A0A023T535_MOUSE Loading...

Caldendrin

AlphaFold DB (D3Z1M4), UniProt , Accession A0A023T535, Species MOUSE (Mus musculus, Mouse), Gene Cabp1, Length 350 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M44.9Very low40.2Very low252 Ų252136.5 Ų136.5100%1.24186%0.858SS**  0150.90-83.7-175.6164.200108.3
2G37.3Very low40.3Very low81 Ų81135.4 Ų135.484%0.83585%0.853SS**  trans88122.9-16100000109.7
3G43.8Very low40.3Very low86 Ų86128.8 Ų128.889%0.88783%0.827SS**  cis116.6105.39.500000109
4G34.3Very low40.3Very low77 Ų77130.6 Ų130.679%0.79483%0.826SS**  trans-164.8110.5-173.400000111.4
5D38.1Very low39.9Very low164 Ų164125.3 Ų125.388%0.87781%0.806SS**  trans-56.4139.2-165-60.1-105.3000117.5A7D5-A7 PolarHBondContact O-N 2.79Å
6G43.7Very low39.8Very low86 Ų86121.4 Ų121.489%0.88779%0.788SS**  trans-84.7103.4161.900000111.1
7A37.3Very low39.9Very low90 Ų90127.3 Ų127.374%0.74479%0.791SS**  trans-93.5104.1177.300000111.8D5 F9D5-A7 PolarHBondContact O-N 2.79Å; A7-F9 PolarHBondContact O-N 2.68Å
8A45.2Very low40Very low98 Ų98125.8 Ų125.881%0.8178%0.776SS**  trans-70.9107.9172.500000111.1K10A8-K10 VanDerWaalsContact C-N 3.27Å; A8-K10 PolarHBondContact O-N 3.19Å
9F33.8Very low40.1Very low177 Ų177126.2 Ų126.278%0.77677%0.768SS**  trans-81.472.2176.9-133.6-80000112.1A7 R11A7-F9 PolarHBondContact O-N 2.68Å; F9-R11 HydrophobicContact CD1-CG 4.11Å; F9-R11 HydrophobicContact CE1-CG 4.23Å; F9-R11 PolarHBondContact O-N 2.91Å
10K44.2Very low40.1Very low188 Ų188130.7 Ų130.782%0.81777%0.771SS**  trans-76.299.9175.3-170.9166.7-175.6169.70110A8 P12A8-K10 VanDerWaalsContact C-N 3.27Å; A8-K10 PolarHBondContact O-N 3.19Å; K10-P12 WeakPolarHBondContact O-CD 3.06Å
11R39.1Very low40.3Very low203 Ų203128.2 Ų128.277%0.76676%0.757SS**  trans-93.6110.3164.7-75.5-172.3178.9-123.90.1110.1F9F9-R11 HydrophobicContact CD1-CG 4.11Å; F9-R11 HydrophobicContact CE1-CG 4.23Å; F9-R11 PolarHBondContact O-N 2.91Å
12P42.1Very low40.2Very low123 Ų123120.3 Ų120.380%0.79972%0.719SS**  trans-85.1112.8167.732.4-28.7000109.3K10K10-P12 WeakPolarHBondContact O-CD 3.06Å
13G39.6Very low40.3Very low50 Ų50119.7 Ų119.752%0.51571%0.713SS.*  trans-168.9-65.8-179.600000114.5
14D41.3Very low40.6Very low153 Ų153121.9 Ų121.982%0.81870%0.704SS**G310 helixtrans-97.9-2-150.6-58.6-79.9000116.4A16D14-A16 VanDerWaalsContact C-N 3.27Å; D14-A16 PolarHBondContact O-N 3.41Å
15G34.5Very low40.6Very low51 Ų51121.1 Ų121.153%0.52670%0.696SS.*G310 helixtrans-77.6-5.7172.500000115Q19G15-Q19 WeakPolarHBondContact O-CG 3.41Å; G15-Q19 PolarHBondContact O-NE2 2.81Å
16A37.5Very low40.5Very low63 Ų63119.6 Ų119.652%0.52170%0.698SS.*G310 helixtrans-93.6-9.9-166.100000115.3D14D14-A16 VanDerWaalsContact C-N 3.27Å; D14-A16 PolarHBondContact O-N 3.41Å
17R41Very low40.4Very low222 Ų222127.2 Ų127.284%0.83870%0.7SS**THydrogen-bonded Turntrans-88.7-40.1-174.8-152.2168.6-177-116.2-2.4113
18L41.7Very low40.4Very low100 Ų100134.4 Ų134.452%0.52471%0.707SS.*THydrogen-bonded Turntrans-75.7-35.9173.2-72.2165.9000112.7R20 V21 T236L18-R20 PolarHBondContact O-N 2.98Å; L18-V21 PolarHBondContact O-N 3.04Å; L18-T236 HydrophobicContact CD1-CG2 4.03Å
19Q42.1Very low40Very low133 Ų133133.7 Ų133.762%0.62170%0.702SS**THydrogen-bonded Turntrans-62.4-16.6176.5-78.8-175.581.300114.6G15 V21G15-Q19 WeakPolarHBondContact O-CG 3.41Å; G15-Q19 PolarHBondContact O-NE2 2.81Å; Q19-V21 VanDerWaalsContact C-N 3.31Å
20R40.1Very low40.1Very low216 Ų216131.4 Ų131.482%0.81571%0.705SS**THydrogen-bonded Turntrans-76-18.3174.8-170.5174-96.1132.4-9.8112.9L18L18-R20 PolarHBondContact O-N 2.98Å
21V45.1Very low39.8Very low80 Ų80134.2 Ų134.249%0.48571%0.71SS.*THydrogen-bonded Turntrans-88.6-21.4179.8175.20000112.8L18 Q19 K285L18-V21 PolarHBondContact O-N 3.04Å; Q19-V21 VanDerWaalsContact C-N 3.31Å; V21-K285 WeakPolarHBondContact O-CE 3.32Å; V21-K285 PolarHBondContact O-NZ 3Å
22L43.2Very low39.7Very low85 Ų85130 Ų13045%0.44571%0.711SS.*SBendtrans-100.41.1-173.6-64.6179.1000115.5L24 I282L22-L24 PolarHBondContact O-N 3.47Å; L22-I282 HydrophobicContact CD2-CD1 4.44Å
23G39.4Very low39.6Very low68 Ų68132.4 Ų132.470%0.70172%0.717SS**  trans65.85.5167.600000117.3G25G23-G25 PolarHBondContact O-N 3.38Å
24L48.7Very low39.8Very low133 Ų133135.8 Ų135.870%0.69673%0.73SS**  trans-73.591.8177.3-63.3178.3000110.1L22L22-L24 PolarHBondContact O-N 3.47Å
25G35.9Very low39.8Very low61 Ų61134.2 Ų134.263%0.62973%0.731SS**  trans-80.2159.1-160.900000116.9G23 R27G23-G25 PolarHBondContact O-N 3.38Å; G25-R27 VanDerWaalsContact C-N 3.26Å; G25-R27 PolarHBondContact O-N 3.36Å
26S34.2Very low40Very low131 Ų131135.9 Ų135.992%0.91675%0.748SS**  trans-70.678.8161.3-80.30000111.2R28S26-R28 PolarHBondContact O-N 2.8Å; S26-R28 VanDerWaalsContact O-N 3.1Å
27R41.8Very low40.2Very low246 Ų246136.2 Ų136.293%0.92876%0.758SS**  trans-67.6102.8160.7-73.9-174.2179.1-114.23.1108.4G25 A29G25-R27 VanDerWaalsContact C-N 3.26Å; G25-R27 PolarHBondContact O-N 3.36Å; R27-A29 PolarHBondContact O-N 3.04Å
28R38.1Very low40.6Very low241 Ų241132.1 Ų132.191%0.90976%0.76SS**PPolyproline II helixtrans-57.9128.7164.1-88.8-175.9170.8-176.6-1108.4S26S26-R28 PolarHBondContact O-N 2.8Å; S26-R28 VanDerWaalsContact O-N 3.1Å
29A36.2Very low41Very low84 Ų84131.9 Ų131.969%0.69477%0.772SS**PPolyproline II helixtrans-58.1145.3173.700000111R27 R31R27-A29 PolarHBondContact O-N 3.04Å; A29-R31 PolarHBondContact O-N 3.04Å
30P35.7Very low41.8Very low129 Ų129131.1 Ų131.184%0.83878%0.779SS**PPolyproline II helixtrans-64.2119.1175.127.2-33.4000109.5
31R38.3Very low42.8Very low247 Ų247126.4 Ų126.493%0.93278%0.776SS**PPolyproline II helixtrans-73.7130.3169.8-86-173.5163.8-163.2-5.5109.3A29A29-R31 PolarHBondContact O-N 3.04Å
32S38Very low43.4Very low113 Ų113128.5 Ų128.579%0.7979%0.791SS**PPolyproline II helixtrans-57.2140.2172.532.30000112.2
33L39.8Very low43.9Very low174 Ų174130.5 Ų130.591%0.91181%0.81SS**PPolyproline II helixtrans-70134.1171.7-70.2159.4000110.8
34P43.5Very low43.9Very low121 Ų121130.6 Ų130.679%0.78681%0.811SS**PPolyproline II helixtrans-94.7147.8149.933.6-28.4000110.9
35S40.8Very low43.8Very low120 Ų120134.2 Ų134.284%0.83982%0.823SS**PPolyproline II helixtrans-79.9143.7-173.951.60000115
36G38.4Very low44Very low86 Ų86136.3 Ų136.389%0.88784%0.835SS**  trans80.6108.4137.800000119.1
37G42.3Very low44.3Very low71 Ų71135.9 Ų135.973%0.73283%0.832SS**  trans-172.7135.6163.900000110.6
38P48.3Very low44.2Very low135 Ų135129.4 Ų129.488%0.87783%0.831SS**PPolyproline II helixtrans-80.7157.6-167.231.9-35.9000114.6
39A51.5Low44.1Very low95 Ų95121.2 Ų121.279%0.78582%0.822SS**PPolyproline II helixtrans-79.6146.7-173.600000114.5
40P57.5Low45.2Very low118 Ų118123.6 Ų123.677%0.76683%0.83SS**PPolyproline II helixtrans-86.6155.1159.734.6-31.6000112.1
41P62.5Low45.1Very low116 Ų116122.5 Ų122.575%0.75383%0.832SS**PPolyproline II helixtrans-84.6162.6-17234.6-37.3000114.4
42P57.5Low45.1Very low124 Ų124115.5 Ų115.581%0.80583%0.827SS**PPolyproline II helixtrans-88.3136.1178.134.2-33.3000113.5
43P53.8Low45.1Very low128 Ų128118.9 Ų118.983%0.83183%0.832SS**PPolyproline II helixtrans-87.5148142.834.8-27.9000108.7
44G39.3Very low44.8Very low70 Ų70115.8 Ų115.872%0.72283%0.826SS**  cis148.3124.510.400000106.7
45H45.7Very low44.6Very low208 Ų208114.4 Ų114.496%0.96382%0.818SS**  trans-64.7135.4-174.5-81.4-107.6000112.4
46A39.9Very low44.6Very low106 Ų106116.6 Ų116.688%0.87682%0.815SS**  trans-146.3127.6158.900000110.3
47S40.8Very low44.8Very low122 Ų122119.6 Ų119.685%0.85381%0.809SS**  trans-112.9165.5174.557.40000110.8
48A39.9Very low44.9Very low110 Ų110120.3 Ų120.391%0.90981%0.808SS**  trans96.5142.5-172.200000113.6
49G35.7Very low44.5Very low69 Ų69123.1 Ų123.171%0.71181%0.807SS**  cis-176.1171.9-0.300000109.7
50P60.4Low44.2Very low133 Ų133123.2 Ų123.286%0.86480%0.802SS**  trans-97.8144.4-165.136.4-34.4000115.2
51A33.1Very low43.7Very low106 Ų106124.7 Ų124.788%0.87680%0.799SS**  trans167.5154161.800000108.5
52A37.5Very low43.1Very low100 Ų100124.2 Ų124.283%0.82680%0.798SS**  cis-149.5176.70.200000111.1
53M38.1Very low42.4Very low184 Ų184126.1 Ų126.191%0.90679%0.793SS**  trans-90.5145.1178.3-57173175.400113.1
54S34.3Very low41.9Very low110 Ų110125.6 Ų125.677%0.76979%0.788SS**  trans165.6110.4140.1-83.90000109.2
55S38.5Very low41.7Very low91 Ų91127.1 Ų127.164%0.63679%0.788SS**  93.4158.971.973.10000112.9
56H42.4Very low41.4Very low167 Ų167124.3 Ų124.377%0.77378%0.779SS**  trans95.4101.8-168-56.4-63.7000112.9
57I41.9Very low41.2Very low148 Ų148126 Ų12676%0.75977%0.772SS**  cis111.4125.537.6-81.3169.6000109.5
58A43.7Very low40.9Very low86 Ų86129.2 Ų129.271%0.71177%0.771SS**  trans68.2143.5163.700000117.4
59K40.5Very low40.7Very low194 Ų194128.5 Ų128.584%0.84377%0.765SS**  cis-153.9149.60.5-129.6168-174.5178.60111.1
60S45.1Very low40.5Very low98 Ų98130.1 Ų130.169%0.68577%0.772SS**  trans-57.4161.5156.852.40000110.5
61E46.8Very low39.2Very low149 Ų149128.2 Ų128.270%0.69677%0.767SS**  -159.1143.771.2-81.3179.982.600114K63E61-K63 IonicContact OE1-NZ 2.79Å; E61-K63 PolarHBondContact OE1-NZ 3.23Å
62S50.8Low39.4Very low105 Ų105127.7 Ų127.773%0.73476%0.763SS**  trans-88.8149.3160.8-45.60000110.8
63K43.4Very low39.2Very low164 Ų164129 Ų12971%0.71377%0.766SS**  trans-164.9119.4146.6-91.6129.6-173.4170.40107E61E61-K63 IonicContact OE1-NZ 2.79Å; E61-K63 PolarHBondContact OE1-NZ 3.23Å
64T42.5Very low38.9Very low118 Ų118124.1 Ų124.172%0.72476%0.763SS**  66.59252.574.20000115.7
65S35.1Very low38.7Very low102 Ų102122.3 Ų122.371%0.71376%0.761SS**  86.2155.3118.1-154.80000121.1
66L38.9Very low38.5Very low148 Ų148123.8 Ų123.878%0.77577%0.772SS**  trans66.5150.2169.5-66.1119.5000117.7
67L36.6Very low38.1Very low141 Ų141127.7 Ų127.774%0.73878%0.78SS**  cis156.8153.7-20.9-124.2129.6000105.3
68K33.7Very low37.9Very low190 Ų190124.8 Ų124.883%0.82678%0.778SS**  trans8895.4149.7-129.1165.4-172.3174.50120.7
69A36Very low38.1Very low96 Ų96126.3 Ų126.379%0.79378%0.78SS**  27.4131.2122.700000122.8
70A31.9Very low37.9Very low102 Ų102127.2 Ų127.284%0.84378%0.778SS**  trans167.6160.9134.100000108.7
71A33.2Very low37.6Very low93 Ų93130 Ų13077%0.76978%0.78SS**  cis169.5133.6-33.200000106.8
72A36.4Very low36.9Very low95 Ų95128.9 Ų128.979%0.78579%0.789SS**  trans73151.7151.600000123.6
73S34.7Very low36.2Very low129 Ų129129.4 Ų129.490%0.90279%0.792SS**  trans70.4140.1173.477.20000117.3
74G30.4Very low35.8Very low80 Ų80125.3 Ų125.383%0.82579%0.789SS**  cis157.4151.2-7.100000112.2
75G30.1Very low35.4Very low72 Ų72131.1 Ų131.174%0.74280%0.798SS**  trans104.699.8157.200000119.4
76S34.1Very low35.6Very low122 Ų122133.1 Ų133.185%0.85380%0.801SS**  39.2119.4129.1-55.20000122.2
77R33.5Very low36Very low250 Ų250132 Ų13294%0.94380%0.802SS**  -176.6135.4107.7-107.2168.5153.7167.2-7.9114.4
78A38.3Very low35.8Very low87 Ų87128 Ų12872%0.71980%0.795SS**  trans-96.5161.5154.800000110.1
79P48.3Very low36Very low117 Ų117127.1 Ų127.176%0.7680%0.798SS**  -132145.1104.77.714.8000113.1
80R36.9Very low36Very low213 Ų213134.9 Ų134.980%0.80481%0.807SS**  53.3138.685.9-59.4-173.2177.7-93.15.1113.5
81H38.8Very low36.1Very low156 Ų156133.4 Ų133.472%0.72280%0.801SS**  cis176.1140.6-3.1-112.4-75.9000103.6
82S31.8Very low36.2Very low126 Ų126140.4 Ų140.488%0.88181%0.808SS**  trans-168.6131.9141.547.30000111.1
83S36.3Very low36.2Very low116 Ų116147 Ų14781%0.81181%0.813SS**  trans-103153.9175178.40000110
84A33.9Very low36.6Very low78 Ų78148.8 Ų148.865%0.64581%0.811SS**  140.1153.3117.400000116.1
85R34.8Very low37.3Very low241 Ų241150.9 Ų150.991%0.90981%0.81SS**  trans90.4100154.7-67.7168.4-175-158.1-1.2120
86D39Very low37.7Very low144 Ų144150.7 Ų150.777%0.7781%0.808SS**  trans-55.9151.7134.9-158-103.5000110.1G88D86-G88 PolarHBondContact OD1-N 3.35Å
87P47.7Very low38.3Very low124 Ų124150.5 Ų150.581%0.80580%0.804SS**  -145.8137.8102.935.1-18.5000115.9
88G32Very low38.7Very low56 Ų56144.5 Ų144.558%0.57780%0.799SS**  109.991.2116.700000120.7D86D86-G88 PolarHBondContact OD1-N 3.35Å
89L37.8Very low39.2Very low172 Ų172146.8 Ų146.890%0.90181%0.806SS**  39.2112.4127.4-64.8171.3000121.4
90R37.3Very low38.4Very low260 Ų260144 Ų14498%0.98180%0.799SS**  trans-172.1142.1131.6-100.8163.3-170-107.64.1107.9
91G32.8Very low38.5Very low70 Ų70139.5 Ų139.572%0.72280%0.8SS**  cis154.995.2-4.600000112.4
92R36.4Very low38.9Very low240 Ų240137.9 Ų137.991%0.90680%0.803SS**  trans55.5123.2162.4-60.8178.3163.7-160-5.2119.2
93R34.6Very low40.1Very low235 Ų235136.9 Ų136.989%0.88779%0.794SS**  177.4122.899.6-94.2175.7-166.8-105.75112.2
94L43.6Very low40.8Very low166 Ų166137.4 Ų137.487%0.86979%0.794SS**  trans-82158.5142.8-73.8167.7000108.6
95P45.4Very low40.8Very low124 Ų124140 Ų14081%0.80581%0.806SS**  -137.1142.9117.836.4-25.4000113.3
96G37.4Very low40.5Very low67 Ų67132.2 Ų132.269%0.69180%0.801SS**  trans-96-151.115100000109.5
97P48.6Very low40.5Very low118 Ų118132.8 Ų132.877%0.76680%0.804SS**  cis-135.6172.6-15.841.4-26.4000114
98C41.4Very low40.5Very low125 Ų125132.2 Ų132.285%0.84580%0.8SS**  trans48.3162.3147.3-62.80000121.2
99P47.4Very low40.5Very low135 Ų135134.4 Ų134.488%0.87781%0.807SS**  cis-127.6-17021.638-17000112.8
100G32.5Very low40.2Very low58 Ų58131.6 Ų131.660%0.59880%0.801SS**  cis172.1131.55.500000106.6
101S38.1Very low40.1Very low118 Ų118131.1 Ų131.183%0.82580%0.8SS**  91.5157.399.770.10000113.9
102P47.3Very low40.4Very low123 Ų123139.1 Ų139.180%0.79981%0.808SS**  -128-136.7-10538.7-15.9000115.5
103P58.8Low41.3Very low105 Ų105132.6 Ų132.668%0.68280%0.797SS**  trans-95.6-171.5-136.443.9-30.7000114.9
104P49.8Very low41.2Very low127 Ų127128.7 Ų128.783%0.82579%0.793SS**  trans-133.8150.4135.637.1-26.5000115.5
105C33.4Very low40.6Very low132 Ų132126 Ų12689%0.89279%0.787SS**  trans-87.9164.5169.8-55.20000111.5
106G29.7Very low40.2Very low78 Ų78131.8 Ų131.880%0.80479%0.792SS**  trans-178.558.917600000117.1
107D38.5Very low40.4Very low156 Ų156134.5 Ų134.583%0.83480%0.798SS**  trans-69.7169.2152.2-120.8-30.2000108.9
108P48.2Very low39.8Very low111 Ų111135.2 Ų135.272%0.72180%0.799SS**  cis-146.2175.332.640.4-19.3000118.9
109S30.7Very low40.1Very low102 Ų102134.7 Ų134.771%0.71380%0.795SS**  trans115.1125.5151.9-48.90000114.3
110S32.6Very low39.3Very low113 Ų113139.3 Ų139.379%0.7979%0.794SS**  cis-144.9126.332.6-64.30000116.1
111R35.2Very low39.4Very low250 Ų250143.1 Ų143.194%0.94380%0.801SS**  trans24.5109.9138.6-61.8-176.7178-137.2-1.5120.7
112R38.9Very low39.1Very low239 Ų239146.5 Ų146.590%0.90280%0.804SS**  trans-73.5-178.1136.9-99.3-176.8-175.2-144.22.9110.4
113P55.6Low38.3Very low102 Ų102144.2 Ų144.266%0.66280%0.803SS**  cis-142.6-163.5-18.628.9-2.8000114.8
114L32.7Very low37.1Very low153 Ų153143.7 Ų143.780%0.80181%0.807SS**  trans105.2126.9144-70.5164.4000123.5
115C29.8Very low36.4Very low110 Ų110149.8 Ų149.874%0.74381%0.814SS**  trans-7.3141.6155.3-55.10000124.3
116R37.2Very low36.3Very low246 Ų246147.2 Ų147.293%0.92881%0.81SS**  trans38.4153.1138.2-85.8-176.2169.1177.5-3.2120.7
117P41.4Very low36.5Very low123 Ų123148.8 Ų148.880%0.79981%0.808SS**  cis-139.4-159.419.740.3-17.9000115.7
118V37.6Very low36.3Very low133 Ų133151.6 Ų151.681%0.80681%0.807SS**  trans-81.2158.8176.7-140.80000112.4
119P46.3Very low35.7Very low114 Ų114157.9 Ų157.974%0.7482%0.817SS**  -156.2166.891.842.3-23.4000118.4
120R31.9Very low35.7Very low232 Ų232156.8 Ų156.888%0.87582%0.821SS**  trans23.9156138.3-80.8-178.8179.8170.5-0.2122.8
121D33.5Very low35.9Very low138 Ų138159.4 Ų159.474%0.73883%0.826SS**  cis-165.8-171.6-8.5-156.9-90.4000109.2
122E32.5Very low36.6Very low189 Ų189153.1 Ų153.188%0.88382%0.817SS**  trans65.6140175.7-54.1-165.48700117.5
123G29.6Very low36.7Very low75 Ų75150.6 Ų150.677%0.77382%0.816SS**  cis158.5154.3-4.100000109.9
124A34.8Very low35.6Very low94 Ų94150.2 Ų150.278%0.77782%0.821SS**  cis-166.6177.7-12.500000109.9
125R34.7Very low35.9Very low255 Ų255151.5 Ų151.596%0.96282%0.823SS**  trans77.4126.5179.7-47.2174.5-172.2-129.8-2.2113.9
126G30.5Very low35.8Very low79 Ų79152.6 Ų152.681%0.81483%0.83SS**  cis115.113823.900000108.2
127S34.8Very low35.5Very low110 Ų110152.2 Ų152.277%0.76983%0.829SS**  cis-164.5148.111.8-171.10000106.8
128R34.8Very low36.3Very low216 Ų216151.6 Ų151.682%0.81583%0.825SS**  169.9162.185.2-94.9-163.8168.1-165.1-6112.6
129R35.4Very low36Very low242 Ų242155.2 Ų155.291%0.91382%0.824SS**  trans77118.7167.4-63.4-176.2-166.4-137.92.4116.1
130G30.4Very low35.2Very low79 Ų79156 Ų15681%0.81482%0.818SS**  trans-113.6162-172.900000114.9
131L37Very low34.9Very low168 Ų168150.4 Ų150.488%0.8881%0.809SS**  trans-59.9-173.4156.3-74.1163.9000111
132P48.5Very low34.7Very low118 Ų118151.5 Ų151.577%0.76681%0.814SS**  cis-145.1177.31642.2-21.4000119.1
133Q41.9Very low35.3Very low186 Ų186147.9 Ų147.987%0.86981%0.807SS**  trans-72.2152.5155.1-57.5172.76.700110.6
134A31.3Very low36.3Very low94 Ų94150.2 Ų150.278%0.77781%0.809SS**  trans-161.7146.8144.300000112.9
135H39.7Very low36.2Very low181 Ų181150.8 Ų150.884%0.83881%0.814SS**  trans-42.3157.3173.9-48.4-85.6000118.2
136C27.5Very low36.2Very low132 Ų132151 Ų15189%0.89281%0.814SS**  trans-167.1150.1132.6-105.50000113.7
137R30.4Very low36.2Very low238 Ų238150.3 Ų150.390%0.89881%0.807SS**  trans-112-169.6156.4-78.2-169.9167-165.9-2.3107.3
138P60.1Low36.3Very low110 Ų110156 Ų15671%0.71481%0.812SS**  -126.4175.5-7538.7-23.2000113
139R30.1Very low36.2Very low209 Ų209152.3 Ų152.379%0.78981%0.808SS**  trans154.3129.7135.1-84.8179.992.1157.46.7115.3
140E29.4Very low36.1Very low132 Ų132144.1 Ų144.162%0.61780%0.8SS**  trans59.5134.3132.9-64.7-173.1111.600126.7
141T26.6Very low36.4Very low113 Ų113149.4 Ų149.469%0.69380%0.803SS**  trans72.8113.2139.2500000123.8
142L29.4Very low36.3Very low161 Ų161147 Ų14784%0.84379%0.788SS**  41.1154.3114.4-77.5153.2000121.2
143P45.4Very low35.5Very low113 Ų113151.6 Ų151.673%0.73479%0.79SS**  cis-135.8-138.4-13.844.5-22.9000112.8
144P49.2Very low34.9Very low125 Ų125145.9 Ų145.981%0.81278%0.781SS**  trans-123.3179.6-133.931.9-6.2000116.9
145A32.9Very low34.8Very low106 Ų106150.3 Ų150.388%0.87679%0.79SS**  trans-133.2155.9175.200000114
146R34.3Very low34.5Very low258 Ų258146 Ų14697%0.97479%0.785SS**  trans-93.6160-165.8-65.9165.3161.2167.3-8.3115.5
147G31Very low35.7Very low65 Ų65145.4 Ų145.467%0.6778%0.78SS**  trans-163.6125.3147.200000108.8
148R36Very low35.7Very low230 Ų230138 Ų13887%0.86877%0.77SS**  72.6133.469.1-77.7-162.4145170.20.7112.7
149D34.2Very low34.5Very low138 Ų138141.5 Ų141.574%0.73878%0.782SS**  cis-159.7173.7-0.4-87.1-41.3000110
150G32.8Very low34.5Very low71 Ų71135.4 Ų135.473%0.73278%0.784SS**  trans103.9115.3164.300000115.8
151E36.2Very low34.7Very low190 Ų190137.2 Ų137.289%0.88880%0.797SS**  76.9130.454.1-158.8156.498.100111.5
152E34.3Very low34.9Very low118 Ų118143.8 Ų143.855%0.55181%0.809SS**  cis-153.1177.324.4-145.8-161.163.500113.1
153R33Very low34.8Very low214 Ų214139.6 Ų139.681%0.80881%0.805SS**  trans-2151.1164-64.4167.4-151.5133.77.4120.4
154G28Very low34.2Very low66 Ų66139.3 Ų139.368%0.6881%0.805SS**  cis160.6-176.23.500000112.3
155L30.4Very low33.6Very low186 Ų186140.6 Ų140.697%0.97481%0.805SS**  trans75.6134.6169.3-54.5174.8000120.3
156A33.8Very low33.5Very low90 Ų90146.6 Ų146.674%0.74481%0.805SS**  trans-109.6-17316200000108
157P52.6Low33.4Very low121 Ų121139.4 Ų139.479%0.78679%0.794SS**  cis-143.3-168.55.742.8-22000116.6
158A30.6Very low33.7Very low83 Ų83148.3 Ų148.369%0.68681%0.807SS**  trans82.5118.8146.700000123
159L33.8Very low33.4Very low182 Ų182140.7 Ų140.795%0.95380%0.8SS**  trans44.5119.5135.3-54177.6000121.3
160G30.1Very low33.6Very low82 Ų82145 Ų14585%0.84581%0.806SS**  trans-171.7144.2165.100000113.7
161L33.3Very low33.7Very low170 Ų170145.3 Ų145.389%0.8981%0.809SS**  trans-98.3158.6-171.6-84.3155.2000114.2
162R32.3Very low33.6Very low251 Ų251142.5 Ų142.595%0.94780%0.8SS**  trans70.6127.8160.1-74.7177.2160.4-123.9-2.6119.5
163G27.4Very low33.9Very low72 Ų72142.5 Ų142.574%0.74281%0.811SS**  131.893.2125.600000119.4
164S32Very low34.1Very low107 Ų107136.4 Ų136.475%0.74881%0.806SS**  trans65.3123.4139.5-135.30000122.2
165L35.5Very low34.6Very low152 Ų152139.2 Ų139.280%0.79681%0.812SS**  trans6197.3145-65.6165.7000120
166R31.3Very low34.8Very low233 Ų233135.1 Ų135.188%0.87981%0.805SS**  177150.2104-93.7168-169.7-106.51.6112.5
167S32.5Very low34.8Very low106 Ų106133.9 Ų133.974%0.74180%0.801SS**  trans13.5142.1152.164.30000119.8
168R37.2Very low34.1Very low252 Ų252133.7 Ų133.795%0.95180%0.798SS**  cis-174.8152.532-148.3175.6-178.2177.1-0.8108.7
169G30.6Very low34.7Very low70 Ų70135.5 Ų135.572%0.72280%0.803SS**  trans145.3120.5151.800000119.3
170R38.4Very low35.1Very low230 Ų230135.2 Ų135.287%0.86880%0.797SS**  trans56.986.2149.6-62.4-170.5-179.6-158.5-1.9119.3
171G33.7Very low35.8Very low77 Ų77134.7 Ų134.779%0.79478%0.784SS**  trans-124.389.1130.200000107.2P173G171-P173 VanDerWaalsContact O-CD 3.29Å; G171-P173 WeakPolarHBondContact O-CD 3.12Å
172D34.5Very low36.7Very low130 Ų130129.2 Ų129.270%0.69576%0.756SS**PPolyproline II helixtrans-71.7116.6177.5-62.8-82.1000108.9
173P40.7Very low37.8Very low119 Ų119121.8 Ų121.877%0.77374%0.74SS**PPolyproline II helixtrans-66.4138.4162.530.2-31.8000107.8G171G171-P173 VanDerWaalsContact O-CD 3.29Å; G171-P173 WeakPolarHBondContact O-CD 3.12Å
174A36.6Very low38.9Very low86 Ų86120.5 Ų120.571%0.71171%0.714SS**PPolyproline II helixtrans-53.3146.4178.700000110.9A176A174-A176 PolarHBondContact O-N 2.81Å; A174-A176 VanDerWaalsContact O-N 3.17Å
175P38.7Very low39.9Very low124 Ų124117 Ų11781%0.80569%0.687SS**PPolyproline II helixtrans-57.2127173.725.9-33.5000108.3G177P175-G177 PolarHBondContact O-N 3.21Å
176A34.9Very low41Very low101 Ų101116.5 Ų116.584%0.83568%0.68SS**  trans-55.7113.3170.700000107.5A174A174-A176 PolarHBondContact O-N 2.81Å; A174-A176 VanDerWaalsContact O-N 3.17Å
177G34Very low42.2Very low64 Ų64113.3 Ų113.366%0.6667%0.668SS**  trans-55.7143.1167.100000108.2P175P175-G177 PolarHBondContact O-N 3.21Å
178T37.5Very low43.2Very low117 Ų117108.5 Ų108.572%0.71863%0.634SS**  trans-43.5139.8155.343.40000108.8E180T178-E180 PolarHBondContact O-N 3.09Å
179P43.8Very low44.2Very low121 Ų121102.4 Ų102.479%0.78661%0.611SS**  trans-58.1110.8170.525.7-32.1000107A181P179-A181 PolarHBondContact O-N 3.43Å
180E41.1Very low45.3Very low176 Ų176102.7 Ų102.782%0.82260%0.6SS**PPolyproline II helixtrans-61.8116.4162.2-63.9-128.5131.600104.6T178 D182T178-E180 PolarHBondContact O-N 3.09Å; E180-D182 PolarHBondContact O-N 2.95Å; E180-D182 VanDerWaalsContact O-N 3.14Å
181A45.6Very low45.8Very low70 Ų7095.8 Ų95.858%0.57958%0.578SS**PPolyproline II helixtrans-54123.5-179.600000108.4P179P179-A181 PolarHBondContact O-N 3.43Å
182D51.5Low46.9Very low56 Ų5692.8 Ų92.830%0.29954%0.544SS..PPolyproline II helixtrans-59.6146.9-159.7-114.1-44.9000110.9E180 F184 L185 H186 E326E180-D182 PolarHBondContact O-N 2.95Å; E180-D182 VanDerWaalsContact O-N 3.14Å; D182-F184 PolarHBondContact O-N 3.23Å; D182-L185 PolarHBondContact O-N 2.86Å; D182-H186 PolarHBondContact O-N 3.33Å; D182-H186 VanDerWaalsContact O-N 3.11Å; D182-E326 HydrophobicContact CB-CG 4.35Å
183P56.6Low47.8Very low95 Ų9588.5 Ų88.562%0.61752%0.524SS*.THydrogen-bonded Turntrans-57.4-18.9-174.8-24.734.3000113.7R187P183-R187 VanDerWaalsContact O-CB 3.25Å; P183-R187 WeakPolarHBondContact O-CB 3.39Å; P183-R187 PolarHBondContact O-N 3.01Å
184F49.6Very low48.3Very low44 Ų4486.5 Ų86.519%0.19351%0.513CS..THydrogen-bonded Turntrans-78.5-43.9175.2-160.3-109.9000112.9D182 R187 L188 V319 D323 E326 I327D182-F184 PolarHBondContact O-N 3.23Å; F184-R187 CarbonylContact O-C 3.48Å; F184-R187 WeakPolarHBondContact O-CA 3.26Å; F184-R187 WeakPolarHBondContact O-CB 3.47Å; F184-R187 PolarHBondContact O-N 3.34Å; F184-R187 VanDerWaalsContact O-N 3.07Å; F184-L188 HydrophobicContact CD1-CD1 3.83Å; F184-L188 HydrophobicContact CD1-CG 4.14Å; F184-L188 HydrophobicContact CE1-CD1 3.44Å; F184-L188 VanDerWaalsContact CE1-CD1 3.44Å; F184-L188 HydrophobicContact CE1-CD2 4.33Å; F184-L188 HydrophobicContact CE1-CG 3.87Å; F184-L188 HydrophobicContact CZ-CD1 4.13Å; F184-L188 HydrophobicContact CZ-CD2 4.21Å; F184-L188 HydrophobicContact CZ-CG 4.18Å; F184-L188 WeakPolarHBondContact O-CG 3.45Å; F184-L188 PolarHBondContact O-N 3.04Å; F184-V319 HydrophobicContact CE1-CG1 4.05Å; F184-V319 HydrophobicContact CZ-CG1 3.86Å; F184-D323 HydrophobicContact CD1-CB 3.89Å; F184-D323 HydrophobicContact CE1-CB 3.48Å; F184-D323 VanDerWaalsContact CE1-CB 3.48Å; F184-D323 HydrophobicContact CE2-CB 4.2Å; F184-D323 HydrophobicContact CG-CB 4.39Å; F184-D323 HydrophobicContact CZ-CB 3.68Å; F184-E326 VanDerWaalsContact CB-OE1 3.3Å; F184-E326 WeakPolarHBondContact CB-OE1 3.31Å; F184-I327 HydrophobicContact CD1-CD1 4.22Å; F184-I327 HydrophobicContact CD1-CG1 4.01Å; F184-I327 HydrophobicContact CE1-CD1 3.8Å; F184-I327 HydrophobicContact CE1-CG1 4.11Å
185L54.3Low49Very low34 Ų3483.8 Ų83.818%0.17849%0.491CS..Hα-helixtrans-64.8-39.9172-81-162.5000111.8D182 R187 L188 R189 I327 D330 V331D182-L185 PolarHBondContact O-N 2.86Å; L185-R187 PolarHBondContact O-N 3.3Å; L185-L188 PolarHBondContact O-N 3.41Å; L185-R189 WeakPolarHBondContact O-CB 3.45Å; L185-R189 PolarHBondContact O-N 3.14Å; L185-I327 HydrophobicContact CD2-CB 4.36Å; L185-I327 HydrophobicContact CD2-CG1 4Å; L185-I327 HydrophobicContact CD2-CG2 4.13Å; L185-D330 HydrophobicContact CD1-CB 3.38Å; L185-D330 WeakPolarHBondContact CD1-OD2 3.45Å; L185-D330 HydrophobicContact CG-CB 4.29Å; L185-V331 HydrophobicContact CD1-CG2 4.38Å
186H58Low49.8Very low141 Ų14179.5 Ų79.565%0.65346%0.459SS*.Hα-helixtrans-64.9-23173-167.4-64.2000112.6D182 P190D182-H186 PolarHBondContact O-N 3.33Å; D182-H186 VanDerWaalsContact O-N 3.11Å; H186-P190 WeakPolarHBondContact O-CD 3.47Å
187R56.2Low50.5Low167 Ų16775.4 Ų75.463%0.6343%0.427SS*.Hα-helixtrans-82.9-39.1174.4179.5-176.2-60-125-2.4112.4P183 F184 L185 P190 M191P183-R187 VanDerWaalsContact O-CB 3.25Å; P183-R187 WeakPolarHBondContact O-CB 3.39Å; P183-R187 PolarHBondContact O-N 3.01Å; F184-R187 CarbonylContact O-C 3.48Å; F184-R187 WeakPolarHBondContact O-CA 3.26Å; F184-R187 WeakPolarHBondContact O-CB 3.47Å; F184-R187 PolarHBondContact O-N 3.34Å; F184-R187 VanDerWaalsContact O-N 3.07Å; L185-R187 PolarHBondContact O-N 3.3Å; R187-P190 WeakPolarHBondContact O-CD 3.44Å; R187-P190 WeakPolarHBondContact O-CG 3.46Å; R187-M191 HydrophobicContact CG-CE 4.22Å; R187-M191 WeakPolarHBondContact O-CE 3.42Å
188L53.5Low51.2Low4 Ų477.4 Ų77.42%0.02142%0.419CS..Hα-helixtrans-73.1-37.9176.3-71.5-172.5000111.9F184 L185 M191 L192 M311 L315 I327F184-L188 HydrophobicContact CD1-CD1 3.83Å; F184-L188 HydrophobicContact CD1-CG 4.14Å; F184-L188 HydrophobicContact CE1-CD1 3.44Å; F184-L188 VanDerWaalsContact CE1-CD1 3.44Å; F184-L188 HydrophobicContact CE1-CD2 4.33Å; F184-L188 HydrophobicContact CE1-CG 3.87Å; F184-L188 HydrophobicContact CZ-CD1 4.13Å; F184-L188 HydrophobicContact CZ-CD2 4.21Å; F184-L188 HydrophobicContact CZ-CG 4.18Å; F184-L188 WeakPolarHBondContact O-CG 3.45Å; F184-L188 PolarHBondContact O-N 3.04Å; L185-L188 PolarHBondContact O-N 3.41Å; L188-M191 HydrophobicContact CD2-CE 3.85Å; L188-M191 CarbonylContact O-C 3.58Å; L188-M191 WeakPolarHBondContact O-CA 3.45Å; L188-M191 WeakPolarHBondContact O-CB 3.29Å; L188-M191 PolarHBondContact O-N 3.07Å; L188-L192 HydrophobicContact CB-CD1 4.17Å; L188-L192 HydrophobicContact CB-CG 4.41Å; L188-L192 WeakPolarHBondContact O-CG 3.24Å; L188-L192 PolarHBondContact O-N 2.88Å; L188-M311 HydrophobicContact CD1-SD 4.36Å; L188-L315 HydrophobicContact CD2-CD1 3.83Å; L188-L315 HydrophobicContact CD2-CD2 4Å; L188-I327 HydrophobicContact CD1-CD1 3.63Å; L188-I327 HydrophobicContact CD1-CG1 3.92Å
189R58.4Low51.6Low125 Ų12579.5 Ų79.547%0.47243%0.426SS..Hα-helixtrans-47-55.7-179.7-178.5-174.8145.9151.54113.3L185 M191 L192 S193 R350L185-R189 WeakPolarHBondContact O-CB 3.45Å; L185-R189 PolarHBondContact O-N 3.14Å; R189-M191 PolarHBondContact O-N 3.33Å; R189-L192 PolarHBondContact O-N 3.05Å; R189-S193 VanDerWaalsContact O-CB 3.25Å; R189-S193 WeakPolarHBondContact O-CB 3.28Å; R189-S193 PolarHBondContact O-N 2.81Å; R189-S193 PolarHBondContact O-OG 2.57Å; R189-R350 PolarHBondContact NE-O 2.86Å; R189-R350 PolarHBondContact NH1-O 3.44Å; R189-R350 PolarHBondContact NH1-OXT 2.79Å
190P53.1Low52.5Low75 Ų7574.8 Ų74.849%0.48739%0.393SS..Hα-helixtrans-62.9-24.617825.6-35.3000113.5H186 R187 S194H186-P190 WeakPolarHBondContact O-CD 3.47Å; R187-P190 WeakPolarHBondContact O-CD 3.44Å; R187-P190 WeakPolarHBondContact O-CG 3.46Å; P190-S194 WeakPolarHBondContact O-CB 3.38Å; P190-S194 PolarHBondContact O-N 3.46Å
191M49.7Very low53.2Low85 Ų8571.8 Ų71.842%0.41939%0.391SS..Hα-helixtrans-83.1-35.3175.9-63.9-171.3-73.400112.6R187 L188 R189 S194 A195 L315R187-M191 HydrophobicContact CG-CE 4.22Å; R187-M191 WeakPolarHBondContact O-CE 3.42Å; L188-M191 HydrophobicContact CD2-CE 3.85Å; L188-M191 CarbonylContact O-C 3.58Å; L188-M191 WeakPolarHBondContact O-CA 3.45Å; L188-M191 WeakPolarHBondContact O-CB 3.29Å; L188-M191 PolarHBondContact O-N 3.07Å; R189-M191 PolarHBondContact O-N 3.33Å; M191-S194 CarbonylContact O-C 3.57Å; M191-S194 PolarHBondContact O-N 3.17Å; M191-A195 WeakPolarHBondContact O-CB 3.34Å; M191-A195 PolarHBondContact O-N 3.3Å; M191-L315 HydrophobicContact CB-CD2 4.43Å; M191-L315 HydrophobicContact CE-CD2 3.42Å; M191-L315 VanDerWaalsContact CE-CD2 3.42Å; M191-L315 HydrophobicContact SD-CD2 3.59Å; M191-L315 VanDerWaalsContact SD-CD2 3.59Å
192L56.7Low54.1Low14 Ų1469.6 Ų69.67%0.07337%0.37CS..Hα-helixtrans-71.9-40.7171.9-63.1177.3000110.7L188 R189 S194 A195 F196 M311 M347 M348L188-L192 HydrophobicContact CB-CD1 4.17Å; L188-L192 HydrophobicContact CB-CG 4.41Å; L188-L192 WeakPolarHBondContact O-CG 3.24Å; L188-L192 PolarHBondContact O-N 2.88Å; R189-L192 PolarHBondContact O-N 3.05Å; L192-S194 VanDerWaalsContact C-N 3.29Å; L192-S194 PolarHBondContact O-N 3.18Å; L192-A195 PolarHBondContact O-N 3.34Å; L192-F196 WeakPolarHBondContact O-CA 3.32Å; L192-F196 WeakPolarHBondContact O-CB 3.48Å; L192-F196 PolarHBondContact O-N 3.16Å; L192-M311 HydrophobicContact CD2-CE 3.83Å; L192-M311 HydrophobicContact CD2-SD 4.23Å; L192-M347 HydrophobicContact CD1-CE 4.45Å; L192-M347 HydrophobicContact CD1-SD 4.38Å; L192-M348 HydrophobicContact CB-SD 4.27Å
193S53.6Low54.7Low40 Ų4071.5 Ų71.528%0.2837%0.373SS..Hα-helixtrans-66.7-27.5169.2-56.70000112.6R189 G197R189-S193 VanDerWaalsContact O-CB 3.25Å; R189-S193 WeakPolarHBondContact O-CB 3.28Å; R189-S193 PolarHBondContact O-N 2.81Å; R189-S193 PolarHBondContact O-OG 2.57Å; S193-G197 CarbonylContact O-C 3.59Å; S193-G197 WeakPolarHBondContact O-CA 3.46Å; S193-G197 PolarHBondContact O-N 2.92Å
194S51.3Low55Low77 Ų7771.6 Ų71.654%0.53837%0.373SS..Hα-helixtrans-81-17.6171.5-178.80000113.7P190 M191 L192 R200P190-S194 WeakPolarHBondContact O-CB 3.38Å; P190-S194 PolarHBondContact O-N 3.46Å; M191-S194 CarbonylContact O-C 3.57Å; M191-S194 PolarHBondContact O-N 3.17Å; L192-S194 VanDerWaalsContact C-N 3.29Å; L192-S194 PolarHBondContact O-N 3.18Å; S194-R200 WeakPolarHBondContact O-CB 3.3Å
195A52Low55.7Low29 Ų2974.5 Ų74.524%0.2439%0.388CS..Hα-helixtrans-95.8-31.3174.400000113M191 L192 R200 L314M191-A195 WeakPolarHBondContact O-CB 3.34Å; M191-A195 PolarHBondContact O-N 3.3Å; L192-A195 PolarHBondContact O-N 3.34Å; A195-R200 VanDerWaalsContact O-CD 3.28Å; A195-R200 WeakPolarHBondContact O-CD 3.34Å; A195-R200 PolarHBondContact O-NH1 2.71Å; A195-L314 HydrophobicContact CB-CD2 4.43Å
196F54.8Low56.4Low34 Ų3473.5 Ų73.515%0.14938%0.382CS..Hα-helixtrans-142.92.4-168.3-53.6-73.9000114.8L192 A290 F294 L314 M348L192-F196 WeakPolarHBondContact O-CA 3.32Å; L192-F196 WeakPolarHBondContact O-CB 3.48Å; L192-F196 PolarHBondContact O-N 3.16Å; F196-A290 HydrophobicContact CD1-CB 4.14Å; F196-A290 HydrophobicContact CE1-CB 4.09Å; F196-F294 AromaticContact CE2-CE2 3.98Å; F196-F294 HydrophobicContact CE2-CE2 3.98Å; F196-F294 AromaticContact CE2-CZ 3.96Å; F196-F294 HydrophobicContact CE2-CZ 3.96Å; F196-F294 AromaticContact CZ-CE2 3.71Å; F196-F294 HydrophobicContact CZ-CE2 3.71Å; F196-F294 HydrophobicContact CZ-CZ 4.17Å; F196-L314 HydrophobicContact CE2-CD1 3.68Å; F196-L314 HydrophobicContact CE2-CD2 3.79Å; F196-L314 HydrophobicContact CE2-CG 4.39Å; F196-L314 HydrophobicContact CZ-CD1 3.94Å; F196-L314 HydrophobicContact CZ-CD2 3.58Å; F196-L314 HydrophobicContact CZ-CG 4.41Å; F196-M348 HydrophobicContact CB-CE 4.19Å; F196-M348 HydrophobicContact CB-SD 4.35Å; F196-M348 HydrophobicContact CD2-CE 3.78Å; F196-M348 HydrophobicContact CE2-CE 4.47Å; F196-M348 HydrophobicContact CG-CE 4.16Å
197G48.6Very low57.2Low15 Ų1569.7 Ų69.716%0.15537%0.366CS..SBendtrans-106.7177.1-178.700000113.7S193 D199 R200S193-G197 CarbonylContact O-C 3.59Å; S193-G197 WeakPolarHBondContact O-CA 3.46Å; S193-G197 PolarHBondContact O-N 2.92Å; G197-D199 PolarHBondContact O-N 2.99Å; G197-D199 VanDerWaalsContact O-N 3.11Å; G197-R200 WeakPolarHBondContact O-CB 3.46Å; G197-R200 WeakPolarHBondContact O-CG 3.24Å; G197-R200 PolarHBondContact O-N 2.85Å; G197-R200 VanDerWaalsContact O-N 3.09Å
198Q49.4Very low58.1Low106 Ų10665.2 Ų65.250%0.49535%0.352SS..THydrogen-bonded Turntrans-71.4-7.4-165.4-55.6-174.9-69.500115.7L275 A276Q198-L275 HydrophobicContact CB-CB 4.29Å; Q198-L275 WeakPolarHBondContact CG-O 3Å; Q198-L275 PolarHBondContact NE2-O 3.09Å; Q198-L275 WeakPolarHBondContact O-CB 3.32Å; Q198-L275 WeakPolarHBondContact O-CD1 3.19Å; Q198-A276 PolarHBondContact NE2-O 3.17Å
199D45.6Very low59.1Low161 Ų16170.9 Ų70.986%0.86138%0.378SS*.THydrogen-bonded Turntrans-108.812.9175.2-76.8-52.3000112.3G197G197-D199 PolarHBondContact O-N 2.99Å; G197-D199 VanDerWaalsContact O-N 3.11Å
200R62.3Low59.9Low22 Ų2265 Ų658%0.08336%0.356CS..PPolyproline II helixtrans-68.3143.6177.176.8175.6-175.6-170.4-11.5111.5S194 A195 G197 L202 E206 L275S194-R200 WeakPolarHBondContact O-CB 3.3Å; A195-R200 VanDerWaalsContact O-CD 3.28Å; A195-R200 WeakPolarHBondContact O-CD 3.34Å; A195-R200 PolarHBondContact O-NH1 2.71Å; G197-R200 WeakPolarHBondContact O-CB 3.46Å; G197-R200 WeakPolarHBondContact O-CG 3.24Å; G197-R200 PolarHBondContact O-N 2.85Å; G197-R200 VanDerWaalsContact O-N 3.09Å; R200-L202 PolarHBondContact O-N 2.94Å; R200-E206 IonicContact CZ-OE1 2.69Å; R200-E206 IonicContact CZ-OE2 3.29Å; R200-E206 IonicContact NE-OE1 2.79Å; R200-E206 PolarHBondContact NE-OE1 2.73Å; R200-E206 IonicContact NE-OE2 3.4Å; R200-E206 PolarHBondContact NE-OE2 2.92Å; R200-E206 IonicContact NH2-OE1 3.33Å; R200-E206 PolarHBondContact NH2-OE1 3.41Å; R200-E206 IonicContact NH2-OE2 3.22Å; R200-E206 PolarHBondContact NH2-OE2 2.97Å; R200-L275 HydrophobicContact CG-CD2 4.25Å
201S57.5Low61.2Low114 Ų11467.1 Ų67.180%0.79735%0.354SS*.PPolyproline II helixtrans-65.1130162.5-164.70000108.3R203S201-R203 PolarHBondContact O-N 3.42Å
202L62.9Low62.6Low23 Ų2368.9 Ų68.912%0.1236%0.362CS..PPolyproline II helixtrans-54.9132.1-175-65.5161.3000110.9R200 E206 I207 L210 V267 L275R200-L202 PolarHBondContact O-N 2.94Å; L202-E206 HydrophobicContact CB-CB 4.29Å; L202-E206 HydrophobicContact CD2-CB 4.07Å; L202-I207 HydrophobicContact CB-CD1 4.25Å; L202-I207 HydrophobicContact CB-CG1 3.75Å; L202-I207 WeakPolarHBondContact O-CD1 3.39Å; L202-L210 HydrophobicContact CD1-CD1 3.64Å; L202-V267 HydrophobicContact CD1-CG1 3.61Å; L202-L275 HydrophobicContact CD2-CD1 4.44Å
203R64.1Low63.6Low97 Ų9768.9 Ų68.937%0.36636%0.363SS..PPolyproline II helixtrans-68157.5175.8-57.3-155.2-52.7179.62.3110.6S201 E205 E206 I207 E293S201-R203 PolarHBondContact O-N 3.42Å; R203-E205 VanDerWaalsContact CB-OE2 3.29Å; R203-E205 WeakPolarHBondContact CB-OE2 3.5Å; R203-E205 IonicContact CZ-OE2 3.69Å; R203-E205 IonicContact NE-OE2 2.71Å; R203-E205 PolarHBondContact O-N 2.97Å; R203-E205 VanDerWaalsContact O-N 3.08Å; R203-E206 HydrophobicContact CB-CG 4.49Å; R203-E206 WeakPolarHBondContact CB-OE2 3.31Å; R203-E206 WeakPolarHBondContact CG-OE2 3.25Å; R203-E206 PolarHBondContact N-OE2 3.47Å; R203-E206 PolarHBondContact O-N 3.27Å; R203-I207 WeakPolarHBondContact O-CG1 3.38Å; R203-I207 PolarHBondContact O-N 3.47Å; R203-E293 IonicContact NH1-OE2 3.37Å
204P63.8Low64.8Low97 Ų9767.7 Ų67.763%0.6335%0.353SS*.Hα-helixtrans-54.3-31.2178.1-26.135.8000113.8E208P204-E208 PolarHBondContact O-N 2.83Å
205E64.1Low66.2Low105 Ų10569.8 Ų69.849%0.49135%0.349SS..Hα-helixtrans-69-45.4176.6-58.172.4-15100111.7R203 I207 E208 E209R203-E205 VanDerWaalsContact CB-OE2 3.29Å; R203-E205 WeakPolarHBondContact CB-OE2 3.5Å; R203-E205 IonicContact CZ-OE2 3.69Å; R203-E205 IonicContact NE-OE2 2.71Å; R203-E205 PolarHBondContact O-N 2.97Å; R203-E205 VanDerWaalsContact O-N 3.08Å; E205-I207 VanDerWaalsContact C-N 3.33Å; E205-I207 PolarHBondContact O-N 3.42Å; E205-E208 PolarHBondContact O-N 3.4Å; E205-E209 PolarHBondContact O-N 3.14Å
206E69.5Low67.5Low12 Ų1273.4 Ų73.46%0.05636%0.361CS..Hα-helixtrans-65.5-37.4176.9-63.3169116.400111.2R200 L202 R203 E209 L210R200-E206 IonicContact CZ-OE1 2.69Å; R200-E206 IonicContact CZ-OE2 3.29Å; R200-E206 IonicContact NE-OE1 2.79Å; R200-E206 PolarHBondContact NE-OE1 2.73Å; R200-E206 IonicContact NE-OE2 3.4Å; R200-E206 PolarHBondContact NE-OE2 2.92Å; R200-E206 IonicContact NH2-OE1 3.33Å; R200-E206 PolarHBondContact NH2-OE1 3.41Å; R200-E206 IonicContact NH2-OE2 3.22Å; R200-E206 PolarHBondContact NH2-OE2 2.97Å; L202-E206 HydrophobicContact CB-CB 4.29Å; L202-E206 HydrophobicContact CD2-CB 4.07Å; R203-E206 HydrophobicContact CB-CG 4.49Å; R203-E206 WeakPolarHBondContact CB-OE2 3.31Å; R203-E206 WeakPolarHBondContact CG-OE2 3.25Å; R203-E206 PolarHBondContact N-OE2 3.47Å; R203-E206 PolarHBondContact O-N 3.27Å; E206-E209 PolarHBondContact O-N 3.2Å; E206-L210 WeakPolarHBondContact O-CG 3.48Å; E206-L210 PolarHBondContact O-N 3.5Å
207I74.5Confident68.4Low61 Ų6172.7 Ų72.731%0.31336%0.358SS..Hα-helixtrans-64.9-41174.9-64.8169.8000110.8L202 R203 E205 L210 R211 F263L202-I207 HydrophobicContact CB-CD1 4.25Å; L202-I207 HydrophobicContact CB-CG1 3.75Å; L202-I207 WeakPolarHBondContact O-CD1 3.39Å; R203-I207 WeakPolarHBondContact O-CG1 3.38Å; R203-I207 PolarHBondContact O-N 3.47Å; E205-I207 VanDerWaalsContact C-N 3.33Å; E205-I207 PolarHBondContact O-N 3.42Å; I207-L210 PolarHBondContact O-N 3.38Å; I207-R211 VanDerWaalsContact O-CB 3.26Å; I207-R211 WeakPolarHBondContact O-CB 3.48Å; I207-R211 PolarHBondContact O-N 2.93Å; I207-F263 HydrophobicContact CG2-CE1 4.39Å; I207-F263 HydrophobicContact CG2-CZ 4.07Å
208E74.9Confident70Confident73 Ų7372.6 Ų72.634%0.34135%0.354SS..Hα-helixtrans-72.9-30.8176.4-165.466.7-150.700111.8P204 E205 R211 E212 R215P204-E208 PolarHBondContact O-N 2.83Å; E205-E208 PolarHBondContact O-N 3.4Å; E208-R211 CarbonylContact O-C 3.59Å; E208-R211 WeakPolarHBondContact O-CB 3.22Å; E208-R211 PolarHBondContact O-N 3.07Å; E208-R211 IonicContact OE1-NH1 3.87Å; E208-R211 WeakPolarHBondContact OE2-CD 3.37Å; E208-R211 IonicContact OE2-CZ 2.73Å; E208-R211 IonicContact OE2-NE 3.84Å; E208-R211 IonicContact OE2-NH1 3.41Å; E208-R211 PolarHBondContact OE2-NH1 3.11Å; E208-E212 WeakPolarHBondContact O-CG 3.38Å; E208-E212 PolarHBondContact O-N 3.19Å; E208-R215 IonicContact OE1-NH2 2.87Å
209E74Confident71.1Confident124 Ų12474.8 Ų74.858%0.57936%0.362SS*.Hα-helixtrans-62.8-47169-73.7-170.5-16500111.8E205 E206 R211 E212 A213E205-E209 PolarHBondContact O-N 3.14Å; E206-E209 PolarHBondContact O-N 3.2Å; E209-R211 PolarHBondContact O-N 3.17Å; E209-E212 PolarHBondContact O-N 2.91Å; E209-A213 WeakPolarHBondContact O-CB 3.43Å; E209-A213 PolarHBondContact O-N 3.43Å
210L75.9Confident72.7Confident1 Ų172.8 Ų72.81%0.00535%0.351CS..Hα-helixtrans-59.9-32.8172.2-74.2169.6000112L202 E206 I207 F214 M237 F266 V267 M270 L274L202-L210 HydrophobicContact CD1-CD1 3.64Å; E206-L210 WeakPolarHBondContact O-CG 3.48Å; E206-L210 PolarHBondContact O-N 3.5Å; I207-L210 PolarHBondContact O-N 3.38Å; L210-F214 WeakPolarHBondContact O-CB 3.43Å; L210-F214 PolarHBondContact O-N 3.4Å; L210-M237 HydrophobicContact CD2-SD 3.93Å; L210-F266 HydrophobicContact CB-CE1 4.13Å; L210-F266 HydrophobicContact CD2-CE1 3.8Å; L210-F266 HydrophobicContact CD2-CZ 4.43Å; L210-F266 WeakPolarHBondContact O-CE1 3.31Å; L210-V267 HydrophobicContact CD1-CG2 4.26Å; L210-M270 HydrophobicContact CD2-CB 3.86Å; L210-L274 HydrophobicContact CD2-CD1 3.83Å; L210-L274 HydrophobicContact CG-CD1 4.25Å
211R79.9Confident73.4Confident119 Ų11979.4 Ų79.445%0.44938%0.381SS..Hα-helixtrans-77.3-36.3178.4-164-170.6-169.4-176.87.7113.7I207 E208 E209 R215 F263I207-R211 VanDerWaalsContact O-CB 3.26Å; I207-R211 WeakPolarHBondContact O-CB 3.48Å; I207-R211 PolarHBondContact O-N 2.93Å; E208-R211 CarbonylContact O-C 3.59Å; E208-R211 WeakPolarHBondContact O-CB 3.22Å; E208-R211 PolarHBondContact O-N 3.07Å; E208-R211 IonicContact OE1-NH1 3.87Å; E208-R211 WeakPolarHBondContact OE2-CD 3.37Å; E208-R211 IonicContact OE2-CZ 2.73Å; E208-R211 IonicContact OE2-NE 3.84Å; E208-R211 IonicContact OE2-NH1 3.41Å; E208-R211 PolarHBondContact OE2-NH1 3.11Å; E209-R211 PolarHBondContact O-N 3.17Å; R211-R215 WeakPolarHBondContact O-CB 3.46Å; R211-R215 PolarHBondContact O-N 3.49Å; R211-R215 VanDerWaalsContact O-N 3.07Å; R211-F263 HydrophobicContact CB-CE2 3.68Å; R211-F263 HydrophobicContact CB-CZ 3.78Å; R211-F263 HydrophobicContact CG-CD2 4.49Å; R211-F263 HydrophobicContact CG-CE2 3.89Å; R211-F263 HydrophobicContact CG-CZ 3.99Å
212E78.9Confident74.4Confident123 Ų12377.9 Ų77.958%0.57536%0.364SS*.Hα-helixtrans-65.3-42.9169.8-72.2-151.2144.400110.2E208 E209 R215 E216E208-E212 WeakPolarHBondContact O-CG 3.38Å; E208-E212 PolarHBondContact O-N 3.19Å; E209-E212 PolarHBondContact O-N 2.91Å; E212-R215 PolarHBondContact O-N 2.76Å; E212-E216 PolarHBondContact O-N 3.09Å; E212-E216 VanDerWaalsContact O-N 3.1Å
213A77.8Confident75.2Confident13 Ų1378.3 Ų78.311%0.10737%0.373CS..Hα-helixtrans-58.2-54.8171.600000111E209 R215 E216 F217 M237E209-A213 WeakPolarHBondContact O-CB 3.43Å; E209-A213 PolarHBondContact O-N 3.43Å; A213-R215 PolarHBondContact O-N 2.87Å; A213-R215 VanDerWaalsContact O-N 3.16Å; A213-E216 WeakPolarHBondContact O-CA 3.23Å; A213-E216 WeakPolarHBondContact O-CB 3.24Å; A213-E216 PolarHBondContact O-N 3.3Å; A213-F217 WeakPolarHBondContact O-CD2 3.08Å; A213-F217 PolarHBondContact O-N 3.39Å; A213-M237 HydrophobicContact CB-CG 3.9Å; A213-M237 HydrophobicContact CB-SD 3.56Å; A213-M237 VanDerWaalsContact CB-SD 3.56Å
214F78.5Confident76Confident15 Ų1578.7 Ų78.77%0.06638%0.375CS..Hα-helixtrans-50.4-45.7179.1-170-82.9000111.9L210 E216 F217 D218 G223 I225 D262 F263 F266L210-F214 WeakPolarHBondContact O-CB 3.43Å; L210-F214 PolarHBondContact O-N 3.4Å; F214-E216 VanDerWaalsContact C-N 3.3Å; F214-E216 PolarHBondContact O-N 3.32Å; F214-F217 PolarHBondContact O-N 3.09Å; F214-D218 HydrophobicContact CD1-CB 4.19Å; F214-D218 HydrophobicContact CE1-CB 4Å; F214-D218 WeakPolarHBondContact O-CB 3.33Å; F214-D218 PolarHBondContact O-N 3.15Å; F214-G223 WeakPolarHBondContact CZ-O 3.25Å; F214-I225 HydrophobicContact CB-CD1 4.37Å; F214-I225 HydrophobicContact CD1-CD1 4.4Å; F214-I225 HydrophobicContact CD2-CD1 3.32Å; F214-I225 HydrophobicContact CD2-CG1 4.01Å; F214-I225 HydrophobicContact CE1-CG1 4.44Å; F214-I225 HydrophobicContact CE2-CB 4.44Å; F214-I225 HydrophobicContact CE2-CD1 3.54Å; F214-I225 HydrophobicContact CE2-CG1 3.69Å; F214-I225 HydrophobicContact CG-CD1 3.8Å; F214-I225 HydrophobicContact CZ-CD1 4.17Å; F214-I225 HydrophobicContact CZ-CG1 3.93Å; F214-D262 WeakPolarHBondContact CE2-O 3.42Å; F214-F263 HydrophobicContact CB-CD2 3.95Å; F214-F263 HydrophobicContact CB-CE2 4.33Å; F214-F263 HydrophobicContact CD1-CD2 4.4Å; F214-F263 HydrophobicContact CD2-CB 4.41Å; F214-F263 AromaticContact CD2-CD2 3.95Å; F214-F263 HydrophobicContact CD2-CD2 3.95Å; F214-F263 HydrophobicContact CE2-CB 4.25Å; F214-F263 AromaticContact CG-CD2 3.84Å; F214-F263 HydrophobicContact CG-CD2 3.84Å; F214-F263 HydrophobicContact CZ-CB 4.3Å; F214-F266 HydrophobicContact CB-CD1 4.38Å; F214-F266 HydrophobicContact CB-CE1 4.32Å; F214-F266 HydrophobicContact CD2-CB 3.78Å; F214-F266 AromaticContact CD2-CD1 3.83Å; F214-F266 HydrophobicContact CD2-CD1 3.83Å; F214-F266 HydrophobicContact CD2-CD2 4.16Å; F214-F266 HydrophobicContact CD2-CE1 4.43Å; F214-F266 AromaticContact CD2-CG 3.67Å; F214-F266 HydrophobicContact CD2-CG 3.67Å; F214-F266 HydrophobicContact CE2-CB 3.9Å; F214-F266 HydrophobicContact CE2-CG 4.24Å
215R80.8Confident76.8Confident122 Ų12274.1 Ų74.146%0.4635%0.346SS..Hα-helixtrans-67.6-21.2177.8-166.2-171.6-60.7141.75.4114.4E208 R211 E212 A213E208-R215 IonicContact OE1-NH2 2.87Å; R211-R215 WeakPolarHBondContact O-CB 3.46Å; R211-R215 PolarHBondContact O-N 3.49Å; R211-R215 VanDerWaalsContact O-N 3.07Å; E212-R215 PolarHBondContact O-N 2.76Å; A213-R215 PolarHBondContact O-N 2.87Å; A213-R215 VanDerWaalsContact O-N 3.16Å
216E79.4Confident77.4Confident104 Ų10472.4 Ų72.449%0.48634%0.34SS..Hα-helixtrans-79.2-29.5173.6-168.4175.9149.700112E212 A213 F214E212-E216 PolarHBondContact O-N 3.09Å; E212-E216 VanDerWaalsContact O-N 3.1Å; A213-E216 WeakPolarHBondContact O-CA 3.23Å; A213-E216 WeakPolarHBondContact O-CB 3.24Å; A213-E216 PolarHBondContact O-N 3.3Å; F214-E216 VanDerWaalsContact C-N 3.3Å; F214-E216 PolarHBondContact O-N 3.32Å
217F75.1Confident77.5Confident19 Ų1973.3 Ų73.38%0.08335%0.347CS..Hα-helixtrans-92.9-36.9-179.7-68.6-79.8000113.5A213 F214 K219 I225 N232 C233 T236A213-F217 WeakPolarHBondContact O-CD2 3.08Å; A213-F217 PolarHBondContact O-N 3.39Å; F214-F217 PolarHBondContact O-N 3.09Å; F217-K219 VanDerWaalsContact C-N 3.29Å; F217-K219 PolarHBondContact O-N 2.88Å; F217-I225 HydrophobicContact CB-CD1 3.94Å; F217-I225 HydrophobicContact CB-CG1 4.44Å; F217-N232 HydrophobicContact CE1-CB 4.06Å; F217-C233 HydrophobicContact CB-CB 4.32Å; F217-C233 HydrophobicContact CD1-CB 3.83Å; F217-C233 HydrophobicContact CD2-CB 3.48Å; F217-C233 VanDerWaalsContact CD2-CB 3.48Å; F217-C233 WeakPolarHBondContact CD2-SG 3.29Å; F217-C233 HydrophobicContact CE1-CB 4.14Å; F217-C233 HydrophobicContact CE2-CB 3.85Å; F217-C233 HydrophobicContact CG-CB 3.54Å; F217-C233 VanDerWaalsContact CZ-CA 3.49Å; F217-C233 HydrophobicContact CZ-CB 4.18Å; F217-T236 HydrophobicContact CE2-CG2 4.19Å; F217-T236 HydrophobicContact CZ-CG2 3.97Å; F217-T236 WeakPolarHBondContact CZ-OG1 3.37Å
218D80.6Confident77.5Confident14 Ų1480.7 Ų80.78%0.07537%0.371CS..  trans-72.480.5167.4179.411.8000110.4F214 K221 D222 G223 I225F214-D218 HydrophobicContact CD1-CB 4.19Å; F214-D218 HydrophobicContact CE1-CB 4Å; F214-D218 WeakPolarHBondContact O-CB 3.33Å; F214-D218 PolarHBondContact O-N 3.15Å; D218-K221 WeakPolarHBondContact OD1-CA 3.45Å; D218-K221 PolarHBondContact OD1-N 2.93Å; D218-K221 WeakPolarHBondContact OD2-CA 3.43Å; D218-D222 PolarHBondContact OD1-N 3.1Å; D218-D222 VanDerWaalsContact OD1-N 3.1Å; D218-G223 WeakPolarHBondContact OD2-CA 3.41Å; D218-G223 PolarHBondContact OD2-N 2.85Å; D218-G223 VanDerWaalsContact OD2-N 3.09Å; D218-I225 HydrophobicContact CB-CG1 4.47Å
219K74Confident77.7Confident152 Ų15279.5 Ų79.566%0.66137%0.367SS*.SBendtrans-78.7-32.1-177.5-71.4168.1-174.5154.60112.3F217 K221F217-K219 VanDerWaalsContact C-N 3.29Å; F217-K219 PolarHBondContact O-N 2.88Å; K219-K221 VanDerWaalsContact C-N 3.27Å
220D77.4Confident77.9Confident118 Ų11873.8 Ų73.863%0.63134%0.341SS*.SBendtrans-65.8-33.4174.8-39.355.7000110.9D222D220-D222 VanDerWaalsContact C-N 3.27Å; D220-D222 HydrophobicContact CB-CB 4.13Å
221K77.8Confident78Confident162 Ų16273.9 Ų73.970%0.70434%0.341SS*.  trans60.937.4-167.1-55.5-177.7-177.5-178.90111.9D218 K219 G223D218-K221 WeakPolarHBondContact OD1-CA 3.45Å; D218-K221 PolarHBondContact OD1-N 2.93Å; D218-K221 WeakPolarHBondContact OD2-CA 3.43Å; K219-K221 VanDerWaalsContact C-N 3.27Å; K221-G223 VanDerWaalsContact C-N 3.29Å
222D79.1Confident78Confident82 Ų8271.7 Ų71.744%0.43934%0.338SS..SBendtrans-83.7-10.6175.978.7-11.4000112.3D218 D220 Y224D218-D222 PolarHBondContact OD1-N 3.1Å; D218-D222 VanDerWaalsContact OD1-N 3.1Å; D220-D222 VanDerWaalsContact C-N 3.27Å; D220-D222 HydrophobicContact CB-CB 4.13Å; D222-Y224 WeakPolarHBondContact O-CD2 3.42Å; D222-Y224 PolarHBondContact OD1-N 2.8Å
223G78.8Confident77.9Confident31 Ų3165.8 Ų65.832%0.3231%0.311SS..SBendtrans91.77.8-179.700000114F214 D218 K221F214-G223 WeakPolarHBondContact CZ-O 3.25Å; D218-G223 WeakPolarHBondContact OD2-CA 3.41Å; D218-G223 PolarHBondContact OD2-N 2.85Å; D218-G223 VanDerWaalsContact OD2-N 3.09Å; K221-G223 VanDerWaalsContact C-N 3.29Å
224Y81.9Confident77.8Confident105 Ų10565.2 Ų65.241%0.41231%0.306SS..  trans-131.8148.2-175-59.5-75.6000113D222 H260 V261 D262D222-Y224 WeakPolarHBondContact O-CD2 3.42Å; D222-Y224 PolarHBondContact OD1-N 2.8Å; Y224-H260 HydrophobicContact CD1-CB 3.75Å; Y224-H260 HydrophobicContact CE1-CB 4.43Å; Y224-H260 HydrophobicContact CG-CB 4.06Å; Y224-V261 CarbonylContact C-O 3.53Å; Y224-V261 VanDerWaalsContact CA-O 3.29Å; Y224-V261 WeakPolarHBondContact CA-O 3.49Å; Y224-D262 HydrophobicContact CD1-CB 4.07Å; Y224-D262 HydrophobicContact CE1-CB 3.93Å
225I80Confident77.8Confident2 Ų270.4 Ų70.41%0.0133%0.325CS..EExtended strand (participates in β ladder)trans-112.3129.8171.2-65.4178.8000110F214 F217 D218 D229 L230 V261 F266F214-I225 HydrophobicContact CB-CD1 4.37Å; F214-I225 HydrophobicContact CD1-CD1 4.4Å; F214-I225 HydrophobicContact CD2-CD1 3.32Å; F214-I225 HydrophobicContact CD2-CG1 4.01Å; F214-I225 HydrophobicContact CE1-CG1 4.44Å; F214-I225 HydrophobicContact CE2-CB 4.44Å; F214-I225 HydrophobicContact CE2-CD1 3.54Å; F214-I225 HydrophobicContact CE2-CG1 3.69Å; F214-I225 HydrophobicContact CG-CD1 3.8Å; F214-I225 HydrophobicContact CZ-CD1 4.17Å; F214-I225 HydrophobicContact CZ-CG1 3.93Å; F217-I225 HydrophobicContact CB-CD1 3.94Å; F217-I225 HydrophobicContact CB-CG1 4.44Å; D218-I225 HydrophobicContact CB-CG1 4.47Å; I225-D229 HydrophobicContact CG2-CB 4.31Å; I225-L230 HydrophobicContact CG2-CB 4.11Å; I225-V261 PolarHBondContact N-O 2.92Å; I225-V261 WeakPolarHBondContact O-CG2 3.46Å; I225-V261 PolarHBondContact O-N 2.78Å; I225-F266 HydrophobicContact CD1-CD2 4.18Å; I225-F266 HydrophobicContact CD1-CE2 4.21Å
226N76.3Confident77.4Confident69 Ų6967.8 Ų67.837%0.36932%0.323SS..EExtended strand (participates in β ladder)trans-76.8145.7173.7-68-53000111.1R228 D229 L230N226-R228 PolarHBondContact O-N 3.21Å; N226-D229 PolarHBondContact O-N 3.3Å; N226-L230 PolarHBondContact O-N 3.07Å
227C71.8Confident76.7Confident30 Ų3065 Ų6520%0.20331%0.311CS..Hα-helixtrans-51.3-30.4178.9-60.90000114.5
228R74.7Confident76.2Confident217 Ų21766.4 Ų66.482%0.81933%0.33SS*.Hα-helixtrans-70.5-35.5177.6-171.1178.6-173.1-179.72.8112.7N226 N232N226-R228 PolarHBondContact O-N 3.21Å; R228-N232 PolarHBondContact O-ND2 3.08Å
229D78.9Confident75.7Confident48 Ų4866.3 Ų66.326%0.25733%0.329SS..Hα-helixtrans-86.6-29.3-179.4-65.6-66.7000111.4I225 N226 G231 N232 C233I225-D229 HydrophobicContact CG2-CB 4.31Å; N226-D229 PolarHBondContact O-N 3.3Å; D229-G231 VanDerWaalsContact C-N 3.29Å; D229-G231 PolarHBondContact O-N 3.19Å; D229-N232 CarbonylContact O-C 3.58Å; D229-N232 WeakPolarHBondContact O-CA 3.46Å; D229-N232 WeakPolarHBondContact O-CB 3.21Å; D229-N232 PolarHBondContact O-N 3.23Å; D229-C233 WeakPolarHBondContact O-CB 3.42Å; D229-C233 PolarHBondContact O-N 3.04Å
230L78.9Confident75.5Confident4 Ų466 Ų662%0.02133%0.331CS..Hα-helixtrans-52.2-45.9168.3-178.364.2000111.9I225 N226 N232 C233 M234 I253 F266 M270I225-L230 HydrophobicContact CG2-CB 4.11Å; N226-L230 PolarHBondContact O-N 3.07Å; L230-N232 PolarHBondContact O-N 2.97Å; L230-C233 VanDerWaalsContact O-CB 3.32Å; L230-C233 WeakPolarHBondContact O-CB 3.48Å; L230-C233 PolarHBondContact O-N 2.89Å; L230-C233 VanDerWaalsContact O-N 3.12Å; L230-M234 WeakPolarHBondContact O-CB 3.3Å; L230-M234 VanDerWaalsContact O-CG 3.31Å; L230-M234 WeakPolarHBondContact O-CG 3.35Å; L230-M234 PolarHBondContact O-N 2.94Å; L230-I253 HydrophobicContact CD2-CD1 3.33Å; L230-F266 HydrophobicContact CD1-CD2 3.87Å; L230-F266 HydrophobicContact CD1-CE2 3.79Å; L230-M270 HydrophobicContact CD1-SD 4.1Å
231G78.5Confident75.3Confident2 Ų260.8 Ų60.82%0.02130%0.304CS..Hα-helixtrans-68.7-12.217700000115.4D229 R235 L246D229-G231 VanDerWaalsContact C-N 3.29Å; D229-G231 PolarHBondContact O-N 3.19Å; G231-R235 VanDerWaalsContact O-CZ 3.28Å; G231-R235 PolarHBondContact O-NE 3.36Å; G231-R235 PolarHBondContact O-NH2 2.76Å; G231-L246 VanDerWaalsContact CA-CD2 3.43Å
232N78.4Confident75.5Confident73 Ų7356.7 Ų56.739%0.3929%0.293SS..Hα-helixtrans-92.2-38.6168.3-63.8-37.3000110.6F217 R228 D229 L230 M234 R235 T236F217-N232 HydrophobicContact CE1-CB 4.06Å; R228-N232 PolarHBondContact O-ND2 3.08Å; D229-N232 CarbonylContact O-C 3.58Å; D229-N232 WeakPolarHBondContact O-CA 3.46Å; D229-N232 WeakPolarHBondContact O-CB 3.21Å; D229-N232 PolarHBondContact O-N 3.23Å; L230-N232 PolarHBondContact O-N 2.97Å; N232-M234 PolarHBondContact O-N 3.38Å; N232-R235 PolarHBondContact O-N 3.2Å; N232-R235 VanDerWaalsContact O-N 3.13Å; N232-T236 PolarHBondContact O-N 3.22Å; N232-T236 PolarHBondContact O-OG1 2.87Å
233C77Confident75.6Confident0 Ų060.4 Ų60.40%031%0.307CS..Hα-helixtrans-54.5-51.9174-173.50000111.7F217 D229 L230 R235 T236 M237 F266F217-C233 HydrophobicContact CB-CB 4.32Å; F217-C233 HydrophobicContact CD1-CB 3.83Å; F217-C233 HydrophobicContact CD2-CB 3.48Å; F217-C233 VanDerWaalsContact CD2-CB 3.48Å; F217-C233 WeakPolarHBondContact CD2-SG 3.29Å; F217-C233 HydrophobicContact CE1-CB 4.14Å; F217-C233 HydrophobicContact CE2-CB 3.85Å; F217-C233 HydrophobicContact CG-CB 3.54Å; F217-C233 VanDerWaalsContact CZ-CA 3.49Å; F217-C233 HydrophobicContact CZ-CB 4.18Å; D229-C233 WeakPolarHBondContact O-CB 3.42Å; D229-C233 PolarHBondContact O-N 3.04Å; L230-C233 VanDerWaalsContact O-CB 3.32Å; L230-C233 WeakPolarHBondContact O-CB 3.48Å; L230-C233 PolarHBondContact O-N 2.89Å; L230-C233 VanDerWaalsContact O-N 3.12Å; C233-R235 VanDerWaalsContact C-N 3.29Å; C233-R235 PolarHBondContact O-N 2.83Å; C233-T236 PolarHBondContact O-N 2.98Å; C233-T236 VanDerWaalsContact O-N 3.1Å; C233-M237 WeakPolarHBondContact O-CG 3.4Å; C233-M237 PolarHBondContact O-N 3.18Å; C233-M237 VanDerWaalsContact SG-CE 3.55Å; C233-F266 VanDerWaalsContact SG-CE2 3.54Å; C233-F266 WeakPolarHBondContact SG-CZ 3.38Å
234M76.4Confident75.6Confident1 Ų164.7 Ų64.71%0.00532%0.321CS..Hα-helixtrans-46.4-51.2171.7-76.4-171.5139.700112.6L230 N232 T236 M237 G238 Y239 P241 L246 L249 M270L230-M234 WeakPolarHBondContact O-CB 3.3Å; L230-M234 VanDerWaalsContact O-CG 3.31Å; L230-M234 WeakPolarHBondContact O-CG 3.35Å; L230-M234 PolarHBondContact O-N 2.94Å; N232-M234 PolarHBondContact O-N 3.38Å; M234-T236 PolarHBondContact O-N 3.02Å; M234-M237 CarbonylContact O-C 3.58Å; M234-M237 PolarHBondContact O-N 2.78Å; M234-G238 PolarHBondContact O-N 3.09Å; M234-Y239 CarbonylContact C-O 3.16Å; M234-Y239 HydrophobicContact CB-CD1 3.83Å; M234-Y239 HydrophobicContact CE-CD1 3.64Å; M234-Y239 HydrophobicContact CE-CE1 3.39Å; M234-Y239 HydrophobicContact CG-CD1 3.83Å; M234-Y239 HydrophobicContact CG-CE1 4.38Å; M234-Y239 PolarHBondContact O-N 2.73Å; M234-Y239 VanDerWaalsContact O-O 3.05Å; M234-Y239 HydrophobicContact SD-CD1 3.71Å; M234-Y239 HydrophobicContact SD-CE1 3.64Å; M234-P241 HydrophobicContact CB-CG 4.08Å; M234-P241 HydrophobicContact SD-CB 4.12Å; M234-P241 HydrophobicContact SD-CG 3.79Å; M234-L246 HydrophobicContact SD-CD2 4.45Å; M234-L249 HydrophobicContact CE-CD1 3.39Å; M234-L249 HydrophobicContact SD-CD1 3.9Å; M234-M270 HydrophobicContact CE-CE 3.8Å; M234-M270 HydrophobicContact CE-SD 3.36Å; M234-M270 WeakPolarHBondContact CE-SD 3.41Å; M234-M270 HydrophobicContact CG-CE 3.91Å; M234-M270 HydrophobicContact CG-SD 3.72Å; M234-M270 HydrophobicContact SD-SD 4.39Å
235R78.7Confident75.5Confident123 Ų12361.4 Ų61.446%0.46431%0.309SS..Hα-helixtrans-68.5-33.5-178.9-77.3-178.2-92.4-125.8-3.3113.8G231 N232 C233 G238 Y239 M240G231-R235 VanDerWaalsContact O-CZ 3.28Å; G231-R235 PolarHBondContact O-NE 3.36Å; G231-R235 PolarHBondContact O-NH2 2.76Å; N232-R235 PolarHBondContact O-N 3.2Å; N232-R235 VanDerWaalsContact O-N 3.13Å; C233-R235 VanDerWaalsContact C-N 3.29Å; C233-R235 PolarHBondContact O-N 2.83Å; R235-G238 PolarHBondContact O-N 3.3Å; R235-Y239 WeakPolarHBondContact CA-O 3.4Å; R235-Y239 PolarHBondContact N-O 3.05Å; R235-M240 HydrophobicContact CG-CG 4.42Å
236T70.9Confident75.5Confident68 Ų6863.1 Ų63.142%0.41732%0.318SS..Hα-helixtrans-72-32.7174.5-67.60000112.2L18 F217 N232 C233 M234 G238L18-T236 HydrophobicContact CD1-CG2 4.03Å; F217-T236 HydrophobicContact CE2-CG2 4.19Å; F217-T236 HydrophobicContact CZ-CG2 3.97Å; F217-T236 WeakPolarHBondContact CZ-OG1 3.37Å; N232-T236 PolarHBondContact O-N 3.22Å; N232-T236 PolarHBondContact O-OG1 2.87Å; C233-T236 PolarHBondContact O-N 2.98Å; C233-T236 VanDerWaalsContact O-N 3.1Å; M234-T236 PolarHBondContact O-N 3.02Å; T236-G238 PolarHBondContact O-N 3.26Å
237M66.1Low75.7Confident46 Ų4663.3 Ų63.323%0.22732%0.318CS..THydrogen-bonded Turntrans-76.4-0.5170.8-63.2-176.8-61.900113.4L210 A213 C233 M234 F266 M270L210-M237 HydrophobicContact CD2-SD 3.93Å; A213-M237 HydrophobicContact CB-CG 3.9Å; A213-M237 HydrophobicContact CB-SD 3.56Å; A213-M237 VanDerWaalsContact CB-SD 3.56Å; C233-M237 WeakPolarHBondContact O-CG 3.4Å; C233-M237 PolarHBondContact O-N 3.18Å; C233-M237 VanDerWaalsContact SG-CE 3.55Å; M234-M237 CarbonylContact O-C 3.58Å; M234-M237 PolarHBondContact O-N 2.78Å; M237-F266 HydrophobicContact CE-CE2 4.28Å; M237-F266 HydrophobicContact CE-CZ 3.71Å; M237-F266 HydrophobicContact SD-CZ 3.98Å; M237-M270 HydrophobicContact CE-CE 3.45Å; M237-M270 VanDerWaalsContact CE-CE 3.45Å; M237-M270 HydrophobicContact CE-CG 4.11Å; M237-M270 HydrophobicContact CE-SD 3.96Å
238G64.4Low76.2Confident47 Ų4767.1 Ų67.149%0.48533%0.333SS..THydrogen-bonded Turntrans95-4.1174.900000115.7M234 R235 T236M234-G238 PolarHBondContact O-N 3.09Å; R235-G238 PolarHBondContact O-N 3.3Å; T236-G238 PolarHBondContact O-N 3.26Å
239Y70.2Confident76.3Confident12 Ų1257.4 Ų57.45%0.04730%0.297CS..  trans-84.9127.3176.2176.9-121000110.3M234 R235 P241 E245 K273 E277M234-Y239 CarbonylContact C-O 3.16Å; M234-Y239 HydrophobicContact CB-CD1 3.83Å; M234-Y239 HydrophobicContact CE-CD1 3.64Å; M234-Y239 HydrophobicContact CE-CE1 3.39Å; M234-Y239 HydrophobicContact CG-CD1 3.83Å; M234-Y239 HydrophobicContact CG-CE1 4.38Å; M234-Y239 PolarHBondContact O-N 2.73Å; M234-Y239 VanDerWaalsContact O-O 3.05Å; M234-Y239 HydrophobicContact SD-CD1 3.71Å; M234-Y239 HydrophobicContact SD-CE1 3.64Å; R235-Y239 WeakPolarHBondContact CA-O 3.4Å; R235-Y239 PolarHBondContact N-O 3.05Å; Y239-P241 VanDerWaalsContact C-CD 3.46Å; Y239-P241 HydrophobicContact CD1-CB 4.24Å; Y239-P241 HydrophobicContact CD1-CG 4.3Å; Y239-P241 HydrophobicContact CE1-CB 3.59Å; Y239-P241 HydrophobicContact CE1-CG 4.12Å; Y239-P241 WeakPolarHBondContact O-CD 3.23Å; Y239-E245 VanDerWaalsContact OH-CD 3.23Å; Y239-E245 PolarHBondContact OH-OE1 2.94Å; Y239-K273 HydrophobicContact CE1-CB 4.49Å; Y239-K273 HydrophobicContact CE1-CD 4.22Å; Y239-K273 HydrophobicContact CE1-CG 4.43Å; Y239-K273 HydrophobicContact CE2-CD 4.26Å; Y239-K273 WeakPolarHBondContact OH-CE 3.44Å; Y239-K273 PolarHBondContact OH-NZ 2.88Å; Y239-E277 HydrophobicContact CD2-CB 3.8Å; Y239-E277 VanDerWaalsContact CD2-CD 3.46Å; Y239-E277 HydrophobicContact CD2-CG 4.22Å; Y239-E277 WeakPolarHBondContact CD2-OE2 3.28Å; Y239-E277 HydrophobicContact CE2-CB 3.86Å; Y239-E277 HydrophobicContact CE2-CG 4.12Å; Y239-E277 VanDerWaalsContact CE2-OE1 3.29Å; Y239-E277 WeakPolarHBondContact CE2-OE1 3.33Å; Y239-E277 WeakPolarHBondContact CE2-OE2 3.08Å
240M69.7Low76.2Confident146 Ų14656.7 Ų56.772%0.71930%0.296SS*.  trans-108.477.4179.8-78.7-154.5-67.200111.2R235R235-M240 HydrophobicContact CG-CG 4.42Å
241P72.5Confident76.2Confident8 Ų862 Ų625%0.05232%0.32CS..  trans-61142.4-177.427.1-36.7000111.5M234 Y239 E245 L246M234-P241 HydrophobicContact CB-CG 4.08Å; M234-P241 HydrophobicContact SD-CB 4.12Å; M234-P241 HydrophobicContact SD-CG 3.79Å; Y239-P241 VanDerWaalsContact C-CD 3.46Å; Y239-P241 HydrophobicContact CD1-CB 4.24Å; Y239-P241 HydrophobicContact CD1-CG 4.3Å; Y239-P241 HydrophobicContact CE1-CB 3.59Å; Y239-P241 HydrophobicContact CE1-CG 4.12Å; Y239-P241 WeakPolarHBondContact O-CD 3.23Å; P241-E245 HydrophobicContact CB-CB 4.38Å; P241-L246 HydrophobicContact CB-CD1 4.45Å; P241-L246 HydrophobicContact CB-CD2 4.42Å; P241-L246 HydrophobicContact CB-CG 3.96Å; P241-L246 HydrophobicContact CG-CD1 4.05Å; P241-L246 HydrophobicContact CG-CD2 3.98Å; P241-L246 HydrophobicContact CG-CG 3.87Å
242T82.3Confident76.1Confident77 Ų7766.7 Ų66.747%0.47234%0.342SS..  trans-66.6160.816763.20000111M244 E245 L246T242-M244 PolarHBondContact O-N 2.78Å; T242-E245 WeakPolarHBondContact CB-OE2 3.31Å; T242-E245 WeakPolarHBondContact CG2-OE2 3.35Å; T242-E245 PolarHBondContact N-OE2 3.29Å; T242-E245 PolarHBondContact O-N 2.77Å; T242-E245 WeakPolarHBondContact OG1-CG 3.45Å; T242-E245 PolarHBondContact OG1-N 3.26Å; T242-E245 PolarHBondContact OG1-OE2 2.9Å; T242-L246 PolarHBondContact O-N 3.24Å
243E80.6Confident76Confident160 Ų16063.2 Ų63.275%0.74832%0.323SS*.Hα-helixtrans-61.9-30.4174.9-170.6166.7-159.400111.8I247E243-I247 HydrophobicContact CG-CD1 4.17Å; E243-I247 WeakPolarHBondContact O-CB 3.49Å; E243-I247 WeakPolarHBondContact O-CD1 3.4Å; E243-I247 WeakPolarHBondContact O-CG1 3.13Å; E243-I247 PolarHBondContact O-N 2.69Å; E243-I247 VanDerWaalsContact O-N 3.07Å
244M80.1Confident75.7Confident121 Ų12167.5 Ų67.560%0.59635%0.347SS*.Hα-helixtrans-65.5-49.7174.4-167.566.469.900111.7T242 L246 I247 E248T242-M244 PolarHBondContact O-N 2.78Å; M244-L246 VanDerWaalsContact C-N 3.33Å; M244-L246 PolarHBondContact O-N 2.8Å; M244-I247 WeakPolarHBondContact O-CA 3.47Å; M244-I247 WeakPolarHBondContact O-CB 3.11Å; M244-I247 PolarHBondContact O-N 3.14Å; M244-I247 VanDerWaalsContact O-N 3.07Å; M244-E248 WeakPolarHBondContact O-CG 3.35Å; M244-E248 PolarHBondContact O-N 2.71Å
245E79.4Confident75.5Confident36 Ų3675.3 Ų75.317%0.16839%0.385CS..Hα-helixtrans-63.9-38.1179.3-70.2165.7109.300112Y239 P241 T242 I247 E248 L249 K273Y239-E245 VanDerWaalsContact OH-CD 3.23Å; Y239-E245 PolarHBondContact OH-OE1 2.94Å; P241-E245 HydrophobicContact CB-CB 4.38Å; T242-E245 WeakPolarHBondContact CB-OE2 3.31Å; T242-E245 WeakPolarHBondContact CG2-OE2 3.35Å; T242-E245 PolarHBondContact N-OE2 3.29Å; T242-E245 PolarHBondContact O-N 2.77Å; T242-E245 WeakPolarHBondContact OG1-CG 3.45Å; T242-E245 PolarHBondContact OG1-N 3.26Å; T242-E245 PolarHBondContact OG1-OE2 2.9Å; E245-I247 VanDerWaalsContact C-N 3.29Å; E245-I247 PolarHBondContact O-N 3.45Å; E245-E248 PolarHBondContact O-N 2.85Å; E245-L249 WeakPolarHBondContact O-CB 3.42Å; E245-L249 WeakPolarHBondContact O-CD1 3.02Å; E245-L249 WeakPolarHBondContact O-CG 3.04Å; E245-L249 PolarHBondContact O-N 3.15Å; E245-K273 IonicContact OE1-NZ 3.79Å; E245-K273 PolarHBondContact OE1-NZ 3.24Å
246L79.4Confident74.9Confident38 Ų3875.2 Ų75.220%0.19939%0.394CS..Hα-helixtrans-60.3-40172.3-79.3165.4000112G231 M234 P241 T242 M244 S250G231-L246 VanDerWaalsContact CA-CD2 3.43Å; M234-L246 HydrophobicContact SD-CD2 4.45Å; P241-L246 HydrophobicContact CB-CD1 4.45Å; P241-L246 HydrophobicContact CB-CD2 4.42Å; P241-L246 HydrophobicContact CB-CG 3.96Å; P241-L246 HydrophobicContact CG-CD1 4.05Å; P241-L246 HydrophobicContact CG-CD2 3.98Å; P241-L246 HydrophobicContact CG-CG 3.87Å; T242-L246 PolarHBondContact O-N 3.24Å; M244-L246 VanDerWaalsContact C-N 3.33Å; M244-L246 PolarHBondContact O-N 2.8Å; L246-S250 WeakPolarHBondContact O-CB 3.38Å; L246-S250 PolarHBondContact O-N 3.19Å; L246-S250 PolarHBondContact O-OG 3.49Å
247I81.3Confident74.6Confident73 Ų7374.8 Ų74.837%0.37439%0.389SS..Hα-helixtrans-66.1-47.6175.8-71.8164.3000110.2E243 M244 E245 S250 Q251E243-I247 HydrophobicContact CG-CD1 4.17Å; E243-I247 WeakPolarHBondContact O-CB 3.49Å; E243-I247 WeakPolarHBondContact O-CD1 3.4Å; E243-I247 WeakPolarHBondContact O-CG1 3.13Å; E243-I247 PolarHBondContact O-N 2.69Å; E243-I247 VanDerWaalsContact O-N 3.07Å; M244-I247 WeakPolarHBondContact O-CA 3.47Å; M244-I247 WeakPolarHBondContact O-CB 3.11Å; M244-I247 PolarHBondContact O-N 3.14Å; M244-I247 VanDerWaalsContact O-N 3.07Å; E245-I247 VanDerWaalsContact C-N 3.29Å; E245-I247 PolarHBondContact O-N 3.45Å; I247-S250 PolarHBondContact O-N 2.87Å; I247-S250 PolarHBondContact O-OG 2.93Å; I247-Q251 WeakPolarHBondContact O-CG 3.45Å; I247-Q251 PolarHBondContact O-N 3.3Å
248E82.4Confident74.7Confident110 Ų11075.6 Ų75.651%0.51441%0.408SS..Hα-helixtrans-59.2-50.7178.3-71.3172.5167.400112.1M244 E245 S250 Q251 Q252M244-E248 WeakPolarHBondContact O-CG 3.35Å; M244-E248 PolarHBondContact O-N 2.71Å; E245-E248 PolarHBondContact O-N 2.85Å; E248-S250 PolarHBondContact O-N 2.74Å; E248-Q251 PolarHBondContact O-N 2.99Å; E248-Q251 VanDerWaalsContact O-N 3.13Å; E248-Q252 WeakPolarHBondContact O-CB 3.04Å; E248-Q252 PolarHBondContact O-N 2.93Å
249L77.4Confident75Confident13 Ų1374 Ų747%0.06839%0.392CS..Hα-helixtrans-60-45176.4-68.6162.4000111.2M234 E245 Q251 Q252 I253 L269M234-L249 HydrophobicContact CE-CD1 3.39Å; M234-L249 HydrophobicContact SD-CD1 3.9Å; E245-L249 WeakPolarHBondContact O-CB 3.42Å; E245-L249 WeakPolarHBondContact O-CD1 3.02Å; E245-L249 WeakPolarHBondContact O-CG 3.04Å; E245-L249 PolarHBondContact O-N 3.15Å; L249-Q251 VanDerWaalsContact C-N 3.27Å; L249-Q251 PolarHBondContact O-N 2.94Å; L249-Q252 PolarHBondContact O-N 3.18Å; L249-I253 WeakPolarHBondContact O-CB 3.25Å; L249-I253 VanDerWaalsContact O-CD1 3.31Å; L249-I253 WeakPolarHBondContact O-CD1 3.43Å; L249-I253 VanDerWaalsContact O-CG1 3.24Å; L249-I253 WeakPolarHBondContact O-CG1 3.44Å; L249-I253 PolarHBondContact O-N 2.86Å; L249-L269 HydrophobicContact CD2-CD2 3.85Å
250S75.2Confident75.1Confident33 Ų3378 Ų7823%0.23141%0.41CS..Hα-helixtrans-62.8-3317778.20000112.6L246 I247 E248 N254L246-S250 WeakPolarHBondContact O-CB 3.38Å; L246-S250 PolarHBondContact O-N 3.19Å; L246-S250 PolarHBondContact O-OG 3.49Å; I247-S250 PolarHBondContact O-N 2.87Å; I247-S250 PolarHBondContact O-OG 2.93Å; E248-S250 PolarHBondContact O-N 2.74Å; S250-N254 VanDerWaalsContact O-CB 3.24Å; S250-N254 WeakPolarHBondContact O-CB 3.2Å; S250-N254 VanDerWaalsContact O-CG 3.25Å; S250-N254 PolarHBondContact O-N 3.11Å; S250-N254 PolarHBondContact O-ND2 3.41Å
251Q79.8Confident75.6Confident114 Ų11471 Ų7153%0.53338%0.376SS..Hα-helixtrans-72.9-42.5175.2-73.217836.500111.4I247 E248 L249 I253 N254 M255I247-Q251 WeakPolarHBondContact O-CG 3.45Å; I247-Q251 PolarHBondContact O-N 3.3Å; E248-Q251 PolarHBondContact O-N 2.99Å; E248-Q251 VanDerWaalsContact O-N 3.13Å; L249-Q251 VanDerWaalsContact C-N 3.27Å; L249-Q251 PolarHBondContact O-N 2.94Å; Q251-I253 VanDerWaalsContact C-N 3.32Å; Q251-I253 PolarHBondContact O-N 3.24Å; Q251-N254 PolarHBondContact O-N 3.14Å; Q251-M255 WeakPolarHBondContact O-CB 3.49Å; Q251-M255 WeakPolarHBondContact O-CG 3.22Å; Q251-M255 PolarHBondContact O-N 3.39Å
252Q76.7Confident76.1Confident101 Ų10173.2 Ų73.247%0.47239%0.387SS..Hα-helixtrans-58.3-44.9175.3-170.4170.9-6.800111E248 L249 N256E248-Q252 WeakPolarHBondContact O-CB 3.04Å; E248-Q252 PolarHBondContact O-N 2.93Å; L249-Q252 PolarHBondContact O-N 3.18Å; Q252-N256 WeakPolarHBondContact O-CB 3.26Å; Q252-N256 PolarHBondContact O-N 3.46Å
253I75Confident76Confident0 Ų071.9 Ų71.90%038%0.375CS..Hα-helixtrans-66.8-47.7175.6-65.5157.6000111.8L230 L249 Q251 M255 L257 G258 G259 V261 L269L230-I253 HydrophobicContact CD2-CD1 3.33Å; L249-I253 WeakPolarHBondContact O-CB 3.25Å; L249-I253 VanDerWaalsContact O-CD1 3.31Å; L249-I253 WeakPolarHBondContact O-CD1 3.43Å; L249-I253 VanDerWaalsContact O-CG1 3.24Å; L249-I253 WeakPolarHBondContact O-CG1 3.44Å; L249-I253 PolarHBondContact O-N 2.86Å; Q251-I253 VanDerWaalsContact C-N 3.32Å; Q251-I253 PolarHBondContact O-N 3.24Å; I253-M255 VanDerWaalsContact C-N 3.32Å; I253-M255 PolarHBondContact O-N 3.09Å; I253-L257 HydrophobicContact CG1-CD1 4.24Å; I253-L257 HydrophobicContact CG2-CB 4.4Å; I253-L257 CarbonylContact O-C 3.37Å; I253-L257 VanDerWaalsContact O-CA 3.32Å; I253-L257 WeakPolarHBondContact O-CA 3.4Å; I253-L257 WeakPolarHBondContact O-CB 3.49Å; I253-L257 PolarHBondContact O-N 2.85Å; I253-G258 PolarHBondContact O-N 2.74Å; I253-G259 PolarHBondContact O-N 2.99Å; I253-V261 HydrophobicContact CB-CG2 4.25Å; I253-V261 HydrophobicContact CD1-CG2 3.56Å; I253-V261 HydrophobicContact CG1-CG2 3.74Å; I253-V261 HydrophobicContact CG2-CG2 3.47Å; I253-V261 VanDerWaalsContact CG2-CG2 3.47Å; I253-L269 HydrophobicContact CD1-CD1 4.06Å; I253-L269 HydrophobicContact CG1-CD1 3.77Å
254N71.1Confident76.1Confident91 Ų9170 Ų7049%0.48737%0.371SS..Hα-helixtrans-67.2-30.9-178.3-78.5-54.9000113.2S250 Q251 G259S250-N254 VanDerWaalsContact O-CB 3.24Å; S250-N254 WeakPolarHBondContact O-CB 3.2Å; S250-N254 VanDerWaalsContact O-CG 3.25Å; S250-N254 PolarHBondContact O-N 3.11Å; S250-N254 PolarHBondContact O-ND2 3.41Å; Q251-N254 PolarHBondContact O-N 3.14Å; N254-G259 VanDerWaalsContact OD1-CA 3.28Å; N254-G259 WeakPolarHBondContact OD1-CA 3.46Å
255M72.3Confident76.1Confident165 Ų16565.9 Ų65.981%0.81335%0.351SS*.Hα-helixtrans-91.8-33.4-179.2-68.5-151.3156.800114.3Q251 I253Q251-M255 WeakPolarHBondContact O-CB 3.49Å; Q251-M255 WeakPolarHBondContact O-CG 3.22Å; Q251-M255 PolarHBondContact O-N 3.39Å; I253-M255 VanDerWaalsContact C-N 3.32Å; I253-M255 PolarHBondContact O-N 3.09Å
256N67.4Low76Confident121 Ų12164.1 Ų64.165%0.64734%0.343SS*.Hα-helixtrans-98.7-32.3-176.5-57.1-1.4000112.5Q252Q252-N256 WeakPolarHBondContact O-CB 3.26Å; Q252-N256 PolarHBondContact O-N 3.46Å
257L64.1Low76Confident59 Ų5963.7 Ų63.731%0.30934%0.342SS..SBendtrans-115.95.6-169.4-57.2171.1000113.1I253 G259 H260 D265 L269I253-L257 HydrophobicContact CG1-CD1 4.24Å; I253-L257 HydrophobicContact CG2-CB 4.4Å; I253-L257 CarbonylContact O-C 3.37Å; I253-L257 VanDerWaalsContact O-CA 3.32Å; I253-L257 WeakPolarHBondContact O-CA 3.4Å; I253-L257 WeakPolarHBondContact O-CB 3.49Å; I253-L257 PolarHBondContact O-N 2.85Å; L257-G259 PolarHBondContact O-N 2.73Å; L257-H260 WeakPolarHBondContact CB-O 3.33Å; L257-D265 HydrophobicContact CD1-CB 3.82Å; L257-D265 WeakPolarHBondContact CD2-OD1 3.1Å; L257-L269 HydrophobicContact CD1-CD1 4.1Å
258G67.8Low75.8Confident62 Ų6267.6 Ų67.664%0.63936%0.358SS*.THydrogen-bonded Turntrans71.412.9176.700000115.1I253I253-G258 PolarHBondContact O-N 2.74Å
259G69.9Low75.5Confident13 Ų1363.3 Ų63.313%0.13434%0.339CS..THydrogen-bonded Turntrans93.8-1.3175.400000115.7I253 N254 L257I253-G259 PolarHBondContact O-N 2.99Å; N254-G259 VanDerWaalsContact OD1-CA 3.28Å; N254-G259 WeakPolarHBondContact OD1-CA 3.46Å; L257-G259 PolarHBondContact O-N 2.73Å
260H73.2Confident75.3Confident96 Ų9662.9 Ų62.944%0.44434%0.336SS..EExtended strand (participates in β ladder)trans-115.1144.2171.7-62.3-79.7000108.9Y224 L257Y224-H260 HydrophobicContact CD1-CB 3.75Å; Y224-H260 HydrophobicContact CE1-CB 4.43Å; Y224-H260 HydrophobicContact CG-CB 4.06Å; L257-H260 WeakPolarHBondContact CB-O 3.33Å
261V79.6Confident75.1Confident0 Ų061.5 Ų61.50%033%0.327CS..EExtended strand (participates in β ladder)trans-113.8116.5177.2-171.80000107.9Y224 I225 I253 D265 F266 L269Y224-V261 CarbonylContact C-O 3.53Å; Y224-V261 VanDerWaalsContact CA-O 3.29Å; Y224-V261 WeakPolarHBondContact CA-O 3.49Å; I225-V261 PolarHBondContact N-O 2.92Å; I225-V261 WeakPolarHBondContact O-CG2 3.46Å; I225-V261 PolarHBondContact O-N 2.78Å; I253-V261 HydrophobicContact CB-CG2 4.25Å; I253-V261 HydrophobicContact CD1-CG2 3.56Å; I253-V261 HydrophobicContact CG1-CG2 3.74Å; I253-V261 HydrophobicContact CG2-CG2 3.47Å; I253-V261 VanDerWaalsContact CG2-CG2 3.47Å; V261-D265 HydrophobicContact CG1-CB 3.71Å; V261-F266 HydrophobicContact CG1-CB 3.92Å; V261-L269 HydrophobicContact CG1-CD1 3.98Å
262D82.4Confident74.6Confident54 Ų5459.9 Ų59.929%0.28933%0.327SS..  trans-82.5-177.1171.480.227.2000112F214 Y224 D264 D265 F266F214-D262 WeakPolarHBondContact CE2-O 3.42Å; Y224-D262 HydrophobicContact CD1-CB 4.07Å; Y224-D262 HydrophobicContact CE1-CB 3.93Å; D262-D264 PolarHBondContact OD1-N 3.48Å; D262-D265 PolarHBondContact N-OD2 3.33Å; D262-D265 PolarHBondContact OD1-N 3.29Å; D262-F266 WeakPolarHBondContact O-CB 3.39Å; D262-F266 PolarHBondContact O-N 3.47Å
263F81.9Confident73.9Confident49 Ų4957.5 Ų57.522%0.21532%0.315CS..Hα-helixtrans-68.3-37.3-178178.3-106000113.3I207 R211 F214 F266 V267I207-F263 HydrophobicContact CG2-CE1 4.39Å; I207-F263 HydrophobicContact CG2-CZ 4.07Å; R211-F263 HydrophobicContact CB-CE2 3.68Å; R211-F263 HydrophobicContact CB-CZ 3.78Å; R211-F263 HydrophobicContact CG-CD2 4.49Å; R211-F263 HydrophobicContact CG-CE2 3.89Å; R211-F263 HydrophobicContact CG-CZ 3.99Å; F214-F263 HydrophobicContact CB-CD2 3.95Å; F214-F263 HydrophobicContact CB-CE2 4.33Å; F214-F263 HydrophobicContact CD1-CD2 4.4Å; F214-F263 HydrophobicContact CD2-CB 4.41Å; F214-F263 AromaticContact CD2-CD2 3.95Å; F214-F263 HydrophobicContact CD2-CD2 3.95Å; F214-F263 HydrophobicContact CE2-CB 4.25Å; F214-F263 AromaticContact CG-CD2 3.84Å; F214-F263 HydrophobicContact CG-CD2 3.84Å; F214-F263 HydrophobicContact CZ-CB 4.3Å; F263-F266 PolarHBondContact O-N 3.22Å; F263-V267 HydrophobicContact CD1-CG2 4.43Å; F263-V267 HydrophobicContact CD2-CG2 4.39Å; F263-V267 HydrophobicContact CE1-CG2 3.91Å; F263-V267 HydrophobicContact CE2-CG2 3.83Å; F263-V267 HydrophobicContact CZ-CG2 3.58Å; F263-V267 VanDerWaalsContact O-CG2 3.32Å; F263-V267 WeakPolarHBondContact O-CG2 3.12Å; F263-V267 PolarHBondContact O-N 2.8Å
264D81.7Confident73.3Confident122 Ų12259.4 Ų59.465%0.65233%0.325SS*.Hα-helixtrans-72.9-41.4-178.5-66.7-35000109.4D262 F266 V267 E268D262-D264 PolarHBondContact OD1-N 3.48Å; D264-F266 VanDerWaalsContact C-N 3.33Å; D264-F266 PolarHBondContact O-N 2.69Å; D264-V267 PolarHBondContact O-N 3.33Å; D264-E268 PolarHBondContact O-N 3.02Å
265D80.4Confident72.8Confident33 Ų3356 Ų5618%0.17631%0.307CS..Hα-helixtrans-57.3-44.8170-61.9-36.2000112L257 V261 D262 V267 E268 L269L257-D265 HydrophobicContact CD1-CB 3.82Å; L257-D265 WeakPolarHBondContact CD2-OD1 3.1Å; V261-D265 HydrophobicContact CG1-CB 3.71Å; D262-D265 PolarHBondContact N-OD2 3.33Å; D262-D265 PolarHBondContact OD1-N 3.29Å; D265-V267 VanDerWaalsContact C-N 3.32Å; D265-V267 PolarHBondContact O-N 3.22Å; D265-E268 PolarHBondContact O-N 3.31Å; D265-L269 WeakPolarHBondContact O-CB 3.45Å; D265-L269 WeakPolarHBondContact O-CD1 3.4Å; D265-L269 WeakPolarHBondContact O-CG 3.48Å; D265-L269 PolarHBondContact O-N 3.07Å
266F78Confident72Confident0 Ų050.9 Ų50.90%029%0.29CS..Hα-helixtrans-62.9-39.6179.9176.9-96.9000111.3L210 F214 I225 L230 C233 M237 V261 D262 F263 D264 M270L210-F266 HydrophobicContact CB-CE1 4.13Å; L210-F266 HydrophobicContact CD2-CE1 3.8Å; L210-F266 HydrophobicContact CD2-CZ 4.43Å; L210-F266 WeakPolarHBondContact O-CE1 3.31Å; F214-F266 HydrophobicContact CB-CD1 4.38Å; F214-F266 HydrophobicContact CB-CE1 4.32Å; F214-F266 HydrophobicContact CD2-CB 3.78Å; F214-F266 AromaticContact CD2-CD1 3.83Å; F214-F266 HydrophobicContact CD2-CD1 3.83Å; F214-F266 HydrophobicContact CD2-CD2 4.16Å; F214-F266 HydrophobicContact CD2-CE1 4.43Å; F214-F266 AromaticContact CD2-CG 3.67Å; F214-F266 HydrophobicContact CD2-CG 3.67Å; F214-F266 HydrophobicContact CE2-CB 3.9Å; F214-F266 HydrophobicContact CE2-CG 4.24Å; I225-F266 HydrophobicContact CD1-CD2 4.18Å; I225-F266 HydrophobicContact CD1-CE2 4.21Å; L230-F266 HydrophobicContact CD1-CD2 3.87Å; L230-F266 HydrophobicContact CD1-CE2 3.79Å; C233-F266 VanDerWaalsContact SG-CE2 3.54Å; C233-F266 WeakPolarHBondContact SG-CZ 3.38Å; M237-F266 HydrophobicContact CE-CE2 4.28Å; M237-F266 HydrophobicContact CE-CZ 3.71Å; M237-F266 HydrophobicContact SD-CZ 3.98Å; V261-F266 HydrophobicContact CG1-CB 3.92Å; D262-F266 WeakPolarHBondContact O-CB 3.39Å; D262-F266 PolarHBondContact O-N 3.47Å; F263-F266 PolarHBondContact O-N 3.22Å; D264-F266 VanDerWaalsContact C-N 3.33Å; D264-F266 PolarHBondContact O-N 2.69Å; F266-M270 HydrophobicContact CD1-CG 4.31Å; F266-M270 HydrophobicContact CD2-CG 3.79Å; F266-M270 HydrophobicContact CE1-CG 4.09Å; F266-M270 HydrophobicContact CE2-CG 3.55Å; F266-M270 HydrophobicContact CE2-SD 4.37Å; F266-M270 HydrophobicContact CG-CG 4.17Å; F266-M270 HydrophobicContact CZ-CG 3.72Å; F266-M270 WeakPolarHBondContact O-CB 3.46Å; F266-M270 VanDerWaalsContact O-CG 3.27Å; F266-M270 WeakPolarHBondContact O-CG 3.47Å; F266-M270 PolarHBondContact O-N 3.21Å
267V78.6Confident71.1Confident29 Ų2949.8 Ų49.818%0.17628%0.281CS..Hα-helixtrans-66.6-40.3175.3171.50000111.3L202 L210 F263 D264 D265 G271L202-V267 HydrophobicContact CD1-CG1 3.61Å; L210-V267 HydrophobicContact CD1-CG2 4.26Å; F263-V267 HydrophobicContact CD1-CG2 4.43Å; F263-V267 HydrophobicContact CD2-CG2 4.39Å; F263-V267 HydrophobicContact CE1-CG2 3.91Å; F263-V267 HydrophobicContact CE2-CG2 3.83Å; F263-V267 HydrophobicContact CZ-CG2 3.58Å; F263-V267 VanDerWaalsContact O-CG2 3.32Å; F263-V267 WeakPolarHBondContact O-CG2 3.12Å; F263-V267 PolarHBondContact O-N 2.8Å; D264-V267 PolarHBondContact O-N 3.33Å; D265-V267 VanDerWaalsContact C-N 3.32Å; D265-V267 PolarHBondContact O-N 3.22Å; V267-G271 WeakPolarHBondContact O-CA 3.4Å; V267-G271 PolarHBondContact O-N 2.92Å
268E77.8Confident70.1Confident155 Ų15548.3 Ų48.372%0.72427%0.274SS*.Hα-helixtrans-67.3-39.1176-169.1176.4168.900112.6D264 D265 P272D264-E268 PolarHBondContact O-N 3.02Å; D265-E268 PolarHBondContact O-N 3.31Å; E268-P272 WeakPolarHBondContact O-CD 3.14Å
269L75.3Confident69Low20 Ų2047.6 Ų47.611%0.10526%0.263CS..Hα-helixtrans-73.3-40.5177.7-76.9159000113L249 I253 L257 V261 D265L249-L269 HydrophobicContact CD2-CD2 3.85Å; I253-L269 HydrophobicContact CD1-CD1 4.06Å; I253-L269 HydrophobicContact CG1-CD1 3.77Å; L257-L269 HydrophobicContact CD1-CD1 4.1Å; V261-L269 HydrophobicContact CG1-CD1 3.98Å; D265-L269 WeakPolarHBondContact O-CB 3.45Å; D265-L269 WeakPolarHBondContact O-CD1 3.4Å; D265-L269 WeakPolarHBondContact O-CG 3.48Å; D265-L269 PolarHBondContact O-N 3.07Å
270M73.5Confident67.7Low3 Ų354 Ų542%0.01529%0.294CS..Hα-helixtrans-90.9-31.1-173.5-67.5-57.2-38.100113.9L210 L230 M234 M237 F266 K273 L274L210-M270 HydrophobicContact CD2-CB 3.86Å; L230-M270 HydrophobicContact CD1-SD 4.1Å; M234-M270 HydrophobicContact CE-CE 3.8Å; M234-M270 HydrophobicContact CE-SD 3.36Å; M234-M270 WeakPolarHBondContact CE-SD 3.41Å; M234-M270 HydrophobicContact CG-CE 3.91Å; M234-M270 HydrophobicContact CG-SD 3.72Å; M234-M270 HydrophobicContact SD-SD 4.39Å; M237-M270 HydrophobicContact CE-CE 3.45Å; M237-M270 VanDerWaalsContact CE-CE 3.45Å; M237-M270 HydrophobicContact CE-CG 4.11Å; M237-M270 HydrophobicContact CE-SD 3.96Å; F266-M270 HydrophobicContact CD1-CG 4.31Å; F266-M270 HydrophobicContact CD2-CG 3.79Å; F266-M270 HydrophobicContact CE1-CG 4.09Å; F266-M270 HydrophobicContact CE2-CG 3.55Å; F266-M270 HydrophobicContact CE2-SD 4.37Å; F266-M270 HydrophobicContact CG-CG 4.17Å; F266-M270 HydrophobicContact CZ-CG 3.72Å; F266-M270 WeakPolarHBondContact O-CB 3.46Å; F266-M270 VanDerWaalsContact O-CG 3.27Å; F266-M270 WeakPolarHBondContact O-CG 3.47Å; F266-M270 PolarHBondContact O-N 3.21Å; M270-K273 HydrophobicContact CE-CB 4.28Å; M270-K273 PolarHBondContact O-N 3.29Å; M270-L274 WeakPolarHBondContact O-CB 3.29Å; M270-L274 PolarHBondContact O-N 2.93Å
271G70.6Confident66Low4 Ų456.8 Ų56.84%0.04131%0.309CS..Hα-helixtrans-52.5-56-178.700000113.1V267 K273 L274 L275V267-G271 WeakPolarHBondContact O-CA 3.4Å; V267-G271 PolarHBondContact O-N 2.92Å; G271-K273 PolarHBondContact O-N 3.36Å; G271-L274 PolarHBondContact O-N 3.08Å; G271-L275 VanDerWaalsContact O-CG 3.31Å; G271-L275 WeakPolarHBondContact O-CG 3.41Å; G271-L275 PolarHBondContact O-N 2.92Å
272P68.8Low64.4Low81 Ų8158.9 Ų58.953%0.52632%0.32SS..Hα-helixtrans-61.1-30.9177.1-2434.9000113.4E268 A276E268-P272 WeakPolarHBondContact O-CD 3.14Å; P272-A276 WeakPolarHBondContact O-CB 3.43Å; P272-A276 PolarHBondContact O-N 3.34Å
273K63.4Low62.9Low51 Ų5156.8 Ų56.822%0.22231%0.311CS..Hα-helixtrans-76.7-37.8179.7-71.4-68.3-167.6167.50112.6Y239 E245 M270 G271 L275 A276 E277Y239-K273 HydrophobicContact CE1-CB 4.49Å; Y239-K273 HydrophobicContact CE1-CD 4.22Å; Y239-K273 HydrophobicContact CE1-CG 4.43Å; Y239-K273 HydrophobicContact CE2-CD 4.26Å; Y239-K273 WeakPolarHBondContact OH-CE 3.44Å; Y239-K273 PolarHBondContact OH-NZ 2.88Å; E245-K273 IonicContact OE1-NZ 3.79Å; E245-K273 PolarHBondContact OE1-NZ 3.24Å; M270-K273 HydrophobicContact CE-CB 4.28Å; M270-K273 PolarHBondContact O-N 3.29Å; G271-K273 PolarHBondContact O-N 3.36Å; K273-L275 PolarHBondContact O-N 2.93Å; K273-A276 PolarHBondContact O-N 3.47Å; K273-E277 PolarHBondContact O-N 3.47Å
274L61.6Low61.7Low39 Ų3957.8 Ų57.820%0.20432%0.321CS..Hα-helixtrans-68.1-23.7172.8-159.9156.5000111.5L210 M270 G271 T278L210-L274 HydrophobicContact CD2-CD1 3.83Å; L210-L274 HydrophobicContact CG-CD1 4.25Å; M270-L274 WeakPolarHBondContact O-CB 3.29Å; M270-L274 PolarHBondContact O-N 2.93Å; G271-L274 PolarHBondContact O-N 3.08Å; L274-T278 VanDerWaalsContact C-OG1 3.3Å; L274-T278 PolarHBondContact O-OG1 3.33Å
275L60.6Low60.6Low21 Ų2155.4 Ų55.411%0.1131%0.305CS..Hα-helixtrans-87.5-33.5171.8-66.2169000112.8Q198 R200 L202 G271 K273Q198-L275 HydrophobicContact CB-CB 4.29Å; Q198-L275 WeakPolarHBondContact CG-O 3Å; Q198-L275 PolarHBondContact NE2-O 3.09Å; Q198-L275 WeakPolarHBondContact O-CB 3.32Å; Q198-L275 WeakPolarHBondContact O-CD1 3.19Å; R200-L275 HydrophobicContact CG-CD2 4.25Å; L202-L275 HydrophobicContact CD2-CD1 4.44Å; G271-L275 VanDerWaalsContact O-CG 3.31Å; G271-L275 WeakPolarHBondContact O-CG 3.41Å; G271-L275 PolarHBondContact O-N 2.92Å; K273-L275 PolarHBondContact O-N 2.93Å
276A55.7Low59.9Low56 Ų5657.1 Ų57.146%0.46331%0.312SS..Hα-helixtrans-83-52.8-170.600000116.1Q198 P272 K273 T278Q198-A276 PolarHBondContact NE2-O 3.17Å; P272-A276 WeakPolarHBondContact O-CB 3.43Å; P272-A276 PolarHBondContact O-N 3.34Å; K273-A276 PolarHBondContact O-N 3.47Å; A276-T278 VanDerWaalsContact C-N 3.29Å; A276-T278 PolarHBondContact O-N 2.99Å
277E47.3Very low59.6Low99 Ų9958.3 Ų58.346%0.46332%0.318SS..THydrogen-bonded Turntrans-82.1-12.6-171.1-152.4-178.5-111.700113Y239 K273Y239-E277 HydrophobicContact CD2-CB 3.8Å; Y239-E277 VanDerWaalsContact CD2-CD 3.46Å; Y239-E277 HydrophobicContact CD2-CG 4.22Å; Y239-E277 WeakPolarHBondContact CD2-OE2 3.28Å; Y239-E277 HydrophobicContact CE2-CB 3.86Å; Y239-E277 HydrophobicContact CE2-CG 4.12Å; Y239-E277 VanDerWaalsContact CE2-OE1 3.29Å; Y239-E277 WeakPolarHBondContact CE2-OE1 3.33Å; Y239-E277 WeakPolarHBondContact CE2-OE2 3.08Å; K273-E277 PolarHBondContact O-N 3.47Å
278T44.1Very low59.4Low27 Ų2764.2 Ų64.217%0.16634%0.337CS..THydrogen-bonded Turntrans-100.1-2.4-162.24.70000113.9L274 A276 D280 M281 I282 G283L274-T278 VanDerWaalsContact C-OG1 3.3Å; L274-T278 PolarHBondContact O-OG1 3.33Å; A276-T278 VanDerWaalsContact C-N 3.29Å; A276-T278 PolarHBondContact O-N 2.99Å; T278-D280 PolarHBondContact O-N 3.1Å; T278-D280 VanDerWaalsContact O-N 3.13Å; T278-M281 PolarHBondContact O-N 2.94Å; T278-M281 VanDerWaalsContact O-N 3.17Å; T278-I282 HydrophobicContact CG2-CB 3.59Å; T278-I282 HydrophobicContact CG2-CD1 3.65Å; T278-I282 HydrophobicContact CG2-CG1 3.67Å; T278-I282 PolarHBondContact O-N 2.84Å; T278-G283 PolarHBondContact O-N 3.34Å
279A45Very low59.2Low48 Ų4860 Ų6040%0.39732%0.32SS..THydrogen-bonded Turntrans-48.6-38.4176.800000113.4
280D42.7Very low59.2Low148 Ų14859.6 Ų59.679%0.79132%0.319SS*.THydrogen-bonded Turntrans-85.6-19.5-174.6-70.1-13.2000114.7T278T278-D280 PolarHBondContact O-N 3.1Å; T278-D280 VanDerWaalsContact O-N 3.13Å
281M38.1Very low59.5Low154 Ų15460.1 Ų60.176%0.75932%0.321SS*.THydrogen-bonded Turntrans-135.1-32.2-171.6-123.7-167.1-179.200117T278T278-M281 PolarHBondContact O-N 2.94Å; T278-M281 VanDerWaalsContact O-N 3.17Å
282I45Very low60.1Low43 Ų4366.8 Ų66.822%0.22135%0.345CS..THydrogen-bonded Turntrans-100.1-30.7170.9-63.7-173.8000110.4L22 T278 V284 K285 E286L22-I282 HydrophobicContact CD2-CD1 4.44Å; T278-I282 HydrophobicContact CG2-CB 3.59Å; T278-I282 HydrophobicContact CG2-CD1 3.65Å; T278-I282 HydrophobicContact CG2-CG1 3.67Å; T278-I282 PolarHBondContact O-N 2.84Å; I282-V284 PolarHBondContact O-N 3.2Å; I282-K285 WeakPolarHBondContact O-CA 3.43Å; I282-K285 WeakPolarHBondContact O-CB 3.31Å; I282-K285 PolarHBondContact O-N 2.75Å; I282-E286 HydrophobicContact CG2-CG 4.18Å; I282-E286 PolarHBondContact O-N 2.95Å
283G51.9Low60.7Low11 Ų1168 Ų6811%0.11334%0.344CS..Hα-helixtrans-51.3-39.6169.500000112.4T278 K285 E286 L287T278-G283 PolarHBondContact O-N 3.34Å; G283-K285 VanDerWaalsContact C-N 3.3Å; G283-K285 PolarHBondContact O-N 3.06Å; G283-E286 PolarHBondContact O-N 2.97Å; G283-L287 WeakPolarHBondContact O-CB 3.4Å; G283-L287 WeakPolarHBondContact O-CD1 3.41Å; G283-L287 WeakPolarHBondContact O-CG 3.47Å; G283-L287 PolarHBondContact O-N 2.97Å
284V55.2Low61.5Low70 Ų7065.7 Ų65.742%0.42433%0.334SS..Hα-helixtrans-62.8-34.2174.3-1780000112.7I282 R288 F341I282-V284 PolarHBondContact O-N 3.2Å; V284-R288 WeakPolarHBondContact O-CB 3.04Å; V284-R288 PolarHBondContact O-N 3.17Å; V284-F341 HydrophobicContact CG1-CE1 4.37Å; V284-F341 HydrophobicContact CG1-CZ 4.2Å
285K58.3Low62.7Low71 Ų7164.3 Ų64.331%0.30933%0.327SS..Hα-helixtrans-74-46.1176.1-173.7-164.4158.3-161.60110.5V21 I282 G283 R288 D289V21-K285 WeakPolarHBondContact O-CE 3.32Å; V21-K285 PolarHBondContact O-NZ 3Å; I282-K285 WeakPolarHBondContact O-CA 3.43Å; I282-K285 WeakPolarHBondContact O-CB 3.31Å; I282-K285 PolarHBondContact O-N 2.75Å; G283-K285 VanDerWaalsContact C-N 3.3Å; G283-K285 PolarHBondContact O-N 3.06Å; K285-R288 CarbonylContact O-C 3.33Å; K285-R288 WeakPolarHBondContact O-CB 3.39Å; K285-R288 PolarHBondContact O-N 2.96Å; K285-R288 VanDerWaalsContact O-N 3.15Å; K285-D289 WeakPolarHBondContact CE-OD2 3.34Å; K285-D289 PolarHBondContact O-N 2.84Å
286E66.7Low63.7Low70 Ų7067.7 Ų67.733%0.32735%0.349SS..Hα-helixtrans-66.2-43.8179.1-66.9-174162.500112.5I282 G283 R288 D289 A290I282-E286 HydrophobicContact CG2-CG 4.18Å; I282-E286 PolarHBondContact O-N 2.95Å; G283-E286 PolarHBondContact O-N 2.97Å; E286-R288 PolarHBondContact O-N 2.9Å; E286-D289 PolarHBondContact O-N 3.1Å; E286-A290 VanDerWaalsContact O-CB 3.23Å; E286-A290 WeakPolarHBondContact O-CB 3.45Å; E286-A290 PolarHBondContact O-N 3.26Å
287L70.6Confident65.2Low24 Ų2469.4 Ų69.413%0.12635%0.35CS..Hα-helixtrans-59-33.2171.5-71.6165.7000111G283 F291 F341 F344 V345 M348G283-L287 WeakPolarHBondContact O-CB 3.4Å; G283-L287 WeakPolarHBondContact O-CD1 3.41Å; G283-L287 WeakPolarHBondContact O-CG 3.47Å; G283-L287 PolarHBondContact O-N 2.97Å; L287-F291 WeakPolarHBondContact O-CB 3.44Å; L287-F291 PolarHBondContact O-N 3.26Å; L287-F341 HydrophobicContact CB-CE2 4.31Å; L287-F341 HydrophobicContact CB-CZ 4.49Å; L287-F344 HydrophobicContact CB-CE1 4.46Å; L287-F344 HydrophobicContact CD2-CD1 4.41Å; L287-F344 HydrophobicContact CD2-CE1 3.95Å; L287-F344 WeakPolarHBondContact O-CE1 3.34Å; L287-V345 HydrophobicContact CB-CG2 4.39Å; L287-V345 HydrophobicContact CD1-CB 4.49Å; L287-V345 HydrophobicContact CD1-CG1 4.25Å; L287-V345 HydrophobicContact CD1-CG2 4.01Å; L287-M348 HydrophobicContact CD2-CB 3.67Å; L287-M348 HydrophobicContact CD2-CG 3.64Å
288R74.8Confident67Low154 Ų15467.5 Ų67.558%0.58136%0.357SS*.Hα-helixtrans-80.7-31.1178.7-172.3176.3-179.4-145.9-0.5113.7V284 K285 E286 R292 F341V284-R288 WeakPolarHBondContact O-CB 3.04Å; V284-R288 PolarHBondContact O-N 3.17Å; K285-R288 CarbonylContact O-C 3.33Å; K285-R288 WeakPolarHBondContact O-CB 3.39Å; K285-R288 PolarHBondContact O-N 2.96Å; K285-R288 VanDerWaalsContact O-N 3.15Å; E286-R288 PolarHBondContact O-N 2.9Å; R288-R292 PolarHBondContact O-N 3.11Å; R288-R292 VanDerWaalsContact O-N 3.15Å; R288-F341 HydrophobicContact CB-CE2 3.74Å; R288-F341 HydrophobicContact CB-CZ 3.98Å; R288-F341 HydrophobicContact CG-CE2 4.25Å
289D74.6Confident69.1Low67 Ų6769.8 Ų69.836%0.35837%0.368SS..Hα-helixtrans-76.5-35.2171.7-71.9-29.4000110.6K285 E286 R292 E293K285-D289 WeakPolarHBondContact CE-OD2 3.34Å; K285-D289 PolarHBondContact O-N 2.84Å; E286-D289 PolarHBondContact O-N 3.1Å; D289-R292 PolarHBondContact O-N 3.48Å; D289-R292 IonicContact OD1-CZ 3.63Å; D289-R292 IonicContact OD1-NH1 3.54Å; D289-R292 PolarHBondContact OD1-NH1 3.43Å; D289-R292 IonicContact OD1-NH2 3.44Å; D289-E293 PolarHBondContact O-N 2.68Å; D289-E293 VanDerWaalsContact O-N 3.09Å
290A74.8Confident71Confident11 Ų1169.2 Ų69.29%0.09137%0.367CS..Hα-helixtrans-66.3-42.9168.300000112F196 E286 R292 E293 F294 F344F196-A290 HydrophobicContact CD1-CB 4.14Å; F196-A290 HydrophobicContact CE1-CB 4.09Å; E286-A290 VanDerWaalsContact O-CB 3.23Å; E286-A290 WeakPolarHBondContact O-CB 3.45Å; E286-A290 PolarHBondContact O-N 3.26Å; A290-R292 VanDerWaalsContact C-N 3.26Å; A290-R292 PolarHBondContact O-N 3.03Å; A290-E293 WeakPolarHBondContact O-CA 3.19Å; A290-E293 WeakPolarHBondContact O-CB 3.47Å; A290-E293 PolarHBondContact O-N 2.68Å; A290-F294 WeakPolarHBondContact O-CD2 3.41Å; A290-F294 PolarHBondContact O-N 2.88Å; A290-F294 VanDerWaalsContact O-N 3.11Å; A290-F344 HydrophobicContact CB-CE1 4.47Å; A290-F344 HydrophobicContact CB-CZ 4.34Å
291F80.4Confident73.2Confident13 Ų1365.7 Ų65.76%0.05735%0.346CS..Hα-helixtrans-56.4-42173.3-172.6-86.1000110.9L287 E293 F294 D295 G300 I302 F341 F344L287-F291 WeakPolarHBondContact O-CB 3.44Å; L287-F291 PolarHBondContact O-N 3.26Å; F291-E293 VanDerWaalsContact C-N 3.29Å; F291-E293 PolarHBondContact O-N 3.17Å; F291-F294 PolarHBondContact O-N 3.09Å; F291-D295 HydrophobicContact CD1-CB 4.23Å; F291-D295 HydrophobicContact CE1-CB 4.05Å; F291-D295 WeakPolarHBondContact O-CB 3.49Å; F291-D295 PolarHBondContact O-N 3.39Å; F291-G300 WeakPolarHBondContact CE1-O 3.38Å; F291-G300 VanDerWaalsContact CZ-O 3.23Å; F291-G300 WeakPolarHBondContact CZ-O 3.46Å; F291-I302 HydrophobicContact CD2-CD1 3.56Å; F291-I302 HydrophobicContact CD2-CG1 4.11Å; F291-I302 HydrophobicContact CE1-CG1 4.39Å; F291-I302 HydrophobicContact CE2-CD1 3.51Å; F291-I302 HydrophobicContact CE2-CG1 3.67Å; F291-I302 HydrophobicContact CG-CD1 4.29Å; F291-I302 HydrophobicContact CZ-CD1 4.19Å; F291-I302 HydrophobicContact CZ-CG1 3.83Å; F291-F341 HydrophobicContact CB-CD2 4.06Å; F291-F341 HydrophobicContact CB-CE2 4.35Å; F291-F341 HydrophobicContact CD2-CB 4.43Å; F291-F341 AromaticContact CD2-CD2 3.94Å; F291-F341 HydrophobicContact CD2-CD2 3.94Å; F291-F341 HydrophobicContact CE2-CB 4.24Å; F291-F341 AromaticContact CG-CD2 3.92Å; F291-F341 HydrophobicContact CG-CD2 3.92Å; F291-F341 HydrophobicContact CZ-CB 4.44Å; F291-F344 HydrophobicContact CB-CD1 4.3Å; F291-F344 HydrophobicContact CB-CE1 4.31Å; F291-F344 HydrophobicContact CD2-CB 3.71Å; F291-F344 AromaticContact CD2-CD1 3.94Å; F291-F344 HydrophobicContact CD2-CD1 3.94Å; F291-F344 HydrophobicContact CD2-CD2 4.2Å; F291-F344 AromaticContact CD2-CG 3.7Å; F291-F344 HydrophobicContact CD2-CG 3.7Å; F291-F344 HydrophobicContact CE2-CB 3.95Å; F291-F344 HydrophobicContact CE2-CG 4.36Å
292R82.6Confident75.6Confident144 Ų14458.4 Ų58.454%0.54331%0.31SS..Hα-helixtrans-68.8-20.4173.3-164.9-172-62.2118.212.3114R288 D289 A290 D295R288-R292 PolarHBondContact O-N 3.11Å; R288-R292 VanDerWaalsContact O-N 3.15Å; D289-R292 PolarHBondContact O-N 3.48Å; D289-R292 IonicContact OD1-CZ 3.63Å; D289-R292 IonicContact OD1-NH1 3.54Å; D289-R292 PolarHBondContact OD1-NH1 3.43Å; D289-R292 IonicContact OD1-NH2 3.44Å; A290-R292 VanDerWaalsContact C-N 3.26Å; A290-R292 PolarHBondContact O-N 3.03Å; R292-D295 VanDerWaalsContact O-O 3.05Å
293E80.6Confident77.7Confident107 Ų10757.4 Ų57.450%0.531%0.307SS..Hα-helixtrans-79.2-24.3172.9-167.4170.8-179.200111.8R203 D289 A290 F291R203-E293 IonicContact NH1-OE2 3.37Å; D289-E293 PolarHBondContact O-N 2.68Å; D289-E293 VanDerWaalsContact O-N 3.09Å; A290-E293 WeakPolarHBondContact O-CA 3.19Å; A290-E293 WeakPolarHBondContact O-CB 3.47Å; A290-E293 PolarHBondContact O-N 2.68Å; F291-E293 VanDerWaalsContact C-N 3.29Å; F291-E293 PolarHBondContact O-N 3.17Å
294F80.5Confident79.4Confident3 Ų359.8 Ų59.81%0.01332%0.319CS..Hα-helixtrans-86-55.3173.5-76.2-129.4000111F196 A290 F291 T296 I302 E306 L307 A310 M311 L314 F344F196-F294 AromaticContact CE2-CE2 3.98Å; F196-F294 HydrophobicContact CE2-CE2 3.98Å; F196-F294 AromaticContact CE2-CZ 3.96Å; F196-F294 HydrophobicContact CE2-CZ 3.96Å; F196-F294 AromaticContact CZ-CE2 3.71Å; F196-F294 HydrophobicContact CZ-CE2 3.71Å; F196-F294 HydrophobicContact CZ-CZ 4.17Å; A290-F294 WeakPolarHBondContact O-CD2 3.41Å; A290-F294 PolarHBondContact O-N 2.88Å; A290-F294 VanDerWaalsContact O-N 3.11Å; F291-F294 PolarHBondContact O-N 3.09Å; F294-T296 PolarHBondContact O-N 3.03Å; F294-T296 PolarHBondContact O-OG1 3.45Å; F294-I302 HydrophobicContact CB-CD1 3.61Å; F294-I302 HydrophobicContact CB-CG1 3.96Å; F294-I302 HydrophobicContact CB-CG2 4.3Å; F294-I302 HydrophobicContact CD1-CD1 4.16Å; F294-I302 HydrophobicContact CG-CD1 4.2Å; F294-E306 WeakPolarHBondContact O-CB 3.09Å; F294-L307 HydrophobicContact CD1-CD1 4.25Å; F294-L307 HydrophobicContact CE1-CD1 4.22Å; F294-A310 HydrophobicContact CB-CB 4.26Å; F294-A310 HydrophobicContact CD1-CB 3.43Å; F294-A310 VanDerWaalsContact CD1-CB 3.43Å; F294-A310 HydrophobicContact CD2-CB 4.08Å; F294-A310 HydrophobicContact CE1-CB 3.74Å; F294-A310 HydrophobicContact CE2-CB 4.35Å; F294-A310 HydrophobicContact CG-CB 3.63Å; F294-A310 HydrophobicContact CZ-CB 4.2Å; F294-M311 HydrophobicContact CE1-CE 3.53Å; F294-M311 HydrophobicContact CZ-CE 4Å; F294-L314 HydrophobicContact CE1-CD1 4.33Å; F294-L314 HydrophobicContact CE2-CD1 3.91Å; F294-L314 HydrophobicContact CZ-CD1 3.5Å; F294-L314 VanDerWaalsContact CZ-CD1 3.5Å; F294-F344 HydrophobicContact CD1-CE2 4.13Å; F294-F344 HydrophobicContact CE1-CE2 4.07Å; F294-F344 HydrophobicContact CE2-CE2 4.44Å; F294-F344 HydrophobicContact CE2-CZ 4.47Å; F294-F344 HydrophobicContact CG-CE2 4.36Å; F294-F344 HydrophobicContact CZ-CE2 4.22Å
295D86.3Confident80.9Confident10 Ų1060.5 Ų60.55%0.05333%0.327CS..  trans-65.690.4172175.314.6000109.8F291 R292 N297 G298 D299 G300 I302F291-D295 HydrophobicContact CD1-CB 4.23Å; F291-D295 HydrophobicContact CE1-CB 4.05Å; F291-D295 WeakPolarHBondContact O-CB 3.49Å; F291-D295 PolarHBondContact O-N 3.39Å; R292-D295 VanDerWaalsContact O-O 3.05Å; D295-N297 VanDerWaalsContact C-N 3.35Å; D295-N297 PolarHBondContact OD1-N 3.1Å; D295-N297 PolarHBondContact OD1-ND2 2.88Å; D295-G298 WeakPolarHBondContact OD1-CA 3.34Å; D295-G298 PolarHBondContact OD1-N 3.19Å; D295-G298 VanDerWaalsContact OD2-CA 3.28Å; D295-G298 WeakPolarHBondContact OD2-CA 3.15Å; D295-D299 PolarHBondContact OD1-N 3.25Å; D295-D299 PolarHBondContact OD2-N 3.31Å; D295-G300 WeakPolarHBondContact OD2-CA 3.45Å; D295-G300 PolarHBondContact OD2-N 3.06Å; D295-I302 HydrophobicContact CB-CG1 4.33Å
296T83Confident82.3Confident92 Ų9258 Ų5856%0.56432%0.317SS*.SBendtrans-81.3-23.3-175.7-57.10000110.8F294 E306F294-T296 PolarHBondContact O-N 3.03Å; F294-T296 PolarHBondContact O-OG1 3.45Å; T296-E306 PolarHBondContact N-OE1 3.17Å
297N86.4Confident83.1Confident91 Ų9154.9 Ų54.949%0.48730%0.302SS..SBendtrans-89.3-27.9-177.289.478.6000113D295 D299 E306D295-N297 VanDerWaalsContact C-N 3.35Å; D295-N297 PolarHBondContact OD1-N 3.1Å; D295-N297 PolarHBondContact OD1-ND2 2.88Å; N297-D299 VanDerWaalsContact ND2-CG 3.26Å; N297-D299 PolarHBondContact ND2-OD1 3.35Å; N297-D299 PolarHBondContact ND2-OD2 2.57Å; N297-D299 WeakPolarHBondContact OD1-CB 3.36Å; N297-D299 PolarHBondContact OD1-N 2.87Å; N297-D299 PolarHBondContact OD1-OD1 3.16Å; N297-D299 PolarHBondContact OD1-OD2 3.39Å; N297-E306 WeakPolarHBondContact CB-OE1 3.38Å; N297-E306 PolarHBondContact N-OE1 2.74Å; N297-E306 PolarHBondContact ND2-OE1 3.39Å; N297-E306 PolarHBondContact ND2-OE2 2.84Å
298G85.7Confident83.8Confident60 Ų6058.4 Ų58.462%0.61931%0.314SS*.  trans86.319.2176.900000115.1D295 G300D295-G298 WeakPolarHBondContact OD1-CA 3.34Å; D295-G298 PolarHBondContact OD1-N 3.19Å; D295-G298 VanDerWaalsContact OD2-CA 3.28Å; D295-G298 WeakPolarHBondContact OD2-CA 3.15Å; G298-G300 VanDerWaalsContact C-N 3.3Å
299D87.8Confident84.2Confident75 Ų7554.5 Ų54.540%0.40130%0.302SS..SBendtrans-77.3-14.9178.464.1-2000113.3D295 N297 E301 R338D295-D299 PolarHBondContact OD1-N 3.25Å; D295-D299 PolarHBondContact OD2-N 3.31Å; N297-D299 VanDerWaalsContact ND2-CG 3.26Å; N297-D299 PolarHBondContact ND2-OD1 3.35Å; N297-D299 PolarHBondContact ND2-OD2 2.57Å; N297-D299 WeakPolarHBondContact OD1-CB 3.36Å; N297-D299 PolarHBondContact OD1-N 2.87Å; N297-D299 PolarHBondContact OD1-OD1 3.16Å; N297-D299 PolarHBondContact OD1-OD2 3.39Å; D299-E301 PolarHBondContact OD1-N 2.82Å; D299-E301 VanDerWaalsContact OD1-N 3.14Å; D299-R338 IonicContact OD2-CZ 3.94Å; D299-R338 IonicContact OD2-NH1 3.54Å; D299-R338 PolarHBondContact OD2-NH1 2.95Å
300G85.2Confident84.4Confident36 Ų3651.5 Ų51.537%0.37129%0.287SS..SBendtrans91.89.6-178.700000114.2F291 D295 G298F291-G300 WeakPolarHBondContact CE1-O 3.38Å; F291-G300 VanDerWaalsContact CZ-O 3.23Å; F291-G300 WeakPolarHBondContact CZ-O 3.46Å; D295-G300 WeakPolarHBondContact OD2-CA 3.45Å; D295-G300 PolarHBondContact OD2-N 3.06Å; G298-G300 VanDerWaalsContact C-N 3.3Å
301E89.4Confident84.4Confident73 Ų7351.1 Ų51.134%0.34128%0.283SS..SBendtrans-136.8120.3-178.4-62.6171.7170.400110D299 S303 R338D299-E301 PolarHBondContact OD1-N 2.82Å; D299-E301 VanDerWaalsContact OD1-N 3.14Å; E301-S303 PolarHBondContact O-N 2.86Å; E301-S303 VanDerWaalsContact O-N 3.17Å; E301-R338 HydrophobicContact CB-CB 4.29Å; E301-R338 WeakPolarHBondContact OE2-CD 3.2Å; E301-R338 IonicContact OE2-CZ 2.81Å; E301-R338 IonicContact OE2-NE 2.83Å; E301-R338 PolarHBondContact OE2-NE 2.93Å; E301-R338 IonicContact OE2-NH1 3.93Å; E301-R338 PolarHBondContact OE2-NH1 3.13Å
302I87.9Confident84.3Confident1 Ų155.9 Ų55.91%0.00530%0.301CS..BIsolated β-bridgetrans-76.5113-179.6-59165.3000109.2F291 F294 D295 E306 L307 V339 F344F291-I302 HydrophobicContact CD2-CD1 3.56Å; F291-I302 HydrophobicContact CD2-CG1 4.11Å; F291-I302 HydrophobicContact CE1-CG1 4.39Å; F291-I302 HydrophobicContact CE2-CD1 3.51Å; F291-I302 HydrophobicContact CE2-CG1 3.67Å; F291-I302 HydrophobicContact CG-CD1 4.29Å; F291-I302 HydrophobicContact CZ-CD1 4.19Å; F291-I302 HydrophobicContact CZ-CG1 3.83Å; F294-I302 HydrophobicContact CB-CD1 3.61Å; F294-I302 HydrophobicContact CB-CG1 3.96Å; F294-I302 HydrophobicContact CB-CG2 4.3Å; F294-I302 HydrophobicContact CD1-CD1 4.16Å; F294-I302 HydrophobicContact CG-CD1 4.2Å; D295-I302 HydrophobicContact CB-CG1 4.33Å; I302-E306 HydrophobicContact CG2-CB 4.13Å; I302-L307 HydrophobicContact CG2-CB 3.91Å; I302-V339 HydrophobicContact CB-CB 4.32Å; I302-V339 PolarHBondContact N-O 2.79Å; I302-V339 PolarHBondContact O-N 3.24Å; I302-V339 VanDerWaalsContact O-N 3.09Å; I302-F344 HydrophobicContact CD1-CD2 3.62Å; I302-F344 HydrophobicContact CD1-CE2 4.03Å; I302-F344 HydrophobicContact CD1-CG 4.33Å
303S89Confident83.8Confident22 Ų2254.7 Ų54.715%0.15430%0.299CS..  trans-75.4159.9175.973.20000113.2E301 S305 E306 L307E301-S303 PolarHBondContact O-N 2.86Å; E301-S303 VanDerWaalsContact O-N 3.17Å; S303-S305 PolarHBondContact O-N 3.27Å; S303-E306 VanDerWaalsContact CB-OE2 3.24Å; S303-E306 WeakPolarHBondContact CB-OE2 3.29Å; S303-E306 PolarHBondContact N-OE2 3.33Å; S303-E306 PolarHBondContact O-N 2.82Å; S303-E306 VanDerWaalsContact O-N 3.09Å; S303-E306 PolarHBondContact OG-N 2.95Å; S303-E306 PolarHBondContact OG-OE2 3.2Å; S303-L307 WeakPolarHBondContact O-CB 3.14Å; S303-L307 PolarHBondContact O-N 3.04Å
304T87.3Confident83.2Confident62 Ų6253 Ų5338%0.3829%0.293SS..Hα-helixtrans-44.1-38.6169.147.80000114.1R308 I328T304-R308 VanDerWaalsContact O-CB 3.32Å; T304-R308 WeakPolarHBondContact O-CB 3.27Å; T304-R308 PolarHBondContact O-N 3.46Å; T304-I328 HydrophobicContact CG2-CD1 3.52Å
305S86.8Confident82.5Confident84 Ų8454.8 Ų54.859%0.58730%0.303SS*.Hα-helixtrans-77.8-39-175.8-64.20000111.8S303 E309S303-S305 PolarHBondContact O-N 3.27Å; S305-E309 PolarHBondContact O-N 2.95Å
306E88.4Confident81.6Confident19 Ų1957.3 Ų57.39%0.08933%0.331CS..Hα-helixtrans-70.5-45.1175.9-78.4158.7134.400111.7F294 T296 N297 I302 S303 R308 E309 A310F294-E306 WeakPolarHBondContact O-CB 3.09Å; T296-E306 PolarHBondContact N-OE1 3.17Å; N297-E306 WeakPolarHBondContact CB-OE1 3.38Å; N297-E306 PolarHBondContact N-OE1 2.74Å; N297-E306 PolarHBondContact ND2-OE1 3.39Å; N297-E306 PolarHBondContact ND2-OE2 2.84Å; I302-E306 HydrophobicContact CG2-CB 4.13Å; S303-E306 VanDerWaalsContact CB-OE2 3.24Å; S303-E306 WeakPolarHBondContact CB-OE2 3.29Å; S303-E306 PolarHBondContact N-OE2 3.33Å; S303-E306 PolarHBondContact O-N 2.82Å; S303-E306 VanDerWaalsContact O-N 3.09Å; S303-E306 PolarHBondContact OG-N 2.95Å; S303-E306 PolarHBondContact OG-OE2 3.2Å; E306-R308 VanDerWaalsContact C-N 3.28Å; E306-R308 PolarHBondContact O-N 3.13Å; E306-E309 PolarHBondContact O-N 2.88Å; E306-A310 WeakPolarHBondContact O-CB 3.06Å; E306-A310 PolarHBondContact O-N 2.86Å
307L84.1Confident80.9Confident5 Ų559.8 Ų59.83%0.02634%0.336CS..Hα-helixtrans-55.9-44.8173.3-177.161000110.9F294 I302 S303 E309 A310 M311 I324 I327 I328F294-L307 HydrophobicContact CD1-CD1 4.25Å; F294-L307 HydrophobicContact CE1-CD1 4.22Å; I302-L307 HydrophobicContact CG2-CB 3.91Å; S303-L307 WeakPolarHBondContact O-CB 3.14Å; S303-L307 PolarHBondContact O-N 3.04Å; L307-E309 PolarHBondContact O-N 2.87Å; L307-A310 PolarHBondContact O-N 3.23Å; L307-M311 HydrophobicContact CD1-CE 3.93Å; L307-M311 HydrophobicContact CD1-CG 4.41Å; L307-M311 VanDerWaalsContact O-CB 3.31Å; L307-M311 WeakPolarHBondContact O-CB 3.36Å; L307-M311 VanDerWaalsContact O-CG 3.24Å; L307-M311 WeakPolarHBondContact O-CG 3.46Å; L307-M311 PolarHBondContact O-N 2.84Å; L307-I324 HydrophobicContact CD2-CG2 4.38Å; L307-I327 HydrophobicContact CD2-CB 4.4Å; L307-I327 HydrophobicContact CD2-CG2 3.81Å; L307-I328 HydrophobicContact CD2-CD1 4.14Å; L307-I328 HydrophobicContact CD2-CG1 3.7Å
308R83.4Confident80.2Confident98 Ų9862.8 Ų62.837%0.3735%0.347SS..Hα-helixtrans-63-38.8176.1-174.5177.5179.6-161.8-5.4112.9T304 E306 R312 I324T304-R308 VanDerWaalsContact O-CB 3.32Å; T304-R308 WeakPolarHBondContact O-CB 3.27Å; T304-R308 PolarHBondContact O-N 3.46Å; E306-R308 VanDerWaalsContact C-N 3.28Å; E306-R308 PolarHBondContact O-N 3.13Å; R308-R312 WeakPolarHBondContact O-CB 3.49Å; R308-R312 PolarHBondContact O-N 2.85Å; R308-I324 HydrophobicContact CB-CD1 4.01Å; R308-I324 HydrophobicContact CB-CG1 4.02Å; R308-I324 HydrophobicContact CG-CD1 4.34Å; R308-I324 HydrophobicContact CG-CG1 4.12Å
309E83.4Confident79.6Confident71 Ų7160.5 Ų60.533%0.33232%0.321SS..Hα-helixtrans-71.3-43.2177.1172.8147.2167.900112.3S305 E306 L307 R312 K313S305-E309 PolarHBondContact O-N 2.95Å; E306-E309 PolarHBondContact O-N 2.88Å; L307-E309 PolarHBondContact O-N 2.87Å; E309-R312 WeakPolarHBondContact O-CB 3.22Å; E309-R312 PolarHBondContact O-N 3.33Å; E309-R312 IonicContact OE1-NH2 3.99Å; E309-R312 PolarHBondContact OE1-NH2 2.96Å; E309-R312 IonicContact OE2-CZ 3.84Å; E309-R312 IonicContact OE2-NH2 3.41Å; E309-R312 PolarHBondContact OE2-NH2 2.8Å; E309-K313 HydrophobicContact CG-CD 4.2Å; E309-K313 WeakPolarHBondContact O-CG 3.46Å; E309-K313 PolarHBondContact O-N 3.28Å; E309-K313 WeakPolarHBondContact OE1-CE 3.33Å; E309-K313 IonicContact OE1-NZ 2.91Å; E309-K313 PolarHBondContact OE1-NZ 3.46Å
310A79.4Confident79.1Confident5 Ų558.3 Ų58.34%0.04132%0.316CS..Hα-helixtrans-59.7-48.7173.700000110.8F294 E306 L307 R312 K313 L314F294-A310 HydrophobicContact CB-CB 4.26Å; F294-A310 HydrophobicContact CD1-CB 3.43Å; F294-A310 VanDerWaalsContact CD1-CB 3.43Å; F294-A310 HydrophobicContact CD2-CB 4.08Å; F294-A310 HydrophobicContact CE1-CB 3.74Å; F294-A310 HydrophobicContact CE2-CB 4.35Å; F294-A310 HydrophobicContact CG-CB 3.63Å; F294-A310 HydrophobicContact CZ-CB 4.2Å; E306-A310 WeakPolarHBondContact O-CB 3.06Å; E306-A310 PolarHBondContact O-N 2.86Å; L307-A310 PolarHBondContact O-N 3.23Å; A310-R312 VanDerWaalsContact C-N 3.32Å; A310-R312 PolarHBondContact O-N 3.34Å; A310-K313 WeakPolarHBondContact O-CB 3.19Å; A310-K313 PolarHBondContact O-N 3.45Å; A310-K313 VanDerWaalsContact O-N 3.09Å; A310-L314 WeakPolarHBondContact O-CB 3.32Å; A310-L314 WeakPolarHBondContact O-CD1 3.26Å; A310-L314 VanDerWaalsContact O-CG 3.29Å; A310-L314 WeakPolarHBondContact O-CG 3.43Å; A310-L314 PolarHBondContact O-N 2.97Å
311M75.8Confident78.9Confident3 Ų362.2 Ų62.22%0.01533%0.325CS..Hα-helixtrans-56.1-43.8173.4-74.5-50.7110.500112L188 L192 F294 L307 K313 L314 L315 V319 I324L188-M311 HydrophobicContact CD1-SD 4.36Å; L192-M311 HydrophobicContact CD2-CE 3.83Å; L192-M311 HydrophobicContact CD2-SD 4.23Å; F294-M311 HydrophobicContact CE1-CE 3.53Å; F294-M311 HydrophobicContact CZ-CE 4Å; L307-M311 HydrophobicContact CD1-CE 3.93Å; L307-M311 HydrophobicContact CD1-CG 4.41Å; L307-M311 VanDerWaalsContact O-CB 3.31Å; L307-M311 WeakPolarHBondContact O-CB 3.36Å; L307-M311 VanDerWaalsContact O-CG 3.24Å; L307-M311 WeakPolarHBondContact O-CG 3.46Å; L307-M311 PolarHBondContact O-N 2.84Å; M311-K313 VanDerWaalsContact C-N 3.34Å; M311-K313 PolarHBondContact O-N 2.82Å; M311-L314 HydrophobicContact CE-CD1 4.12Å; M311-L314 PolarHBondContact O-N 3.07Å; M311-L315 HydrophobicContact CB-CD1 3.97Å; M311-L315 HydrophobicContact CG-CD1 4.35Å; M311-L315 VanDerWaalsContact O-CB 3.3Å; M311-L315 WeakPolarHBondContact O-CB 3.49Å; M311-L315 PolarHBondContact O-N 2.87Å; M311-L315 HydrophobicContact SD-CD1 3.81Å; M311-V319 HydrophobicContact CB-CG2 3.88Å; M311-I324 HydrophobicContact CG-CD1 4.23Å
312R77.7Confident78.5Confident113 Ų11368.4 Ų68.443%0.42635%0.345SS..Hα-helixtrans-61.4-39.9175.9-177.9-173.866.9-156.6-5.3112.5R308 E309 A310 G316R308-R312 WeakPolarHBondContact O-CB 3.49Å; R308-R312 PolarHBondContact O-N 2.85Å; E309-R312 WeakPolarHBondContact O-CB 3.22Å; E309-R312 PolarHBondContact O-N 3.33Å; E309-R312 IonicContact OE1-NH2 3.99Å; E309-R312 PolarHBondContact OE1-NH2 2.96Å; E309-R312 IonicContact OE2-CZ 3.84Å; E309-R312 IonicContact OE2-NH2 3.41Å; E309-R312 PolarHBondContact OE2-NH2 2.8Å; A310-R312 VanDerWaalsContact C-N 3.32Å; A310-R312 PolarHBondContact O-N 3.34Å; R312-G316 WeakPolarHBondContact O-CA 3.31Å; R312-G316 PolarHBondContact O-N 3.13Å
313K72.1Confident78.2Confident118 Ų11870.9 Ų70.951%0.51336%0.358SS..Hα-helixtrans-66.5-42.5177.2-71.6166.5-178.4163.30111.5E309 A310 M311E309-K313 HydrophobicContact CG-CD 4.2Å; E309-K313 WeakPolarHBondContact O-CG 3.46Å; E309-K313 PolarHBondContact O-N 3.28Å; E309-K313 WeakPolarHBondContact OE1-CE 3.33Å; E309-K313 IonicContact OE1-NZ 2.91Å; E309-K313 PolarHBondContact OE1-NZ 3.46Å; A310-K313 WeakPolarHBondContact O-CB 3.19Å; A310-K313 PolarHBondContact O-N 3.45Å; A310-K313 VanDerWaalsContact O-N 3.09Å; M311-K313 VanDerWaalsContact C-N 3.34Å; M311-K313 PolarHBondContact O-N 2.82Å
314L68.1Low77.9Confident71 Ų7170.1 Ų70.137%0.37235%0.352SS..Hα-helixtrans-79.1-44.7-174.5-68.2162.7000113.6A195 F196 F294 A310 M311A195-L314 HydrophobicContact CB-CD2 4.43Å; F196-L314 HydrophobicContact CE2-CD1 3.68Å; F196-L314 HydrophobicContact CE2-CD2 3.79Å; F196-L314 HydrophobicContact CE2-CG 4.39Å; F196-L314 HydrophobicContact CZ-CD1 3.94Å; F196-L314 HydrophobicContact CZ-CD2 3.58Å; F196-L314 HydrophobicContact CZ-CG 4.41Å; F294-L314 HydrophobicContact CE1-CD1 4.33Å; F294-L314 HydrophobicContact CE2-CD1 3.91Å; F294-L314 HydrophobicContact CZ-CD1 3.5Å; F294-L314 VanDerWaalsContact CZ-CD1 3.5Å; A310-L314 WeakPolarHBondContact O-CB 3.32Å; A310-L314 WeakPolarHBondContact O-CD1 3.26Å; A310-L314 VanDerWaalsContact O-CG 3.29Å; A310-L314 WeakPolarHBondContact O-CG 3.43Å; A310-L314 PolarHBondContact O-N 2.97Å; M311-L314 HydrophobicContact CE-CD1 4.12Å; M311-L314 PolarHBondContact O-N 3.07Å
315L66.4Low77.7Confident42 Ų4271.3 Ų71.322%0.2235%0.354CS..Hα-helixtrans-87-10.5-176.8-67.4148000112.6L188 M191 M311 H317 V319L188-L315 HydrophobicContact CD2-CD1 3.83Å; L188-L315 HydrophobicContact CD2-CD2 4Å; M191-L315 HydrophobicContact CB-CD2 4.43Å; M191-L315 HydrophobicContact CE-CD2 3.42Å; M191-L315 VanDerWaalsContact CE-CD2 3.42Å; M191-L315 HydrophobicContact SD-CD2 3.59Å; M191-L315 VanDerWaalsContact SD-CD2 3.59Å; M311-L315 HydrophobicContact CB-CD1 3.97Å; M311-L315 HydrophobicContact CG-CD1 4.35Å; M311-L315 VanDerWaalsContact O-CB 3.3Å; M311-L315 WeakPolarHBondContact O-CB 3.49Å; M311-L315 PolarHBondContact O-N 2.87Å; M311-L315 HydrophobicContact SD-CD1 3.81Å; L315-H317 PolarHBondContact O-N 3.5Å; L315-H317 PolarHBondContact O-ND1 3.23Å; L315-V319 HydrophobicContact CD1-CG2 3.73Å
316G65.8Low77.5Confident62 Ų6269.7 Ų69.764%0.63934%0.337SS*.SBendtrans65.51.3-174.400000114.9R312R312-G316 WeakPolarHBondContact O-CA 3.31Å; R312-G316 PolarHBondContact O-N 3.13Å
317H69.1Low77.1Confident145 Ų14569 Ų6967%0.67133%0.334SS*.SBendtrans-131.3153.5-173.6-63.883.3000110.3L315 V319L315-H317 PolarHBondContact O-N 3.5Å; L315-H317 PolarHBondContact O-ND1 3.23Å; H317-V319 PolarHBondContact O-N 3.22Å
318Q70.8Confident77.1Confident153 Ų15369.2 Ų69.272%0.71533%0.334SS*.  trans-77.9115.6177.3-69.1-171.678.300110.8
319V73.7Confident77.1Confident12 Ų1271.8 Ų71.87%0.07334%0.344CS..  trans-72.5140.9166.5-177.50000109.5F184 M311 L315 H317 D323 I324F184-V319 HydrophobicContact CE1-CG1 4.05Å; F184-V319 HydrophobicContact CZ-CG1 3.86Å; M311-V319 HydrophobicContact CB-CG2 3.88Å; L315-V319 HydrophobicContact CD1-CG2 3.73Å; H317-V319 PolarHBondContact O-N 3.22Å; V319-D323 HydrophobicContact CG1-CB 3.72Å; V319-I324 HydrophobicContact CB-CD1 4.07Å; V319-I324 HydrophobicContact CB-CG1 4.42Å; V319-I324 HydrophobicContact CG1-CD1 3.7Å; V319-I324 HydrophobicContact CG1-CG1 3.93Å
320G78Confident77Confident29 Ų2971 Ų7130%0.29934%0.342SS..  trans-72.5153.7-179.700000112.2R322 D323 I324G320-R322 PolarHBondContact O-N 3.22Å; G320-D323 VanDerWaalsContact CA-OD2 3.26Å; G320-D323 WeakPolarHBondContact CA-OD2 3.48Å; G320-D323 PolarHBondContact N-OD2 3.35Å; G320-D323 PolarHBondContact O-N 2.94Å; G320-I324 WeakPolarHBondContact O-CG1 3.36Å; G320-I324 PolarHBondContact O-N 3.27Å; G320-I324 VanDerWaalsContact O-N 3.14Å
321H80.6Confident77.1Confident118 Ų11871.2 Ų71.255%0.54634%0.343SS..Hα-helixtrans-59.8-37.1-179.9-163.3-80.8000112.3I324 E325H321-I324 PolarHBondContact O-N 3.26Å; H321-E325 IonicContact CE1-OE1 3.19Å; H321-E325 PolarHBondContact CE1-OE1 3.1Å; H321-E325 IonicContact CG-OE1 3.95Å; H321-E325 IonicContact ND1-OE1 2.68Å; H321-E325 PolarHBondContact ND1-OE1 2.95Å; H321-E325 WeakPolarHBondContact O-CG 3.24Å; H321-E325 PolarHBondContact O-N 3.49Å
322R81.7Confident77.6Confident203 Ų20372.4 Ų72.477%0.76635%0.35SS*.Hα-helixtrans-65-43.3177.1-69.3-176.7173.8-174.9-3.4112.2G320 I324 E325 E326G320-R322 PolarHBondContact O-N 3.22Å; R322-I324 VanDerWaalsContact C-N 3.29Å; R322-I324 PolarHBondContact O-N 2.94Å; R322-E325 WeakPolarHBondContact O-CB 3.19Å; R322-E325 PolarHBondContact O-N 3.2Å; R322-E326 WeakPolarHBondContact O-CB 3.32Å; R322-E326 PolarHBondContact O-N 3.27Å
323D81.8Confident77.9Confident53 Ų5372 Ų7228%0.28336%0.355SS..Hα-helixtrans-66.7-33.9-180-22-37.6000110.8F184 V319 G320 E326 I327F184-D323 HydrophobicContact CD1-CB 3.89Å; F184-D323 HydrophobicContact CE1-CB 3.48Å; F184-D323 VanDerWaalsContact CE1-CB 3.48Å; F184-D323 HydrophobicContact CE2-CB 4.2Å; F184-D323 HydrophobicContact CG-CB 4.39Å; F184-D323 HydrophobicContact CZ-CB 3.68Å; V319-D323 HydrophobicContact CG1-CB 3.72Å; G320-D323 VanDerWaalsContact CA-OD2 3.26Å; G320-D323 WeakPolarHBondContact CA-OD2 3.48Å; G320-D323 PolarHBondContact N-OD2 3.35Å; G320-D323 PolarHBondContact O-N 2.94Å; D323-E326 WeakPolarHBondContact O-CB 3.48Å; D323-E326 PolarHBondContact O-N 2.79Å; D323-I327 WeakPolarHBondContact O-CD1 3.29Å; D323-I327 VanDerWaalsContact O-CG1 3.25Å; D323-I327 WeakPolarHBondContact O-CG1 3.38Å; D323-I327 PolarHBondContact O-N 3.33Å
324I82.6Confident78.5Confident6 Ų670.5 Ų70.53%0.03135%0.353CS..Hα-helixtrans-67.1-42.6171.5-60.5-65.8000112L307 R308 M311 V319 G320 H321 R322 E326 I327 I328L307-I324 HydrophobicContact CD2-CG2 4.38Å; R308-I324 HydrophobicContact CB-CD1 4.01Å; R308-I324 HydrophobicContact CB-CG1 4.02Å; R308-I324 HydrophobicContact CG-CD1 4.34Å; R308-I324 HydrophobicContact CG-CG1 4.12Å; M311-I324 HydrophobicContact CG-CD1 4.23Å; V319-I324 HydrophobicContact CB-CD1 4.07Å; V319-I324 HydrophobicContact CB-CG1 4.42Å; V319-I324 HydrophobicContact CG1-CD1 3.7Å; V319-I324 HydrophobicContact CG1-CG1 3.93Å; G320-I324 WeakPolarHBondContact O-CG1 3.36Å; G320-I324 PolarHBondContact O-N 3.27Å; G320-I324 VanDerWaalsContact O-N 3.14Å; H321-I324 PolarHBondContact O-N 3.26Å; R322-I324 VanDerWaalsContact C-N 3.29Å; R322-I324 PolarHBondContact O-N 2.94Å; I324-E326 VanDerWaalsContact C-N 3.25Å; I324-E326 PolarHBondContact O-N 2.99Å; I324-I327 HydrophobicContact CD1-CD1 3.97Å; I324-I327 PolarHBondContact O-N 3.2Å; I324-I328 PolarHBondContact O-N 2.89Å
325E82.8Confident79.3Confident88 Ų8870.2 Ų70.241%0.41137%0.367SS..Hα-helixtrans-62.3-32.4173.5-71.8168.7-145.900112.6H321 R322 R329H321-E325 IonicContact CE1-OE1 3.19Å; H321-E325 PolarHBondContact CE1-OE1 3.1Å; H321-E325 IonicContact CG-OE1 3.95Å; H321-E325 IonicContact ND1-OE1 2.68Å; H321-E325 PolarHBondContact ND1-OE1 2.95Å; H321-E325 WeakPolarHBondContact O-CG 3.24Å; H321-E325 PolarHBondContact O-N 3.49Å; R322-E325 WeakPolarHBondContact O-CB 3.19Å; R322-E325 PolarHBondContact O-N 3.2Å; E325-R329 WeakPolarHBondContact O-CB 3.47Å; E325-R329 PolarHBondContact O-N 2.94Å; E325-R329 PolarHBondContact O-NH2 2.85Å
326E82.5Confident80.2Confident49 Ų4971.8 Ų71.823%0.22938%0.376CS..Hα-helixtrans-71-48.4176-166.1176.5114.300111.2D182 F184 R322 D323 I324 I328 R329 D330D182-E326 HydrophobicContact CB-CG 4.35Å; F184-E326 VanDerWaalsContact CB-OE1 3.3Å; F184-E326 WeakPolarHBondContact CB-OE1 3.31Å; R322-E326 WeakPolarHBondContact O-CB 3.32Å; R322-E326 PolarHBondContact O-N 3.27Å; D323-E326 WeakPolarHBondContact O-CB 3.48Å; D323-E326 PolarHBondContact O-N 2.79Å; I324-E326 VanDerWaalsContact C-N 3.25Å; I324-E326 PolarHBondContact O-N 2.99Å; E326-I328 VanDerWaalsContact C-N 3.34Å; E326-I328 PolarHBondContact O-N 2.96Å; E326-R329 PolarHBondContact O-N 2.87Å; E326-D330 PolarHBondContact O-N 2.97Å
327I79.1Confident81.1Confident5 Ų570.4 Ų70.43%0.02636%0.361CS..Hα-helixtrans-54-49.9173.9-66.3153.7000111.2F184 L185 L188 L307 D323 I324 R329 D330 V331F184-I327 HydrophobicContact CD1-CD1 4.22Å; F184-I327 HydrophobicContact CD1-CG1 4.01Å; F184-I327 HydrophobicContact CE1-CD1 3.8Å; F184-I327 HydrophobicContact CE1-CG1 4.11Å; L185-I327 HydrophobicContact CD2-CB 4.36Å; L185-I327 HydrophobicContact CD2-CG1 4Å; L185-I327 HydrophobicContact CD2-CG2 4.13Å; L188-I327 HydrophobicContact CD1-CD1 3.63Å; L188-I327 HydrophobicContact CD1-CG1 3.92Å; L307-I327 HydrophobicContact CD2-CB 4.4Å; L307-I327 HydrophobicContact CD2-CG2 3.81Å; D323-I327 WeakPolarHBondContact O-CD1 3.29Å; D323-I327 VanDerWaalsContact O-CG1 3.25Å; D323-I327 WeakPolarHBondContact O-CG1 3.38Å; D323-I327 PolarHBondContact O-N 3.33Å; I324-I327 HydrophobicContact CD1-CD1 3.97Å; I324-I327 PolarHBondContact O-N 3.2Å; I327-R329 PolarHBondContact O-N 2.99Å; I327-D330 PolarHBondContact O-N 3.12Å; I327-V331 HydrophobicContact CG2-CG2 4.36Å; I327-V331 WeakPolarHBondContact O-CG2 3.46Å; I327-V331 PolarHBondContact O-N 3.22Å
328I83.9Confident82Confident9 Ų967.4 Ų67.45%0.04634%0.344CS..Hα-helixtrans-63.6-44.7-178.4-68.8-165.3000110.1T304 L307 I324 E326 D330 V331 D332 V339T304-I328 HydrophobicContact CG2-CD1 3.52Å; L307-I328 HydrophobicContact CD2-CD1 4.14Å; L307-I328 HydrophobicContact CD2-CG1 3.7Å; I324-I328 PolarHBondContact O-N 2.89Å; E326-I328 VanDerWaalsContact C-N 3.34Å; E326-I328 PolarHBondContact O-N 2.96Å; I328-D330 PolarHBondContact O-N 2.68Å; I328-D330 VanDerWaalsContact O-N 3.09Å; I328-V331 PolarHBondContact O-N 2.93Å; I328-D332 HydrophobicContact CG2-CB 3.83Å; I328-D332 WeakPolarHBondContact O-CB 3.07Å; I328-D332 PolarHBondContact O-N 3.44Å; I328-V339 HydrophobicContact CG1-CG2 4.33Å
329R84Confident82.8Confident152 Ų15260.4 Ų60.457%0.57431%0.311SS*.Hα-helixtrans-58.1-27.9179.6-165.3-174.2-51.8110.911.4114.4E325 E326 I327E325-R329 WeakPolarHBondContact O-CB 3.47Å; E325-R329 PolarHBondContact O-N 2.94Å; E325-R329 PolarHBondContact O-NH2 2.85Å; E326-R329 PolarHBondContact O-N 2.87Å; I327-R329 PolarHBondContact O-N 2.99Å
330D81.6Confident83.6Confident54 Ų5462.2 Ų62.229%0.28932%0.321SS..Hα-helixtrans-89.2-19.8178.8-86.112.2000113.9L185 E326 I327 I328L185-D330 HydrophobicContact CD1-CB 3.38Å; L185-D330 WeakPolarHBondContact CD1-OD2 3.45Å; L185-D330 HydrophobicContact CG-CB 4.29Å; E326-D330 PolarHBondContact O-N 2.97Å; I327-D330 PolarHBondContact O-N 3.12Å; I328-D330 PolarHBondContact O-N 2.68Å; I328-D330 VanDerWaalsContact O-N 3.09Å
331V81.6Confident83.8Confident11 Ų1164.1 Ų64.17%0.06732%0.321CS..Hα-helixtrans-105.2-39.3-175.5176.20000112.2L185 I327 I328 L333 V339 E343 M347L185-V331 HydrophobicContact CD1-CG2 4.38Å; I327-V331 HydrophobicContact CG2-CG2 4.36Å; I327-V331 WeakPolarHBondContact O-CG2 3.46Å; I327-V331 PolarHBondContact O-N 3.22Å; I328-V331 PolarHBondContact O-N 2.93Å; V331-L333 PolarHBondContact O-N 3.21Å; V331-V339 HydrophobicContact CB-CG2 4.44Å; V331-V339 HydrophobicContact CG1-CG1 3.71Å; V331-V339 HydrophobicContact CG1-CG2 3.96Å; V331-E343 HydrophobicContact CG1-CB 4.14Å; V331-M347 HydrophobicContact CG1-CB 4.18Å; V331-M347 HydrophobicContact CG2-CB 4.22Å; V331-M347 HydrophobicContact CG2-CG 3.97Å; V331-M347 HydrophobicContact CG2-SD 3.93Å
332D86.8Confident83.9Confident27 Ų2765.6 Ų65.614%0.14433%0.328CS..  trans-66.4107.2173.91786.1000109.7I328 N334 G335 D336 G337I328-D332 HydrophobicContact CG2-CB 3.83Å; I328-D332 WeakPolarHBondContact O-CB 3.07Å; I328-D332 PolarHBondContact O-N 3.44Å; D332-N334 PolarHBondContact OD1-N 3.38Å; D332-N334 VanDerWaalsContact OD1-N 3.14Å; D332-G335 WeakPolarHBondContact OD1-CA 3.36Å; D332-G335 PolarHBondContact OD1-N 2.88Å; D332-G335 WeakPolarHBondContact OD2-CA 3.06Å; D332-D336 PolarHBondContact OD1-N 2.95Å; D332-D336 PolarHBondContact OD2-N 3.33Å; D332-G337 WeakPolarHBondContact OD2-CA 3.24Å; D332-G337 PolarHBondContact OD2-N 2.76Å
333L82.4Confident84.1Confident105 Ų10556.3 Ų56.355%0.5529%0.293SS..SBendtrans-93.4-22.6177.8-62179.3000111.9V331 E343V331-L333 PolarHBondContact O-N 3.21Å; L333-E343 HydrophobicContact CG-CG 4.43Å; L333-E343 PolarHBondContact N-OE1 3.45Å
334N84.9Confident84Confident87 Ų8753.8 Ų53.847%0.46528%0.28SS..SBendtrans-92.3-24.3-170.886.143.5000112.1D332 D336 E343D332-N334 PolarHBondContact OD1-N 3.38Å; D332-N334 VanDerWaalsContact OD1-N 3.14Å; N334-D336 PolarHBondContact ND2-OD2 3.25Å; N334-D336 WeakPolarHBondContact OD1-CB 3.28Å; N334-D336 PolarHBondContact OD1-N 2.91Å; N334-D336 PolarHBondContact OD1-OD2 2.9Å; N334-D336 VanDerWaalsContact OD1-OD2 3.1Å; N334-E343 PolarHBondContact N-OE1 2.87Å
335G85.4Confident83.6Confident64 Ų6455.3 Ų55.366%0.6629%0.289SS*.SBendtrans89.517.2177.200000115.7D332D332-G335 WeakPolarHBondContact OD1-CA 3.36Å; D332-G335 PolarHBondContact OD1-N 2.88Å; D332-G335 WeakPolarHBondContact OD2-CA 3.06Å
336D86Confident83.2Confident76 Ų7657.2 Ų57.241%0.40629%0.293SS..SBendtrans-85.3-10.4-176.870.622.3000114.8D332 N334 R338D332-D336 PolarHBondContact OD1-N 2.95Å; D332-D336 PolarHBondContact OD2-N 3.33Å; N334-D336 PolarHBondContact ND2-OD2 3.25Å; N334-D336 WeakPolarHBondContact OD1-CB 3.28Å; N334-D336 PolarHBondContact OD1-N 2.91Å; N334-D336 PolarHBondContact OD1-OD2 2.9Å; N334-D336 VanDerWaalsContact OD1-OD2 3.1Å; D336-R338 WeakPolarHBondContact OD1-CA 3.49Å; D336-R338 VanDerWaalsContact OD1-CB 3.24Å; D336-R338 WeakPolarHBondContact OD1-CB 3.5Å; D336-R338 PolarHBondContact OD1-N 3.33Å
337G84.4Confident82.7Confident32 Ų3256.6 Ų56.633%0.3329%0.29SS..SBendtrans78.716.7-179.100000114.9D332D332-G337 WeakPolarHBondContact OD2-CA 3.24Å; D332-G337 PolarHBondContact OD2-N 2.76Å
338R88.1Confident82.1Confident83 Ų8358 Ų5831%0.31330%0.297SS..SBendtrans-120.9-173.6173.8-55.1178.4159.7-121.4-10.7108.7D299 E301 D336D299-R338 IonicContact OD2-CZ 3.94Å; D299-R338 IonicContact OD2-NH1 3.54Å; D299-R338 PolarHBondContact OD2-NH1 2.95Å; E301-R338 HydrophobicContact CB-CB 4.29Å; E301-R338 WeakPolarHBondContact OE2-CD 3.2Å; E301-R338 IonicContact OE2-CZ 2.81Å; E301-R338 IonicContact OE2-NE 2.83Å; E301-R338 PolarHBondContact OE2-NE 2.93Å; E301-R338 IonicContact OE2-NH1 3.93Å; E301-R338 PolarHBondContact OE2-NH1 3.13Å; D336-R338 WeakPolarHBondContact OD1-CA 3.49Å; D336-R338 VanDerWaalsContact OD1-CB 3.24Å; D336-R338 WeakPolarHBondContact OD1-CB 3.5Å; D336-R338 PolarHBondContact OD1-N 3.33Å
339V87.7Confident80.7Confident5 Ų562 Ų623%0.0333%0.326CS..BIsolated β-bridgetrans-134.6114.7173.1176.60000108.4I302 I328 V331 E343 F344I302-V339 HydrophobicContact CB-CB 4.32Å; I302-V339 PolarHBondContact N-O 2.79Å; I302-V339 PolarHBondContact O-N 3.24Å; I302-V339 VanDerWaalsContact O-N 3.09Å; I328-V339 HydrophobicContact CG1-CG2 4.33Å; V331-V339 HydrophobicContact CB-CG2 4.44Å; V331-V339 HydrophobicContact CG1-CG1 3.71Å; V331-V339 HydrophobicContact CG1-CG2 3.96Å; V339-E343 HydrophobicContact CG1-CB 3.95Å; V339-F344 HydrophobicContact CG1-CB 4.08Å
340D88.8Confident79Confident51 Ų5164.7 Ų64.727%0.27334%0.336SS..  trans-80176.6176.38035.4000112.6E342 E343 F344D340-E342 PolarHBondContact O-N 3.32Å; D340-E342 WeakPolarHBondContact OD1-CA 3.34Å; D340-E342 WeakPolarHBondContact OD1-CB 3.46Å; D340-E342 PolarHBondContact OD1-N 2.96Å; D340-E343 PolarHBondContact N-OE2 3.26Å; D340-E343 PolarHBondContact OD1-N 3.44Å; D340-F344 VanDerWaalsContact O-CB 3.31Å; D340-F344 WeakPolarHBondContact O-CB 3.4Å; D340-F344 PolarHBondContact O-N 2.88Å
341F83.9Confident78.9Confident68 Ų6865.2 Ų65.230%0.29834%0.338SS..Hα-helixtrans-66.1-34.6-179.1-178.4-106.9000113.6V284 L287 R288 F291 V345V284-F341 HydrophobicContact CG1-CE1 4.37Å; V284-F341 HydrophobicContact CG1-CZ 4.2Å; L287-F341 HydrophobicContact CB-CE2 4.31Å; L287-F341 HydrophobicContact CB-CZ 4.49Å; R288-F341 HydrophobicContact CB-CE2 3.74Å; R288-F341 HydrophobicContact CB-CZ 3.98Å; R288-F341 HydrophobicContact CG-CE2 4.25Å; F291-F341 HydrophobicContact CB-CD2 4.06Å; F291-F341 HydrophobicContact CB-CE2 4.35Å; F291-F341 HydrophobicContact CD2-CB 4.43Å; F291-F341 AromaticContact CD2-CD2 3.94Å; F291-F341 HydrophobicContact CD2-CD2 3.94Å; F291-F341 HydrophobicContact CE2-CB 4.24Å; F291-F341 AromaticContact CG-CD2 3.92Å; F291-F341 HydrophobicContact CG-CD2 3.92Å; F291-F341 HydrophobicContact CZ-CB 4.44Å; F341-V345 HydrophobicContact CD1-CG2 4.27Å; F341-V345 HydrophobicContact CD2-CG2 4.44Å; F341-V345 HydrophobicContact CE1-CG2 3.84Å; F341-V345 HydrophobicContact CE2-CG2 4Å; F341-V345 HydrophobicContact CZ-CG2 3.69Å; F341-V345 WeakPolarHBondContact O-CB 3.35Å; F341-V345 WeakPolarHBondContact O-CG2 3.43Å; F341-V345 PolarHBondContact O-N 3.07Å
342E82.2Confident78.8Confident149 Ų14968.1 Ų68.170%0.69635%0.352SS*.Hα-helixtrans-72.6-39.3178.9-169.5172.1158.200110.8D340 V345 R346D340-E342 PolarHBondContact O-N 3.32Å; D340-E342 WeakPolarHBondContact OD1-CA 3.34Å; D340-E342 WeakPolarHBondContact OD1-CB 3.46Å; D340-E342 PolarHBondContact OD1-N 2.96Å; E342-V345 PolarHBondContact O-N 3.07Å; E342-R346 VanDerWaalsContact O-CB 3.31Å; E342-R346 WeakPolarHBondContact O-CB 3.34Å; E342-R346 PolarHBondContact O-N 3.29Å
343E85.1Confident78.3Confident8 Ų870.3 Ų70.34%0.03736%0.364CS..Hα-helixtrans-65.4-42.6173.1-66.8172.3151.800111.9V331 L333 N334 V339 D340 R346 M347V331-E343 HydrophobicContact CG1-CB 4.14Å; L333-E343 HydrophobicContact CG-CG 4.43Å; L333-E343 PolarHBondContact N-OE1 3.45Å; N334-E343 PolarHBondContact N-OE1 2.87Å; V339-E343 HydrophobicContact CG1-CB 3.95Å; D340-E343 PolarHBondContact N-OE2 3.26Å; D340-E343 PolarHBondContact OD1-N 3.44Å; E343-R346 WeakPolarHBondContact O-CB 3.18Å; E343-R346 PolarHBondContact O-N 2.71Å; E343-M347 PolarHBondContact O-N 2.92Å
344F79.3Confident78.1Confident1 Ų168.3 Ų68.30%0.00435%0.353CS..Hα-helixtrans-62.9-44.2173.9-178.6-94.2000112.5L287 A290 F291 F294 I302 V339 D340 R346 M347 M348L287-F344 HydrophobicContact CB-CE1 4.46Å; L287-F344 HydrophobicContact CD2-CD1 4.41Å; L287-F344 HydrophobicContact CD2-CE1 3.95Å; L287-F344 WeakPolarHBondContact O-CE1 3.34Å; A290-F344 HydrophobicContact CB-CE1 4.47Å; A290-F344 HydrophobicContact CB-CZ 4.34Å; F291-F344 HydrophobicContact CB-CD1 4.3Å; F291-F344 HydrophobicContact CB-CE1 4.31Å; F291-F344 HydrophobicContact CD2-CB 3.71Å; F291-F344 AromaticContact CD2-CD1 3.94Å; F291-F344 HydrophobicContact CD2-CD1 3.94Å; F291-F344 HydrophobicContact CD2-CD2 4.2Å; F291-F344 AromaticContact CD2-CG 3.7Å; F291-F344 HydrophobicContact CD2-CG 3.7Å; F291-F344 HydrophobicContact CE2-CB 3.95Å; F291-F344 HydrophobicContact CE2-CG 4.36Å; F294-F344 HydrophobicContact CD1-CE2 4.13Å; F294-F344 HydrophobicContact CE1-CE2 4.07Å; F294-F344 HydrophobicContact CE2-CE2 4.44Å; F294-F344 HydrophobicContact CE2-CZ 4.47Å; F294-F344 HydrophobicContact CG-CE2 4.36Å; F294-F344 HydrophobicContact CZ-CE2 4.22Å; I302-F344 HydrophobicContact CD1-CD2 3.62Å; I302-F344 HydrophobicContact CD1-CE2 4.03Å; I302-F344 HydrophobicContact CD1-CG 4.33Å; V339-F344 HydrophobicContact CG1-CB 4.08Å; D340-F344 VanDerWaalsContact O-CB 3.31Å; D340-F344 WeakPolarHBondContact O-CB 3.4Å; D340-F344 PolarHBondContact O-N 2.88Å; F344-R346 VanDerWaalsContact C-N 3.31Å; F344-R346 PolarHBondContact O-N 3.31Å; F344-M347 HydrophobicContact CD2-CE 3.72Å; F344-M347 HydrophobicContact CE2-CE 3.84Å; F344-M347 WeakPolarHBondContact O-CB 3.4Å; F344-M347 PolarHBondContact O-N 3.43Å; F344-M348 HydrophobicContact CE1-CE 4.31Å; F344-M348 HydrophobicContact CE1-CG 4.32Å; F344-M348 HydrophobicContact CE2-CE 3.9Å; F344-M348 HydrophobicContact CZ-CE 3.62Å; F344-M348 HydrophobicContact CZ-CG 4.5Å; F344-M348 WeakPolarHBondContact O-CG 3.49Å; F344-M348 PolarHBondContact O-N 3.26Å
345V76.1Confident77.6Confident37 Ų3767.1 Ų67.122%0.22435%0.346CS..Hα-helixtrans-58.9-46.3173.21690000109.7L287 F341 E342 M347 M348 S349L287-V345 HydrophobicContact CB-CG2 4.39Å; L287-V345 HydrophobicContact CD1-CB 4.49Å; L287-V345 HydrophobicContact CD1-CG1 4.25Å; L287-V345 HydrophobicContact CD1-CG2 4.01Å; F341-V345 HydrophobicContact CD1-CG2 4.27Å; F341-V345 HydrophobicContact CD2-CG2 4.44Å; F341-V345 HydrophobicContact CE1-CG2 3.84Å; F341-V345 HydrophobicContact CE2-CG2 4Å; F341-V345 HydrophobicContact CZ-CG2 3.69Å; F341-V345 WeakPolarHBondContact O-CB 3.35Å; F341-V345 WeakPolarHBondContact O-CG2 3.43Å; F341-V345 PolarHBondContact O-N 3.07Å; E342-V345 PolarHBondContact O-N 3.07Å; V345-M347 VanDerWaalsContact C-N 3.3Å; V345-M347 PolarHBondContact O-N 3.06Å; V345-M348 PolarHBondContact O-N 3.5Å; V345-S349 PolarHBondContact O-N 3.41Å; V345-S349 PolarHBondContact O-OG 3.3Å; V345-S349 VanDerWaalsContact O-OG 3.08Å
346R72.9Confident77.1Confident129 Ų12967.3 Ų67.349%0.48733%0.325SS..Hα-helixtrans-63.2-32.6179.1-167.4-174.9-168.7124.8-2.2113.5E342 E343 F344 M348 R350E342-R346 VanDerWaalsContact O-CB 3.31Å; E342-R346 WeakPolarHBondContact O-CB 3.34Å; E342-R346 PolarHBondContact O-N 3.29Å; E343-R346 WeakPolarHBondContact O-CB 3.18Å; E343-R346 PolarHBondContact O-N 2.71Å; F344-R346 VanDerWaalsContact C-N 3.31Å; F344-R346 PolarHBondContact O-N 3.31Å; R346-M348 VanDerWaalsContact C-N 3.32Å; R346-R350 WeakPolarHBondContact O-CB 3.48Å
347M71.6Confident76.5Confident36 Ų3666.7 Ų66.718%0.17732%0.319CS..Hα-helixtrans-64.9-36172.2-176.9-175.565.200111.7L192 V331 E343 F344 V345L192-M347 HydrophobicContact CD1-CE 4.45Å; L192-M347 HydrophobicContact CD1-SD 4.38Å; V331-M347 HydrophobicContact CG1-CB 4.18Å; V331-M347 HydrophobicContact CG2-CB 4.22Å; V331-M347 HydrophobicContact CG2-CG 3.97Å; V331-M347 HydrophobicContact CG2-SD 3.93Å; E343-M347 PolarHBondContact O-N 2.92Å; F344-M347 HydrophobicContact CD2-CE 3.72Å; F344-M347 HydrophobicContact CE2-CE 3.84Å; F344-M347 WeakPolarHBondContact O-CB 3.4Å; F344-M347 PolarHBondContact O-N 3.43Å; V345-M347 VanDerWaalsContact C-N 3.3Å; V345-M347 PolarHBondContact O-N 3.06Å
348M66.6Low75.9Confident34 Ų3469.4 Ų69.417%0.16732%0.318CS..Hα-helixtrans-86.6-26.4-178.1-64-62-168.700114L192 F196 L287 F344 V345 R346L192-M348 HydrophobicContact CB-SD 4.27Å; F196-M348 HydrophobicContact CB-CE 4.19Å; F196-M348 HydrophobicContact CB-SD 4.35Å; F196-M348 HydrophobicContact CD2-CE 3.78Å; F196-M348 HydrophobicContact CE2-CE 4.47Å; F196-M348 HydrophobicContact CG-CE 4.16Å; L287-M348 HydrophobicContact CD2-CB 3.67Å; L287-M348 HydrophobicContact CD2-CG 3.64Å; F344-M348 HydrophobicContact CE1-CE 4.31Å; F344-M348 HydrophobicContact CE1-CG 4.32Å; F344-M348 HydrophobicContact CE2-CE 3.9Å; F344-M348 HydrophobicContact CZ-CE 3.62Å; F344-M348 HydrophobicContact CZ-CG 4.5Å; F344-M348 WeakPolarHBondContact O-CG 3.49Å; F344-M348 PolarHBondContact O-N 3.26Å; V345-M348 PolarHBondContact O-N 3.5Å; R346-M348 VanDerWaalsContact C-N 3.32Å
349S55.8Low74.9Confident92 Ų9268.3 Ų68.364%0.64332%0.319SS*.  trans-86.95.9-176.8-57.70000115.8V345V345-S349 PolarHBondContact O-N 3.41Å; V345-S349 PolarHBondContact O-OG 3.3Å; V345-S349 VanDerWaalsContact O-OG 3.08Å
350R48.4Very low73.7Confident209 Ų20974 Ų7479%0.78935%0.345SS*.  trans-117.20-164.2-157.1-179.9-165.4-162.42.1114.3R189 R346R189-R350 PolarHBondContact NE-O 2.86Å; R189-R350 PolarHBondContact NH1-O 3.44Å; R189-R350 PolarHBondContact NH1-OXT 2.79Å; R346-R350 WeakPolarHBondContact O-CB 3.48Å

Retrieved 350 of 350 residues in 408.8 ms (Link to these results)