 Ų131105.2 Ų105.257%0.5755%0.548SS*.Hα-helixtrans-72.5-31.9177.7-158.7163.9-166.11610113E356 H357 S358 K364E356-K360 VanDerWaalsContact O-CB 3.29Å; E356-K360 WeakPolarHBondContact O-CB 3.38Å; E356-K360 PolarHBondContact O-N 3.41Å; H357-K360 PolarHBondContact O-N 3.33Å; S358-K360 VanDerWaalsContact C-N 3.32Å; S358-K360 PolarHBondContact O-N 3.01Å; K360-K364 WeakPolarHBondContact O-CG 3.32Å; K360-K364 PolarHBondContact O-N 3.02Å
361V79.7Confident74.5Confident71 Ų71103.6 Ų103.643%0.4354%0.54SS..Hα-helixtrans-69.8-50.2170.6170.10000110.5H357 S358 G363 K364 V365H357-V361 WeakPolarHBondContact O-CG2 3.35Å; H357-V361 PolarHBondContact O-N 2.99Å; S358-V361 PolarHBondContact O-N 3.45Å; V361-G363 VanDerWaalsContact C-N 3.32Å; V361-G363 PolarHBondContact O-N 3.22Å; V361-K364 PolarHBondContact O-N 3.41Å; V361-V365 WeakPolarHBondContact O-CG2 3.47Å; V361-V365 PolarHBondContact O-N 3Å
362L71.1Confident72.5Confident112 Ų112102 Ų10259%0.58654%0.539SS*.Hα-helixtrans-63.1-36.9177.8-71.5168.4000112.3S358 V365 S366S358-L362 WeakPolarHBondContact O-CB 3.44Å; S358-L362 WeakPolarHBondContact O-CG 3.43Å; S358-L362 PolarHBondContact O-N 3.41Å; L362-V365 PolarHBondContact O-N 3.05Å; L362-S366 WeakPolarHBondContact O-CB 3.29Å; L362-S366 PolarHBondContact O-N 3.28Å; L362-S366 PolarHBondContact O-OG 3.04Å
363G61.9Low70.5Confident41 Ų41100.8 Ų100.842%0.42353%0.533SS..Hα-helixtrans-65.1-37.2174.900000113.3A359 V361 H367A359-G363 PolarHBondContact O-N 3.29Å; V361-G363 VanDerWaalsContact C-N 3.32Å; V361-G363 PolarHBondContact O-N 3.22Å; G363-H367 WeakPolarHBondContact O-CB 3.27Å; G363-H367 PolarHBondContact O-N 3.47Å
364K58Low68.4Low138 Ų138100 Ų10060%0.653%0.529SS*.Hα-helixtrans-66.4-48.1171.9-77.1-178.9174.7-163.30111.8K360 V361 S366 H367 D368K360-K364 WeakPolarHBondContact O-CG 3.32Å; K360-K364 PolarHBondContact O-N 3.02Å; V361-K364 PolarHBondContact O-N 3.41Å; K364-S366 VanDerWaalsContact C-N 3.25Å; K364-S366 PolarHBondContact O-N 2.78Å; K364-H367 WeakPolarHBondContact O-CB 3.46Å; K364-H367 PolarHBondContact O-N 2.9Å; K364-D368 PolarHBondContact O-N 3.02Å
365V55.8Low66.5Low85 Ų85103.3 Ų103.352%0.51553%0.534SS..Hα-helixtrans-58.5-37.7176174.20000111.6V361 L362 R369V361-V365 WeakPolarHBondContact O-CG2 3.47Å; V361-V365 PolarHBondContact O-N 3Å; L362-V365 PolarHBondContact O-N 3.05Å; V365-R369 VanDerWaalsContact O-CB 3.27Å; V365-R369 WeakPolarHBondContact O-CB 3.49Å; V365-R369 PolarHBondContact O-N 2.93Å
366S57.7Low64.5Low82 Ų82104.1 Ų104.157%0.57354%0.538SS*.Hα-helixtrans-69.2-33.9174.4-65.50000113.5L362 K364 L370L362-S366 WeakPolarHBondContact O-CB 3.29Å; L362-S366 PolarHBondContact O-N 3.28Å; L362-S366 PolarHBondContact O-OG 3.04Å; K364-S366 VanDerWaalsContact C-N 3.25Å; K364-S366 PolarHBondContact O-N 2.78Å; S366-L370 WeakPolarHBondContact O-CB 3.44Å; S366-L370 PolarHBondContact O-N 3.13Å
367H55.9Low62.8Low114 Ų114104.2 Ų104.253%0.52854%0.541SS..Hα-helixtrans-70.9-45.8175.5-174.5-85.4000111.2G363 K364 R369 L370 L371G363-H367 WeakPolarHBondContact O-CB 3.27Å; G363-H367 PolarHBondContact O-N 3.47Å; K364-H367 WeakPolarHBondContact O-CB 3.46Å; K364-H367 PolarHBondContact O-N 2.9Å; H367-R369 PolarHBondContact O-N 3.02Å; H367-L370 PolarHBondContact O-N 3.09Å; H367-L370 VanDerWaalsContact O-N 3.13Å; H367-L371 PolarHBondContact O-N 3.16Å
368D56.2Low60.9Low92 Ų92104.6 Ų104.649%0.49254%0.543SS..Hα-helixtrans-62.7-43.2178.6-63.7-23.5000110.9K364 L370 L371 E372K364-D368 PolarHBondContact O-N 3.02Å; D368-L370 VanDerWaalsContact C-N 3.26Å; D368-L370 PolarHBondContact O-N 2.89Å; D368-L371 WeakPolarHBondContact O-CB 3.42Å; D368-L371 PolarHBondContact O-N 3.01Å; D368-E372 PolarHBondContact O-N 3.35Å
369R56.7Low59.7Low194 Ų194106.5 Ų106.573%0.73255%0.552SS**Hα-helixtrans-64.4-26.8175.1-163.9178.2-173.7-148.9-0.7113.7V365 H367 G373V365-R369 VanDerWaalsContact O-CB 3.27Å; V365-R369 WeakPolarHBondContact O-CB 3.49Å; V365-R369 PolarHBondContact O-N 2.93Å; H367-R369 PolarHBondContact O-N 3.02Å; R369-G373 PolarHBondContact O-N 3.23Å
370L53.7Low58.2Low105 Ų105106.8 Ų106.855%0.5556%0.555SS.*Hα-helixtrans-81.9-20.8174.7-165.9119.4000112.5S366 H367 D368 K374S366-L370 WeakPolarHBondContact O-CB 3.44Å; S366-L370 PolarHBondContact O-N 3.13Å; H367-L370 PolarHBondContact O-N 3.09Å; H367-L370 VanDerWaalsContact O-N 3.13Å; D368-L370 VanDerWaalsContact C-N 3.26Å; D368-L370 PolarHBondContact O-N 2.89Å; L370-K374 WeakPolarHBondContact O-CG 3.43Å
371L53.8Low56.6Low80 Ų80107.5 Ų107.542%0.41956%0.56SS.*Hα-helixtrans-78.4-43.6170.3-67.9176.9000111.3H367 D368 G373 K374 Q375H367-L371 PolarHBondContact O-N 3.16Å; D368-L371 WeakPolarHBondContact O-CB 3.42Å; D368-L371 PolarHBondContact O-N 3.01Å; L371-G373 PolarHBondContact O-N 3.49Å; L371-K374 PolarHBondContact O-N 3.06Å; L371-K374 VanDerWaalsContact O-N 3.16Å; L371-Q375 PolarHBondContact O-N 3.06Å; L371-Q375 VanDerWaalsContact O-N 3.13Å
372E53.5Low55.3Low134 Ų134111.3 Ų111.363%0.62657%0.573SS**Hα-helixtrans-56.3-50.4172.4-74.2-179.413500111D368 K374 Q375 E376D368-E372 PolarHBondContact O-N 3.35Å; E372-K374 PolarHBondContact O-N 3.13Å; E372-K374 VanDerWaalsContact O-N 3.09Å; E372-Q375 PolarHBondContact O-N 3.28Å; E372-Q375 VanDerWaalsContact O-N 3.09Å; E372-E376 PolarHBondContact O-N 3.03Å
373G52.6Low54.3Low32 Ų32114.2 Ų114.233%0.3358%0.581SS.*Hα-helixtrans-64-14.817900000115.4R369 L371 I377R369-G373 PolarHBondContact O-N 3.23Å; L371-G373 PolarHBondContact O-N 3.49Å; G373-I377 WeakPolarHBondContact O-CD1 3.35Å; G373-I377 WeakPolarHBondContact O-CG1 3.38Å
374K52.1Low53.8Low131 Ų131116.2 Ų116.257%0.5759%0.594SS**Hα-helixtrans-90.6-32.3172.1-79-176.9176-173.20113L370 L371 E372 Q378L370-K374 WeakPolarHBondContact O-CG 3.43Å; L371-K374 PolarHBondContact O-N 3.06Å; L371-K374 VanDerWaalsContact O-N 3.16Å; E372-K374 PolarHBondContact O-N 3.13Å; E372-K374 VanDerWaalsContact O-N 3.09Å; K374-Q378 PolarHBondContact O-N 3.29Å
375Q51.9Low53.5Low130 Ų130113.8 Ų113.861%0.60759%0.594SS**Hα-helixtrans-69.3-38.3173.6-70.4178.92.800111.1L371 E372 I377 Q378 V379L371-Q375 PolarHBondContact O-N 3.06Å; L371-Q375 VanDerWaalsContact O-N 3.13Å; E372-Q375 PolarHBondContact O-N 3.28Å; E372-Q375 VanDerWaalsContact O-N 3.09Å; Q375-I377 VanDerWaalsContact C-N 3.3Å; Q375-I377 PolarHBondContact O-N 3.35Å; Q375-Q378 PolarHBondContact O-N 3.33Å; Q375-V379 WeakPolarHBondContact O-CG2 3.4Å; Q375-V379 PolarHBondContact O-N 3.24Å
376E52.2Low53.1Low152 Ų152116.6 Ų116.671%0.7161%0.606SS**Hα-helixtrans-63.9-33.2179.8-148.4172.2-158.600112.8E372 A380E372-E376 PolarHBondContact O-N 3.03Å; E376-A380 PolarHBondContact O-N 3.09Å
377I54.3Low52.6Low116 Ų116120.1 Ų120.160%0.59562%0.618SS**Hα-helixtrans-73.2-41.7176-64.1171000111.4G373 Q375 A380 E381G373-I377 WeakPolarHBondContact O-CD1 3.35Å; G373-I377 WeakPolarHBondContact O-CG1 3.38Å; Q375-I377 VanDerWaalsContact C-N 3.3Å; Q375-I377 PolarHBondContact O-N 3.35Å; I377-A380 PolarHBondContact O-N 3.22Å; I377-E381 PolarHBondContact O-N 3.19Å
378Q51.7Low52Low139 Ų139120.6 Ų120.665%0.6563%0.628SS**Hα-helixtrans-67.5-38.7179.6-73.1-178.4-23.900112.5K374 Q375 A380 E381 E382K374-Q378 PolarHBondContact O-N 3.29Å; Q375-Q378 PolarHBondContact O-N 3.33Å; Q378-A380 VanDerWaalsContact C-N 3.27Å; Q378-A380 PolarHBondContact O-N 3.4Å; Q378-E381 PolarHBondContact O-N 3.38Å; Q378-E382 PolarHBondContact O-N 3.29Å
379V54.8Low51.1Low97 Ų97121.9 Ų121.959%0.58865%0.645SS**Hα-helixtrans-68.3-26.6176.2173.50000112.2Q375Q375-V379 WeakPolarHBondContact O-CG2 3.4Å; Q375-V379 PolarHBondContact O-N 3.24Å
380A53.3Low51.1Low67 Ų67117.9 Ų117.955%0.55464%0.644SS**Hα-helixtrans-74.9-32.9174.400000113E376 I377 Q378E376-A380 PolarHBondContact O-N 3.09Å; I377-A380 PolarHBondContact O-N 3.22Å; Q378-A380 VanDerWaalsContact C-N 3.27Å; Q378-A380 PolarHBondContact O-N 3.4Å
381E52.1Low50.2Low146 Ų146122 Ų12268%0.68266%0.66SS**Hα-helixtrans-76.5-43.2-179.1-162.1172.1168.900112I377 Q378 K383 A384I377-E381 PolarHBondContact O-N 3.19Å; Q378-E381 PolarHBondContact O-N 3.38Å; E381-K383 VanDerWaalsContact C-N 3.26Å; E381-K383 PolarHBondContact O-N 3.16Å; E381-A384 PolarHBondContact O-N 3.29Å; E381-A384 VanDerWaalsContact O-N 3.16Å
382E52.2Low49.7Very low150 Ų150127.7 Ų127.770%0.70168%0.682SS**Hα-helixtrans-64.5-28.9178.8-166.7172.2-149.100112.9Q378 A384 S385Q378-E382 PolarHBondContact O-N 3.29Å; E382-A384 VanDerWaalsContact C-N 3.3Å; E382-A384 PolarHBondContact O-N 2.95Å; E382-S385 PolarHBondContact O-OG 3.42Å
383K50.8Low49.1Very low174 Ų174130.6 Ų130.676%0.75770%0.695SS**THydrogen-bonded Turntrans-76.8-11.5178.1-163.3171.3-177.7179.80114.2E381E381-K383 VanDerWaalsContact C-N 3.26Å; E381-K383 PolarHBondContact O-N 3.16Å
384A50.3Low48.8Very low83 Ų83137.4 Ų137.469%0.68672%0.718SS**THydrogen-bonded Turntrans-87.8-19.4179.300000113.4E381 E382E381-A384 PolarHBondContact O-N 3.29Å; E381-A384 VanDerWaalsContact O-N 3.16Å; E382-A384 VanDerWaalsContact C-N 3.3Å; E382-A384 PolarHBondContact O-N 2.95Å
385S51.8Low48.5Very low86 Ų86142.4 Ų142.460%0.60173%0.734SS**SBendtrans-86.9-14.8-176.432.60000115.4E382 L387E382-S385 PolarHBondContact O-OG 3.42Å; S385-L387 PolarHBondContact O-N 3.38Å
386D47.1Very low47.8Very low144 Ų144141 Ų14177%0.7774%0.738SS**SBendtrans-9421.6-167.4-155.132000114.8
387L47Very low48.2Very low157 Ų157143.3 Ų143.382%0.82277%0.766SS**  trans-12760.7-180-74.6177.4000112.6S385S385-L387 PolarHBondContact O-N 3.38Å
388T43.8Very low47.9Very low123 Ų123144.7 Ų144.776%0.75578%0.775SS**  trans-137.553.2176.5-230000116.7
389S37.5Very low47.7Very low119 Ų119144.9 Ų144.983%0.83278%0.781SS**  trans61.4-178.8152.9-121.20000117.9
390P55.7Low47.3Very low110 Ų110147.6 Ų147.671%0.71479%0.792SS**  cis-131165.1-20.239.4-24.5000114.6
391E36.2Very low46.9Very low192 Ų192152.4 Ų152.490%0.89781%0.806SS**  trans-173.3130.4146.2-108.5166.4176.700108.4
392K43.7Very low46.6Very low199 Ų199152.8 Ų152.887%0.86581%0.814SS**  62.197.353.7-89.6-167.9177.9-179.90115.3
393E39.9Very low46.2Very low195 Ų195152.9 Ų152.991%0.91182%0.822SS**  trans-153.5171.2132.1-129.6-172.7141.500113.5
394Q46.7Very low45.9Very low175 Ų175151.4 Ų151.482%0.81883%0.826SS**  trans-94.5172.2-162.2-52.8173.33.600111.3
395R44.8Very low45.6Very low236 Ų236156.7 Ų156.789%0.89184%0.837SS**  -178.4157.671.9-168.8170.9-176.5175.71.3112.5
396S38.4Very low45.1Very low100 Ų100162.6 Ų162.670%0.69986%0.857SS**  trans-65177.7-177.8-30.10000115.4
397P59.8Low44.9Very low201 Ų201164.3 Ų164.3100%1.30586%0.864SS**  -103.6063.4-6.726000115.4

Retrieved 397 of 397 residues in 591.4 ms (Link to these results)