A0A5K4FCK1_SCHMA Loading...

Calcium-binding protein, putative

AlphaFold DB , UniProt , Accession A0A5K4FCK1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 326 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M33Very low35.1Very low239 Ų239143.8 Ų143.8100%1.17782%0.821SS**  0102.90-80.3160.4153.700108.2
2C36Very low35.3Very low134 Ų134148.1 Ų148.191%0.90583%0.829SS**  trans-145.2119.8162.2-87.80000106.2
3H34Very low35.7Very low181 Ų181146.1 Ų146.184%0.83881%0.808SS**  trans-72.6143.5-175.9-84.5-101.7000111.6
4K34.9Very low36.1Very low203 Ų203144.8 Ų144.888%0.88382%0.815SS**  trans-56.4129.4162.4-76.7175.9173.5177.80109.6
5F32.6Very low36.2Very low195 Ų195139.1 Ų139.186%0.85580%0.802SS**  trans-110.7107150.7-101.2-87.4000107.9
6S30Very low36.2Very low110 Ų110135.5 Ų135.577%0.76979%0.793SS**  trans-83.1130.1152.560.40000107.4
7S38Very low36.5Very low83 Ų83134.8 Ų134.858%0.5879%0.785SS**  trans-154.593.2155.454.60000109.5S9S7-S9 PolarHBondContact O-N 3.49Å
8T34.3Very low36.4Very low150 Ų150138.4 Ų138.492%0.9278%0.784SS**  trans-46.298.313136.50000107.9
9S42.3Very low36.5Very low95 Ų95138.3 Ų138.366%0.66478%0.776SS**  trans-12997.6164.446.10000106.4S7 C11S7-S9 PolarHBondContact O-N 3.49Å; S9-C11 PolarHBondContact O-N 2.76Å
10A36.8Very low36.7Very low95 Ų95138.7 Ų138.779%0.78578%0.776SS**  trans-64.1123.2169.500000107.4Q12A10-Q12 PolarHBondContact O-N 3.33Å; A10-Q12 VanDerWaalsContact O-N 3.16Å
11C34.3Very low36.6Very low97 Ų97137 Ų13766%0.65577%0.773SS**  trans-71110.6177.1-142.90000108.1S9 H13S9-C11 PolarHBondContact O-N 2.76Å; C11-H13 WeakPolarHBondContact CB-NE2 3.3Å; C11-H13 PolarHBondContact O-N 2.83Å; C11-H13 PolarHBondContact SG-CD2 3.35Å; C11-H13 PolarHBondContact SG-NE2 3.21Å
12Q37.8Very low36.7Very low195 Ų195133.8 Ų133.891%0.91175%0.748SS**  trans-85.392.3174.2-74.1-175.5-34.200108.7A10A10-Q12 PolarHBondContact O-N 3.33Å; A10-Q12 VanDerWaalsContact O-N 3.16Å
13H40.4Very low36.6Very low122 Ų122134.7 Ų134.757%0.56574%0.742SS**  trans-119.9113.6164.719.667.8000109.2C11C11-H13 WeakPolarHBondContact CB-NE2 3.3Å; C11-H13 PolarHBondContact O-N 2.83Å; C11-H13 PolarHBondContact SG-CD2 3.35Å; C11-H13 PolarHBondContact SG-NE2 3.21Å
14S40.6Very low36.5Very low128 Ų128130.4 Ų130.490%0.89573%0.732SS**  trans-87.5114.1168.454.50000108.8
15G38.3Very low36.6Very low60 Ų60125.8 Ų125.862%0.61972%0.716SS**SBendtrans118.7113.7171.200000114.1D17G15-D17 VanDerWaalsContact C-N 3.3Å; G15-D17 PolarHBondContact O-N 3.5Å
16A36.6Very low37Very low81 Ų81122.2 Ų122.267%0.66971%0.706SS**SBendtrans47.2-10.9151.200000123.7
17D40.1Very low37.2Very low123 Ų123122.7 Ų122.766%0.65871%0.708SS**  trans-114.850.4-171.2-67.8-21.9000113.8G15 E19G15-D17 VanDerWaalsContact C-N 3.3Å; G15-D17 PolarHBondContact O-N 3.5Å; D17-E19 VanDerWaalsContact C-N 3.32Å; D17-E19 PolarHBondContact O-N 2.67Å
18W36.2Very low37.1Very low200 Ų200126.6 Ų126.676%0.75872%0.715SS**  trans-79.8-7.7179.866.2-86.5000114.5
19E37.9Very low37Very low136 Ų136122.8 Ų122.864%0.63671%0.705SS**SBendtrans-94.8-20.8-174.2-70.4178.8153.600114.3D17 C21D17-E19 VanDerWaalsContact C-N 3.32Å; D17-E19 PolarHBondContact O-N 2.67Å; E19-C21 VanDerWaalsContact C-N 3.35Å; E19-C21 PolarHBondContact O-N 2.8Å
20D39.2Very low36.8Very low146 Ų146126 Ų12678%0.78171%0.713SS**THydrogen-bonded Turntrans-80.5-9.5-177.9-94-12.6000114.6
21C35Very low36.9Very low105 Ų105131.9 Ų131.971%0.70972%0.721SS**THydrogen-bonded Turntrans-88.3-1.9178.6-81.30000115E19E19-C21 VanDerWaalsContact C-N 3.35Å; E19-C21 PolarHBondContact O-N 2.8Å
22R35.8Very low36.9Very low171 Ų171129.9 Ų129.965%0.64572%0.717SS**SBendtrans-98.11.1-172.5-158.3167.6166174.1-6.8115.2D179R22-D179 IonicContact NH2-OD2 3.92Å; R22-D179 PolarHBondContact NH2-OD2 2.94Å
23I32.9Very low36.9Very low152 Ų152130.2 Ų130.278%0.77972%0.716SS**  trans-104.570.5175-49.1177.4000109.8
24S32.6Very low36.7Very low92 Ų92132.5 Ų132.564%0.64373%0.726SS**  trans-12484.9158.3-169.10000107.2D26S24-D26 PolarHBondContact O-N 3.38Å
25I37.4Very low36.2Very low106 Ų106132.8 Ų132.854%0.54473%0.726SS.*  trans-78.2104.3165.8-62.6174.6000105.9C27 S109I25-C27 VanDerWaalsContact C-N 3.3Å; I25-C27 PolarHBondContact O-N 3.35Å; I25-S109 VanDerWaalsContact CD1-OG 3.24Å; I25-S109 WeakPolarHBondContact CD1-OG 3.17Å
26D39.9Very low36.2Very low120 Ų120138 Ų13864%0.64273%0.732SS**  trans-6685.1172.9-84.7-33.3000110.6S24 F28S24-D26 PolarHBondContact O-N 3.38Å; D26-F28 HydrophobicContact CB-CD2 4.12Å; D26-F28 PolarHBondContact O-N 3.16Å
27C35.3Very low35.9Very low120 Ų120138.3 Ų138.381%0.81173%0.729SS**  trans-7674.1161.5-70.90000109.9I25I25-C27 VanDerWaalsContact C-N 3.3Å; I25-C27 PolarHBondContact O-N 3.35Å
28F35.5Very low35.6Very low164 Ų164140.9 Ų140.972%0.71974%0.741SS**  trans-88.4101.5165.5-90-87.8000109.8D26D26-F28 HydrophobicContact CB-CD2 4.12Å; D26-F28 PolarHBondContact O-N 3.16Å
29G32.6Very low35.6Very low70 Ų70141.5 Ų141.572%0.72274%0.743SS**  trans176.817.1176.700000120.2
30I38.3Very low35.3Very low162 Ų162143.8 Ų143.883%0.83175%0.754SS**  trans-132.1101.9170.2-54.2179.7000109.8G32I30-G32 PolarHBondContact O-N 3.37Å
31K37.5Very low34.8Very low219 Ų219145 Ų14595%0.95276%0.759SS**  trans-70.4106.1160.7-74.6-177.8176.41780107.5
32G35.2Very low34.8Very low55 Ų55148.7 Ų148.757%0.56777%0.766SS**SBendtrans144.7103.4161.500000115.8I30I30-G32 PolarHBondContact O-N 3.37Å
33K39Very low34.8Very low203 Ų203149.9 Ų149.988%0.88378%0.775SS**  trans69.9112.9145.3-56.6-178.5-179.1178.70118.4
34H34.2Very low34.9Very low170 Ų170150.1 Ų150.179%0.78778%0.778SS**  trans70.498.9156.9-78.9-59.6000119.3
35C30.8Very low35.1Very low133 Ų133154.6 Ų154.690%0.89979%0.789SS**  trans-114.3110.7145-161.80000108.4
36K38Very low34.9Very low171 Ų171154.1 Ų154.174%0.74380%0.795SS**  trans-87.5119.3171.7-78.2-178.4178.4175.60108.2
37S31.7Very low34.5Very low87 Ų87158.5 Ų158.561%0.60880%0.804SS**  trans-5120.3155.1-169.40000117.4R39S37-R39 WeakPolarHBondContact OG-CG 3.46Å
38I32.9Very low34.5Very low176 Ų176161.6 Ų161.690%0.90380%0.803SS**  trans-105.3109.8148.3-68.5177.1000106.7
39R35.2Very low34.4Very low213 Ų213159.3 Ų159.380%0.80481%0.808SS**  trans-88130172.8-63.8-176.5-164.3173.32.7109.3S37S37-R39 WeakPolarHBondContact OG-CG 3.46Å
40H31.6Very low34.4Very low184 Ų184160.5 Ų160.585%0.85281%0.811SS**  trans35.8112.8135.1-7549.1000118.2
41L30.3Very low34.3Very low171 Ų171157.9 Ų157.990%0.89581%0.805SS**  trans-131.987.1152.7-100.2161.5000108
42H33.7Very low34.1Very low184 Ų184156 Ų15685%0.85280%0.799SS**  trans-153.4136.5156.6-107.5-96.3000109.1
43K35.4Very low33.9Very low195 Ų195159.4 Ų159.485%0.84881%0.809SS**  trans99.393170.3-58.3178.5-179.91780116.6
44N36.4Very low33.4Very low157 Ų157160.5 Ų160.584%0.8481%0.809SS**  trans-114.3110138.1-81-26.5000107.5
45H36.7Very low33.3Very low187 Ų187160.7 Ų160.787%0.86682%0.815SS**  174.1118.2120.5-104.6-85.7000112.4
46S34Very low33.3Very low96 Ų96159.2 Ų159.267%0.67181%0.807SS**  trans-10.6123.9158.8-83.10000119.1
47Y29.4Very low33Very low212 Ų212156 Ų15683%0.83181%0.805SS**  81.8112.984.1-89.9-74.6000114.7
48K35.8Very low33Very low184 Ų184157.5 Ų157.580%0.881%0.811SS**  166.7127.3104.2-89.6-172.4-177.4176.80113.7
49S33.7Very low33Very low116 Ų116157 Ų15781%0.81180%0.804SS**  trans55143.3140.357.20000120.8
50A33.4Very low33Very low95 Ų95154.6 Ų154.679%0.78581%0.806SS**  cis-168.7172.17.700000108.9
51P35.3Very low33.1Very low108 Ų108148.7 Ų148.770%0.70180%0.795SS**  trans-120.5-174.8-154.642-29.6000117.1
52Q33.6Very low33.1Very low178 Ų178147.9 Ų147.983%0.83279%0.792SS**  trans85.6140.1160.7-64.7-179.84.800116.2
53T31.8Very low33.1Very low127 Ų127145.3 Ų145.378%0.77979%0.789SS**  cis-162.9164.333.121.60000112
54Y26.9Very low33.1Very low226 Ų226144.3 Ų144.389%0.88679%0.787SS**  trans-47.5155.6174.1-73.2-103000118
55L33Very low33.1Very low175 Ų175144.6 Ų144.692%0.91679%0.789SS**  trans-165.4135.6132.4-98.5167.7000111.2
56S29.7Very low32.9Very low102 Ų102138.7 Ų138.771%0.71378%0.779SS**  trans-100.6157.6175.751.10000111.6
57S32.7Very low33Very low103 Ų103141.6 Ų141.672%0.7279%0.786SS**  trans141.9106.1146.8-79.20000111.9
58T31Very low33.2Very low119 Ų119138.7 Ų138.773%0.7379%0.785SS**  78.6129.498.357.90000117.4
59H33.6Very low33Very low164 Ų164137.1 Ų137.176%0.75979%0.786SS**  trans95.6130.8135.2-100.1-65.7000121.8
60I35Very low33.1Very low163 Ų163140 Ų14084%0.83678%0.783SS**  trans82133.6151.2-52.1148.4000114.8
61G33.2Very low33.3Very low61 Ų61146.1 Ų146.163%0.62979%0.788SS**  cis173.9156.94.400000109.4
62N30Very low33.1Very low153 Ų153148.7 Ų148.782%0.81880%0.795SS**  trans16.5135.6156.2-60.1-13.2000121.1
63T35Very low33Very low131 Ų131148.2 Ų148.280%0.80480%0.797SS**  176.3122.296.439.30000113.1
64Q35.1Very low33Very low173 Ų173147.3 Ų147.381%0.80879%0.793SS**  trans34138135.7-62.5-174.6-1600123.7
65N35.9Very low33.2Very low163 Ų163144.3 Ų144.387%0.87279%0.792SS**  trans130.8125.2146.4-67.4-17.9000109.5
66G32.6Very low33.1Very low64 Ų64141.7 Ų141.766%0.6679%0.785SS**  cis152.3139.58.700000107.3
67L35.3Very low33.2Very low157 Ų157144.6 Ų144.682%0.82279%0.791SS**  trans72.3104.5151.6-61.9166000119.3
68N35.4Very low33.1Very low150 Ų150151.2 Ų151.280%0.80280%0.8SS**  163.3118.496.3-81.4-36.1000112.9
69D31.6Very low33Very low152 Ų152151.4 Ų151.481%0.81380%0.801SS**  trans-61.2148.6162.1-66.9-55.8000112.1
70K35.4Very low32.9Very low176 Ų176149.1 Ų149.177%0.76580%0.801SS**  172148124.9-89.7157.4-172.1-178.10111.7
71Y36.1Very low32.6Very low223 Ų223147 Ų14788%0.87580%0.801SS**  trans92.665.4173.1-47.1-68.4000117.4
72L32.7Very low32.6Very low162 Ų162151.8 Ų151.885%0.84881%0.81SS**  trans-78.3127.7144.2-133.197.9000108.4
73L31.4Very low32.5Very low169 Ų169152.5 Ų152.589%0.88581%0.808SS**  trans-153.9120144.4-80-171.1000110.1
74P30.9Very low32.4Very low107 Ų107154 Ų15470%0.69581%0.81SS**  trans-93.3135.7171.534.2-26.7000110.5
75L32.1Very low32.1Very low164 Ų164153 Ų15386%0.85981%0.806SS**  trans-106.5124.5169.3-68.5-179.8000110.5
76P29.4Very low31.9Very low119 Ų119150.8 Ų150.877%0.77380%0.804SS**  trans-90.6130.2-179.934.3-28.8000110.2
77I33.1Very low32.1Very low164 Ų164156.3 Ų156.384%0.84181%0.809SS**  trans-113.3111.7167.4-57.4178.8000108.5T79I77-T79 PolarHBondContact O-N 3.05Å
78R29.4Very low32Very low241 Ų241158.2 Ų158.291%0.90981%0.811SS**PPolyproline II helixtrans-62.8123.3174.1-70.9175.4171.2-165.9-2.8109.9
79T30Very low32Very low123 Ų123159.1 Ų159.176%0.75582%0.815SS**PPolyproline II helixtrans-84.5131.7161.450.70000109.7I77 S81I77-T79 PolarHBondContact O-N 3.05Å; T79-S81 PolarHBondContact O-N 2.97Å
80P30.9Very low32.3Very low117 Ų117159.2 Ų159.276%0.7682%0.815SS**PPolyproline II helixtrans-77.5116.816829.6-28.2000109.8I82P80-I82 PolarHBondContact O-N 3.05Å
81S28.9Very low32.1Very low119 Ų119160.5 Ų160.583%0.83282%0.821SS**  trans-67113.2167.5-65.20000109.8T79T79-S81 PolarHBondContact O-N 2.97Å
82I33.1Very low32Very low160 Ų160156.6 Ų156.682%0.82182%0.821SS**  trans-90.3110.6168.7-16.9176000107.6P80 L84P80-I82 PolarHBondContact O-N 3.05Å; I82-L84 PolarHBondContact O-N 3.49Å
83H28.3Very low32Very low168 Ų168154 Ų15478%0.77882%0.816SS**  trans-78.1105.5-177.8-161.7-61.6000109
84L33.4Very low32.1Very low162 Ų162155.1 Ų155.185%0.84882%0.817SS**  trans-86.6112.1170.1-125.583.6000109.9I82 S86I82-L84 PolarHBondContact O-N 3.49Å; L84-S86 PolarHBondContact O-N 3.35Å
85E28.9Very low32Very low152 Ų152155.6 Ų155.671%0.7182%0.823SS**  trans-70.2118.1-175.3-151.8171.5141.400111.6K87E85-K87 PolarHBondContact O-N 3.3Å
86S30.5Very low32.3Very low118 Ų118155.7 Ų155.783%0.82582%0.822SS**  trans-78.295175.2-59.50000110.3L84 K88L84-S86 PolarHBondContact O-N 3.35Å; S86-K88 PolarHBondContact O-N 2.95Å
87K38.3Very low32.4Very low179 Ų179160.7 Ų160.778%0.77883%0.826SS**  trans-78.7108.8167.9-79-176.4178.2175.70110.5E85E85-K87 PolarHBondContact O-N 3.3Å
88K31.9Very low32.5Very low198 Ų198158.4 Ų158.486%0.86182%0.821SS**  trans-52.2128.4164.1-69.8171.2176.4173.40110.2S86S86-K88 PolarHBondContact O-N 2.95Å
89L36.8Very low32.7Very low169 Ų169155.7 Ų155.789%0.88582%0.818SS**  trans-136.6141.4156.9-100.6159.2000109.9
90N36Very low32.9Very low154 Ų154154.9 Ų154.982%0.82482%0.818SS**  trans-77.2155.2-152.1-79.8-36.9000115.2
91K32Very low33Very low203 Ų203157.3 Ų157.388%0.88382%0.824SS**  trans-50.9128.6164.6-68.6170.2174.1175.50111.8
92T33.9Very low33.1Very low141 Ų141156.7 Ų156.787%0.86582%0.818SS**  trans-146126.2135.6-30.80000109.7
93S32Very low33Very low107 Ų107151.4 Ų151.475%0.74880%0.798SS**  trans-55.7138.4179.9-53.60000113.4
94Q35.5Very low33.2Very low193 Ų193152.6 Ų152.690%0.90280%0.796SS**  -172118.7123.8-100.1169.524.500112.2I96Q94-I96 PolarHBondContact O-N 3.1Å
95S28.6Very low33.2Very low117 Ų117149.8 Ų149.882%0.81879%0.79SS**  trans-26.1111.5163.6162.10000117.2
96I37.5Very low33.5Very low165 Ų165145.8 Ų145.885%0.84678%0.775SS**  trans-147.1132.7142.4-54.3-176.4000108.6Q94Q94-I96 PolarHBondContact O-N 3.1Å
97R30.7Very low33.9Very low225 Ų225147.2 Ų147.285%0.84976%0.763SS**  trans-59.7140.8-166.4-50175.4-171.2-147.80.4114.2
98P36.8Very low33.7Very low116 Ų116140.5 Ų140.575%0.75374%0.735SS**  trans-101.6117.6162.833.7-22.5000110.4S100P98-S100 VanDerWaalsContact C-N 3.33Å; P98-S100 PolarHBondContact O-N 3.21Å; P98-S100 VanDerWaalsContact O-N 3.1Å
99H33.6Very low33.9Very low183 Ų183134.2 Ų134.285%0.84772%0.716SS**  trans-68.799.1152.1-82.3-89.1000106.7L101H99-L101 PolarHBondContact O-N 2.95Å; H99-L101 VanDerWaalsContact O-N 3.07Å
100S33.4Very low33.7Very low106 Ų106128.6 Ų128.674%0.74169%0.687SS**  trans-73.593.3173.458.80000109.7P98 C102P98-S100 VanDerWaalsContact C-N 3.33Å; P98-S100 PolarHBondContact O-N 3.21Å; P98-S100 VanDerWaalsContact O-N 3.1Å; S100-C102 VanDerWaalsContact C-N 3.29Å; S100-C102 PolarHBondContact O-N 2.62Å
101L33.3Very low33.6Very low169 Ų169127.5 Ų127.589%0.88568%0.679SS**  trans-79.790.4156.8-69.5175.7000107H99 A103H99-L101 PolarHBondContact O-N 2.95Å; H99-L101 VanDerWaalsContact O-N 3.07Å; L101-A103 PolarHBondContact O-N 3.39Å; L101-A103 VanDerWaalsContact O-N 3.11Å
102C30.1Very low33.4Very low105 Ų105122.6 Ų122.671%0.70967%0.668SS**  trans-59.6107.5166.6177.30000108S100 R104S100-C102 VanDerWaalsContact C-N 3.29Å; S100-C102 PolarHBondContact O-N 2.62Å; C102-R104 PolarHBondContact O-N 2.66Å
103A30.8Very low33.2Very low49 Ų49122 Ų12241%0.40566%0.659SS.*  trans-66.2113.3168.800000107.8L101 E184L101-A103 PolarHBondContact O-N 3.39Å; L101-A103 VanDerWaalsContact O-N 3.11Å; A103-E184 HydrophobicContact CB-CG 3.89Å; A103-E184 WeakPolarHBondContact CB-OE1 3.43Å
104R33.8Very low33.1Very low194 Ų194122.2 Ų122.273%0.73265%0.652SS**  trans-86.7131172.7-75.7177.2158.8-170.4-9.3107.9C102 V106C102-R104 PolarHBondContact O-N 2.66Å; R104-V106 PolarHBondContact O-N 3.48Å
105S33.6Very low32.7Very low102 Ų102119 Ų11971%0.71365%0.648SS**  trans-45.4121.6170.1172.70000110.1R107S105-R107 PolarHBondContact O-N 2.9Å
106V34.8Very low32.8Very low68 Ų68119.4 Ų119.441%0.41264%0.639SS.*  trans-87.598.8173.9-178.50000106.5R104 L108R104-V106 PolarHBondContact O-N 3.48Å; V106-L108 VanDerWaalsContact C-N 3.33Å; V106-L108 HydrophobicContact CG1-CG 4.44Å; V106-L108 PolarHBondContact O-N 3.39Å
107R37.8Very low32.3Very low148 Ų148119.5 Ų119.556%0.55863%0.63SS**  trans-72.693.7168.6-167-179.7-168.6140.410.9107.4S105 S109 D179S105-R107 PolarHBondContact O-N 2.9Å; R107-S109 VanDerWaalsContact C-N 3.34Å; R107-S109 PolarHBondContact O-N 3.29Å; R107-D179 IonicContact NH2-OD2 2.98Å; R107-D179 PolarHBondContact NH2-OD2 3.15Å
108L35.5Very low32.4Very low39 Ų39118.6 Ų118.620%0.20463%0.632CS.*  trans-66.9100.7162.5-87.8157.9000106.6V106 I110 I182 L247 I248V106-L108 VanDerWaalsContact C-N 3.33Å; V106-L108 HydrophobicContact CG1-CG 4.44Å; V106-L108 PolarHBondContact O-N 3.39Å; L108-I110 HydrophobicContact CB-CG1 4.14Å; L108-I110 PolarHBondContact O-N 3.2Å; L108-I182 HydrophobicContact CD1-CD1 3.68Å; L108-L247 HydrophobicContact CD1-CB 4.04Å; L108-I248 HydrophobicContact CD2-CD1 4.43Å; L108-I248 HydrophobicContact CD2-CG1 3.52Å
109S35.1Very low32.3Very low65 Ų65123.8 Ų123.846%0.45564%0.637SS.*  trans-66.380.6156.755.20000106.3I25 R107 I111I25-S109 VanDerWaalsContact CD1-OG 3.24Å; I25-S109 WeakPolarHBondContact CD1-OG 3.17Å; R107-S109 VanDerWaalsContact C-N 3.34Å; R107-S109 PolarHBondContact O-N 3.29Å; S109-I111 PolarHBondContact O-N 3.07Å
110I33.8Very low32Very low52 Ų52120.3 Ų120.327%0.26763%0.633SS.*  trans-62.3101.6161.1-59.6179.3000103.2L108 P112L108-I110 HydrophobicContact CB-CG1 4.14Å; L108-I110 PolarHBondContact O-N 3.2Å; I110-P112 VanDerWaalsContact O-N 3.14Å
111I32.2Very low31.8Very low131 Ų131120.1 Ų120.167%0.67263%0.629SS**  trans-51.1122.8173.3-63.4169.1000104.5S109 L113S109-I111 PolarHBondContact O-N 3.07Å; I111-L113 PolarHBondContact O-N 3.06Å
112P29.6Very low31.8Very low100 Ų100117.2 Ų117.265%0.64962%0.623SS**  trans-54122.7175.320.5-29.7000106.8I110 N114I110-P112 VanDerWaalsContact O-N 3.14Å; P112-N114 PolarHBondContact O-N 3.41Å
113L29.3Very low32.1Very low127 Ų127120.5 Ų120.567%0.66563%0.633SS**SBendtrans-63.477.3169.9-71168.8000107.6I111I111-L113 PolarHBondContact O-N 3.06Å
114N28.9Very low32.1Very low113 Ų113121.3 Ų121.360%0.60465%0.646SS**  trans169.6104.3146.6-101.8-45.3000110.7P112 I116P112-N114 PolarHBondContact O-N 3.41Å; N114-I116 PolarHBondContact O-N 3.07Å
115P27.7Very low32.1Very low125 Ų125123.7 Ų123.781%0.81266%0.655SS**  trans-92.572.4166.136-28000109.5
116I30.2Very low31.9Very low126 Ų126130.4 Ų130.465%0.64666%0.664SS**  trans-133.458.6168.1-45178.6000110N114N114-I116 PolarHBondContact O-N 3.07Å
117Y28.2Very low31.9Very low167 Ų167136.9 Ų136.966%0.65569%0.687SS**  trans-153.280.3149.7-85.4-65000109.9R119 V160Y117-R119 PolarHBondContact O-N 3.43Å; Y117-V160 HydrophobicContact CE2-CG1 4.2Å; Y117-V160 HydrophobicContact CE2-CG2 4.36Å; Y117-V160 WeakPolarHBondContact OH-CG1 3.44Å; Y117-V160 WeakPolarHBondContact OH-CG2 3.23Å
118K32.9Very low31.6Very low205 Ų205137.6 Ų137.689%0.89170%0.701SS**  trans-6693.2147.5-79.9-178.6176177.70106.7S120K118-S120 PolarHBondContact O-N 2.93Å
119R32.9Very low31.4Very low226 Ų226141.9 Ų141.985%0.85373%0.733SS**  trans-67.8100.5164.6-86.6-176.2174.5-172.8-1.2107.4Y117 P121Y117-R119 PolarHBondContact O-N 3.43Å; R119-P121 VanDerWaalsContact O-CD 3.3Å; R119-P121 WeakPolarHBondContact O-CD 3.44Å
120S27.5Very low31.1Very low109 Ų109146.7 Ų146.776%0.76275%0.753SS**  trans-61.3120.1161.7-62.80000108.5K118 S122K118-S120 PolarHBondContact O-N 2.93Å; S120-S122 PolarHBondContact O-N 3.31Å
121P30.7Very low31.3Very low102 Ų102150.1 Ų150.166%0.66278%0.778SS**  trans-88.7107.7174.130.8-23.7000108.8R119R119-P121 VanDerWaalsContact O-CD 3.3Å; R119-P121 WeakPolarHBondContact O-CD 3.44Å
122S32.4Very low31.4Very low108 Ų108150.7 Ų150.776%0.75578%0.783SS**  trans154153.1153.2520000111.3S120S120-S122 PolarHBondContact O-N 3.31Å
123L35.8Very low31.7Very low174 Ų174155.1 Ų155.191%0.91179%0.794SS**  trans89.982.4-165.1-54.9163.4000110.6
124G31Very low32Very low66 Ų66155.8 Ų155.868%0.6880%0.799SS**  cis69.496.535.800000110.5
125R35.3Very low32.2Very low245 Ų245154.2 Ų154.293%0.92580%0.797SS**  trans92.7104.3167.8-60.9-177.5-174.2-160.10.6118.5
126R29.5Very low32.5Very low242 Ų242157.2 Ų157.291%0.91380%0.8SS**  9.7130.6129.7-62.5-179.9-174.4-176.40.5116.7
127K34.1Very low32.6Very low205 Ų205155.6 Ų155.689%0.89180%0.8SS**  -170.9130.4116.3-105.2173.6-178.9-1740111.5
128L31.2Very low32.9Very low163 Ų163154.6 Ų154.685%0.85380%0.804SS**  trans-49.7145.8162.2-73.581.5000111.1
129C30.9Very low32.8Very low128 Ų128155.2 Ų155.287%0.86580%0.801SS**  trans-156.2107147.4-85.20000110.1
130L28.8Very low32.8Very low167 Ų167151 Ų15187%0.87480%0.8SS**  trans-66.6147.5153.7-73154.5000109
131P38.1Very low33Very low124 Ų124149.5 Ų149.581%0.80580%0.801SS**  trans-107.8112.915930.9-18.4000110.6
132N33.7Very low33.1Very low143 Ų143149.8 Ų149.877%0.76581%0.806SS**  trans-107.2109.9158.5-167.65.8000106.3
133H37.7Very low33.3Very low192 Ų192150.3 Ų150.389%0.88981%0.805SS**  trans-143.3103.4167-94.2-69.1000110.5
134N35.6Very low33.2Very low142 Ų142153 Ų15376%0.75980%0.803SS**  trans-84.5131.1159.1-147-4.1000108.1
135S32.1Very low33.2Very low80 Ų80157.6 Ų157.656%0.55981%0.812SS**  trans65.4129.8147.7-6.10000122.1
136Q34.5Very low33Very low188 Ų188152.2 Ų152.288%0.87981%0.806SS**  trans75141.4147.3-59.9175.215.400116.9
137S32.4Very low33.3Very low92 Ų92145.1 Ų145.164%0.64379%0.791SS**  cis-173.2168.1-1168.10000107
138I35Very low33Very low145 Ų145148 Ų14874%0.74480%0.797SS**  trans84.697.6152.3-59.5164.8000119
139R29Very low32.8Very low219 Ų219147.3 Ų147.383%0.82679%0.792SS**  56.9125.4117.1-71-175.1179.9-160-0.1122.9
140T33.5Very low32.7Very low138 Ų138148.8 Ų148.885%0.84779%0.792SS**  trans82.6122.7130.5580000120.1
141G32.5Very low32.7Very low76 Ų76145.8 Ų145.878%0.78479%0.785SS**  trans162.575.2161.400000115.6
142S32.5Very low32.2Very low108 Ų108148.2 Ų148.276%0.75578%0.783SS**  trans16.4117.3147.3-1660000119.6
143T35.5Very low32.1Very low119 Ų119144.7 Ų144.773%0.7376%0.764SS**  175125.1107.830.80000112.7
144R33.7Very low31.9Very low232 Ų232142.5 Ų142.588%0.87576%0.758SS**  trans66.5102.4151.7-62.5-178.7-165.2167.75.7120.3
145N32.5Very low31.8Very low162 Ų162143.8 Ų143.887%0.86675%0.753SS**  trans47.397.7136.7-71.25.2000119.6
146T29.8Very low32.3Very low132 Ų132144.8 Ų144.881%0.8175%0.752SS**  trans-53.8-178.2151.839.70000114.9
147P35.2Very low32.3Very low92 Ų92139.6 Ų139.660%0.59774%0.735SS**  cis-147.1140.3-25.929.7-9000115.3
148W27.9Very low32.8Very low265 Ų265139.1 Ų139.1100%1.00472%0.723SS**  trans-148.371.6141.5-69.195.7000109.4
149I28.8Very low33.6Very low149 Ų149134.1 Ų134.176%0.76470%0.699SS**  trans-115.4122.3151.4-62.8175.1000103.8
150N26.8Very low34.7Very low159 Ų159126 Ų12685%0.8567%0.674SS**  trans151.281.2152.8-75.9-15.3000110.6
151S29.7Very low35.5Very low104 Ų104122.8 Ų122.873%0.72765%0.651SS**  trans-176.876141.2-171.40000107.9D153S151-D153 PolarHBondContact O-N 2.9Å
152F28.2Very low36.7Very low176 Ų176122.4 Ų122.477%0.77263%0.626SS**  trans-87.894.7155.5-157.6-96.5000104.5L154F152-L154 PolarHBondContact O-N 3.42Å
153D30.6Very low37.8Very low68 Ų68119.9 Ų119.936%0.36460%0.604SS.*  trans-64113.1-176-157.8-15.5000108.5S151 R155 N156S151-D153 PolarHBondContact O-N 2.9Å; D153-R155 PolarHBondContact O-N 3.19Å; D153-R155 WeakPolarHBondContact OD1-CB 3.34Å; D153-R155 WeakPolarHBondContact OD1-CG 3.15Å; D153-R155 IonicContact OD1-CZ 2.67Å; D153-R155 PolarHBondContact OD1-N 3.23Å; D153-R155 IonicContact OD1-NE 2.69Å; D153-R155 PolarHBondContact OD1-NE 3.12Å; D153-R155 IonicContact OD1-NH2 3.39Å; D153-R155 IonicContact OD2-CZ 2.91Å; D153-R155 IonicContact OD2-NE 3.79Å; D153-R155 PolarHBondContact OD2-NE 2.99Å; D153-R155 IonicContact OD2-NH2 3.16Å; D153-N156 WeakPolarHBondContact O-CB 3.41Å; D153-N156 PolarHBondContact O-N 3.11Å
154L33.5Very low38.9Very low146 Ų146117.7 Ų117.776%0.76459%0.592SS**THydrogen-bonded Turntrans-56.6-20.1176.9-88.790.8000112.2F152 N156 C157F152-L154 PolarHBondContact O-N 3.42Å; L154-N156 PolarHBondContact O-N 3.27Å; L154-C157 PolarHBondContact O-N 3.4Å
155R33.9Very low40.2Very low170 Ų170107.5 Ų107.564%0.64255%0.554SS**Hα-helixtrans-54.9-33.1171.6-73.7-179.1-97.5-150.9-10112.8D153 C157 Q158 T159D153-R155 PolarHBondContact O-N 3.19Å; D153-R155 WeakPolarHBondContact OD1-CB 3.34Å; D153-R155 WeakPolarHBondContact OD1-CG 3.15Å; D153-R155 IonicContact OD1-CZ 2.67Å; D153-R155 PolarHBondContact OD1-N 3.23Å; D153-R155 IonicContact OD1-NE 2.69Å; D153-R155 PolarHBondContact OD1-NE 3.12Å; D153-R155 IonicContact OD1-NH2 3.39Å; D153-R155 IonicContact OD2-CZ 2.91Å; D153-R155 IonicContact OD2-NE 3.79Å; D153-R155 PolarHBondContact OD2-NE 2.99Å; D153-R155 IonicContact OD2-NH2 3.16Å; R155-C157 VanDerWaalsContact C-N 3.31Å; R155-C157 PolarHBondContact O-N 3.47Å; R155-Q158 PolarHBondContact O-N 3.03Å; R155-T159 PolarHBondContact O-N 3.47Å; R155-T159 PolarHBondContact O-OG1 3.19Å; R155-T159 VanDerWaalsContact O-OG1 3.06Å
156N41.7Very low41.5Very low101 Ų101102.9 Ų102.954%0.5452%0.524SS..Hα-helixtrans-71-25.4-176.8-142.652.7000112.9D153 L154 V160D153-N156 WeakPolarHBondContact O-CB 3.41Å; D153-N156 PolarHBondContact O-N 3.11Å; L154-N156 PolarHBondContact O-N 3.27Å; N156-V160 WeakPolarHBondContact O-CG2 3.5Å; N156-V160 PolarHBondContact O-N 3.06Å
157C35Very low42.9Very low78 Ų78103.2 Ų103.253%0.52752%0.515SS..Hα-helixtrans-74.4-40.9172.1-90.30000111.6L154 R155 V160 L161L154-C157 PolarHBondContact O-N 3.4Å; R155-C157 VanDerWaalsContact C-N 3.31Å; R155-C157 PolarHBondContact O-N 3.47Å; C157-V160 PolarHBondContact O-N 3.18Å; C157-L161 WeakPolarHBondContact O-CG 3.26Å; C157-L161 PolarHBondContact O-N 2.95Å
158Q44.3Very low44.1Very low83 Ų83101.9 Ų101.939%0.38850%0.503SS..Hα-helixtrans-63.3-41.9175.2-74.8-178.5-28.800111.4R155 V160 L161 R162R155-Q158 PolarHBondContact O-N 3.03Å; Q158-V160 VanDerWaalsContact C-N 3.33Å; Q158-V160 PolarHBondContact O-N 3.36Å; Q158-L161 PolarHBondContact O-N 3.35Å; Q158-R162 VanDerWaalsContact O-CB 3.25Å; Q158-R162 WeakPolarHBondContact O-CB 3.49Å; Q158-R162 WeakPolarHBondContact O-CG 3.49Å; Q158-R162 PolarHBondContact O-N 2.69Å
159T51.3Low45.9Very low39 Ų3989.3 Ų89.324%0.23946%0.455CS..Hα-helixtrans-63-35.8177.2-54.20000113R155 R162 N163 E326R155-T159 PolarHBondContact O-N 3.47Å; R155-T159 PolarHBondContact O-OG1 3.19Å; R155-T159 VanDerWaalsContact O-OG1 3.06Å; T159-R162 PolarHBondContact O-N 2.91Å; T159-N163 WeakPolarHBondContact O-CB 3.19Å; T159-N163 PolarHBondContact O-N 3.21Å; T159-N163 PolarHBondContact O-ND2 3.42Å; T159-E326 WeakPolarHBondContact CG2-OXT 3.42Å
160V51Low47.4Very low50 Ų5084 Ų8430%0.30343%0.428SS..Hα-helixtrans-73.3-44.2179.4174.20000111.1Y117 N156 C157 Q158 R162 N163 C164Y117-V160 HydrophobicContact CE2-CG1 4.2Å; Y117-V160 HydrophobicContact CE2-CG2 4.36Å; Y117-V160 WeakPolarHBondContact OH-CG1 3.44Å; Y117-V160 WeakPolarHBondContact OH-CG2 3.23Å; N156-V160 WeakPolarHBondContact O-CG2 3.5Å; N156-V160 PolarHBondContact O-N 3.06Å; C157-V160 PolarHBondContact O-N 3.18Å; Q158-V160 VanDerWaalsContact C-N 3.33Å; Q158-V160 PolarHBondContact O-N 3.36Å; V160-R162 PolarHBondContact O-N 3.36Å; V160-N163 PolarHBondContact O-N 3.25Å; V160-C164 WeakPolarHBondContact O-CB 3.15Å; V160-C164 PolarHBondContact O-N 3.06Å
161L50.7Low48.8Very low69 Ų6982.5 Ų82.536%0.36142%0.415SS..Hα-helixtrans-59.2-42170.9-72.4169.4000110C157 Q158 C164 W165 L294C157-L161 WeakPolarHBondContact O-CG 3.26Å; C157-L161 PolarHBondContact O-N 2.95Å; Q158-L161 PolarHBondContact O-N 3.35Å; L161-C164 PolarHBondContact O-N 3.45Å; L161-C164 VanDerWaalsContact O-N 3.17Å; L161-W165 PolarHBondContact O-N 2.77Å; L161-L294 HydrophobicContact CD2-CD2 4.43Å
162R57.2Low50.2Low69 Ų6985.6 Ų85.626%0.2641%0.411SS..Hα-helixtrans-54.3-53.5174.6-76180-171.6-174.24.8114.7Q158 T159 V160 C164 W165 R166 D305Q158-R162 VanDerWaalsContact O-CB 3.25Å; Q158-R162 WeakPolarHBondContact O-CB 3.49Å; Q158-R162 WeakPolarHBondContact O-CG 3.49Å; Q158-R162 PolarHBondContact O-N 2.69Å; T159-R162 PolarHBondContact O-N 2.91Å; V160-R162 PolarHBondContact O-N 3.36Å; R162-C164 VanDerWaalsContact C-N 3.28Å; R162-C164 PolarHBondContact O-N 3.38Å; R162-W165 HydrophobicContact CB-CZ2 4.21Å; R162-W165 HydrophobicContact CG-CZ2 4.02Å; R162-W165 PolarHBondContact O-N 3.4Å; R162-R166 VanDerWaalsContact O-CB 3.26Å; R162-R166 WeakPolarHBondContact O-CB 2.99Å; R162-R166 PolarHBondContact O-N 3.44Å; R162-D305 IonicContact CZ-OD2 2.89Å; R162-D305 IonicContact NH2-OD2 3.8Å; R162-D305 PolarHBondContact NH2-OD2 3.4Å
163N57.3Low51.4Low55 Ų5579.2 Ų79.229%0.29438%0.384SS..Hα-helixtrans-68-29.4178.7-74.3-51.4000112.9T159 V160 K167T159-N163 WeakPolarHBondContact O-CB 3.19Å; T159-N163 PolarHBondContact O-N 3.21Å; T159-N163 PolarHBondContact O-ND2 3.42Å; V160-N163 PolarHBondContact O-N 3.25Å; N163-K167 WeakPolarHBondContact O-CG 3.48Å; N163-K167 PolarHBondContact O-N 2.98Å
164C57.5Low52.4Low73 Ų7376.6 Ų76.649%0.49337%0.372SS..Hα-helixtrans-73.8-44177-152.40000111.9V160 L161 R162 N168V160-C164 WeakPolarHBondContact O-CB 3.15Å; V160-C164 PolarHBondContact O-N 3.06Å; L161-C164 PolarHBondContact O-N 3.45Å; L161-C164 VanDerWaalsContact O-N 3.17Å; R162-C164 VanDerWaalsContact C-N 3.28Å; R162-C164 PolarHBondContact O-N 3.38Å; C164-N168 PolarHBondContact O-N 3.48Å; C164-N168 VanDerWaalsContact O-N 3.08Å; C164-N168 PolarHBondContact O-ND2 2.99Å
165W60.7Low52.9Low18 Ų1879 Ų797%0.06838%0.377CS..Hα-helixtrans-71.5-38.2177.171.8-115.6000111.6L161 R162 K167 N168 L169 M302 L322 M323L161-W165 PolarHBondContact O-N 2.77Å; R162-W165 HydrophobicContact CB-CZ2 4.21Å; R162-W165 HydrophobicContact CG-CZ2 4.02Å; R162-W165 PolarHBondContact O-N 3.4Å; W165-K167 VanDerWaalsContact C-N 3.31Å; W165-K167 PolarHBondContact O-N 3.43Å; W165-N168 PolarHBondContact O-N 3.29Å; W165-L169 HydrophobicContact CE3-CB 4.34Å; W165-L169 HydrophobicContact CE3-CD2 3.72Å; W165-L169 HydrophobicContact CZ3-CD2 3.7Å; W165-L169 WeakPolarHBondContact O-CB 3.48Å; W165-L169 PolarHBondContact O-N 3.37Å; W165-M302 HydrophobicContact CB-CE 4.43Å; W165-M302 VanDerWaalsContact CD1-SD 3.54Å; W165-M302 HydrophobicContact CD2-CE 3.51Å; W165-M302 HydrophobicContact CE3-CE 4.14Å; W165-M302 HydrophobicContact CG-CE 3.59Å; W165-M302 HydrophobicContact CG-SD 4.25Å; W165-M302 HydrophobicContact CZ2-CE 4.36Å; W165-L322 HydrophobicContact CH2-CB 4.43Å; W165-L322 HydrophobicContact CH2-CD1 3.2Å; W165-L322 HydrophobicContact CH2-CD2 4.1Å; W165-L322 HydrophobicContact CH2-CG 3.3Å; W165-L322 VanDerWaalsContact CH2-O 3.3Å; W165-L322 WeakPolarHBondContact CH2-O 3.35Å; W165-L322 HydrophobicContact CZ2-CD1 3.34Å; W165-L322 HydrophobicContact CZ2-CG 4.01Å; W165-L322 HydrophobicContact CZ3-CD1 4.08Å; W165-L322 HydrophobicContact CZ3-CD2 4.19Å; W165-L322 HydrophobicContact CZ3-CG 3.85Å; W165-M323 HydrophobicContact CZ3-SD 4.11Å
166R61.2Low53.5Low65 Ų6578.4 Ų78.425%0.24538%0.379CS..Hα-helixtrans-53.5-49.8173.9177.2-177.4168.4171.47110.8R162 I170 M323R162-R166 VanDerWaalsContact O-CB 3.26Å; R162-R166 WeakPolarHBondContact O-CB 2.99Å; R162-R166 PolarHBondContact O-N 3.44Å; R166-I170 HydrophobicContact CG-CD1 3.82Å; R166-I170 WeakPolarHBondContact O-CB 3.33Å; R166-I170 WeakPolarHBondContact O-CG1 3.44Å; R166-I170 PolarHBondContact O-N 2.93Å; R166-M323 VanDerWaalsContact CD-O 3.27Å; R166-M323 WeakPolarHBondContact CD-O 3.37Å; R166-M323 PolarHBondContact NE-O 3.31Å; R166-M323 PolarHBondContact NH1-O 3.37Å; R166-M323 PolarHBondContact NH2-O 2.92Å
167K57.7Low53.9Low139 Ų13977.5 Ų77.560%0.60437%0.373SS*.Hα-helixtrans-64.5-43.4179-73.6-178.9-179.81800112.4N163 W165 Q171N163-K167 WeakPolarHBondContact O-CG 3.48Å; N163-K167 PolarHBondContact O-N 2.98Å; W165-K167 VanDerWaalsContact C-N 3.31Å; W165-K167 PolarHBondContact O-N 3.43Å; K167-Q171 WeakPolarHBondContact O-CB 3.21Å; K167-Q171 WeakPolarHBondContact O-CG 3.25Å; K167-Q171 PolarHBondContact O-N 2.89Å
168N61.8Low54.7Low64 Ų6479.6 Ų79.634%0.34238%0.379SS..Hα-helixtrans-70.3-41179.8-79.2-62.1000112.9C164 W165 Q171 R172C164-N168 PolarHBondContact O-N 3.48Å; C164-N168 VanDerWaalsContact O-N 3.08Å; C164-N168 PolarHBondContact O-ND2 2.99Å; W165-N168 PolarHBondContact O-N 3.29Å; N168-Q171 PolarHBondContact O-N 2.86Å; N168-R172 WeakPolarHBondContact O-CB 3.15Å; N168-R172 PolarHBondContact O-N 3.44Å
169L64.4Low55.5Low1 Ų180.1 Ų80.11%0.00539%0.385CS..Hα-helixtrans-62.7-49.9177.1-179.266.1000110.2W165 R172 M173 I286 L290 M323W165-L169 HydrophobicContact CE3-CB 4.34Å; W165-L169 HydrophobicContact CE3-CD2 3.72Å; W165-L169 HydrophobicContact CZ3-CD2 3.7Å; W165-L169 WeakPolarHBondContact O-CB 3.48Å; W165-L169 PolarHBondContact O-N 3.37Å; L169-R172 PolarHBondContact O-N 2.83Å; L169-M173 HydrophobicContact CD1-CE 3.22Å; L169-M173 HydrophobicContact CD1-CG 4.02Å; L169-M173 HydrophobicContact CD1-SD 3.47Å; L169-M173 WeakPolarHBondContact CD1-SD 3.48Å; L169-M173 HydrophobicContact CD2-CE 4.04Å; L169-M173 HydrophobicContact CG-CE 3.39Å; L169-M173 HydrophobicContact CG-SD 4.26Å; L169-M173 VanDerWaalsContact O-CB 3.27Å; L169-M173 WeakPolarHBondContact O-CB 3.44Å; L169-M173 VanDerWaalsContact O-CG 3.23Å; L169-M173 WeakPolarHBondContact O-CG 3.26Å; L169-M173 PolarHBondContact O-N 3.17Å; L169-I286 HydrophobicContact CD1-CG2 3.59Å; L169-L290 HydrophobicContact CB-CD1 3.9Å; L169-L290 HydrophobicContact CD1-CD1 3.07Å; L169-L290 HydrophobicContact CD1-CG 4.49Å; L169-L290 HydrophobicContact CG-CD1 4.04Å; L169-M323 HydrophobicContact CD2-CE 3.21Å; L169-M323 HydrophobicContact CD2-SD 3.95Å; L169-M323 HydrophobicContact CG-CE 3.67Å
170I61.2Low56.3Low37 Ų3781.1 Ų81.119%0.1939%0.386CS..Hα-helixtrans-64.7-42.5174.7-57.3168.8000110R166 R172 M173 A174 I177 L263 M323R166-I170 HydrophobicContact CG-CD1 3.82Å; R166-I170 WeakPolarHBondContact O-CB 3.33Å; R166-I170 WeakPolarHBondContact O-CG1 3.44Å; R166-I170 PolarHBondContact O-N 2.93Å; I170-R172 VanDerWaalsContact C-N 3.29Å; I170-R172 PolarHBondContact O-N 3.37Å; I170-M173 PolarHBondContact O-N 2.74Å; I170-A174 HydrophobicContact CG2-CB 4.07Å; I170-A174 WeakPolarHBondContact O-CA 3.45Å; I170-A174 WeakPolarHBondContact O-CB 3.31Å; I170-A174 PolarHBondContact O-N 2.9Å; I170-I177 HydrophobicContact CB-CD1 4.22Å; I170-I177 HydrophobicContact CG2-CD1 3.45Å; I170-I177 VanDerWaalsContact CG2-CD1 3.45Å; I170-I177 HydrophobicContact CG2-CG1 4.07Å; I170-L263 HydrophobicContact CD1-CD2 4.43Å; I170-L263 HydrophobicContact CG1-CD2 4.34Å; I170-M323 HydrophobicContact CD1-SD 4.25Å; I170-M323 HydrophobicContact CG1-CE 4.34Å; I170-M323 HydrophobicContact CG1-SD 3.98Å
171Q55.6Low57.2Low127 Ų12781.6 Ų81.659%0.59339%0.389SS*.Hα-helixtrans-62.1-32.1178.8-82.6178.7-14.800114.5K167 N168 I177K167-Q171 WeakPolarHBondContact O-CB 3.21Å; K167-Q171 WeakPolarHBondContact O-CG 3.25Å; K167-Q171 PolarHBondContact O-N 2.89Å; N168-Q171 PolarHBondContact O-N 2.86Å; Q171-I177 HydrophobicContact CG-CD1 4.14Å
172R58.8Low58.7Low170 Ų17079.1 Ų79.164%0.64238%0.376SS*.Hα-helixtrans-91.5-28.5179.8-100.7178.8157.6154-10.6113.6N168 L169 I170 G289 L290N168-R172 WeakPolarHBondContact O-CB 3.15Å; N168-R172 PolarHBondContact O-N 3.44Å; L169-R172 PolarHBondContact O-N 2.83Å; I170-R172 VanDerWaalsContact C-N 3.29Å; I170-R172 PolarHBondContact O-N 3.37Å; R172-G289 PolarHBondContact NH1-O 3.41Å; R172-L290 HydrophobicContact CB-CD2 3.37Å; R172-L290 HydrophobicContact CG-CD2 3.89Å; R172-L290 PolarHBondContact NH1-O 2.89Å
173M54Low60Low41 Ų4181.6 Ų81.620%0.20239%0.39CS..Hα-helixtrans-88.3-34.9177.2-60.2-159-54.900112.2L169 I170 F175 A266 L270 I286 F319 M323L169-M173 HydrophobicContact CD1-CE 3.22Å; L169-M173 HydrophobicContact CD1-CG 4.02Å; L169-M173 HydrophobicContact CD1-SD 3.47Å; L169-M173 WeakPolarHBondContact CD1-SD 3.48Å; L169-M173 HydrophobicContact CD2-CE 4.04Å; L169-M173 HydrophobicContact CG-CE 3.39Å; L169-M173 HydrophobicContact CG-SD 4.26Å; L169-M173 VanDerWaalsContact O-CB 3.27Å; L169-M173 WeakPolarHBondContact O-CB 3.44Å; L169-M173 VanDerWaalsContact O-CG 3.23Å; L169-M173 WeakPolarHBondContact O-CG 3.26Å; L169-M173 PolarHBondContact O-N 3.17Å; I170-M173 PolarHBondContact O-N 2.74Å; M173-F175 PolarHBondContact O-N 3.2Å; M173-A266 HydrophobicContact CB-CB 4.18Å; M173-A266 HydrophobicContact CE-CB 4.18Å; M173-L270 HydrophobicContact CE-CD1 3.9Å; M173-L270 HydrophobicContact SD-CD1 3.68Å; M173-L270 HydrophobicContact SD-CD2 3.71Å; M173-L270 HydrophobicContact SD-CG 4Å; M173-I286 HydrophobicContact SD-CG2 3.91Å; M173-F319 HydrophobicContact CE-CE2 4.25Å; M173-F319 HydrophobicContact CE-CZ 3.87Å; M173-M323 HydrophobicContact CE-CE 3.86Å
174A51.2Low61.4Low14 Ų1483.4 Ų83.412%0.11640%0.397CS..SBendtrans-84.196.9170.200000108.8I170 K176 I177I170-A174 HydrophobicContact CG2-CB 4.07Å; I170-A174 WeakPolarHBondContact O-CA 3.45Å; I170-A174 WeakPolarHBondContact O-CB 3.31Å; I170-A174 PolarHBondContact O-N 2.9Å; A174-K176 VanDerWaalsContact C-N 3.27Å; A174-K176 PolarHBondContact O-N 3.08Å; A174-I177 HydrophobicContact CB-CG1 3.85Å
175F45Very low62.9Low197 Ų19784 Ų8486%0.86440%0.395SS*.THydrogen-bonded Turntrans-59.291.7169-148-95.6000108.4M173M173-F175 PolarHBondContact O-N 3.2Å
176K45.1Very low64.2Low157 Ų15786 Ų8668%0.68341%0.405SS*.THydrogen-bonded Turntrans7389.8-172.7-52.3174.3-179.6177.40114.4A174 D178A174-K176 VanDerWaalsContact C-N 3.27Å; A174-K176 PolarHBondContact O-N 3.08Å; K176-D178 PolarHBondContact O-N 2.9Å
177I51.6Low65.5Low81 Ų8184.2 Ų84.242%0.41540%0.402SS..  trans-7089.4147.6-48.4172.8000105.5I170 Q171 A174 D179I170-I177 HydrophobicContact CB-CD1 4.22Å; I170-I177 HydrophobicContact CG2-CD1 3.45Å; I170-I177 VanDerWaalsContact CG2-CD1 3.45Å; I170-I177 HydrophobicContact CG2-CG1 4.07Å; Q171-I177 HydrophobicContact CG-CD1 4.14Å; A174-I177 HydrophobicContact CB-CG1 3.85Å; I177-D179 PolarHBondContact O-N 3.34Å
178D50.6Low67.1Low122 Ų12283 Ų8365%0.65240%0.397SS*.  trans-62.2132.7164.6-73.7-31.2000106.7K176 F180K176-D178 PolarHBondContact O-N 2.9Å; D178-F180 PolarHBondContact O-N 2.99Å
179D60.7Low68.6Low95 Ų9583.3 Ų83.351%0.50840%0.401SS..  trans-44.3112.9172.4-85.4-9.1000107.3R22 R107 I177 T181R22-D179 IonicContact NH2-OD2 3.92Å; R22-D179 PolarHBondContact NH2-OD2 2.94Å; R107-D179 IonicContact NH2-OD2 2.98Å; R107-D179 PolarHBondContact NH2-OD2 3.15Å; I177-D179 PolarHBondContact O-N 3.34Å; D179-T181 PolarHBondContact O-N 2.98Å
180F68.6Low69.8Low60 Ų6083.3 Ų83.326%0.26340%0.401SS..  trans-56.9120.5-175.1172.1-95.3000108.7D178 I182 G251 L254 Q255 Q258D178-F180 PolarHBondContact O-N 2.99Å; F180-I182 HydrophobicContact CE1-CG1 3.88Å; F180-I182 HydrophobicContact CZ-CG1 4.19Å; F180-G251 WeakPolarHBondContact CE1-O 3.31Å; F180-L254 HydrophobicContact CE1-CB 4.17Å; F180-L254 HydrophobicContact CE2-CB 3.95Å; F180-L254 HydrophobicContact CZ-CB 3.32Å; F180-L254 HydrophobicContact CZ-CD1 4.14Å; F180-L254 HydrophobicContact CZ-CG 4.41Å; F180-Q255 HydrophobicContact CB-CG 4.26Å; F180-Q255 HydrophobicContact CD1-CB 3.79Å; F180-Q255 HydrophobicContact CD1-CG 4.26Å; F180-Q255 HydrophobicContact CD2-CB 4.44Å; F180-Q255 HydrophobicContact CE1-CB 4.08Å; F180-Q255 HydrophobicContact CG-CB 4.02Å; F180-Q255 HydrophobicContact CG-CG 4.15Å; F180-Q258 HydrophobicContact CD2-CB 4.37Å; F180-Q258 HydrophobicContact CD2-CG 4.47Å
181T71.1Confident71.3Confident60 Ų6086.2 Ų86.237%0.36841%0.412SS..  trans-129129.7178.745.90000109.2D179 Q183D179-T181 PolarHBondContact O-N 2.98Å; T181-Q183 PolarHBondContact O-N 3.49Å
182I82.4Confident73Confident17 Ų1784.3 Ų84.39%0.08741%0.406CS..  trans-67.3122.7175.9-51.4179.2000107.9L108 F180 Q186 V187 Y250 L254L108-I182 HydrophobicContact CD1-CD1 3.68Å; F180-I182 HydrophobicContact CE1-CG1 3.88Å; F180-I182 HydrophobicContact CZ-CG1 4.19Å; I182-Q186 HydrophobicContact CG2-CB 3.69Å; I182-V187 HydrophobicContact CB-CG2 4.16Å; I182-V187 HydrophobicContact CG2-CG2 3.62Å; I182-Y250 HydrophobicContact CD1-CD1 4.36Å; I182-Y250 HydrophobicContact CG2-CE1 4.21Å; I182-L254 HydrophobicContact CG2-CD1 4.18Å
183Q84.5Confident74.6Confident120 Ų12076.4 Ų76.456%0.56138%0.377SS*.  trans-68.7153.5178.6-61.5-67.1-2700111.2T181 D185 Q186 V187T181-Q183 PolarHBondContact O-N 3.49Å; Q183-D185 VanDerWaalsContact C-N 3.29Å; Q183-D185 WeakPolarHBondContact CB-OD1 3.18Å; Q183-D185 PolarHBondContact O-N 3.37Å; Q183-Q186 HydrophobicContact CB-CG 4.16Å; Q183-Q186 WeakPolarHBondContact O-CB 3.15Å; Q183-Q186 PolarHBondContact O-N 3.34Å; Q183-Q186 VanDerWaalsContact O-N 3.08Å; Q183-V187 PolarHBondContact O-N 2.93Å
184E85.7Confident76.4Confident93 Ų9374.9 Ų74.944%0.43537%0.369SS..Hα-helixtrans-63.7-33.5-173.2-164.6-166.8137.700113.1A103 V187 K188A103-E184 HydrophobicContact CB-CG 3.89Å; A103-E184 WeakPolarHBondContact CB-OE1 3.43Å; E184-V187 PolarHBondContact O-N 2.87Å; E184-K188 WeakPolarHBondContact O-CG 3.05Å; E184-K188 PolarHBondContact O-N 3.5Å; E184-K188 WeakPolarHBondContact OE1-CE 3.47Å; E184-K188 IonicContact OE1-NZ 2.7Å; E184-K188 PolarHBondContact OE1-NZ 3.27Å
185D88.2Confident78.3Confident85 Ų8580.1 Ų80.146%0.45539%0.389SS..Hα-helixtrans-62.5-44.6172.464.3-44.1000111.4Q183 V187 K188 V189Q183-D185 VanDerWaalsContact C-N 3.29Å; Q183-D185 WeakPolarHBondContact CB-OD1 3.18Å; Q183-D185 PolarHBondContact O-N 3.37Å; D185-V187 VanDerWaalsContact C-N 3.35Å; D185-V187 PolarHBondContact O-N 3.44Å; D185-K188 WeakPolarHBondContact O-CB 3.47Å; D185-K188 PolarHBondContact O-N 3.2Å; D185-K188 VanDerWaalsContact O-N 3.16Å; D185-V189 WeakPolarHBondContact O-CG2 3.4Å; D185-V189 PolarHBondContact O-N 3.06Å
186Q88.1Confident80.5Confident60 Ų6079.6 Ų79.628%0.2838%0.381SS..Hα-helixtrans-63.8-41.3176.9-58.6-58.3-5600111.1I182 Q183 K188 V189 A190 Y250 L254I182-Q186 HydrophobicContact CG2-CB 3.69Å; Q183-Q186 HydrophobicContact CB-CG 4.16Å; Q183-Q186 WeakPolarHBondContact O-CB 3.15Å; Q183-Q186 PolarHBondContact O-N 3.34Å; Q183-Q186 VanDerWaalsContact O-N 3.08Å; Q186-K188 VanDerWaalsContact C-N 3.31Å; Q186-K188 PolarHBondContact O-N 2.91Å; Q186-V189 PolarHBondContact O-N 2.97Å; Q186-A190 VanDerWaalsContact O-CB 3.3Å; Q186-A190 WeakPolarHBondContact O-CB 3.45Å; Q186-A190 PolarHBondContact O-N 2.67Å; Q186-Y250 HydrophobicContact CB-CE1 4.12Å; Q186-Y250 PolarHBondContact OE1-OH 2.88Å; Q186-L254 HydrophobicContact CB-CD1 4.45Å
187V90Very high82.7Confident29 Ų2974.1 Ų74.118%0.17636%0.357CS..Hα-helixtrans-62-39174.1178.40000111.4I182 Q183 E184 D185 K191 F243 L247I182-V187 HydrophobicContact CB-CG2 4.16Å; I182-V187 HydrophobicContact CG2-CG2 3.62Å; Q183-V187 PolarHBondContact O-N 2.93Å; E184-V187 PolarHBondContact O-N 2.87Å; D185-V187 VanDerWaalsContact C-N 3.35Å; D185-V187 PolarHBondContact O-N 3.44Å; V187-K191 VanDerWaalsContact O-CB 3.27Å; V187-K191 WeakPolarHBondContact O-CB 3.26Å; V187-K191 PolarHBondContact O-N 2.68Å; V187-F243 HydrophobicContact CG1-CZ 4.27Å; V187-L247 HydrophobicContact CG1-CD1 4.43Å; V187-L247 HydrophobicContact CG1-CD2 4.45Å
188K91.3Very high84.5Confident113 Ų11371.4 Ų71.449%0.49134%0.344SS..Hα-helixtrans-64.1-46.7176.4-75.5169-174.6165.40111.5E184 D185 Q186 K191 D192E184-K188 WeakPolarHBondContact O-CG 3.05Å; E184-K188 PolarHBondContact O-N 3.5Å; E184-K188 WeakPolarHBondContact OE1-CE 3.47Å; E184-K188 IonicContact OE1-NZ 2.7Å; E184-K188 PolarHBondContact OE1-NZ 3.27Å; D185-K188 WeakPolarHBondContact O-CB 3.47Å; D185-K188 PolarHBondContact O-N 3.2Å; D185-K188 VanDerWaalsContact O-N 3.16Å; Q186-K188 VanDerWaalsContact C-N 3.31Å; Q186-K188 PolarHBondContact O-N 2.91Å; K188-K191 WeakPolarHBondContact O-CB 3.27Å; K188-K191 PolarHBondContact O-N 2.93Å; K188-D192 PolarHBondContact O-N 3.06Å
189V91.7Very high85.8Confident71 Ų7174.1 Ų74.143%0.4335%0.35SS..Hα-helixtrans-62.5-45.3177.6178.10000110.7D185 Q186 K191 D192 V193 L217D185-V189 WeakPolarHBondContact O-CG2 3.4Å; D185-V189 PolarHBondContact O-N 3.06Å; Q186-V189 PolarHBondContact O-N 2.97Å; V189-K191 VanDerWaalsContact C-N 3.31Å; V189-K191 PolarHBondContact O-N 2.92Å; V189-D192 PolarHBondContact O-N 3Å; V189-V193 PolarHBondContact O-N 3.34Å; V189-L217 HydrophobicContact CG1-CD2 3.62Å
190A91.1Very high86.6Confident0 Ų079.4 Ų79.40%036%0.362CS..Hα-helixtrans-58.2-42.6174.600000111.9Q186 V193 F194 F246 L247 Y250Q186-A190 VanDerWaalsContact O-CB 3.3Å; Q186-A190 WeakPolarHBondContact O-CB 3.45Å; Q186-A190 PolarHBondContact O-N 2.67Å; A190-V193 PolarHBondContact O-N 3.37Å; A190-F194 VanDerWaalsContact O-CB 3.29Å; A190-F194 WeakPolarHBondContact O-CB 3.47Å; A190-F194 PolarHBondContact O-N 3.32Å; A190-F246 HydrophobicContact CB-CE1 3.98Å; A190-L247 HydrophobicContact CB-CD2 3.94Å; A190-Y250 HydrophobicContact CB-CD1 3.86Å; A190-Y250 HydrophobicContact CB-CE1 3.8Å; A190-Y250 HydrophobicContact CB-CG 4.47Å
191K91.2Very high87.3Confident99 Ų9979.4 Ų79.443%0.4338%0.379SS..Hα-helixtrans-64.7-39.9176.6-169.7172.4-172.7169.80112.6V187 K188 V189 F194 K195 F243V187-K191 VanDerWaalsContact O-CB 3.27Å; V187-K191 WeakPolarHBondContact O-CB 3.26Å; V187-K191 PolarHBondContact O-N 2.68Å; K188-K191 WeakPolarHBondContact O-CB 3.27Å; K188-K191 PolarHBondContact O-N 2.93Å; V189-K191 VanDerWaalsContact C-N 3.31Å; V189-K191 PolarHBondContact O-N 2.92Å; K191-F194 PolarHBondContact O-N 2.72Å; K191-K195 VanDerWaalsContact O-CG 3.32Å; K191-K195 WeakPolarHBondContact O-CG 3.23Å; K191-K195 PolarHBondContact O-N 3.5Å; K191-F243 HydrophobicContact CB-CE2 3.87Å; K191-F243 HydrophobicContact CB-CZ 3.7Å; K191-F243 HydrophobicContact CD-CZ 4.49Å; K191-F243 HydrophobicContact CG-CE2 4.23Å; K191-F243 HydrophobicContact CG-CZ 4.07Å
192D92Very high87.9Confident86 Ų8680.9 Ų80.946%0.4638%0.382SS..Hα-helixtrans-68.2-39.2178-73.9-15.5000111.5K188 V189 R196K188-D192 PolarHBondContact O-N 3.06Å; V189-D192 PolarHBondContact O-N 3Å; D192-R196 WeakPolarHBondContact O-CG 3.48Å; D192-R196 PolarHBondContact O-N 2.91Å
193V92.8Very high88.1Confident5 Ų587.6 Ų87.63%0.0341%0.413CS..Hα-helixtrans-66.7-46.9172.7172.90000111.1V189 A190 K195 R196 F197 A213 A216 L217V189-V193 PolarHBondContact O-N 3.34Å; A190-V193 PolarHBondContact O-N 3.37Å; V193-K195 VanDerWaalsContact C-N 3.27Å; V193-K195 PolarHBondContact O-N 2.89Å; V193-R196 WeakPolarHBondContact O-CB 3.47Å; V193-R196 PolarHBondContact O-N 2.84Å; V193-F197 HydrophobicContact CG1-CD2 3.9Å; V193-F197 HydrophobicContact CG1-CE2 3.81Å; V193-F197 WeakPolarHBondContact O-CD2 3.46Å; V193-F197 PolarHBondContact O-N 3.4Å; V193-A213 HydrophobicContact CG1-CB 4.08Å; V193-A216 HydrophobicContact CG1-CB 4.04Å; V193-A216 HydrophobicContact CG2-CB 4.44Å; V193-L217 HydrophobicContact CB-CD2 3.94Å; V193-L217 HydrophobicContact CB-CG 4.12Å; V193-L217 HydrophobicContact CG1-CD1 4.47Å; V193-L217 HydrophobicContact CG1-CD2 4.46Å; V193-L217 HydrophobicContact CG1-CG 4.1Å; V193-L217 HydrophobicContact CG2-CD2 3.44Å; V193-L217 VanDerWaalsContact CG2-CD2 3.44Å; V193-L217 HydrophobicContact CG2-CG 3.86Å
194F91.6Very high88.4Confident9 Ų985.7 Ų85.74%0.03940%0.403CS..Hα-helixtrans-53.1-45.6178-175.3-89.7000112A190 K191 R196 F197 D198 E203 I205 F243 F246A190-F194 VanDerWaalsContact O-CB 3.29Å; A190-F194 WeakPolarHBondContact O-CB 3.47Å; A190-F194 PolarHBondContact O-N 3.32Å; K191-F194 PolarHBondContact O-N 2.72Å; F194-R196 VanDerWaalsContact C-N 3.28Å; F194-R196 PolarHBondContact O-N 3.5Å; F194-F197 PolarHBondContact O-N 2.87Å; F194-F197 VanDerWaalsContact O-N 3.12Å; F194-D198 HydrophobicContact CE1-CB 4.49Å; F194-D198 PolarHBondContact O-N 3.44Å; F194-E203 WeakPolarHBondContact CZ-O 3.45Å; F194-I205 HydrophobicContact CD2-CD1 3.84Å; F194-I205 HydrophobicContact CD2-CG1 4.19Å; F194-I205 HydrophobicContact CD2-CG2 3.93Å; F194-I205 HydrophobicContact CE1-CG2 4.41Å; F194-I205 HydrophobicContact CE2-CB 4.29Å; F194-I205 HydrophobicContact CE2-CD1 3.89Å; F194-I205 HydrophobicContact CE2-CG1 3.74Å; F194-I205 HydrophobicContact CE2-CG2 3.73Å; F194-I205 HydrophobicContact CG-CG2 4.37Å; F194-I205 HydrophobicContact CZ-CG2 3.99Å; F194-F243 HydrophobicContact CB-CD2 3.89Å; F194-F243 HydrophobicContact CB-CE2 4.15Å; F194-F243 HydrophobicContact CD1-CB 4.34Å; F194-F243 AromaticContact CD1-CD2 3.98Å; F194-F243 HydrophobicContact CD1-CD2 3.98Å; F194-F243 HydrophobicContact CD2-CB 4.48Å; F194-F243 AromaticContact CD2-CD2 3.87Å; F194-F243 HydrophobicContact CD2-CD2 3.87Å; F194-F243 HydrophobicContact CE1-CB 4.01Å; F194-F243 HydrophobicContact CE1-CD2 4.48Å; F194-F243 HydrophobicContact CE2-CB 4.15Å; F194-F243 HydrophobicContact CE2-CD2 4.36Å; F194-F243 AromaticContact CG-CD2 3.64Å; F194-F243 HydrophobicContact CG-CD2 3.64Å; F194-F243 HydrophobicContact CG-CE2 4.39Å; F194-F243 HydrophobicContact CZ-CB 3.9Å; F194-F246 HydrophobicContact CB-CD1 4.3Å; F194-F246 HydrophobicContact CB-CE1 4.41Å; F194-F246 HydrophobicContact CD2-CB 3.74Å; F194-F246 AromaticContact CD2-CD1 3.97Å; F194-F246 HydrophobicContact CD2-CD1 3.97Å; F194-F246 HydrophobicContact CD2-CD2 4.39Å; F194-F246 AromaticContact CD2-CG 3.78Å; F194-F246 HydrophobicContact CD2-CG 3.78Å; F194-F246 HydrophobicContact CE2-CB 3.92Å; F194-F246 HydrophobicContact CE2-CG 4.41Å
195K91Very high88.6Confident124 Ų12481.4 Ų81.454%0.53938%0.383SS..Hα-helixtrans-62.9-29176.2-74.7174.4178.2178.80114.2K191 V193 F197K191-K195 VanDerWaalsContact O-CG 3.32Å; K191-K195 WeakPolarHBondContact O-CG 3.23Å; K191-K195 PolarHBondContact O-N 3.5Å; V193-K195 VanDerWaalsContact C-N 3.27Å; V193-K195 PolarHBondContact O-N 2.89Å; K195-F197 VanDerWaalsContact C-N 3.3Å
196R91.1Very high88.7Confident186 Ų18678.6 Ų78.670%0.70237%0.37SS*.Hα-helixtrans-70.1-30.2175.9-69.6171.6-174.5-1742.1111.8D192 V193 F194D192-R196 WeakPolarHBondContact O-CG 3.48Å; D192-R196 PolarHBondContact O-N 2.91Å; V193-R196 WeakPolarHBondContact O-CB 3.47Å; V193-R196 PolarHBondContact O-N 2.84Å; F194-R196 VanDerWaalsContact C-N 3.28Å; F194-R196 PolarHBondContact O-N 3.5Å
197F90.7Very high88.8Confident41 Ų4177.7 Ų77.718%0.1837%0.369CS..Hα-helixtrans-91.4-24.8179.6-73.1-82.1000113.1V193 F194 K195 K199 I205 D209 P212 A213 A216V193-F197 HydrophobicContact CG1-CD2 3.9Å; V193-F197 HydrophobicContact CG1-CE2 3.81Å; V193-F197 WeakPolarHBondContact O-CD2 3.46Å; V193-F197 PolarHBondContact O-N 3.4Å; F194-F197 PolarHBondContact O-N 2.87Å; F194-F197 VanDerWaalsContact O-N 3.12Å; K195-F197 VanDerWaalsContact C-N 3.3Å; F197-K199 PolarHBondContact O-N 2.82Å; F197-I205 HydrophobicContact CB-CG2 3.92Å; F197-D209 HydrophobicContact CD1-CB 4.04Å; F197-P212 HydrophobicContact CE1-CB 3.52Å; F197-P212 HydrophobicContact CZ-CB 3.8Å; F197-A213 HydrophobicContact CD2-CB 3.7Å; F197-A213 HydrophobicContact CE2-CB 3.78Å; F197-A213 HydrophobicContact CG-CB 4.21Å; F197-A213 HydrophobicContact CZ-CB 4.31Å; F197-A216 HydrophobicContact CE2-CB 4.05Å; F197-A216 HydrophobicContact CZ-CB 4.4Å
198D89.1Confident88.8Confident24 Ų2481.2 Ų81.213%0.12839%0.391CS..  trans-73.470.1170.4-175.112.5000111.9F194 R200 G201 Q202 E203 I205F194-D198 HydrophobicContact CE1-CB 4.49Å; F194-D198 PolarHBondContact O-N 3.44Å; D198-R200 PolarHBondContact O-N 3.16Å; D198-R200 VanDerWaalsContact O-N 3.1Å; D198-G201 PolarHBondContact O-N 3.29Å; D198-G201 WeakPolarHBondContact OD1-CA 3.49Å; D198-G201 PolarHBondContact OD1-N 3.3Å; D198-G201 VanDerWaalsContact OD2-C 3.32Å; D198-G201 VanDerWaalsContact OD2-CA 3.28Å; D198-G201 WeakPolarHBondContact OD2-CA 3.37Å; D198-Q202 PolarHBondContact OD1-N 2.97Å; D198-Q202 PolarHBondContact OD2-N 2.87Å; D198-Q202 VanDerWaalsContact OD2-N 3.13Å; D198-E203 WeakPolarHBondContact OD2-CA 3.18Å; D198-E203 PolarHBondContact OD2-N 3.1Å; D198-I205 HydrophobicContact CB-CG2 4.28Å
199K78.5Confident88.7Confident180 Ų18078 Ų7878%0.78338%0.379SS*.THydrogen-bonded Turntrans-59.4-22.5-179.7-67.1174.7-177167.80113.3F197F197-K199 PolarHBondContact O-N 2.82Å
200R78.5Confident88.7Confident205 Ų20574.6 Ų74.677%0.77436%0.358SS*.THydrogen-bonded Turntrans-105.1-2.5-173-62.6-172.9179.6-151.41.2113.1D198 Q202D198-R200 PolarHBondContact O-N 3.16Å; D198-R200 VanDerWaalsContact O-N 3.1Å; R200-Q202 HydrophobicContact CB-CB 4.5Å; R200-Q202 HydrophobicContact CB-CG 3.69Å; R200-Q202 PolarHBondContact O-N 2.74Å
201G82.1Confident88.7Confident60 Ų6075.4 Ų75.462%0.61937%0.366SS*.SBendtrans59.631.8-17500000112.4D198 E203D198-G201 PolarHBondContact O-N 3.29Å; D198-G201 WeakPolarHBondContact OD1-CA 3.49Å; D198-G201 PolarHBondContact OD1-N 3.3Å; D198-G201 VanDerWaalsContact OD2-C 3.32Å; D198-G201 VanDerWaalsContact OD2-CA 3.28Å; D198-G201 WeakPolarHBondContact OD2-CA 3.37Å; G201-E203 VanDerWaalsContact C-N 3.29Å
202Q83.3Confident88.7Confident92 Ų9273.2 Ų73.243%0.4336%0.362SS..SBendtrans-89.53.4-177.7-69.4-176.7-7.700112.5D198 R200 K204D198-Q202 PolarHBondContact OD1-N 2.97Å; D198-Q202 PolarHBondContact OD2-N 2.87Å; D198-Q202 VanDerWaalsContact OD2-N 3.13Å; R200-Q202 HydrophobicContact CB-CB 4.5Å; R200-Q202 HydrophobicContact CB-CG 3.69Å; R200-Q202 PolarHBondContact O-N 2.74Å; Q202-K204 HydrophobicContact CB-CD 4.31Å; Q202-K204 HydrophobicContact CB-CG 3.74Å; Q202-K204 PolarHBondContact O-N 3.33Å
203E86.6Confident88.7Confident157 Ų15769.1 Ų69.173%0.73434%0.34SS*.SBendtrans58.423.9-174.9-56.4-171.6153.100113.2F194 D198 G201F194-E203 WeakPolarHBondContact CZ-O 3.45Å; D198-E203 WeakPolarHBondContact OD2-CA 3.18Å; D198-E203 PolarHBondContact OD2-N 3.1Å; G201-E203 VanDerWaalsContact C-N 3.29Å
204K91.1Very high88.7Confident81 Ų8169 Ų6935%0.35234%0.339SS..EExtended strand (participates in β ladder)trans-144.2148179.663.4-175.8-179.1168.80111.1Q202 F240 I241Q202-K204 HydrophobicContact CB-CD 4.31Å; Q202-K204 HydrophobicContact CB-CG 3.74Å; Q202-K204 PolarHBondContact O-N 3.33Å; K204-F240 HydrophobicContact CB-CB 4.33Å; K204-F240 HydrophobicContact CD-CB 4Å; K204-F240 HydrophobicContact CD-CD1 4.26Å; K204-F240 HydrophobicContact CD-CG 4.11Å; K204-F240 HydrophobicContact CG-CB 4.41Å; K204-F240 HydrophobicContact CG-CD1 4.3Å; K204-I241 CarbonylContact C-O 3.46Å; K204-I241 VanDerWaalsContact CA-O 3.22Å; K204-I241 WeakPolarHBondContact CA-O 3.48Å; K204-I241 WeakPolarHBondContact CB-O 3.46Å
205I91.1Very high88.7Confident2 Ų277.3 Ų77.31%0.0137%0.37CS..EExtended strand (participates in β ladder)trans-119.9152.2176.262.4175.1000109.8F194 F197 D198 L210 F240 I241 F246F194-I205 HydrophobicContact CD2-CD1 3.84Å; F194-I205 HydrophobicContact CD2-CG1 4.19Å; F194-I205 HydrophobicContact CD2-CG2 3.93Å; F194-I205 HydrophobicContact CE1-CG2 4.41Å; F194-I205 HydrophobicContact CE2-CB 4.29Å; F194-I205 HydrophobicContact CE2-CD1 3.89Å; F194-I205 HydrophobicContact CE2-CG1 3.74Å; F194-I205 HydrophobicContact CE2-CG2 3.73Å; F194-I205 HydrophobicContact CG-CG2 4.37Å; F194-I205 HydrophobicContact CZ-CG2 3.99Å; F197-I205 HydrophobicContact CB-CG2 3.92Å; D198-I205 HydrophobicContact CB-CG2 4.28Å; I205-L210 HydrophobicContact CD1-CD2 4Å; I205-F240 CarbonylContact O-C 3.52Å; I205-F240 VanDerWaalsContact O-CA 3.29Å; I205-F240 WeakPolarHBondContact O-CA 3.31Å; I205-I241 HydrophobicContact CD1-CD1 4.17Å; I205-I241 HydrophobicContact CD1-CG1 4.15Å; I205-I241 HydrophobicContact CG1-CD1 4.17Å; I205-I241 HydrophobicContact CG1-CG1 3.59Å; I205-I241 PolarHBondContact N-O 2.76Å; I205-I241 PolarHBondContact O-N 3.41Å; I205-F246 HydrophobicContact CD1-CB 4.47Å; I205-F246 HydrophobicContact CD1-CD2 3.59Å; I205-F246 HydrophobicContact CD1-CE2 4.09Å; I205-F246 HydrophobicContact CD1-CG 4.24Å
206S90.8Very high88.7Confident26 Ų2673.6 Ų73.618%0.18236%0.363CS..EExtended strand (participates in β ladder)trans-68143.9174.9-1780000110.4T208 D209 L210 G239S206-T208 WeakPolarHBondContact CB-OG1 3.38Å; S206-T208 PolarHBondContact O-N 3.04Å; S206-T208 VanDerWaalsContact O-N 3.15Å; S206-T208 PolarHBondContact OG-N 2.82Å; S206-T208 PolarHBondContact OG-OG1 3.37Å; S206-D209 WeakPolarHBondContact O-CB 3.27Å; S206-D209 PolarHBondContact O-N 3.02Å; S206-L210 PolarHBondContact O-N 2.87Å; S206-G239 WeakPolarHBondContact CA-O 3.1Å
207T89.5Confident88.7Confident42 Ų4265.8 Ų65.826%0.25834%0.335SS..G310 helixtrans-58.3-25.8171.654.40000112D209 L210 A230 G239 I241T207-D209 VanDerWaalsContact C-N 3.34Å; T207-L210 WeakPolarHBondContact O-CB 3.34Å; T207-L210 PolarHBondContact O-N 3.32Å; T207-A230 HydrophobicContact CG2-CB 4.09Å; T207-G239 PolarHBondContact N-O 3.43Å; T207-G239 PolarHBondContact OG1-O 3.13Å; T207-I241 HydrophobicContact CG2-CG2 4.1Å
208T88.8Confident88.7Confident103 Ų10371 Ų7163%0.63237%0.365SS*.G310 helixtrans-70.7-27.717361.40000113.6S206 L210 P212S206-T208 WeakPolarHBondContact CB-OG1 3.38Å; S206-T208 PolarHBondContact O-N 3.04Å; S206-T208 VanDerWaalsContact O-N 3.15Å; S206-T208 PolarHBondContact OG-N 2.82Å; S206-T208 PolarHBondContact OG-OG1 3.37Å; T208-L210 VanDerWaalsContact C-N 3.31Å; T208-P212 WeakPolarHBondContact O-CD 3.26Å
209D90.5Very high88.7Confident45 Ų4570.9 Ų70.924%0.24136%0.364CS..G310 helixtrans-84.2-9.7-179.4-69.3-33.2000112.2F197 S206 T207 G211 P212 A213F197-D209 HydrophobicContact CD1-CB 4.04Å; S206-D209 WeakPolarHBondContact O-CB 3.27Å; S206-D209 PolarHBondContact O-N 3.02Å; T207-D209 VanDerWaalsContact C-N 3.34Å; D209-G211 PolarHBondContact O-N 2.79Å; D209-P212 WeakPolarHBondContact O-CD 3.28Å; D209-A213 VanDerWaalsContact O-CB 3.29Å; D209-A213 WeakPolarHBondContact O-CB 3.3Å; D209-A213 PolarHBondContact O-N 3.28Å
210L90.3Very high89.1Confident0 Ų068.2 Ų68.20%036%0.363CS..Hα-helixtrans-56.5-47.6173.6-80.4174.6000112.5I205 S206 T207 T208 A213 F214 L226 A230 I241 F246I205-L210 HydrophobicContact CD1-CD2 4Å; S206-L210 PolarHBondContact O-N 2.87Å; T207-L210 WeakPolarHBondContact O-CB 3.34Å; T207-L210 PolarHBondContact O-N 3.32Å; T208-L210 VanDerWaalsContact C-N 3.31Å; L210-A213 WeakPolarHBondContact O-CB 3.49Å; L210-A213 PolarHBondContact O-N 3.03Å; L210-A213 VanDerWaalsContact O-N 3.11Å; L210-F214 HydrophobicContact CD2-CD2 4.47Å; L210-F214 HydrophobicContact CD2-CE2 3.99Å; L210-F214 VanDerWaalsContact O-CD2 3.24Å; L210-F214 WeakPolarHBondContact O-CD2 3.19Å; L210-F214 PolarHBondContact O-N 2.98Å; L210-L226 HydrophobicContact CB-CD1 4.32Å; L210-L226 HydrophobicContact CB-CD2 4.04Å; L210-L226 HydrophobicContact CB-CG 4.29Å; L210-A230 HydrophobicContact CD1-CB 3.59Å; L210-I241 HydrophobicContact CD1-CD1 3.92Å; L210-I241 HydrophobicContact CD2-CD1 3.34Å; L210-I241 HydrophobicContact CD2-CG1 4.39Å; L210-I241 HydrophobicContact CG-CD1 3.89Å; L210-F246 HydrophobicContact CD2-CD2 3.68Å; L210-F246 HydrophobicContact CD2-CE2 4.06Å
211G91.3Very high89.6Confident16 Ų1660 Ų6017%0.16534%0.335CS..Hα-helixtrans-59.2-51.3-178.600000112.6D209 A213 R215 L226D209-G211 PolarHBondContact O-N 2.79Å; G211-A213 VanDerWaalsContact C-N 3.33Å; G211-A213 PolarHBondContact O-N 2.89Å; G211-R215 WeakPolarHBondContact O-CG 3.45Å; G211-R215 PolarHBondContact O-N 3.11Å; G211-R215 VanDerWaalsContact O-N 3.15Å; G211-L226 VanDerWaalsContact CA-CD2 3.46Å
212P91.8Very high90Very high53 Ų5364.5 Ų64.534%0.34434%0.338SS..Hα-helixtrans-58.1-38.6170.2-28.836.8000114.3F197 T208 D209 R215 A216F197-P212 HydrophobicContact CE1-CB 3.52Å; F197-P212 HydrophobicContact CZ-CB 3.8Å; T208-P212 WeakPolarHBondContact O-CD 3.26Å; D209-P212 WeakPolarHBondContact O-CD 3.28Å; P212-R215 PolarHBondContact O-N 3.42Å; P212-A216 PolarHBondContact O-N 3.4Å
213A92.1Very high90.3Very high0 Ų064.9 Ų64.90%035%0.348CS..Hα-helixtrans-64.5-43.6178.600000112.6V193 F197 D209 L210 G211 R215 A216 L217 F246V193-A213 HydrophobicContact CG1-CB 4.08Å; F197-A213 HydrophobicContact CD2-CB 3.7Å; F197-A213 HydrophobicContact CE2-CB 3.78Å; F197-A213 HydrophobicContact CG-CB 4.21Å; F197-A213 HydrophobicContact CZ-CB 4.31Å; D209-A213 VanDerWaalsContact O-CB 3.29Å; D209-A213 WeakPolarHBondContact O-CB 3.3Å; D209-A213 PolarHBondContact O-N 3.28Å; L210-A213 WeakPolarHBondContact O-CB 3.49Å; L210-A213 PolarHBondContact O-N 3.03Å; L210-A213 VanDerWaalsContact O-N 3.11Å; G211-A213 VanDerWaalsContact C-N 3.33Å; G211-A213 PolarHBondContact O-N 2.89Å; A213-R215 VanDerWaalsContact C-N 3.34Å; A213-R215 PolarHBondContact O-N 3.3Å; A213-A216 WeakPolarHBondContact O-CB 3.22Å; A213-A216 PolarHBondContact O-N 2.98Å; A213-A216 VanDerWaalsContact O-N 3.16Å; A213-L217 PolarHBondContact O-N 3.45Å; A213-L217 VanDerWaalsContact O-N 3.16Å; A213-F246 HydrophobicContact CB-CE2 3.85Å; A213-F246 HydrophobicContact CB-CZ 4.22Å
214F92Very high90.5Very high3 Ų362.8 Ų62.81%0.01334%0.342CS..Hα-helixtrans-65.5-38.6176.2-84.5-116.1000111.5L210 A216 L217 N218 L219 V221 L226 W229 F246 C249 K253L210-F214 HydrophobicContact CD2-CD2 4.47Å; L210-F214 HydrophobicContact CD2-CE2 3.99Å; L210-F214 VanDerWaalsContact O-CD2 3.24Å; L210-F214 WeakPolarHBondContact O-CD2 3.19Å; L210-F214 PolarHBondContact O-N 2.98Å; F214-A216 VanDerWaalsContact C-N 3.3Å; F214-A216 PolarHBondContact O-N 2.79Å; F214-L217 CarbonylContact O-C 3.59Å; F214-L217 WeakPolarHBondContact O-CA 3.43Å; F214-L217 WeakPolarHBondContact O-CB 3.38Å; F214-L217 PolarHBondContact O-N 3.25Å; F214-N218 PolarHBondContact O-N 3.14Å; F214-L219 CarbonylContact C-O 3.56Å; F214-L219 HydrophobicContact CB-CB 4.4Å; F214-L219 HydrophobicContact CD1-CB 4.15Å; F214-L219 HydrophobicContact CD1-CD1 4.12Å; F214-L219 HydrophobicContact CE1-CD1 4.43Å; F214-L219 PolarHBondContact O-N 3.09Å; F214-V221 HydrophobicContact CD1-CG2 3.62Å; F214-V221 HydrophobicContact CE1-CG2 4.13Å; F214-L226 HydrophobicContact CD2-CD1 4.36Å; F214-L226 HydrophobicContact CE1-CD1 4.49Å; F214-L226 HydrophobicContact CE2-CD1 4.22Å; F214-L226 HydrophobicContact CZ-CD1 4.28Å; F214-W229 HydrophobicContact CE1-CZ3 4.39Å; F214-F246 HydrophobicContact CD2-CE2 4.07Å; F214-F246 HydrophobicContact CE2-CD2 4.23Å; F214-F246 AromaticContact CE2-CE2 3.72Å; F214-F246 HydrophobicContact CE2-CE2 3.72Å; F214-F246 HydrophobicContact CE2-CZ 4.41Å; F214-C249 HydrophobicContact CE2-CB 4.27Å; F214-C249 HydrophobicContact CZ-CB 3.71Å; F214-K253 HydrophobicContact CE1-CB 3.97Å; F214-K253 HydrophobicContact CE1-CG 4.46Å
215R92.4Very high90.4Very high183 Ų18360.7 Ų60.769%0.69134%0.336SS*.Hα-helixtrans-61.7-37.1172-73-174.7-117.9-152-1.7112.7G211 P212 A213 L217 N218G211-R215 WeakPolarHBondContact O-CG 3.45Å; G211-R215 PolarHBondContact O-N 3.11Å; G211-R215 VanDerWaalsContact O-N 3.15Å; P212-R215 PolarHBondContact O-N 3.42Å; A213-R215 VanDerWaalsContact C-N 3.34Å; A213-R215 PolarHBondContact O-N 3.3Å; R215-L217 PolarHBondContact O-N 3.46Å; R215-N218 PolarHBondContact O-N 2.77Å
216A91.9Very high90.3Very high47 Ų4761.3 Ų61.339%0.38834%0.34SS..Hα-helixtrans-68.1-22175.100000113.2V193 F197 P212 A213 F214 N218V193-A216 HydrophobicContact CG1-CB 4.04Å; V193-A216 HydrophobicContact CG2-CB 4.44Å; F197-A216 HydrophobicContact CE2-CB 4.05Å; F197-A216 HydrophobicContact CZ-CB 4.4Å; P212-A216 PolarHBondContact O-N 3.4Å; A213-A216 WeakPolarHBondContact O-CB 3.22Å; A213-A216 PolarHBondContact O-N 2.98Å; A213-A216 VanDerWaalsContact O-N 3.16Å; F214-A216 VanDerWaalsContact C-N 3.3Å; F214-A216 PolarHBondContact O-N 2.79Å; A216-N218 VanDerWaalsContact C-N 3.29Å
217L91.1Very high90.3Very high21 Ų2166.5 Ų66.511%0.1136%0.359CS..THydrogen-bonded Turntrans-86.95.2171.7-67.8167.8000113.1V189 V193 A213 F214 R215 L219 F246 Y250V189-L217 HydrophobicContact CG1-CD2 3.62Å; V193-L217 HydrophobicContact CB-CD2 3.94Å; V193-L217 HydrophobicContact CB-CG 4.12Å; V193-L217 HydrophobicContact CG1-CD1 4.47Å; V193-L217 HydrophobicContact CG1-CD2 4.46Å; V193-L217 HydrophobicContact CG1-CG 4.1Å; V193-L217 HydrophobicContact CG2-CD2 3.44Å; V193-L217 VanDerWaalsContact CG2-CD2 3.44Å; V193-L217 HydrophobicContact CG2-CG 3.86Å; A213-L217 PolarHBondContact O-N 3.45Å; A213-L217 VanDerWaalsContact O-N 3.16Å; F214-L217 CarbonylContact O-C 3.59Å; F214-L217 WeakPolarHBondContact O-CA 3.43Å; F214-L217 WeakPolarHBondContact O-CB 3.38Å; F214-L217 PolarHBondContact O-N 3.25Å; R215-L217 PolarHBondContact O-N 3.46Å; L217-L219 HydrophobicContact CB-CD1 4.3Å; L217-L219 HydrophobicContact CB-CG 4.17Å; L217-L219 PolarHBondContact O-N 3.01Å; L217-F246 HydrophobicContact CD1-CE1 4.19Å; L217-F246 HydrophobicContact CD1-CZ 3.7Å; L217-Y250 HydrophobicContact CD1-CD2 3.73Å; L217-Y250 HydrophobicContact CD1-CE2 3.72Å; L217-Y250 HydrophobicContact CG-CE2 4.49Å
218N90.3Very high90.3Very high151 Ų15169.6 Ų69.681%0.80737%0.371SS*.THydrogen-bonded Turntrans57.728.8-171-62.6-33.2000113.8F214 R215 A216F214-N218 PolarHBondContact O-N 3.14Å; R215-N218 PolarHBondContact O-N 2.77Å; A216-N218 VanDerWaalsContact C-N 3.29Å
219L89.5Confident90.4Very high21 Ų2166 Ų6611%0.1135%0.345CS..  trans-102.4132174.4-63179.6000110.4F214 L217 Y250 K253F214-L219 CarbonylContact C-O 3.56Å; F214-L219 HydrophobicContact CB-CB 4.4Å; F214-L219 HydrophobicContact CD1-CB 4.15Å; F214-L219 HydrophobicContact CD1-CD1 4.12Å; F214-L219 HydrophobicContact CE1-CD1 4.43Å; F214-L219 PolarHBondContact O-N 3.09Å; L217-L219 HydrophobicContact CB-CD1 4.3Å; L217-L219 HydrophobicContact CB-CG 4.17Å; L217-L219 PolarHBondContact O-N 3.01Å; L219-Y250 HydrophobicContact CD1-CD2 3.55Å; L219-Y250 HydrophobicContact CD1-CE2 3.42Å; L219-Y250 VanDerWaalsContact CD1-CE2 3.42Å; L219-K253 HydrophobicContact CB-CG 4.34Å; L219-K253 HydrophobicContact CD1-CB 4.35Å; L219-K253 HydrophobicContact CD1-CG 3.89Å; L219-K253 HydrophobicContact CD2-CG 4.32Å; L219-K253 HydrophobicContact CG-CG 4.43Å
220T86.9Confident90.3Very high124 Ų12464 Ų6476%0.76134%0.335SS*.  trans-105.9115.4174.953.60000110.1K253T220-K253 WeakPolarHBondContact O-CE 3.21Å
221V88.2Confident90.2Very high32 Ų3268.4 Ų68.419%0.19436%0.359CS..  trans-125.1140.1177.6-172.30000108.4F214 T225 L226 W229 K253F214-V221 HydrophobicContact CD1-CG2 3.62Å; F214-V221 HydrophobicContact CE1-CG2 4.13Å; V221-T225 HydrophobicContact CG1-CG2 4.44Å; V221-L226 HydrophobicContact CG1-CB 3.98Å; V221-W229 HydrophobicContact CG1-CE3 4.26Å; V221-W229 HydrophobicContact CG1-CH2 4.01Å; V221-W229 HydrophobicContact CG1-CZ3 3.66Å; V221-W229 HydrophobicContact CG2-CZ3 4.05Å; V221-K253 HydrophobicContact CG2-CB 4.48Å; V221-K253 HydrophobicContact CG2-CD 3.78Å; V221-K253 HydrophobicContact CG2-CG 3.87Å
222K90.4Very high90Very high155 Ų15571.6 Ų71.667%0.67437%0.37SS*.  trans-63.3141174.4-70.2179.5-179172.10109.8D224 T225 L226K222-D224 PolarHBondContact O-N 2.84Å; K222-T225 PolarHBondContact O-N 2.87Å; K222-L226 WeakPolarHBondContact O-CB 3.04Å; K222-L226 PolarHBondContact O-N 2.93Å
223P88.9Confident89.9Confident100 Ų10070.6 Ų70.665%0.64936%0.362SS*.Hα-helixtrans-60.6-35-177.325-33.9000112.3L226 K227P223-L226 PolarHBondContact O-N 2.79Å; P223-K227 WeakPolarHBondContact O-CB 3.41Å; P223-K227 PolarHBondContact O-N 3Å
224D91.1Very high89.8Confident113 Ų11371.5 Ų71.560%0.60437%0.367SS*.Hα-helixtrans-66.8-50.7179.3-56.2-38.5000111.3K222 L226 K227 E228K222-D224 PolarHBondContact O-N 2.84Å; D224-L226 VanDerWaalsContact C-N 3.3Å; D224-L226 PolarHBondContact O-N 2.7Å; D224-K227 WeakPolarHBondContact O-CB 3.33Å; D224-K227 PolarHBondContact O-N 2.76Å; D224-K227 VanDerWaalsContact O-N 3.13Å; D224-E228 WeakPolarHBondContact O-CG 3.35Å; D224-E228 PolarHBondContact O-N 3.23Å
225T89Confident89.3Confident38 Ų3878.1 Ų78.123%0.23340%0.402CS..Hα-helixtrans-60.3-39.9175.5-49.20000112V221 K222 K227 E228 W229V221-T225 HydrophobicContact CG1-CG2 4.44Å; K222-T225 PolarHBondContact O-N 2.87Å; T225-K227 VanDerWaalsContact C-N 3.31Å; T225-K227 PolarHBondContact O-N 3.49Å; T225-E228 PolarHBondContact O-N 2.81Å; T225-W229 HydrophobicContact CG2-CD2 4.29Å; T225-W229 HydrophobicContact CG2-CH2 4.26Å; T225-W229 HydrophobicContact CG2-CZ2 3.61Å; T225-W229 PolarHBondContact O-N 3.39Å
226L90.3Very high89Confident15 Ų1576.2 Ų76.28%0.07941%0.406CS..Hα-helixtrans-66.8-36.3178-174.261.5000111.8L210 G211 F214 V221 K222 P223 D224 W229 A230L210-L226 HydrophobicContact CB-CD1 4.32Å; L210-L226 HydrophobicContact CB-CD2 4.04Å; L210-L226 HydrophobicContact CB-CG 4.29Å; G211-L226 VanDerWaalsContact CA-CD2 3.46Å; F214-L226 HydrophobicContact CD2-CD1 4.36Å; F214-L226 HydrophobicContact CE1-CD1 4.49Å; F214-L226 HydrophobicContact CE2-CD1 4.22Å; F214-L226 HydrophobicContact CZ-CD1 4.28Å; V221-L226 HydrophobicContact CG1-CB 3.98Å; K222-L226 WeakPolarHBondContact O-CB 3.04Å; K222-L226 PolarHBondContact O-N 2.93Å; P223-L226 PolarHBondContact O-N 2.79Å; D224-L226 VanDerWaalsContact C-N 3.3Å; D224-L226 PolarHBondContact O-N 2.7Å; L226-W229 HydrophobicContact CD1-CE3 4.26Å; L226-W229 PolarHBondContact O-N 3.33Å; L226-A230 WeakPolarHBondContact O-CB 3.31Å; L226-A230 PolarHBondContact O-N 2.93Å
227K89.6Confident88.7Confident135 Ų13578.1 Ų78.159%0.58742%0.422SS*.Hα-helixtrans-64.9-45.3174.1-174.6-174.4173.9-168.90110.8P223 D224 T225 W229 A230 D231P223-K227 WeakPolarHBondContact O-CB 3.41Å; P223-K227 PolarHBondContact O-N 3Å; D224-K227 WeakPolarHBondContact O-CB 3.33Å; D224-K227 PolarHBondContact O-N 2.76Å; D224-K227 VanDerWaalsContact O-N 3.13Å; T225-K227 VanDerWaalsContact C-N 3.31Å; T225-K227 PolarHBondContact O-N 3.49Å; K227-W229 VanDerWaalsContact C-N 3.31Å; K227-W229 PolarHBondContact O-N 3.16Å; K227-A230 WeakPolarHBondContact O-CB 3.45Å; K227-A230 PolarHBondContact O-N 3.44Å; K227-A230 VanDerWaalsContact O-N 3.11Å; K227-D231 WeakPolarHBondContact O-CB 3.06Å; K227-D231 PolarHBondContact O-N 2.8Å
228E89.8Confident88.5Confident107 Ų10780.8 Ų80.850%0.544%0.439SS..Hα-helixtrans-58.2-42.7174.9-69.4168.4-171.900112.1D224 T225 A230 D231 Q232D224-E228 WeakPolarHBondContact O-CG 3.35Å; D224-E228 PolarHBondContact O-N 3.23Å; T225-E228 PolarHBondContact O-N 2.81Å; E228-A230 VanDerWaalsContact C-N 3.35Å; E228-D231 PolarHBondContact O-N 2.86Å; E228-Q232 WeakPolarHBondContact O-CB 3.44Å; E228-Q232 VanDerWaalsContact O-CG 3.23Å; E228-Q232 WeakPolarHBondContact O-CG 3.07Å; E228-Q232 PolarHBondContact O-N 3.32Å
229W89.9Confident88.5Confident26 Ų2674.7 Ų74.710%0.09841%0.412CS..Hα-helixtrans-67.1-36.6175.8-65-8.4000112.7F214 V221 T225 L226 K227 Q232 V233 K252 K253F214-W229 HydrophobicContact CE1-CZ3 4.39Å; V221-W229 HydrophobicContact CG1-CE3 4.26Å; V221-W229 HydrophobicContact CG1-CH2 4.01Å; V221-W229 HydrophobicContact CG1-CZ3 3.66Å; V221-W229 HydrophobicContact CG2-CZ3 4.05Å; T225-W229 HydrophobicContact CG2-CD2 4.29Å; T225-W229 HydrophobicContact CG2-CH2 4.26Å; T225-W229 HydrophobicContact CG2-CZ2 3.61Å; T225-W229 PolarHBondContact O-N 3.39Å; L226-W229 HydrophobicContact CD1-CE3 4.26Å; L226-W229 PolarHBondContact O-N 3.33Å; K227-W229 VanDerWaalsContact C-N 3.31Å; K227-W229 PolarHBondContact O-N 3.16Å; W229-Q232 PolarHBondContact O-N 2.67Å; W229-V233 WeakPolarHBondContact O-CG2 3.4Å; W229-V233 PolarHBondContact O-N 3.42Å; W229-K252 HydrophobicContact CD2-CB 4.37Å; W229-K252 HydrophobicContact CD2-CD 4.29Å; W229-K252 HydrophobicContact CG-CD 4.1Å; W229-K252 HydrophobicContact CH2-CB 4.45Å; W229-K252 HydrophobicContact CZ2-CB 4.24Å; W229-K253 HydrophobicContact CH2-CB 3.98Å; W229-K253 HydrophobicContact CH2-CD 4.13Å; W229-K253 HydrophobicContact CZ3-CB 3.83Å
230A89.6Confident88.5Confident4 Ų477.8 Ų77.83%0.03342%0.424CS..Hα-helixtrans-64.4-46.3174.600000111.1T207 L210 L226 K227 E228 Q232 V233 D234T207-A230 HydrophobicContact CG2-CB 4.09Å; L210-A230 HydrophobicContact CD1-CB 3.59Å; L226-A230 WeakPolarHBondContact O-CB 3.31Å; L226-A230 PolarHBondContact O-N 2.93Å; K227-A230 WeakPolarHBondContact O-CB 3.45Å; K227-A230 PolarHBondContact O-N 3.44Å; K227-A230 VanDerWaalsContact O-N 3.11Å; E228-A230 VanDerWaalsContact C-N 3.35Å; A230-Q232 VanDerWaalsContact C-N 3.29Å; A230-Q232 PolarHBondContact O-N 2.94Å; A230-V233 PolarHBondContact O-N 3.36Å; A230-V233 VanDerWaalsContact O-N 3.09Å; A230-D234 WeakPolarHBondContact O-CB 3.45Å; A230-D234 PolarHBondContact O-N 2.88Å
231D89Confident88.6Confident92 Ų9272 Ų7249%0.49239%0.389SS..Hα-helixtrans-64.3-33.7179-66.5-14.1000111.5K227 E228 V233K227-D231 WeakPolarHBondContact O-CB 3.06Å; K227-D231 PolarHBondContact O-N 2.8Å; E228-D231 PolarHBondContact O-N 2.86Å; D231-V233 VanDerWaalsContact C-N 3.29Å; D231-V233 PolarHBondContact O-N 2.9Å
232Q86.8Confident88.7Confident84 Ų8474.6 Ų74.639%0.39340%0.402SS..THydrogen-bonded Turntrans-72.8-17.4174.4-75.217431.900114.4E228 W229 A230E228-Q232 WeakPolarHBondContact O-CB 3.44Å; E228-Q232 VanDerWaalsContact O-CG 3.23Å; E228-Q232 WeakPolarHBondContact O-CG 3.07Å; E228-Q232 PolarHBondContact O-N 3.32Å; W229-Q232 PolarHBondContact O-N 2.67Å; A230-Q232 VanDerWaalsContact C-N 3.29Å; A230-Q232 PolarHBondContact O-N 2.94Å
233V88.2Confident88.7Confident31 Ų3169.6 Ų69.619%0.18838%0.38CS..THydrogen-bonded Turntrans-104-32.7-177.8166.10000110.8W229 A230 D231 D235 I241 I248W229-V233 WeakPolarHBondContact O-CG2 3.4Å; W229-V233 PolarHBondContact O-N 3.42Å; A230-V233 PolarHBondContact O-N 3.36Å; A230-V233 VanDerWaalsContact O-N 3.09Å; D231-V233 VanDerWaalsContact C-N 3.29Å; D231-V233 PolarHBondContact O-N 2.9Å; V233-D235 VanDerWaalsContact C-N 3.34Å; V233-D235 PolarHBondContact O-N 3.18Å; V233-I241 HydrophobicContact CB-CG2 4.47Å; V233-I241 HydrophobicContact CG1-CB 4.18Å; V233-I241 HydrophobicContact CG1-CG2 3.78Å; V233-I248 HydrophobicContact CG2-CB 4.05Å; V233-I248 HydrophobicContact CG2-CD1 4.5Å; V233-I248 HydrophobicContact CG2-CG2 3.77Å
234D90.2Very high88.7Confident20 Ų2068.7 Ų68.711%0.10737%0.37CS..  trans-94.261.2174.8-173.729.4000110.2A230 D236 A237 T238 G239 I241A230-D234 WeakPolarHBondContact O-CB 3.45Å; A230-D234 PolarHBondContact O-N 2.88Å; D234-D236 PolarHBondContact O-N 2.78Å; D234-A237 PolarHBondContact O-N 3.43Å; D234-A237 PolarHBondContact OD1-N 3.33Å; D234-A237 WeakPolarHBondContact OD2-CA 3.23Å; D234-T238 VanDerWaalsContact CG-N 3.29Å; D234-T238 WeakPolarHBondContact OD1-CB 3.36Å; D234-T238 PolarHBondContact OD1-N 2.88Å; D234-T238 PolarHBondContact OD1-OG1 3.17Å; D234-T238 PolarHBondContact OD2-N 2.93Å; D234-G239 WeakPolarHBondContact OD2-CA 3.41Å; D234-G239 PolarHBondContact OD2-N 3.42Å; D234-I241 HydrophobicContact CB-CG2 4.2Å
235D82Confident88.6Confident141 Ų14163.3 Ų63.375%0.75434%0.341SS*.THydrogen-bonded Turntrans-55.5-26178.9-72.8-28.7000112.4V233 A237V233-D235 VanDerWaalsContact C-N 3.34Å; V233-D235 PolarHBondContact O-N 3.18Å; D235-A237 VanDerWaalsContact C-N 3.34Å
236D86.4Confident88.6Confident144 Ų14461.5 Ų61.577%0.7733%0.33SS*.THydrogen-bonded Turntrans-86.9-0.2179.1-69.7-35.9000113.4D234 T238D234-D236 PolarHBondContact O-N 2.78Å; D236-T238 HydrophobicContact CB-CG2 3.65Å; D236-T238 PolarHBondContact O-N 2.78Å; D236-T238 VanDerWaalsContact O-N 3.15Å
237A85.6Confident88.6Confident86 Ų8661.1 Ų61.171%0.71133%0.328SS*.  trans49.237.8-177.600000113.5D234 D235 G239D234-A237 PolarHBondContact O-N 3.43Å; D234-A237 PolarHBondContact OD1-N 3.33Å; D234-A237 WeakPolarHBondContact OD2-CA 3.23Å; D235-A237 VanDerWaalsContact C-N 3.34Å; A237-G239 PolarHBondContact O-N 3.46Å
238T87.4Confident88.5Confident77 Ų7756.7 Ų56.747%0.47231%0.31SS..  trans-73.2-19.9-178.265.70000112.7D234 D236 F240D234-T238 VanDerWaalsContact CG-N 3.29Å; D234-T238 WeakPolarHBondContact OD1-CB 3.36Å; D234-T238 PolarHBondContact OD1-N 2.88Å; D234-T238 PolarHBondContact OD1-OG1 3.17Å; D234-T238 PolarHBondContact OD2-N 2.93Å; D236-T238 HydrophobicContact CB-CG2 3.65Å; D236-T238 PolarHBondContact O-N 2.78Å; D236-T238 VanDerWaalsContact O-N 3.15Å; T238-F240 VanDerWaalsContact O-CD2 3.26Å; T238-F240 WeakPolarHBondContact O-CD2 3.31Å; T238-F240 PolarHBondContact OG1-N 3.43Å; T238-F240 VanDerWaalsContact OG1-N 3.1Å; T238-F240 PolarHBondContact OG1-O 2.86Å
239G89.2Confident88.4Confident23 Ų2351.6 Ų51.624%0.23729%0.286CS..SBendtrans76.77.1-168.500000113.3S206 T207 D234 A237S206-G239 WeakPolarHBondContact CA-O 3.1Å; T207-G239 PolarHBondContact N-O 3.43Å; T207-G239 PolarHBondContact OG1-O 3.13Å; D234-G239 WeakPolarHBondContact OD2-CA 3.41Å; D234-G239 PolarHBondContact OD2-N 3.42Å; A237-G239 PolarHBondContact O-N 3.46Å
240F89.9Confident88.4Confident86 Ų8650.6 Ų50.638%0.37728%0.283SS..EExtended strand (participates in β ladder)trans-129.5141.2-179.9-62.5-84.2000110.9K204 I205 T238K204-F240 HydrophobicContact CB-CB 4.33Å; K204-F240 HydrophobicContact CD-CB 4Å; K204-F240 HydrophobicContact CD-CD1 4.26Å; K204-F240 HydrophobicContact CD-CG 4.11Å; K204-F240 HydrophobicContact CG-CB 4.41Å; K204-F240 HydrophobicContact CG-CD1 4.3Å; I205-F240 CarbonylContact O-C 3.52Å; I205-F240 VanDerWaalsContact O-CA 3.29Å; I205-F240 WeakPolarHBondContact O-CA 3.31Å; T238-F240 VanDerWaalsContact O-CD2 3.26Å; T238-F240 WeakPolarHBondContact O-CD2 3.31Å; T238-F240 PolarHBondContact OG1-N 3.43Å; T238-F240 VanDerWaalsContact OG1-N 3.1Å; T238-F240 PolarHBondContact OG1-O 2.86Å
241I89.8Confident88.4Confident3 Ų350.4 Ų50.42%0.01528%0.281CS..EExtended strand (participates in β ladder)trans-118.2143.5171.564.8165.6000110.2K204 I205 T207 L210 V233 D234 F246K204-I241 CarbonylContact C-O 3.46Å; K204-I241 VanDerWaalsContact CA-O 3.22Å; K204-I241 WeakPolarHBondContact CA-O 3.48Å; K204-I241 WeakPolarHBondContact CB-O 3.46Å; I205-I241 HydrophobicContact CD1-CD1 4.17Å; I205-I241 HydrophobicContact CD1-CG1 4.15Å; I205-I241 HydrophobicContact CG1-CD1 4.17Å; I205-I241 HydrophobicContact CG1-CG1 3.59Å; I205-I241 PolarHBondContact N-O 2.76Å; I205-I241 PolarHBondContact O-N 3.41Å; T207-I241 HydrophobicContact CG2-CG2 4.1Å; L210-I241 HydrophobicContact CD1-CD1 3.92Å; L210-I241 HydrophobicContact CD2-CD1 3.34Å; L210-I241 HydrophobicContact CD2-CG1 4.39Å; L210-I241 HydrophobicContact CG-CD1 3.89Å; V233-I241 HydrophobicContact CB-CG2 4.47Å; V233-I241 HydrophobicContact CG1-CB 4.18Å; V233-I241 HydrophobicContact CG1-CG2 3.78Å; D234-I241 HydrophobicContact CB-CG2 4.2Å; I241-F246 HydrophobicContact CD1-CB 3.99Å; I241-F246 HydrophobicContact CD1-CD2 4.35Å
242D90.5Very high88.2Confident86 Ų8647.2 Ų47.246%0.4626%0.263SS..EExtended strand (participates in β ladder)trans-79.7177.5172.373.2-19000111N244 G245 F246D242-N244 PolarHBondContact O-N 2.88Å; D242-N244 PolarHBondContact OD1-N 3.05Å; D242-G245 PolarHBondContact O-N 2.87Å; D242-G245 PolarHBondContact OD1-N 2.96Å; D242-F246 PolarHBondContact O-N 2.91Å
243F89.5Confident88.3Confident51 Ų5144 Ų4422%0.22425%0.248CC..Hα-helixtrans-62-33.3179.2-178.9-116.6000112.6V187 K191 F194 F246 L247V187-F243 HydrophobicContact CG1-CZ 4.27Å; K191-F243 HydrophobicContact CB-CE2 3.87Å; K191-F243 HydrophobicContact CB-CZ 3.7Å; K191-F243 HydrophobicContact CD-CZ 4.49Å; K191-F243 HydrophobicContact CG-CE2 4.23Å; K191-F243 HydrophobicContact CG-CZ 4.07Å; F194-F243 HydrophobicContact CB-CD2 3.89Å; F194-F243 HydrophobicContact CB-CE2 4.15Å; F194-F243 HydrophobicContact CD1-CB 4.34Å; F194-F243 AromaticContact CD1-CD2 3.98Å; F194-F243 HydrophobicContact CD1-CD2 3.98Å; F194-F243 HydrophobicContact CD2-CB 4.48Å; F194-F243 AromaticContact CD2-CD2 3.87Å; F194-F243 HydrophobicContact CD2-CD2 3.87Å; F194-F243 HydrophobicContact CE1-CB 4.01Å; F194-F243 HydrophobicContact CE1-CD2 4.48Å; F194-F243 HydrophobicContact CE2-CB 4.15Å; F194-F243 HydrophobicContact CE2-CD2 4.36Å; F194-F243 AromaticContact CG-CD2 3.64Å; F194-F243 HydrophobicContact CG-CD2 3.64Å; F194-F243 HydrophobicContact CG-CE2 4.39Å; F194-F243 HydrophobicContact CZ-CB 3.9Å; F243-F246 HydrophobicContact CD2-CD1 4.46Å; F243-F246 HydrophobicContact CE2-CD1 4.41Å; F243-F246 PolarHBondContact O-N 3.32Å; F243-L247 HydrophobicContact CD1-CD1 4.02Å; F243-L247 HydrophobicContact CD1-CG 4.42Å; F243-L247 HydrophobicContact CE1-CD1 3.46Å; F243-L247 VanDerWaalsContact CE1-CD1 3.46Å; F243-L247 HydrophobicContact CE1-CD2 4.48Å; F243-L247 HydrophobicContact CE1-CG 3.96Å; F243-L247 HydrophobicContact CE2-CD1 4.46Å; F243-L247 HydrophobicContact CE2-CD2 4.18Å; F243-L247 HydrophobicContact CE2-CG 4.06Å; F243-L247 HydrophobicContact CZ-CD1 3.71Å; F243-L247 HydrophobicContact CZ-CD2 3.86Å; F243-L247 HydrophobicContact CZ-CG 3.77Å; F243-L247 WeakPolarHBondContact O-CG 3.31Å; F243-L247 PolarHBondContact O-N 2.89Å
244N88.6Confident88.3Confident80 Ų8043.8 Ų43.843%0.42825%0.245SC..Hα-helixtrans-67.3-44.8177.9-172.242.2000111D242 F246 L247 I248D242-N244 PolarHBondContact O-N 2.88Å; D242-N244 PolarHBondContact OD1-N 3.05Å; N244-F246 VanDerWaalsContact C-N 3.31Å; N244-F246 PolarHBondContact O-N 2.98Å; N244-L247 WeakPolarHBondContact O-CB 3.24Å; N244-L247 PolarHBondContact O-N 2.86Å; N244-L247 VanDerWaalsContact O-N 3.13Å; N244-I248 WeakPolarHBondContact O-CG1 3.23Å; N244-I248 PolarHBondContact O-N 2.86Å
245G88.4Confident87.9Confident1 Ų145.8 Ų45.81%0.0125%0.254CS..Hα-helixtrans-58.2-42.4172.600000113D242 L247 I248 C249D242-G245 PolarHBondContact O-N 2.87Å; D242-G245 PolarHBondContact OD1-N 2.96Å; G245-L247 VanDerWaalsContact C-N 3.33Å; G245-L247 PolarHBondContact O-N 2.89Å; G245-I248 WeakPolarHBondContact O-CB 3.13Å; G245-I248 PolarHBondContact O-N 3Å; G245-C249 PolarHBondContact O-N 3.46Å; G245-C249 VanDerWaalsContact O-N 3.16Å
246F90.3Very high88Confident0 Ų042.2 Ų42.20%023%0.233CC..Hα-helixtrans-60.8-42.8174-178.2-105.7000112.2A190 F194 I205 L210 A213 F214 L217 I241 D242 F243 N244 I248 C249 Y250A190-F246 HydrophobicContact CB-CE1 3.98Å; F194-F246 HydrophobicContact CB-CD1 4.3Å; F194-F246 HydrophobicContact CB-CE1 4.41Å; F194-F246 HydrophobicContact CD2-CB 3.74Å; F194-F246 AromaticContact CD2-CD1 3.97Å; F194-F246 HydrophobicContact CD2-CD1 3.97Å; F194-F246 HydrophobicContact CD2-CD2 4.39Å; F194-F246 AromaticContact CD2-CG 3.78Å; F194-F246 HydrophobicContact CD2-CG 3.78Å; F194-F246 HydrophobicContact CE2-CB 3.92Å; F194-F246 HydrophobicContact CE2-CG 4.41Å; I205-F246 HydrophobicContact CD1-CB 4.47Å; I205-F246 HydrophobicContact CD1-CD2 3.59Å; I205-F246 HydrophobicContact CD1-CE2 4.09Å; I205-F246 HydrophobicContact CD1-CG 4.24Å; L210-F246 HydrophobicContact CD2-CD2 3.68Å; L210-F246 HydrophobicContact CD2-CE2 4.06Å; A213-F246 HydrophobicContact CB-CE2 3.85Å; A213-F246 HydrophobicContact CB-CZ 4.22Å; F214-F246 HydrophobicContact CD2-CE2 4.07Å; F214-F246 HydrophobicContact CE2-CD2 4.23Å; F214-F246 AromaticContact CE2-CE2 3.72Å; F214-F246 HydrophobicContact CE2-CE2 3.72Å; F214-F246 HydrophobicContact CE2-CZ 4.41Å; L217-F246 HydrophobicContact CD1-CE1 4.19Å; L217-F246 HydrophobicContact CD1-CZ 3.7Å; I241-F246 HydrophobicContact CD1-CB 3.99Å; I241-F246 HydrophobicContact CD1-CD2 4.35Å; D242-F246 PolarHBondContact O-N 2.91Å; F243-F246 HydrophobicContact CD2-CD1 4.46Å; F243-F246 HydrophobicContact CE2-CD1 4.41Å; F243-F246 PolarHBondContact O-N 3.32Å; N244-F246 VanDerWaalsContact C-N 3.31Å; N244-F246 PolarHBondContact O-N 2.98Å; F246-I248 VanDerWaalsContact C-N 3.32Å; F246-I248 PolarHBondContact O-N 3.39Å; F246-C249 PolarHBondContact O-N 2.78Å; F246-Y250 VanDerWaalsContact O-CB 3.28Å; F246-Y250 WeakPolarHBondContact O-CB 3.39Å; F246-Y250 PolarHBondContact O-N 3.45Å
247L90Very high87.9Confident6 Ų637 Ų373%0.03121%0.205CC..Hα-helixtrans-65.8-32.5176.5-74.4179.9000112.9L108 V187 A190 F243 N244 G245 Y250 G251L108-L247 HydrophobicContact CD1-CB 4.04Å; V187-L247 HydrophobicContact CG1-CD1 4.43Å; V187-L247 HydrophobicContact CG1-CD2 4.45Å; A190-L247 HydrophobicContact CB-CD2 3.94Å; F243-L247 HydrophobicContact CD1-CD1 4.02Å; F243-L247 HydrophobicContact CD1-CG 4.42Å; F243-L247 HydrophobicContact CE1-CD1 3.46Å; F243-L247 VanDerWaalsContact CE1-CD1 3.46Å; F243-L247 HydrophobicContact CE1-CD2 4.48Å; F243-L247 HydrophobicContact CE1-CG 3.96Å; F243-L247 HydrophobicContact CE2-CD1 4.46Å; F243-L247 HydrophobicContact CE2-CD2 4.18Å; F243-L247 HydrophobicContact CE2-CG 4.06Å; F243-L247 HydrophobicContact CZ-CD1 3.71Å; F243-L247 HydrophobicContact CZ-CD2 3.86Å; F243-L247 HydrophobicContact CZ-CG 3.77Å; F243-L247 WeakPolarHBondContact O-CG 3.31Å; F243-L247 PolarHBondContact O-N 2.89Å; N244-L247 WeakPolarHBondContact O-CB 3.24Å; N244-L247 PolarHBondContact O-N 2.86Å; N244-L247 VanDerWaalsContact O-N 3.13Å; G245-L247 VanDerWaalsContact C-N 3.33Å; G245-L247 PolarHBondContact O-N 2.89Å; L247-Y250 HydrophobicContact CD2-CD1 4.36Å; L247-G251 WeakPolarHBondContact O-CA 3.35Å; L247-G251 PolarHBondContact O-N 3.31Å
248I87.3Confident87.6Confident42 Ų4235.8 Ų35.822%0.21519%0.185CC..Hα-helixtrans-62-51.8173.2-69.2165.1000109.8L108 V233 N244 G245 F246 Y250 G251 K252L108-I248 HydrophobicContact CD2-CD1 4.43Å; L108-I248 HydrophobicContact CD2-CG1 3.52Å; V233-I248 HydrophobicContact CG2-CB 4.05Å; V233-I248 HydrophobicContact CG2-CD1 4.5Å; V233-I248 HydrophobicContact CG2-CG2 3.77Å; N244-I248 WeakPolarHBondContact O-CG1 3.23Å; N244-I248 PolarHBondContact O-N 2.86Å; G245-I248 WeakPolarHBondContact O-CB 3.13Å; G245-I248 PolarHBondContact O-N 3Å; F246-I248 VanDerWaalsContact C-N 3.32Å; F246-I248 PolarHBondContact O-N 3.39Å; I248-Y250 VanDerWaalsContact C-N 3.35Å; I248-Y250 PolarHBondContact O-N 2.75Å; I248-G251 PolarHBondContact O-N 3.36Å; I248-K252 WeakPolarHBondContact O-CG 3.46Å; I248-K252 PolarHBondContact O-N 3.36Å
249C88.6Confident87.3Confident0 Ų035.1 Ų35.10%018%0.178CC..Hα-helixtrans-61.6-43.8178.3-62.80000111.7F214 G245 F246 K252 K253F214-C249 HydrophobicContact CE2-CB 4.27Å; F214-C249 HydrophobicContact CZ-CB 3.71Å; G245-C249 PolarHBondContact O-N 3.46Å; G245-C249 VanDerWaalsContact O-N 3.16Å; F246-C249 PolarHBondContact O-N 2.78Å; C249-K252 PolarHBondContact O-N 3.39Å; C249-K253 PolarHBondContact O-N 3.02Å; C249-K253 VanDerWaalsContact O-N 3.13Å
250Y89.4Confident86.9Confident5 Ų536.7 Ų36.72%0.0218%0.179CC..Hα-helixtrans-64.5-42.1179.1178.9-119.2000111.7I182 Q186 A190 L217 L219 F246 L247 I248 K253 L254I182-Y250 HydrophobicContact CD1-CD1 4.36Å; I182-Y250 HydrophobicContact CG2-CE1 4.21Å; Q186-Y250 HydrophobicContact CB-CE1 4.12Å; Q186-Y250 PolarHBondContact OE1-OH 2.88Å; A190-Y250 HydrophobicContact CB-CD1 3.86Å; A190-Y250 HydrophobicContact CB-CE1 3.8Å; A190-Y250 HydrophobicContact CB-CG 4.47Å; L217-Y250 HydrophobicContact CD1-CD2 3.73Å; L217-Y250 HydrophobicContact CD1-CE2 3.72Å; L217-Y250 HydrophobicContact CG-CE2 4.49Å; L219-Y250 HydrophobicContact CD1-CD2 3.55Å; L219-Y250 HydrophobicContact CD1-CE2 3.42Å; L219-Y250 VanDerWaalsContact CD1-CE2 3.42Å; F246-Y250 VanDerWaalsContact O-CB 3.28Å; F246-Y250 WeakPolarHBondContact O-CB 3.39Å; F246-Y250 PolarHBondContact O-N 3.45Å; L247-Y250 HydrophobicContact CD2-CD1 4.36Å; I248-Y250 VanDerWaalsContact C-N 3.35Å; I248-Y250 PolarHBondContact O-N 2.75Å; Y250-K253 PolarHBondContact O-N 2.84Å; Y250-L254 HydrophobicContact CD1-CD1 3.97Å; Y250-L254 HydrophobicContact CD2-CG 4.45Å; Y250-L254 HydrophobicContact CE1-CD1 3.48Å; Y250-L254 VanDerWaalsContact CE1-CD1 3.48Å; Y250-L254 HydrophobicContact CE1-CG 4.3Å; Y250-L254 HydrophobicContact CE2-CD1 4.15Å; Y250-L254 HydrophobicContact CE2-CD2 4.3Å; Y250-L254 HydrophobicContact CE2-CG 4.12Å; Y250-L254 WeakPolarHBondContact O-CG 3.47Å; Y250-L254 PolarHBondContact O-N 3.25Å
251G88.3Confident86.6Confident0 Ų038.1 Ų38.10%018%0.182CC..Hα-helixtrans-61.1-44.1174.700000112.6F180 L247 I248 K253 L254 Q255F180-G251 WeakPolarHBondContact CE1-O 3.31Å; L247-G251 WeakPolarHBondContact O-CA 3.35Å; L247-G251 PolarHBondContact O-N 3.31Å; I248-G251 PolarHBondContact O-N 3.36Å; G251-K253 VanDerWaalsContact C-N 3.31Å; G251-K253 PolarHBondContact O-N 3.04Å; G251-L254 PolarHBondContact O-N 2.77Å; G251-Q255 VanDerWaalsContact O-CB 3.31Å; G251-Q255 WeakPolarHBondContact O-CB 3.39Å; G251-Q255 PolarHBondContact O-N 2.91Å
252K86.3Confident86.1Confident25 Ų2540 Ų4011%0.10919%0.192CC..Hα-helixtrans-56.9-44.8174.3-76.4178.8179.1173.20111.7W229 I248 C249 Q255 E256W229-K252 HydrophobicContact CD2-CB 4.37Å; W229-K252 HydrophobicContact CD2-CD 4.29Å; W229-K252 HydrophobicContact CG-CD 4.1Å; W229-K252 HydrophobicContact CH2-CB 4.45Å; W229-K252 HydrophobicContact CZ2-CB 4.24Å; I248-K252 WeakPolarHBondContact O-CG 3.46Å; I248-K252 PolarHBondContact O-N 3.36Å; C249-K252 PolarHBondContact O-N 3.39Å; K252-Q255 PolarHBondContact O-N 3.41Å; K252-E256 WeakPolarHBondContact O-CB 3.43Å; K252-E256 PolarHBondContact O-N 2.95Å
253K88.1Confident85.7Confident17 Ų1736.4 Ų36.47%0.07417%0.173CC..Hα-helixtrans-65.8-46.1178.4-176.748.4-179.6160.60112.5F214 L219 T220 V221 W229 C249 Y250 G251 Q255 E256 D257F214-K253 HydrophobicContact CE1-CB 3.97Å; F214-K253 HydrophobicContact CE1-CG 4.46Å; L219-K253 HydrophobicContact CB-CG 4.34Å; L219-K253 HydrophobicContact CD1-CB 4.35Å; L219-K253 HydrophobicContact CD1-CG 3.89Å; L219-K253 HydrophobicContact CD2-CG 4.32Å; L219-K253 HydrophobicContact CG-CG 4.43Å; T220-K253 WeakPolarHBondContact O-CE 3.21Å; V221-K253 HydrophobicContact CG2-CB 4.48Å; V221-K253 HydrophobicContact CG2-CD 3.78Å; V221-K253 HydrophobicContact CG2-CG 3.87Å; W229-K253 HydrophobicContact CH2-CB 3.98Å; W229-K253 HydrophobicContact CH2-CD 4.13Å; W229-K253 HydrophobicContact CZ3-CB 3.83Å; C249-K253 PolarHBondContact O-N 3.02Å; C249-K253 VanDerWaalsContact O-N 3.13Å; Y250-K253 PolarHBondContact O-N 2.84Å; G251-K253 VanDerWaalsContact C-N 3.31Å; G251-K253 PolarHBondContact O-N 3.04Å; K253-Q255 PolarHBondContact O-N 3.38Å; K253-E256 VanDerWaalsContact CD-OE2 3.23Å; K253-E256 WeakPolarHBondContact CD-OE2 3.47Å; K253-E256 IonicContact NZ-OE2 2.85Å; K253-E256 PolarHBondContact NZ-OE2 3.02Å; K253-E256 PolarHBondContact O-N 3.02Å; K253-D257 WeakPolarHBondContact CE-OD1 3.31Å; K253-D257 IonicContact NZ-OD1 2.69Å; K253-D257 PolarHBondContact NZ-OD1 2.99Å; K253-D257 PolarHBondContact O-N 2.86Å
254L87.4Confident85.5Confident26 Ų2639 Ų3914%0.13618%0.181CC..Hα-helixtrans-62.8-35.5178.1-72179.5000112.3F180 I182 Q186 Y250 G251 Q258F180-L254 HydrophobicContact CE1-CB 4.17Å; F180-L254 HydrophobicContact CE2-CB 3.95Å; F180-L254 HydrophobicContact CZ-CB 3.32Å; F180-L254 HydrophobicContact CZ-CD1 4.14Å; F180-L254 HydrophobicContact CZ-CG 4.41Å; I182-L254 HydrophobicContact CG2-CD1 4.18Å; Q186-L254 HydrophobicContact CB-CD1 4.45Å; Y250-L254 HydrophobicContact CD1-CD1 3.97Å; Y250-L254 HydrophobicContact CD2-CG 4.45Å; Y250-L254 HydrophobicContact CE1-CD1 3.48Å; Y250-L254 VanDerWaalsContact CE1-CD1 3.48Å; Y250-L254 HydrophobicContact CE1-CG 4.3Å; Y250-L254 HydrophobicContact CE2-CD1 4.15Å; Y250-L254 HydrophobicContact CE2-CD2 4.3Å; Y250-L254 HydrophobicContact CE2-CG 4.12Å; Y250-L254 WeakPolarHBondContact O-CG 3.47Å; Y250-L254 PolarHBondContact O-N 3.25Å; G251-L254 PolarHBondContact O-N 2.77Å; L254-Q258 WeakPolarHBondContact O-CB 3.38Å; L254-Q258 PolarHBondContact O-N 3.25Å
255Q83.1Confident85.2Confident62 Ų6239 Ų3929%0.2918%0.181SC..Hα-helixtrans-67.2-46.7174.1-174.2177.8-7.400111.1F180 G251 K252 K253 D257 Q258 D259F180-Q255 HydrophobicContact CB-CG 4.26Å; F180-Q255 HydrophobicContact CD1-CB 3.79Å; F180-Q255 HydrophobicContact CD1-CG 4.26Å; F180-Q255 HydrophobicContact CD2-CB 4.44Å; F180-Q255 HydrophobicContact CE1-CB 4.08Å; F180-Q255 HydrophobicContact CG-CB 4.02Å; F180-Q255 HydrophobicContact CG-CG 4.15Å; G251-Q255 VanDerWaalsContact O-CB 3.31Å; G251-Q255 WeakPolarHBondContact O-CB 3.39Å; G251-Q255 PolarHBondContact O-N 2.91Å; K252-Q255 PolarHBondContact O-N 3.41Å; K253-Q255 PolarHBondContact O-N 3.38Å; Q255-D257 VanDerWaalsContact C-N 3.3Å; Q255-D257 PolarHBondContact O-N 3.4Å; Q255-Q258 CarbonylContact O-C 3.56Å; Q255-Q258 WeakPolarHBondContact O-CA 3.44Å; Q255-Q258 WeakPolarHBondContact O-CB 3.35Å; Q255-Q258 PolarHBondContact O-N 3.1Å; Q255-D259 WeakPolarHBondContact O-CB 3.15Å; Q255-D259 VanDerWaalsContact O-CG 3.26Å; Q255-D259 PolarHBondContact O-N 3.2Å
256E82.9Confident84.7Confident66 Ų6639.3 Ų39.331%0.30818%0.184SC..Hα-helixtrans-55.5-46.1175.2-176.6-170.4-155.100111.3K252 K253 Q258 D259 E260K252-E256 WeakPolarHBondContact O-CB 3.43Å; K252-E256 PolarHBondContact O-N 2.95Å; K253-E256 VanDerWaalsContact CD-OE2 3.23Å; K253-E256 WeakPolarHBondContact CD-OE2 3.47Å; K253-E256 IonicContact NZ-OE2 2.85Å; K253-E256 PolarHBondContact NZ-OE2 3.02Å; K253-E256 PolarHBondContact O-N 3.02Å; E256-Q258 VanDerWaalsContact C-N 3.28Å; E256-Q258 PolarHBondContact O-N 3.38Å; E256-D259 PolarHBondContact O-N 3.26Å; E256-E260 PolarHBondContact O-N 2.85Å
257D84.5Confident84.4Confident36 Ų3639.9 Ų39.919%0.19319%0.186CC..Hα-helixtrans-66.8-31.4177.9-65.9-19.6000112.1K253 Q255 R261K253-D257 WeakPolarHBondContact CE-OD1 3.31Å; K253-D257 IonicContact NZ-OD1 2.69Å; K253-D257 PolarHBondContact NZ-OD1 2.99Å; K253-D257 PolarHBondContact O-N 2.86Å; Q255-D257 VanDerWaalsContact C-N 3.3Å; Q255-D257 PolarHBondContact O-N 3.4Å; D257-R261 VanDerWaalsContact C-NH1 3.35Å; D257-R261 VanDerWaalsContact O-CG 3.3Å; D257-R261 WeakPolarHBondContact O-CG 3.46Å; D257-R261 VanDerWaalsContact O-CZ 3.25Å; D257-R261 PolarHBondContact O-N 2.95Å; D257-R261 PolarHBondContact O-NH1 3.01Å
258Q80.2Confident84.1Confident59 Ų5947.9 Ų47.928%0.27622%0.216SC..Hα-helixtrans-71.6-47.1175-179.560.335.600111.1F180 L254 Q255 E256 E260 R261 D262F180-Q258 HydrophobicContact CD2-CB 4.37Å; F180-Q258 HydrophobicContact CD2-CG 4.47Å; L254-Q258 WeakPolarHBondContact O-CB 3.38Å; L254-Q258 PolarHBondContact O-N 3.25Å; Q255-Q258 CarbonylContact O-C 3.56Å; Q255-Q258 WeakPolarHBondContact O-CA 3.44Å; Q255-Q258 WeakPolarHBondContact O-CB 3.35Å; Q255-Q258 PolarHBondContact O-N 3.1Å; E256-Q258 VanDerWaalsContact C-N 3.28Å; E256-Q258 PolarHBondContact O-N 3.38Å; Q258-E260 VanDerWaalsContact C-N 3.31Å; Q258-E260 PolarHBondContact O-N 3.13Å; Q258-R261 WeakPolarHBondContact O-CB 3.35Å; Q258-R261 PolarHBondContact O-N 3.36Å; Q258-R261 VanDerWaalsContact O-N 3.1Å; Q258-D262 PolarHBondContact NE2-OD1 3.47Å; Q258-D262 PolarHBondContact NE2-OD2 3.21Å; Q258-D262 VanDerWaalsContact O-CG 3.28Å; Q258-D262 PolarHBondContact O-N 3.16Å
259D79.9Confident83.8Confident63 Ų6351.2 Ų51.234%0.33724%0.238SC..Hα-helixtrans-59.3-43176.9-68-16.8000110.1Q255 E256 R261 D262 L263Q255-D259 WeakPolarHBondContact O-CB 3.15Å; Q255-D259 VanDerWaalsContact O-CG 3.26Å; Q255-D259 PolarHBondContact O-N 3.2Å; E256-D259 PolarHBondContact O-N 3.26Å; D259-R261 PolarHBondContact O-N 3.47Å; D259-D262 PolarHBondContact O-N 3.19Å; D259-L263 WeakPolarHBondContact O-CB 3.42Å; D259-L263 VanDerWaalsContact O-CG 3.23Å; D259-L263 WeakPolarHBondContact O-CG 3.3Å; D259-L263 PolarHBondContact O-N 3.33Å
260E82.9Confident83.4Confident57 Ų5752 Ų5227%0.26624%0.242SC..Hα-helixtrans-61.7-42.3174.9-167.7-167.8147.500111.9E256 Q258 L263 R264 Y320E256-E260 PolarHBondContact O-N 2.85Å; Q258-E260 VanDerWaalsContact C-N 3.31Å; Q258-E260 PolarHBondContact O-N 3.13Å; E260-L263 PolarHBondContact O-N 2.79Å; E260-R264 WeakPolarHBondContact O-CG 3.23Å; E260-R264 PolarHBondContact O-N 3.41Å; E260-R264 IonicContact OE1-CZ 3.29Å; E260-R264 VanDerWaalsContact OE1-CZ 3.29Å; E260-R264 IonicContact OE1-NE 2.91Å; E260-R264 PolarHBondContact OE1-NE 2.98Å; E260-R264 IonicContact OE1-NH2 2.76Å; E260-R264 PolarHBondContact OE1-NH2 3.43Å; E260-Y320 HydrophobicContact CG-CE2 4.13Å
261R82.6Confident83.2Confident116 Ų11652.4 Ų52.444%0.43825%0.245SC..Hα-helixtrans-62.3-46.3175.7-77-173.9-61.2-87.37.2111.6D257 Q258 D259 L263 R264 D265D257-R261 VanDerWaalsContact C-NH1 3.35Å; D257-R261 VanDerWaalsContact O-CG 3.3Å; D257-R261 WeakPolarHBondContact O-CG 3.46Å; D257-R261 VanDerWaalsContact O-CZ 3.25Å; D257-R261 PolarHBondContact O-N 2.95Å; D257-R261 PolarHBondContact O-NH1 3.01Å; Q258-R261 WeakPolarHBondContact O-CB 3.35Å; Q258-R261 PolarHBondContact O-N 3.36Å; Q258-R261 VanDerWaalsContact O-N 3.1Å; D259-R261 PolarHBondContact O-N 3.47Å; R261-L263 VanDerWaalsContact C-N 3.3Å; R261-L263 PolarHBondContact O-N 3.38Å; R261-R264 PolarHBondContact O-N 3.35Å; R261-D265 PolarHBondContact O-N 3.28Å
262D79.4Confident82.8Confident42 Ų4259 Ų5923%0.22527%0.273CS..Hα-helixtrans-64.1-38-179.8-67.9-24.7000110.9Q258 D259 D265 A266Q258-D262 PolarHBondContact NE2-OD1 3.47Å; Q258-D262 PolarHBondContact NE2-OD2 3.21Å; Q258-D262 VanDerWaalsContact O-CG 3.28Å; Q258-D262 PolarHBondContact O-N 3.16Å; D259-D262 PolarHBondContact O-N 3.19Å; D262-D265 PolarHBondContact O-N 3.13Å; D262-A266 VanDerWaalsContact O-CB 3.31Å; D262-A266 WeakPolarHBondContact O-CB 3.42Å; D262-A266 PolarHBondContact O-N 2.96Å
263L83Confident82.7Confident11 Ų1162.3 Ų62.36%0.05829%0.292CS..Hα-helixtrans-65.5-41.7172.6-72.3178.7000112.5I170 D259 E260 R261 A266 F267 F319 Y320 M323 T324I170-L263 HydrophobicContact CD1-CD2 4.43Å; I170-L263 HydrophobicContact CG1-CD2 4.34Å; D259-L263 WeakPolarHBondContact O-CB 3.42Å; D259-L263 VanDerWaalsContact O-CG 3.23Å; D259-L263 WeakPolarHBondContact O-CG 3.3Å; D259-L263 PolarHBondContact O-N 3.33Å; E260-L263 PolarHBondContact O-N 2.79Å; R261-L263 VanDerWaalsContact C-N 3.3Å; R261-L263 PolarHBondContact O-N 3.38Å; L263-A266 PolarHBondContact O-N 2.95Å; L263-F267 WeakPolarHBondContact O-CB 3.44Å; L263-F267 PolarHBondContact O-N 3.31Å; L263-F319 HydrophobicContact CB-CE1 4.46Å; L263-F319 HydrophobicContact CD2-CE1 4.11Å; L263-Y320 HydrophobicContact CD1-CD2 4.03Å; L263-Y320 HydrophobicContact CD1-CE2 4.28Å; L263-M323 HydrophobicContact CD1-CB 3.72Å; L263-M323 HydrophobicContact CD1-CG 4.44Å; L263-M323 HydrophobicContact CD2-CB 3.71Å; L263-M323 HydrophobicContact CD2-CE 3.94Å; L263-M323 HydrophobicContact CD2-CG 3.57Å; L263-M323 HydrophobicContact CD2-SD 3.91Å; L263-M323 HydrophobicContact CG-CB 4.38Å; L263-T324 HydrophobicContact CD1-CG2 4.47Å
264R85.1Confident82.5Confident105 Ų10570.2 Ų70.240%0.39633%0.327SS..Hα-helixtrans-63.5-41.2175-76.2179.5-174.2-79.71.3112E260 R261 F267 R268 F316E260-R264 WeakPolarHBondContact O-CG 3.23Å; E260-R264 PolarHBondContact O-N 3.41Å; E260-R264 IonicContact OE1-CZ 3.29Å; E260-R264 VanDerWaalsContact OE1-CZ 3.29Å; E260-R264 IonicContact OE1-NE 2.91Å; E260-R264 PolarHBondContact OE1-NE 2.98Å; E260-R264 IonicContact OE1-NH2 2.76Å; E260-R264 PolarHBondContact OE1-NH2 3.43Å; R261-R264 PolarHBondContact O-N 3.35Å; R264-F267 PolarHBondContact O-N 3.08Å; R264-R268 VanDerWaalsContact O-CG 3.31Å; R264-R268 WeakPolarHBondContact O-CG 3.49Å; R264-R268 PolarHBondContact O-N 3.11Å; R264-F316 HydrophobicContact CB-CE2 4.2Å; R264-F316 HydrophobicContact CG-CD2 4.36Å; R264-F316 HydrophobicContact CG-CE1 4.28Å; R264-F316 HydrophobicContact CG-CE2 3.39Å; R264-F316 HydrophobicContact CG-CZ 3.34Å
265D81Confident82.4Confident79 Ų7974.9 Ų74.942%0.42234%0.342SS..Hα-helixtrans-70.7-38.8178.3-76.3-17.4000111.4R261 D262 R268 V269R261-D265 PolarHBondContact O-N 3.28Å; D262-D265 PolarHBondContact O-N 3.13Å; D265-R268 PolarHBondContact O-N 2.7Å; D265-R268 IonicContact OD1-CZ 2.96Å; D265-R268 IonicContact OD1-NH1 2.95Å; D265-R268 PolarHBondContact OD1-NH1 3.46Å; D265-V269 WeakPolarHBondContact O-CG2 3.43Å; D265-V269 PolarHBondContact O-N 3.18Å; D265-V269 VanDerWaalsContact O-N 3.14Å
266A79.2Confident82.6Confident8 Ų873.8 Ų73.87%0.06635%0.348CS..Hα-helixtrans-58.2-48.8169.900000111.1M173 D262 L263 R268 V269 L270M173-A266 HydrophobicContact CB-CB 4.18Å; M173-A266 HydrophobicContact CE-CB 4.18Å; D262-A266 VanDerWaalsContact O-CB 3.31Å; D262-A266 WeakPolarHBondContact O-CB 3.42Å; D262-A266 PolarHBondContact O-N 2.96Å; L263-A266 PolarHBondContact O-N 2.95Å; A266-R268 VanDerWaalsContact C-N 3.31Å; A266-R268 PolarHBondContact O-N 2.69Å; A266-V269 WeakPolarHBondContact O-CB 3.23Å; A266-V269 PolarHBondContact O-N 2.76Å; A266-L270 WeakPolarHBondContact O-CG 3.48Å; A266-L270 PolarHBondContact O-N 3.25Å; A266-L270 VanDerWaalsContact O-N 3.13Å
267F83.3Confident82.9Confident13 Ų1374.4 Ų74.46%0.05735%0.351CS..Hα-helixtrans-56.2-43.6177.6-172.1-87.5000112.1L263 R264 V269 L270 D271 G276 I278 F316 F319L263-F267 WeakPolarHBondContact O-CB 3.44Å; L263-F267 PolarHBondContact O-N 3.31Å; R264-F267 PolarHBondContact O-N 3.08Å; F267-V269 VanDerWaalsContact C-N 3.28Å; F267-V269 PolarHBondContact O-N 3.3Å; F267-L270 PolarHBondContact O-N 3.01Å; F267-L270 VanDerWaalsContact O-N 3.1Å; F267-D271 HydrophobicContact CD1-CB 4.48Å; F267-D271 HydrophobicContact CE1-CB 4.23Å; F267-D271 PolarHBondContact O-N 3.21Å; F267-G276 VanDerWaalsContact CZ-O 3.31Å; F267-G276 WeakPolarHBondContact CZ-O 3.45Å; F267-I278 HydrophobicContact CD2-CD1 3.29Å; F267-I278 HydrophobicContact CD2-CG1 3.96Å; F267-I278 HydrophobicContact CE2-CD1 3.36Å; F267-I278 HydrophobicContact CE2-CG1 3.61Å; F267-I278 HydrophobicContact CG-CD1 4.06Å; F267-I278 HydrophobicContact CZ-CD1 4.17Å; F267-I278 HydrophobicContact CZ-CG1 3.92Å; F267-F316 HydrophobicContact CB-CD2 4.1Å; F267-F316 HydrophobicContact CB-CE2 4.44Å; F267-F316 HydrophobicContact CD1-CD2 4.32Å; F267-F316 HydrophobicContact CD2-CB 4.5Å; F267-F316 HydrophobicContact CD2-CD2 4.04Å; F267-F316 HydrophobicContact CE1-CB 4.46Å; F267-F316 HydrophobicContact CE2-CB 4.24Å; F267-F316 AromaticContact CG-CD2 3.89Å; F267-F316 HydrophobicContact CG-CD2 3.89Å; F267-F316 HydrophobicContact CZ-CB 4.22Å; F267-F319 HydrophobicContact CB-CD1 4.27Å; F267-F319 HydrophobicContact CB-CE1 4.22Å; F267-F319 HydrophobicContact CD2-CB 3.84Å; F267-F319 AromaticContact CD2-CD1 3.81Å; F267-F319 HydrophobicContact CD2-CD1 3.81Å; F267-F319 HydrophobicContact CD2-CD2 4.4Å; F267-F319 HydrophobicContact CD2-CE1 4.42Å; F267-F319 AromaticContact CD2-CG 3.77Å; F267-F319 HydrophobicContact CD2-CG 3.77Å; F267-F319 HydrophobicContact CE2-CB 4Å; F267-F319 HydrophobicContact CE2-CG 4.38Å
268R83.8Confident83Confident174 Ų17472.7 Ų72.766%0.65734%0.342SS*.Hα-helixtrans-63.3-30.1176.7-74.8168.8175169.8-2.8114R264 D265 A266R264-R268 VanDerWaalsContact O-CG 3.31Å; R264-R268 WeakPolarHBondContact O-CG 3.49Å; R264-R268 PolarHBondContact O-N 3.11Å; D265-R268 PolarHBondContact O-N 2.7Å; D265-R268 IonicContact OD1-CZ 2.96Å; D265-R268 IonicContact OD1-NH1 2.95Å; D265-R268 PolarHBondContact OD1-NH1 3.46Å; A266-R268 VanDerWaalsContact C-N 3.31Å; A266-R268 PolarHBondContact O-N 2.69Å
269V80.9Confident83.4Confident112 Ų11272.4 Ų72.468%0.67934%0.342SS*.Hα-helixtrans-73.6-33.4175.4172.90000110.6D265 A266 F267D265-V269 WeakPolarHBondContact O-CG2 3.43Å; D265-V269 PolarHBondContact O-N 3.18Å; D265-V269 VanDerWaalsContact O-N 3.14Å; A266-V269 WeakPolarHBondContact O-CB 3.23Å; A266-V269 PolarHBondContact O-N 2.76Å; F267-V269 VanDerWaalsContact C-N 3.28Å; F267-V269 PolarHBondContact O-N 3.3Å
270L79.7Confident83.7Confident16 Ų1670.2 Ų70.28%0.08433%0.331CS..Hα-helixtrans-79.6-38.3179.8-59.7-166.7000113.1M173 A266 F267 K272 I278 I286 F319M173-L270 HydrophobicContact CE-CD1 3.9Å; M173-L270 HydrophobicContact SD-CD1 3.68Å; M173-L270 HydrophobicContact SD-CD2 3.71Å; M173-L270 HydrophobicContact SD-CG 4Å; A266-L270 WeakPolarHBondContact O-CG 3.48Å; A266-L270 PolarHBondContact O-N 3.25Å; A266-L270 VanDerWaalsContact O-N 3.13Å; F267-L270 PolarHBondContact O-N 3.01Å; F267-L270 VanDerWaalsContact O-N 3.1Å; L270-K272 PolarHBondContact O-N 3.43Å; L270-I278 HydrophobicContact CB-CD1 3.61Å; L270-I278 HydrophobicContact CB-CG1 3.83Å; L270-I278 HydrophobicContact CB-CG2 4.23Å; L270-I278 HydrophobicContact CD1-CD1 3.75Å; L270-I278 HydrophobicContact CG-CD1 4.27Å; L270-I286 HydrophobicContact CD1-CD1 3.71Å; L270-I286 HydrophobicContact CD2-CD1 3.25Å; L270-I286 HydrophobicContact CD2-CG1 4.22Å; L270-I286 HydrophobicContact CG-CD1 3.95Å; L270-F319 HydrophobicContact CD1-CE2 4.09Å; L270-F319 HydrophobicContact CD1-CZ 4.43Å
271D85.4Confident83.8Confident13 Ų1372.7 Ų72.77%0.0734%0.342CS..  trans-74.574.2175.1-178.110.4000110.9F267 N273 K274 R275 G276 I278F267-D271 HydrophobicContact CD1-CB 4.48Å; F267-D271 HydrophobicContact CE1-CB 4.23Å; F267-D271 PolarHBondContact O-N 3.21Å; D271-N273 PolarHBondContact O-N 2.88Å; D271-N273 VanDerWaalsContact O-N 3.11Å; D271-N273 PolarHBondContact OD1-N 3.37Å; D271-K274 VanDerWaalsContact CG-CA 3.46Å; D271-K274 PolarHBondContact O-N 3.06Å; D271-K274 VanDerWaalsContact O-N 3.09Å; D271-K274 WeakPolarHBondContact OD1-CA 3.49Å; D271-K274 PolarHBondContact OD1-N 2.84Å; D271-K274 WeakPolarHBondContact OD2-CA 3.39Å; D271-R275 PolarHBondContact OD1-N 3.47Å; D271-R275 PolarHBondContact OD2-N 3.09Å; D271-G276 WeakPolarHBondContact OD2-CA 3.44Å; D271-G276 PolarHBondContact OD2-N 3.28Å; D271-I278 HydrophobicContact CB-CG1 4.48Å
272K80.3Confident83.8Confident139 Ų13968.8 Ų68.860%0.60433%0.33SS*.THydrogen-bonded Turntrans-54.4-30.9178.1-67170.5-173.2161.80112.2L270 D282L270-K272 PolarHBondContact O-N 3.43Å; K272-D282 IonicContact NZ-OD1 3.2Å; K272-D282 PolarHBondContact NZ-OD1 3.33Å; K272-D282 IonicContact NZ-OD2 3.76Å
273N84.5Confident83.9Confident94 Ų9466.8 Ų66.850%0.50332%0.32SS..THydrogen-bonded Turntrans-94.4-6.5-174.5-62-49.5000113.1D271 R275D271-N273 PolarHBondContact O-N 2.88Å; D271-N273 VanDerWaalsContact O-N 3.11Å; D271-N273 PolarHBondContact OD1-N 3.37Å; N273-R275 HydrophobicContact CB-CG 3.94Å; N273-R275 VanDerWaalsContact CG-NH1 3.35Å; N273-R275 PolarHBondContact ND2-NH1 3.4Å; N273-R275 PolarHBondContact ND2-NH2 2.98Å; N273-R275 PolarHBondContact O-N 3.5Å
274K84.2Confident83.9Confident184 Ų18468.5 Ų68.580%0.833%0.325SS*.  trans53.737.6-176.8-57.8-178.1-179179.90112.9D271D271-K274 VanDerWaalsContact CG-CA 3.46Å; D271-K274 PolarHBondContact O-N 3.06Å; D271-K274 VanDerWaalsContact O-N 3.09Å; D271-K274 WeakPolarHBondContact OD1-CA 3.49Å; D271-K274 PolarHBondContact OD1-N 2.84Å; D271-K274 WeakPolarHBondContact OD2-CA 3.39Å
275R84.5Confident83.7Confident123 Ų12372.8 Ų72.846%0.46434%0.342SS..SBendtrans-83-15.4178.8-68.9-168.3-63.2-107.40.1113.1D271 N273D271-R275 PolarHBondContact OD1-N 3.47Å; D271-R275 PolarHBondContact OD2-N 3.09Å; N273-R275 HydrophobicContact CB-CG 3.94Å; N273-R275 VanDerWaalsContact CG-NH1 3.35Å; N273-R275 PolarHBondContact ND2-NH1 3.4Å; N273-R275 PolarHBondContact ND2-NH2 2.98Å; N273-R275 PolarHBondContact O-N 3.5Å
276G86.8Confident83.6Confident39 Ų3970.6 Ų70.640%0.40233%0.329SS..SBendtrans88.310.6-167.700000113.1F267 D271F267-G276 VanDerWaalsContact CZ-O 3.31Å; F267-G276 WeakPolarHBondContact CZ-O 3.45Å; D271-G276 WeakPolarHBondContact OD2-CA 3.44Å; D271-G276 PolarHBondContact OD2-N 3.28Å
277E89.9Confident83.3Confident79 Ų7970.3 Ų70.337%0.36933%0.327SS..EExtended strand (participates in β ladder)trans-145.4138.1-171.5-75.6168.6-161.300109.6F313 V314E277-F313 HydrophobicContact CB-CB 4.11Å; E277-F313 HydrophobicContact CG-CB 4.35Å; E277-V314 WeakPolarHBondContact CA-O 3.43Å
278I86.5Confident83.1Confident1 Ų173.7 Ų73.71%0.00534%0.342CS..EExtended strand (participates in β ladder)trans-97.4132.9175.5-61165.5000108.7F267 L270 D271 V280 D282 L283 F313 V314 F319F267-I278 HydrophobicContact CD2-CD1 3.29Å; F267-I278 HydrophobicContact CD2-CG1 3.96Å; F267-I278 HydrophobicContact CE2-CD1 3.36Å; F267-I278 HydrophobicContact CE2-CG1 3.61Å; F267-I278 HydrophobicContact CG-CD1 4.06Å; F267-I278 HydrophobicContact CZ-CD1 4.17Å; F267-I278 HydrophobicContact CZ-CG1 3.92Å; L270-I278 HydrophobicContact CB-CD1 3.61Å; L270-I278 HydrophobicContact CB-CG1 3.83Å; L270-I278 HydrophobicContact CB-CG2 4.23Å; L270-I278 HydrophobicContact CD1-CD1 3.75Å; L270-I278 HydrophobicContact CG-CD1 4.27Å; D271-I278 HydrophobicContact CB-CG1 4.48Å; I278-V280 PolarHBondContact O-N 2.82Å; I278-D282 HydrophobicContact CG2-CB 4.31Å; I278-L283 HydrophobicContact CG2-CB 4.33Å; I278-F313 CarbonylContact O-C 3.56Å; I278-F313 WeakPolarHBondContact O-CA 3.48Å; I278-V314 HydrophobicContact CB-CB 4.46Å; I278-V314 PolarHBondContact N-O 3.43Å; I278-V314 PolarHBondContact O-N 3.48Å; I278-F319 HydrophobicContact CD1-CD2 4.05Å; I278-F319 HydrophobicContact CD1-CE2 4.3Å
279D87.8Confident82.4Confident53 Ų5367.7 Ų67.728%0.28333%0.333SS..EExtended strand (participates in β ladder)trans-66.7132.5173.1-166.5-34.4000109.9E281 D282 L283D279-E281 PolarHBondContact O-N 3.38Å; D279-E281 VanDerWaalsContact O-N 3.15Å; D279-E281 PolarHBondContact OD1-N 3.44Å; D279-D282 HydrophobicContact CB-CB 4.21Å; D279-D282 WeakPolarHBondContact O-CA 3.09Å; D279-D282 WeakPolarHBondContact O-CB 3.13Å; D279-D282 PolarHBondContact O-N 2.99Å; D279-L283 PolarHBondContact O-N 2.97Å
280V86.3Confident81.7Confident16 Ų1663.4 Ų63.410%0.09731%0.307CS..Hα-helixtrans-53.7-34176.1160.80000111.9I278 L283 R284 I303 G312 V314I278-V280 PolarHBondContact O-N 2.82Å; V280-L283 PolarHBondContact O-N 3.11Å; V280-R284 WeakPolarHBondContact O-CB 3.46Å; V280-R284 PolarHBondContact O-N 2.92Å; V280-I303 HydrophobicContact CB-CG2 4.32Å; V280-I303 HydrophobicContact CG1-CB 4.42Å; V280-I303 HydrophobicContact CG1-CD1 3.95Å; V280-I303 HydrophobicContact CG1-CG1 4.27Å; V280-I303 HydrophobicContact CG1-CG2 3.33Å; V280-I303 HydrophobicContact CG2-CG2 4Å; V280-G312 WeakPolarHBondContact CB-O 3.44Å; V280-G312 VanDerWaalsContact CG2-C 3.42Å; V280-G312 WeakPolarHBondContact CG2-O 2.93Å; V280-G312 PolarHBondContact N-O 3.21Å; V280-V314 HydrophobicContact CG2-CG2 4.24Å
281E85Confident80.8Confident110 Ų11063.5 Ų63.551%0.51431%0.311SS..Hα-helixtrans-70.2-33.9176.6-69.7-60.6125.100112.7D279 R284 W285D279-E281 PolarHBondContact O-N 3.38Å; D279-E281 VanDerWaalsContact O-N 3.15Å; D279-E281 PolarHBondContact OD1-N 3.44Å; E281-R284 IonicContact OE1-NE 2.62Å; E281-R284 PolarHBondContact OE1-NE 3.47Å; E281-R284 IonicContact OE2-NE 2.67Å; E281-W285 WeakPolarHBondContact O-CB 3.48Å; E281-W285 PolarHBondContact O-N 2.95Å
282D82.8Confident79.6Confident33 Ų3370.8 Ų70.818%0.17635%0.351CS..Hα-helixtrans-67.6-43.5172.6-82.8-35.8000110.4K272 I278 D279 W285 I286K272-D282 IonicContact NZ-OD1 3.2Å; K272-D282 PolarHBondContact NZ-OD1 3.33Å; K272-D282 IonicContact NZ-OD2 3.76Å; I278-D282 HydrophobicContact CG2-CB 4.31Å; D279-D282 HydrophobicContact CB-CB 4.21Å; D279-D282 WeakPolarHBondContact O-CA 3.09Å; D279-D282 WeakPolarHBondContact O-CB 3.13Å; D279-D282 PolarHBondContact O-N 2.99Å; D282-W285 WeakPolarHBondContact O-CB 3.37Å; D282-W285 PolarHBondContact O-N 3.13Å; D282-I286 WeakPolarHBondContact O-CD1 3.33Å; D282-I286 VanDerWaalsContact O-CG1 3.26Å; D282-I286 WeakPolarHBondContact O-CG1 3.11Å; D282-I286 PolarHBondContact O-N 2.95Å; D282-I286 VanDerWaalsContact O-N 3.11Å
283L82.3Confident79Confident1 Ų171.3 Ų71.31%0.00536%0.36CS..Hα-helixtrans-60.5-46.1174.7-175.860.9000111.3I278 D279 V280 W285 I286 L287 V314I278-L283 HydrophobicContact CG2-CB 4.33Å; D279-L283 PolarHBondContact O-N 2.97Å; V280-L283 PolarHBondContact O-N 3.11Å; L283-W285 VanDerWaalsContact C-N 3.33Å; L283-W285 PolarHBondContact O-N 3.36Å; L283-I286 PolarHBondContact O-N 3.48Å; L283-L287 HydrophobicContact CD1-CG 4.44Å; L283-L287 HydrophobicContact CG-CD1 4.08Å; L283-L287 HydrophobicContact CG-CG 4.43Å; L283-L287 VanDerWaalsContact O-CG 3.31Å; L283-L287 WeakPolarHBondContact O-CG 3.41Å; L283-L287 PolarHBondContact O-N 2.77Å; L283-V314 HydrophobicContact CD2-CG2 3.95Å
284R83.2Confident78.4Confident47 Ų4768.3 Ų68.318%0.17734%0.344CS..Hα-helixtrans-54.9-47.2174.4179.6-170.3-71.6-77.32111.4V280 E281 I286 L287 K288 I299 D300 I303V280-R284 WeakPolarHBondContact O-CB 3.46Å; V280-R284 PolarHBondContact O-N 2.92Å; E281-R284 IonicContact OE1-NE 2.62Å; E281-R284 PolarHBondContact OE1-NE 3.47Å; E281-R284 IonicContact OE2-NE 2.67Å; R284-I286 VanDerWaalsContact C-N 3.3Å; R284-I286 PolarHBondContact O-N 3.35Å; R284-L287 PolarHBondContact O-N 3.3Å; R284-K288 HydrophobicContact CG-CD 4.46Å; R284-K288 WeakPolarHBondContact O-CG 3.37Å; R284-K288 PolarHBondContact O-N 3.44Å; R284-I299 HydrophobicContact CB-CG2 4.39Å; R284-I299 HydrophobicContact CG-CG2 3.96Å; R284-D300 IonicContact CZ-OD1 3.79Å; R284-D300 IonicContact NH1-OD1 3.77Å; R284-D300 PolarHBondContact NH1-OD1 2.74Å; R284-D300 IonicContact NH2-OD1 2.68Å; R284-D300 PolarHBondContact NH2-OD1 2.73Å; R284-I303 HydrophobicContact CB-CD1 3.89Å; R284-I303 HydrophobicContact CG-CD1 4.4Å
285W81.2Confident78.3Confident195 Ų19562.7 Ų62.774%0.73933%0.325SS*.Hα-helixtrans-59.7-42.1179.5176.7-100.2000112E281 D282 L283 G289E281-W285 WeakPolarHBondContact O-CB 3.48Å; E281-W285 PolarHBondContact O-N 2.95Å; D282-W285 WeakPolarHBondContact O-CB 3.37Å; D282-W285 PolarHBondContact O-N 3.13Å; L283-W285 VanDerWaalsContact C-N 3.33Å; L283-W285 PolarHBondContact O-N 3.36Å; W285-G289 PolarHBondContact O-N 3.32Å
286I77Confident78.3Confident32 Ų3262.3 Ų62.316%0.16433%0.328CS..Hα-helixtrans-66.9-45.5178-64.6151.9000110.6L169 M173 L270 D282 L283 R284 K288 G289 L290L169-I286 HydrophobicContact CD1-CG2 3.59Å; M173-I286 HydrophobicContact SD-CG2 3.91Å; L270-I286 HydrophobicContact CD1-CD1 3.71Å; L270-I286 HydrophobicContact CD2-CD1 3.25Å; L270-I286 HydrophobicContact CD2-CG1 4.22Å; L270-I286 HydrophobicContact CG-CD1 3.95Å; D282-I286 WeakPolarHBondContact O-CD1 3.33Å; D282-I286 VanDerWaalsContact O-CG1 3.26Å; D282-I286 WeakPolarHBondContact O-CG1 3.11Å; D282-I286 PolarHBondContact O-N 2.95Å; D282-I286 VanDerWaalsContact O-N 3.11Å; L283-I286 PolarHBondContact O-N 3.48Å; R284-I286 VanDerWaalsContact C-N 3.3Å; R284-I286 PolarHBondContact O-N 3.35Å; I286-K288 VanDerWaalsContact C-N 3.34Å; I286-K288 PolarHBondContact O-N 3.28Å; I286-G289 PolarHBondContact O-N 2.97Å; I286-L290 HydrophobicContact CG2-CD1 3.46Å; I286-L290 VanDerWaalsContact CG2-CD1 3.46Å; I286-L290 HydrophobicContact CG2-CG 4.3Å; I286-L290 WeakPolarHBondContact O-CB 3.38Å; I286-L290 VanDerWaalsContact O-CD1 3.26Å; I286-L290 WeakPolarHBondContact O-CD1 3.33Å; I286-L290 WeakPolarHBondContact O-CG 3.42Å; I286-L290 PolarHBondContact O-N 2.97Å
287L74.9Confident78.2Confident3 Ų366.6 Ų66.62%0.01634%0.338CS..Hα-helixtrans-59.3-43.6177.4-70.4173.8000111.7L283 R284 G289 L290 G291 I299 M302 I303L283-L287 HydrophobicContact CD1-CG 4.44Å; L283-L287 HydrophobicContact CG-CD1 4.08Å; L283-L287 HydrophobicContact CG-CG 4.43Å; L283-L287 VanDerWaalsContact O-CG 3.31Å; L283-L287 WeakPolarHBondContact O-CG 3.41Å; L283-L287 PolarHBondContact O-N 2.77Å; R284-L287 PolarHBondContact O-N 3.3Å; L287-G289 VanDerWaalsContact C-N 3.31Å; L287-G289 PolarHBondContact O-N 3.39Å; L287-L290 PolarHBondContact O-N 3.44Å; L287-G291 PolarHBondContact O-N 2.92Å; L287-I299 HydrophobicContact CB-CD1 4.28Å; L287-I299 HydrophobicContact CB-CG1 4.26Å; L287-I299 HydrophobicContact CB-CG2 4.2Å; L287-I299 HydrophobicContact CD1-CG2 3.93Å; L287-M302 HydrophobicContact CD1-CE 4.02Å; L287-M302 HydrophobicContact CD2-CE 3.6Å; L287-M302 HydrophobicContact CG-CE 4.47Å; L287-I303 HydrophobicContact CD1-CG1 4.45Å
288K77.6Confident77.7Confident84 Ų8465.6 Ų65.637%0.36533%0.333SS..Hα-helixtrans-61.5-35.9173.2-75.4-172.9170.7-172.80112.8R284 I286 L290 E296 I299R284-K288 HydrophobicContact CG-CD 4.46Å; R284-K288 WeakPolarHBondContact O-CG 3.37Å; R284-K288 PolarHBondContact O-N 3.44Å; I286-K288 VanDerWaalsContact C-N 3.34Å; I286-K288 PolarHBondContact O-N 3.28Å; K288-L290 VanDerWaalsContact C-N 3.31Å; K288-E296 IonicContact NZ-OE1 3.75Å; K288-E296 PolarHBondContact NZ-OE1 3.48Å; K288-I299 HydrophobicContact CB-CD1 4.42Å; K288-I299 HydrophobicContact CG-CD1 3.47Å; K288-I299 VanDerWaalsContact CG-CD1 3.47Å
289G70.2Confident77.5Confident47 Ų4765.6 Ų65.649%0.48533%0.333SS..Hα-helixtrans-76.7-14.6177.800000114.7R172 W285 I286 L287R172-G289 PolarHBondContact NH1-O 3.41Å; W285-G289 PolarHBondContact O-N 3.32Å; I286-G289 PolarHBondContact O-N 2.97Å; L287-G289 VanDerWaalsContact C-N 3.31Å; L287-G289 PolarHBondContact O-N 3.39Å
290L65.2Low77.4Confident22 Ų2266.4 Ų66.412%0.11534%0.337CS..Hα-helixtrans-96.7-37.4-173.7-75.6163.6000114L169 R172 I286 L287 K288L169-L290 HydrophobicContact CB-CD1 3.9Å; L169-L290 HydrophobicContact CD1-CD1 3.07Å; L169-L290 HydrophobicContact CD1-CG 4.49Å; L169-L290 HydrophobicContact CG-CD1 4.04Å; R172-L290 HydrophobicContact CB-CD2 3.37Å; R172-L290 HydrophobicContact CG-CD2 3.89Å; R172-L290 PolarHBondContact NH1-O 2.89Å; I286-L290 HydrophobicContact CG2-CD1 3.46Å; I286-L290 VanDerWaalsContact CG2-CD1 3.46Å; I286-L290 HydrophobicContact CG2-CG 4.3Å; I286-L290 WeakPolarHBondContact O-CB 3.38Å; I286-L290 VanDerWaalsContact O-CD1 3.26Å; I286-L290 WeakPolarHBondContact O-CD1 3.33Å; I286-L290 WeakPolarHBondContact O-CG 3.42Å; I286-L290 PolarHBondContact O-N 2.97Å; L287-L290 PolarHBondContact O-N 3.44Å; K288-L290 VanDerWaalsContact C-N 3.31Å
291G61.5Low77.2Confident18 Ų1868.2 Ų68.219%0.18635%0.347CS..  trans-119.3111.1-179.900000110.8L287 D293 L294L287-G291 PolarHBondContact O-N 2.92Å; G291-D293 PolarHBondContact O-N 3.01Å; G291-L294 PolarHBondContact O-N 3.16Å
292D60.2Low76.9Confident167 Ų16763.8 Ų63.889%0.89333%0.326SS*.THydrogen-bonded Turntrans-63.6-15.1164-69.7-27.8000111.3
293D67.4Low76.9Confident149 Ų14962.9 Ų62.980%0.79732%0.321SS*.THydrogen-bonded Turntrans-103.2-3.7-174.3-62.5-40.7000114.3G291G291-D293 PolarHBondContact O-N 3.01Å
294L71.7Confident77Confident32 Ų3270.1 Ų70.117%0.16835%0.349CS..  trans-88.5122.7178.3-66.9178.4000110.6L161 G291 I299 M302L161-L294 HydrophobicContact CD2-CD2 4.43Å; G291-L294 PolarHBondContact O-N 3.16Å; L294-I299 HydrophobicContact CB-CD1 4.23Å; L294-I299 HydrophobicContact CB-CG1 4.03Å; L294-I299 HydrophobicContact CD1-CG1 4.45Å; L294-M302 HydrophobicContact CD1-SD 4.34Å
295T82.1Confident77Confident65 Ų6570.9 Ų70.940%0.39936%0.356SS..  trans-71.8158.2172.157.70000111.3E297 E298 I299T295-E297 WeakPolarHBondContact CB-OE2 3.41Å; T295-E297 PolarHBondContact O-N 2.87Å; T295-E298 PolarHBondContact N-OE2 3.42Å; T295-E298 PolarHBondContact O-N 2.98Å; T295-E298 WeakPolarHBondContact OG1-CB 3.43Å; T295-E298 WeakPolarHBondContact OG1-CG 3.3Å; T295-E298 PolarHBondContact OG1-N 2.89Å; T295-E298 PolarHBondContact OG1-OE2 3.46Å; T295-I299 WeakPolarHBondContact O-CG1 3.28Å; T295-I299 PolarHBondContact O-N 3.15Å; T295-I299 VanDerWaalsContact O-N 3.1Å
296E84Confident77Confident115 Ų11561.9 Ų61.954%0.53732%0.322SS..Hα-helixtrans-61.5-35.9177.5-64.8-166.4149.300111.2K288 I299 D300K288-E296 IonicContact NZ-OE1 3.75Å; K288-E296 PolarHBondContact NZ-OE1 3.48Å; E296-I299 PolarHBondContact O-N 3.42Å; E296-D300 VanDerWaalsContact O-CG 3.3Å; E296-D300 PolarHBondContact O-N 3Å
297E84.3Confident77.5Confident129 Ų12961.4 Ų61.460%0.60332%0.32SS*.Hα-helixtrans-64.1-40.3176-60.987.917200112.3T295 I299 D300 D301T295-E297 WeakPolarHBondContact CB-OE2 3.41Å; T295-E297 PolarHBondContact O-N 2.87Å; E297-I299 VanDerWaalsContact C-N 3.34Å; E297-D300 PolarHBondContact O-N 3.1Å; E297-D301 WeakPolarHBondContact O-CB 3.38Å; E297-D301 PolarHBondContact O-N 3.33Å
298E81Confident77.8Confident59 Ų5966 Ų6628%0.27635%0.349SS..Hα-helixtrans-67-36.7176.2-75.8165.8143.500111.9T295 D301 M302T295-E298 PolarHBondContact N-OE2 3.42Å; T295-E298 PolarHBondContact O-N 2.98Å; T295-E298 WeakPolarHBondContact OG1-CB 3.43Å; T295-E298 WeakPolarHBondContact OG1-CG 3.3Å; T295-E298 PolarHBondContact OG1-N 2.89Å; T295-E298 PolarHBondContact OG1-OE2 3.46Å; E298-D301 PolarHBondContact O-N 3.07Å; E298-M302 WeakPolarHBondContact O-CB 3.27Å; E298-M302 VanDerWaalsContact O-CG 3.23Å; E298-M302 WeakPolarHBondContact O-CG 3.37Å; E298-M302 PolarHBondContact O-N 3.1Å
299I81.8Confident78.3Confident1 Ų167.1 Ų67.11%0.00536%0.359CS..Hα-helixtrans-66.4-42175.3-65.5172.6000110.4R284 L287 K288 L294 T295 E296 E297 M302 I303R284-I299 HydrophobicContact CB-CG2 4.39Å; R284-I299 HydrophobicContact CG-CG2 3.96Å; L287-I299 HydrophobicContact CB-CD1 4.28Å; L287-I299 HydrophobicContact CB-CG1 4.26Å; L287-I299 HydrophobicContact CB-CG2 4.2Å; L287-I299 HydrophobicContact CD1-CG2 3.93Å; K288-I299 HydrophobicContact CB-CD1 4.42Å; K288-I299 HydrophobicContact CG-CD1 3.47Å; K288-I299 VanDerWaalsContact CG-CD1 3.47Å; L294-I299 HydrophobicContact CB-CD1 4.23Å; L294-I299 HydrophobicContact CB-CG1 4.03Å; L294-I299 HydrophobicContact CD1-CG1 4.45Å; T295-I299 WeakPolarHBondContact O-CG1 3.28Å; T295-I299 PolarHBondContact O-N 3.15Å; T295-I299 VanDerWaalsContact O-N 3.1Å; E296-I299 PolarHBondContact O-N 3.42Å; E297-I299 VanDerWaalsContact C-N 3.34Å; I299-M302 PolarHBondContact O-N 2.84Å; I299-I303 HydrophobicContact CG2-CD1 3.68Å; I299-I303 HydrophobicContact CG2-CG1 4.39Å; I299-I303 WeakPolarHBondContact O-CB 3.43Å; I299-I303 WeakPolarHBondContact O-CD1 3.5Å; I299-I303 VanDerWaalsContact O-CG1 3.26Å; I299-I303 WeakPolarHBondContact O-CG1 3.45Å; I299-I303 PolarHBondContact O-N 3.47Å
300D84.9Confident79Confident69 Ų6967.7 Ų67.737%0.36936%0.364SS..Hα-helixtrans-61.9-44.6176-72.7-6.8000111.9R284 E296 E297 M302 I303 R304R284-D300 IonicContact CZ-OD1 3.79Å; R284-D300 IonicContact NH1-OD1 3.77Å; R284-D300 PolarHBondContact NH1-OD1 2.74Å; R284-D300 IonicContact NH2-OD1 2.68Å; R284-D300 PolarHBondContact NH2-OD1 2.73Å; E296-D300 VanDerWaalsContact O-CG 3.3Å; E296-D300 PolarHBondContact O-N 3Å; E297-D300 PolarHBondContact O-N 3.1Å; D300-M302 VanDerWaalsContact C-N 3.32Å; D300-M302 PolarHBondContact O-N 3.44Å; D300-I303 PolarHBondContact O-N 3.19Å; D300-R304 WeakPolarHBondContact O-CB 3.48Å; D300-R304 PolarHBondContact O-N 2.92Å
301D83.7Confident80.2Confident55 Ų5569.2 Ų69.229%0.29438%0.377SS..Hα-helixtrans-62.3-41.2176.3-78.4-15.5000111.2E297 E298 R304 D305E297-D301 WeakPolarHBondContact O-CB 3.38Å; E297-D301 PolarHBondContact O-N 3.33Å; E298-D301 PolarHBondContact O-N 3.07Å; D301-R304 PolarHBondContact O-N 2.89Å; D301-R304 IonicContact OD1-CZ 3.06Å; D301-R304 IonicContact OD1-NH1 3.88Å; D301-R304 PolarHBondContact OD1-NH1 3.11Å; D301-R304 IonicContact OD1-NH2 2.66Å; D301-R304 PolarHBondContact OD1-NH2 3.36Å; D301-D305 WeakPolarHBondContact O-CB 3.38Å; D301-D305 PolarHBondContact O-N 3.01Å
302M78Confident81.4Confident17 Ų1769.7 Ų69.78%0.08438%0.382CS..Hα-helixtrans-65.3-42.8176.2-76.8177.85200113W165 L287 L294 E298 I299 D300 R304 D305 T306W165-M302 HydrophobicContact CB-CE 4.43Å; W165-M302 VanDerWaalsContact CD1-SD 3.54Å; W165-M302 HydrophobicContact CD2-CE 3.51Å; W165-M302 HydrophobicContact CE3-CE 4.14Å; W165-M302 HydrophobicContact CG-CE 3.59Å; W165-M302 HydrophobicContact CG-SD 4.25Å; W165-M302 HydrophobicContact CZ2-CE 4.36Å; L287-M302 HydrophobicContact CD1-CE 4.02Å; L287-M302 HydrophobicContact CD2-CE 3.6Å; L287-M302 HydrophobicContact CG-CE 4.47Å; L294-M302 HydrophobicContact CD1-SD 4.34Å; E298-M302 WeakPolarHBondContact O-CB 3.27Å; E298-M302 VanDerWaalsContact O-CG 3.23Å; E298-M302 WeakPolarHBondContact O-CG 3.37Å; E298-M302 PolarHBondContact O-N 3.1Å; I299-M302 PolarHBondContact O-N 2.84Å; D300-M302 VanDerWaalsContact C-N 3.32Å; D300-M302 PolarHBondContact O-N 3.44Å; M302-R304 VanDerWaalsContact C-N 3.35Å; M302-D305 PolarHBondContact O-N 3.15Å; M302-T306 WeakPolarHBondContact O-CB 3.29Å; M302-T306 PolarHBondContact O-N 2.92Å; M302-T306 PolarHBondContact O-OG1 2.92Å
303I83.2Confident82.8Confident14 Ų1465 Ų657%0.07235%0.354CS..Hα-helixtrans-61.1-48.2176.6-75.1164.2000109.4V280 R284 L287 I299 D300 D305 T306 D307V280-I303 HydrophobicContact CB-CG2 4.32Å; V280-I303 HydrophobicContact CG1-CB 4.42Å; V280-I303 HydrophobicContact CG1-CD1 3.95Å; V280-I303 HydrophobicContact CG1-CG1 4.27Å; V280-I303 HydrophobicContact CG1-CG2 3.33Å; V280-I303 HydrophobicContact CG2-CG2 4Å; R284-I303 HydrophobicContact CB-CD1 3.89Å; R284-I303 HydrophobicContact CG-CD1 4.4Å; L287-I303 HydrophobicContact CD1-CG1 4.45Å; I299-I303 HydrophobicContact CG2-CD1 3.68Å; I299-I303 HydrophobicContact CG2-CG1 4.39Å; I299-I303 WeakPolarHBondContact O-CB 3.43Å; I299-I303 WeakPolarHBondContact O-CD1 3.5Å; I299-I303 VanDerWaalsContact O-CG1 3.26Å; I299-I303 WeakPolarHBondContact O-CG1 3.45Å; I299-I303 PolarHBondContact O-N 3.47Å; D300-I303 PolarHBondContact O-N 3.19Å; I303-D305 VanDerWaalsContact C-N 3.26Å; I303-D305 PolarHBondContact O-N 3.48Å; I303-T306 WeakPolarHBondContact O-CB 3.33Å; I303-T306 PolarHBondContact O-N 3.34Å; I303-D307 WeakPolarHBondContact O-CB 3.43Å; I303-D307 PolarHBondContact O-N 2.84Å
304R84.7Confident83.7Confident153 Ų15358 Ų5858%0.57732%0.316SS*.Hα-helixtrans-62.2-33179-172.5-179.667.3-131.7-6.6112.9D300 D301 M302 T306D300-R304 WeakPolarHBondContact O-CB 3.48Å; D300-R304 PolarHBondContact O-N 2.92Å; D301-R304 PolarHBondContact O-N 2.89Å; D301-R304 IonicContact OD1-CZ 3.06Å; D301-R304 IonicContact OD1-NH1 3.88Å; D301-R304 PolarHBondContact OD1-NH1 3.11Å; D301-R304 IonicContact OD1-NH2 2.66Å; D301-R304 PolarHBondContact OD1-NH2 3.36Å; M302-R304 VanDerWaalsContact C-N 3.35Å; R304-T306 VanDerWaalsContact C-N 3.32Å
305D81.4Confident84.6Confident62 Ų6259 Ų5933%0.33232%0.322SS..Hα-helixtrans-75.4-22.6175.5-72.8-10.3000112.7R162 D301 M302 I303R162-D305 IonicContact CZ-OD2 2.89Å; R162-D305 IonicContact NH2-OD2 3.8Å; R162-D305 PolarHBondContact NH2-OD2 3.4Å; D301-D305 WeakPolarHBondContact O-CB 3.38Å; D301-D305 PolarHBondContact O-N 3.01Å; M302-D305 PolarHBondContact O-N 3.15Å; I303-D305 VanDerWaalsContact C-N 3.26Å; I303-D305 PolarHBondContact O-N 3.48Å
306T82.5Confident84.9Confident6 Ų657.4 Ų57.44%0.03731%0.309CS..Hα-helixtrans-87.6-50.5-179.3-54.30000111.7M302 I303 R304 T308 V314 E318 L322M302-T306 WeakPolarHBondContact O-CB 3.29Å; M302-T306 PolarHBondContact O-N 2.92Å; M302-T306 PolarHBondContact O-OG1 2.92Å; I303-T306 WeakPolarHBondContact O-CB 3.33Å; I303-T306 PolarHBondContact O-N 3.34Å; R304-T306 VanDerWaalsContact C-N 3.32Å; T306-T308 VanDerWaalsContact C-N 3.27Å; T306-T308 PolarHBondContact O-N 3.05Å; T306-V314 HydrophobicContact CG2-CB 4.41Å; T306-V314 HydrophobicContact CG2-CG1 3.61Å; T306-V314 HydrophobicContact CG2-CG2 3.85Å; T306-E318 HydrophobicContact CG2-CB 4.44Å; T306-L322 HydrophobicContact CG2-CB 4.03Å; T306-L322 HydrophobicContact CG2-CD2 3.71Å; T306-L322 HydrophobicContact CG2-CG 4.25Å; T306-L322 VanDerWaalsContact OG1-CD1 3.28Å; T306-L322 WeakPolarHBondContact OG1-CD1 3.38Å; T306-L322 WeakPolarHBondContact OG1-CD2 3.43Å
307D86.5Confident85.1Confident22 Ų2256.8 Ų56.812%0.11831%0.31CS..  trans-78.577.8178.4179.410.3000108.4I303 D309 G310 S311 G312I303-D307 WeakPolarHBondContact O-CB 3.43Å; I303-D307 PolarHBondContact O-N 2.84Å; D307-D309 VanDerWaalsContact C-N 3.28Å; D307-D309 PolarHBondContact O-N 3.48Å; D307-G310 PolarHBondContact O-N 3.41Å; D307-G310 WeakPolarHBondContact OD1-CA 3.37Å; D307-G310 PolarHBondContact OD1-N 3.16Å; D307-S311 PolarHBondContact OD1-N 3.16Å; D307-S311 PolarHBondContact OD2-N 3.34Å; D307-G312 WeakPolarHBondContact OD2-CA 3.22Å; D307-G312 PolarHBondContact OD2-N 3.06Å
308T82.5Confident85.2Confident101 Ų10151 Ų5162%0.6228%0.283SS*.SBendtrans-74.5-23.5-173.155.50000112.4T306 E318T306-T308 VanDerWaalsContact C-N 3.27Å; T306-T308 PolarHBondContact O-N 3.05Å; T308-E318 PolarHBondContact N-OE1 3.45Å; T308-E318 PolarHBondContact OG1-OE1 3.46Å
309D87.4Confident85.3Confident107 Ų10748.2 Ų48.257%0.57227%0.269SS*.SBendtrans-90.9-12.6175.875.2-2.9000113.4D307 S311D307-D309 VanDerWaalsContact C-N 3.28Å; D307-D309 PolarHBondContact O-N 3.48Å; D309-S311 VanDerWaalsContact C-N 3.27Å; D309-S311 WeakPolarHBondContact OD1-CB 3.24Å; D309-S311 PolarHBondContact OD1-N 2.91Å; D309-S311 PolarHBondContact OD1-OG 3.37Å
310G86Confident85.4Confident58 Ų5851.2 Ų51.260%0.59828%0.281SS*.  trans70.225.7179.300000112.5D307 G312D307-G310 PolarHBondContact O-N 3.41Å; D307-G310 WeakPolarHBondContact OD1-CA 3.37Å; D307-G310 PolarHBondContact OD1-N 3.16Å; G310-G312 PolarHBondContact O-N 2.96Å
311S88.7Confident85.2Confident54 Ų5453.7 Ų53.738%0.37829%0.289SS..  trans-72.5-18-177.963.50000112.9D307 D309 F313D307-S311 PolarHBondContact OD1-N 3.16Å; D307-S311 PolarHBondContact OD2-N 3.34Å; D309-S311 VanDerWaalsContact C-N 3.27Å; D309-S311 WeakPolarHBondContact OD1-CB 3.24Å; D309-S311 PolarHBondContact OD1-N 2.91Å; D309-S311 PolarHBondContact OD1-OG 3.37Å; S311-F313 WeakPolarHBondContact O-CD2 3.29Å; S311-F313 PolarHBondContact OG-N 3.22Å; S311-F313 VanDerWaalsContact OG-N 3.16Å; S311-F313 PolarHBondContact OG-O 3.4Å
312G86.9Confident84.9Confident28 Ų2852 Ų5229%0.28928%0.279SS..SBendtrans76.88-168.900000113V280 D307 G310V280-G312 WeakPolarHBondContact CB-O 3.44Å; V280-G312 VanDerWaalsContact CG2-C 3.42Å; V280-G312 WeakPolarHBondContact CG2-O 2.93Å; V280-G312 PolarHBondContact N-O 3.21Å; D307-G312 WeakPolarHBondContact OD2-CA 3.22Å; D307-G312 PolarHBondContact OD2-N 3.06Å; G310-G312 PolarHBondContact O-N 2.96Å
313F89.3Confident84.6Confident70 Ų7051.2 Ų51.231%0.30728%0.276SS..EExtended strand (participates in β ladder)trans-130.2144.6176.7-63.3-74.3000109.2E277 I278 S311E277-F313 HydrophobicContact CB-CB 4.11Å; E277-F313 HydrophobicContact CG-CB 4.35Å; I278-F313 CarbonylContact O-C 3.56Å; I278-F313 WeakPolarHBondContact O-CA 3.48Å; S311-F313 WeakPolarHBondContact O-CD2 3.29Å; S311-F313 PolarHBondContact OG-N 3.22Å; S311-F313 VanDerWaalsContact OG-N 3.16Å; S311-F313 PolarHBondContact OG-O 3.4Å
314V87.9Confident84Confident0 Ų052.8 Ų52.80%029%0.286CS..EExtended strand (participates in β ladder)trans-107.6113.2177.6177.90000108.7E277 I278 V280 L283 T306 E318 F319E277-V314 WeakPolarHBondContact CA-O 3.43Å; I278-V314 HydrophobicContact CB-CB 4.46Å; I278-V314 PolarHBondContact N-O 3.43Å; I278-V314 PolarHBondContact O-N 3.48Å; V280-V314 HydrophobicContact CG2-CG2 4.24Å; L283-V314 HydrophobicContact CD2-CG2 3.95Å; T306-V314 HydrophobicContact CG2-CB 4.41Å; T306-V314 HydrophobicContact CG2-CG1 3.61Å; T306-V314 HydrophobicContact CG2-CG2 3.85Å; V314-E318 HydrophobicContact CG1-CB 3.89Å; V314-F319 HydrophobicContact CG1-CB 3.99Å
315D90.7Very high83Confident55 Ų5547.7 Ų47.729%0.29427%0.274SS..EExtended strand (participates in β ladder)trans-75.8174175.477.430.1000111.9D317 E318 F319D315-D317 VanDerWaalsContact C-N 3.31Å; D315-D317 PolarHBondContact O-N 2.91Å; D315-D317 WeakPolarHBondContact OD1-CA 3.46Å; D315-D317 WeakPolarHBondContact OD1-CB 3.29Å; D315-D317 PolarHBondContact OD1-N 3.33Å; D315-E318 PolarHBondContact N-OE2 2.82Å; D315-E318 PolarHBondContact OD1-N 2.9Å; D315-F319 VanDerWaalsContact O-CB 3.31Å; D315-F319 WeakPolarHBondContact O-CB 3.44Å; D315-F319 PolarHBondContact O-N 3.33Å
316F88Confident81.3Confident31 Ų3154.2 Ų54.214%0.13630%0.302CS..Hα-helixtrans-65.2-34180179.7-99.3000113R264 F267 Y320R264-F316 HydrophobicContact CB-CE2 4.2Å; R264-F316 HydrophobicContact CG-CD2 4.36Å; R264-F316 HydrophobicContact CG-CE1 4.28Å; R264-F316 HydrophobicContact CG-CE2 3.39Å; R264-F316 HydrophobicContact CG-CZ 3.34Å; F267-F316 HydrophobicContact CB-CD2 4.1Å; F267-F316 HydrophobicContact CB-CE2 4.44Å; F267-F316 HydrophobicContact CD1-CD2 4.32Å; F267-F316 HydrophobicContact CD2-CB 4.5Å; F267-F316 HydrophobicContact CD2-CD2 4.04Å; F267-F316 HydrophobicContact CE1-CB 4.46Å; F267-F316 HydrophobicContact CE2-CB 4.24Å; F267-F316 AromaticContact CG-CD2 3.89Å; F267-F316 HydrophobicContact CG-CD2 3.89Å; F267-F316 HydrophobicContact CZ-CB 4.22Å; F316-Y320 HydrophobicContact CE1-CD2 4.46Å; F316-Y320 HydrophobicContact CZ-CD2 4.26Å; F316-Y320 WeakPolarHBondContact O-CB 3.32Å; F316-Y320 PolarHBondContact O-N 3.13Å
317D87.7Confident81.2Confident102 Ų10256.6 Ų56.655%0.54532%0.316SS..Hα-helixtrans-73.5-37.3-177.9-73.3-19.2000110.9D315 Y320 K321D315-D317 VanDerWaalsContact C-N 3.31Å; D315-D317 PolarHBondContact O-N 2.91Å; D315-D317 WeakPolarHBondContact OD1-CA 3.46Å; D315-D317 WeakPolarHBondContact OD1-CB 3.29Å; D315-D317 PolarHBondContact OD1-N 3.33Å; D317-Y320 PolarHBondContact O-N 3.15Å; D317-K321 WeakPolarHBondContact O-CB 3.44Å; D317-K321 WeakPolarHBondContact O-CG 3.47Å; D317-K321 PolarHBondContact O-N 2.94Å
318E87.1Confident80.9Confident7 Ų758.4 Ų58.43%0.03333%0.326CS..Hα-helixtrans-65.8-46.2170.8-70.5-173.8139.600111.4T306 T308 V314 D315 Y320 K321 L322T306-E318 HydrophobicContact CG2-CB 4.44Å; T308-E318 PolarHBondContact N-OE1 3.45Å; T308-E318 PolarHBondContact OG1-OE1 3.46Å; V314-E318 HydrophobicContact CG1-CB 3.89Å; D315-E318 PolarHBondContact N-OE2 2.82Å; D315-E318 PolarHBondContact OD1-N 2.9Å; E318-Y320 VanDerWaalsContact C-N 3.31Å; E318-Y320 PolarHBondContact O-N 2.75Å; E318-K321 PolarHBondContact O-N 2.92Å; E318-L322 VanDerWaalsContact O-CB 3.23Å; E318-L322 WeakPolarHBondContact O-CB 3.45Å; E318-L322 PolarHBondContact O-N 3.49Å
319F83.5Confident80.9Confident0 Ų056.1 Ų56.10%031%0.31CS..Hα-helixtrans-60.9-40.8173.4-176.2-101.3000111.8M173 L263 F267 L270 I278 V314 D315 L322 M323M173-F319 HydrophobicContact CE-CE2 4.25Å; M173-F319 HydrophobicContact CE-CZ 3.87Å; L263-F319 HydrophobicContact CB-CE1 4.46Å; L263-F319 HydrophobicContact CD2-CE1 4.11Å; F267-F319 HydrophobicContact CB-CD1 4.27Å; F267-F319 HydrophobicContact CB-CE1 4.22Å; F267-F319 HydrophobicContact CD2-CB 3.84Å; F267-F319 AromaticContact CD2-CD1 3.81Å; F267-F319 HydrophobicContact CD2-CD1 3.81Å; F267-F319 HydrophobicContact CD2-CD2 4.4Å; F267-F319 HydrophobicContact CD2-CE1 4.42Å; F267-F319 AromaticContact CD2-CG 3.77Å; F267-F319 HydrophobicContact CD2-CG 3.77Å; F267-F319 HydrophobicContact CE2-CB 4Å; F267-F319 HydrophobicContact CE2-CG 4.38Å; L270-F319 HydrophobicContact CD1-CE2 4.09Å; L270-F319 HydrophobicContact CD1-CZ 4.43Å; I278-F319 HydrophobicContact CD1-CD2 4.05Å; I278-F319 HydrophobicContact CD1-CE2 4.3Å; V314-F319 HydrophobicContact CG1-CB 3.99Å; D315-F319 VanDerWaalsContact O-CB 3.31Å; D315-F319 WeakPolarHBondContact O-CB 3.44Å; D315-F319 PolarHBondContact O-N 3.33Å; F319-L322 WeakPolarHBondContact O-CB 3.41Å; F319-L322 PolarHBondContact O-N 2.97Å; F319-M323 HydrophobicContact CD1-CG 4.27Å; F319-M323 HydrophobicContact CD2-CE 4.49Å; F319-M323 HydrophobicContact CE1-CE 3.84Å; F319-M323 HydrophobicContact CE1-CG 4.08Å; F319-M323 HydrophobicContact CE2-CE 3.55Å; F319-M323 HydrophobicContact CE2-CG 4.49Å; F319-M323 HydrophobicContact CZ-CE 3.17Å; F319-M323 HydrophobicContact CZ-CG 4.21Å; F319-M323 VanDerWaalsContact O-CB 3.31Å; F319-M323 WeakPolarHBondContact O-CB 3.43Å; F319-M323 WeakPolarHBondContact O-CG 3.28Å; F319-M323 PolarHBondContact O-N 2.95Å
320Y83.5Confident80.5Confident65 Ų6553.1 Ų53.126%0.25529%0.294SS..Hα-helixtrans-66.3-44.9177.3-177.4-93.1000111.4E260 L263 F316 D317 E318 M323 T324E260-Y320 HydrophobicContact CG-CE2 4.13Å; L263-Y320 HydrophobicContact CD1-CD2 4.03Å; L263-Y320 HydrophobicContact CD1-CE2 4.28Å; F316-Y320 HydrophobicContact CE1-CD2 4.46Å; F316-Y320 HydrophobicContact CZ-CD2 4.26Å; F316-Y320 WeakPolarHBondContact O-CB 3.32Å; F316-Y320 PolarHBondContact O-N 3.13Å; D317-Y320 PolarHBondContact O-N 3.15Å; E318-Y320 VanDerWaalsContact C-N 3.31Å; E318-Y320 PolarHBondContact O-N 2.75Å; Y320-M323 CarbonylContact O-C 3.37Å; Y320-M323 PolarHBondContact O-N 3.12Å; Y320-M323 VanDerWaalsContact O-N 3.16Å; Y320-T324 HydrophobicContact CD1-CG2 4.13Å; Y320-T324 HydrophobicContact CD2-CG2 4.16Å; Y320-T324 HydrophobicContact CE1-CG2 3.72Å; Y320-T324 WeakPolarHBondContact CE1-OG1 3.35Å; Y320-T324 HydrophobicContact CE2-CG2 3.76Å; Y320-T324 HydrophobicContact CG-CG2 4.34Å; Y320-T324 WeakPolarHBondContact O-CB 3.46Å; Y320-T324 WeakPolarHBondContact O-CG2 3.26Å; Y320-T324 PolarHBondContact O-N 3.33Å; Y320-T324 PolarHBondContact O-OG1 2.87Å
321K81Confident80.1Confident121 Ų12152.8 Ų52.853%0.52628%0.275SS..Hα-helixtrans-62-43.6174.4-75.7168.2-170.9163.30111.3D317 E318 M323 T324 S325D317-K321 WeakPolarHBondContact O-CB 3.44Å; D317-K321 WeakPolarHBondContact O-CG 3.47Å; D317-K321 PolarHBondContact O-N 2.94Å; E318-K321 PolarHBondContact O-N 2.92Å; K321-M323 PolarHBondContact O-N 3.32Å; K321-T324 PolarHBondContact O-N 3.25Å; K321-S325 WeakPolarHBondContact O-CA 3.33Å; K321-S325 WeakPolarHBondContact O-CB 3.38Å; K321-S325 PolarHBondContact O-N 3.1Å; K321-S325 PolarHBondContact O-OG 2.83Å
322L76Confident79.6Confident18 Ų1852.7 Ų52.79%0.09427%0.268CS..Hα-helixtrans-53.7-47.8173.6177.362.2000109.4W165 T306 E318 F319 T324 S325W165-L322 HydrophobicContact CH2-CB 4.43Å; W165-L322 HydrophobicContact CH2-CD1 3.2Å; W165-L322 HydrophobicContact CH2-CD2 4.1Å; W165-L322 HydrophobicContact CH2-CG 3.3Å; W165-L322 VanDerWaalsContact CH2-O 3.3Å; W165-L322 WeakPolarHBondContact CH2-O 3.35Å; W165-L322 HydrophobicContact CZ2-CD1 3.34Å; W165-L322 HydrophobicContact CZ2-CG 4.01Å; W165-L322 HydrophobicContact CZ3-CD1 4.08Å; W165-L322 HydrophobicContact CZ3-CD2 4.19Å; W165-L322 HydrophobicContact CZ3-CG 3.85Å; T306-L322 HydrophobicContact CG2-CB 4.03Å; T306-L322 HydrophobicContact CG2-CD2 3.71Å; T306-L322 HydrophobicContact CG2-CG 4.25Å; T306-L322 VanDerWaalsContact OG1-CD1 3.28Å; T306-L322 WeakPolarHBondContact OG1-CD1 3.38Å; T306-L322 WeakPolarHBondContact OG1-CD2 3.43Å; E318-L322 VanDerWaalsContact O-CB 3.23Å; E318-L322 WeakPolarHBondContact O-CB 3.45Å; E318-L322 PolarHBondContact O-N 3.49Å; F319-L322 WeakPolarHBondContact O-CB 3.41Å; F319-L322 PolarHBondContact O-N 2.97Å; L322-T324 PolarHBondContact O-N 3.06Å; L322-S325 PolarHBondContact O-OG 3.29Å
323M73.2Confident79Confident1 Ų154.4 Ų54.41%0.00527%0.267CS..Hα-helixtrans-77.9-15.9-177.8-68-72.7-155.200115.7W165 R166 L169 I170 M173 L263 F319 Y320 K321W165-M323 HydrophobicContact CZ3-SD 4.11Å; R166-M323 VanDerWaalsContact CD-O 3.27Å; R166-M323 WeakPolarHBondContact CD-O 3.37Å; R166-M323 PolarHBondContact NE-O 3.31Å; R166-M323 PolarHBondContact NH1-O 3.37Å; R166-M323 PolarHBondContact NH2-O 2.92Å; L169-M323 HydrophobicContact CD2-CE 3.21Å; L169-M323 HydrophobicContact CD2-SD 3.95Å; L169-M323 HydrophobicContact CG-CE 3.67Å; I170-M323 HydrophobicContact CD1-SD 4.25Å; I170-M323 HydrophobicContact CG1-CE 4.34Å; I170-M323 HydrophobicContact CG1-SD 3.98Å; M173-M323 HydrophobicContact CE-CE 3.86Å; L263-M323 HydrophobicContact CD1-CB 3.72Å; L263-M323 HydrophobicContact CD1-CG 4.44Å; L263-M323 HydrophobicContact CD2-CB 3.71Å; L263-M323 HydrophobicContact CD2-CE 3.94Å; L263-M323 HydrophobicContact CD2-CG 3.57Å; L263-M323 HydrophobicContact CD2-SD 3.91Å; L263-M323 HydrophobicContact CG-CB 4.38Å; F319-M323 HydrophobicContact CD1-CG 4.27Å; F319-M323 HydrophobicContact CD2-CE 4.49Å; F319-M323 HydrophobicContact CE1-CE 3.84Å; F319-M323 HydrophobicContact CE1-CG 4.08Å; F319-M323 HydrophobicContact CE2-CE 3.55Å; F319-M323 HydrophobicContact CE2-CG 4.49Å; F319-M323 HydrophobicContact CZ-CE 3.17Å; F319-M323 HydrophobicContact CZ-CG 4.21Å; F319-M323 VanDerWaalsContact O-CB 3.31Å; F319-M323 WeakPolarHBondContact O-CB 3.43Å; F319-M323 WeakPolarHBondContact O-CG 3.28Å; F319-M323 PolarHBondContact O-N 2.95Å; Y320-M323 CarbonylContact O-C 3.37Å; Y320-M323 PolarHBondContact O-N 3.12Å; Y320-M323 VanDerWaalsContact O-N 3.16Å; K321-M323 PolarHBondContact O-N 3.32Å
324T70Confident78.2Confident48 Ų4853.2 Ų53.229%0.29426%0.264SS..Hα-helixtrans-118.4-14-176.556.50000114.4L263 Y320 K321 L322L263-T324 HydrophobicContact CD1-CG2 4.47Å; Y320-T324 HydrophobicContact CD1-CG2 4.13Å; Y320-T324 HydrophobicContact CD2-CG2 4.16Å; Y320-T324 HydrophobicContact CE1-CG2 3.72Å; Y320-T324 WeakPolarHBondContact CE1-OG1 3.35Å; Y320-T324 HydrophobicContact CE2-CG2 3.76Å; Y320-T324 HydrophobicContact CG-CG2 4.34Å; Y320-T324 WeakPolarHBondContact O-CB 3.46Å; Y320-T324 WeakPolarHBondContact O-CG2 3.26Å; Y320-T324 PolarHBondContact O-N 3.33Å; Y320-T324 PolarHBondContact O-OG1 2.87Å; K321-T324 PolarHBondContact O-N 3.25Å; L322-T324 PolarHBondContact O-N 3.06Å
325S63.5Low77.4Confident46 Ų4657.7 Ų57.732%0.32229%0.286SS..  trans-64.2133.4178.154.40000111.6K321 L322K321-S325 WeakPolarHBondContact O-CA 3.33Å; K321-S325 WeakPolarHBondContact O-CB 3.38Å; K321-S325 PolarHBondContact O-N 3.1Å; K321-S325 PolarHBondContact O-OG 2.83Å; L322-S325 PolarHBondContact O-OG 3.29Å
326E45.3Very low76.2Confident198 Ų19857.9 Ų57.993%0.92529%0.285SS*.  trans-95.60171.1-65.5-17415600110.9T159T159-E326 WeakPolarHBondContact CG2-OXT 3.42Å

Retrieved 326 of 326 residues in 254.5 ms (Link to these results)