A0A087X187_HUMAN Loading...

POTE ankyrin domain family member M

AlphaFold DB , UniProt , Accession A0A087X187, Species HUMAN (Homo sapiens, Human), Gene POTEM, Length 486 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M39.5Very low30.8Very low248 Ų248134.3 Ų134.3100%1.22287%0.866SS**  0123.30-82.5170.4164.200107.4
2V32.2Very low30.6Very low145 Ų145132.8 Ų132.888%0.87986%0.862SS**  trans-92.9156.2-161.1172.30000110.9
3A30.5Very low30.4Very low83 Ų83131.5 Ų131.569%0.68686%0.858SS**  trans-39.6158.2174.700000118
4E29.7Very low30.3Very low197 Ų197131.7 Ų131.792%0.92186%0.855SS**  -161.9153.4110-112-174.9164.300113.5
5A30.7Very low30.3Very low104 Ų104136.3 Ų136.386%0.8686%0.856SS**  trans-83.2158.5-174.200000113
6G26.6Very low30.4Very low78 Ų78139.3 Ų139.380%0.80485%0.852SS**  trans-177.486.8171.600000114.8
7S28.8Very low30.3Very low123 Ų123138.8 Ų138.886%0.8685%0.852SS**  trans15.7131.7149.5-142.90000121.5
8M31.2Very low30.2Very low181 Ų181142.8 Ų142.889%0.89286%0.857SS**PPolyproline II helixtrans-62.6143.8168.9-58.917384.600112.9
9P30.2Very low30.4Very low126 Ų126138.7 Ų138.782%0.81885%0.846SS**PPolyproline II helixtrans-99.5134.6157.130.6-20.7000111.8
10A29Very low30.5Very low98 Ų98140.1 Ų140.181%0.8185%0.847SS**PPolyproline II helixtrans-65.3151.7174.800000113.3
11A29.9Very low30.5Very low94 Ų94144.8 Ų144.878%0.77785%0.85SS**  trans4.4119.416000000118.3S13A11-S13 PolarHBondContact O-N 3.36Å
12S28.5Very low30.4Very low117 Ų117136.9 Ų136.982%0.81882%0.819SS**  trans-57.1118.5170.555.30000112.8V14S12-V14 PolarHBondContact O-N 3.3Å
13S28.2Very low30.6Very low116 Ų116138.6 Ų138.681%0.81182%0.815SS**  trans-60.5110.8171.8-55.80000112.6A11 K15A11-S13 PolarHBondContact O-N 3.36Å; S13-K15 PolarHBondContact O-N 3.11Å
14V28.8Very low30.7Very low134 Ų134141.9 Ų141.981%0.81282%0.818SS**  trans-72.3118.4165.2175.40000108.9S12 K16S12-V14 PolarHBondContact O-N 3.3Å; V14-K16 PolarHBondContact O-N 3.28Å
15K30.3Very low30.8Very low201 Ų201134 Ų13487%0.87479%0.79SS**  trans-59.7113.2176-72.3174177.5173.30110.4S13S13-K15 PolarHBondContact O-N 3.11Å
16K31.9Very low31.1Very low183 Ų183136.7 Ų136.780%0.79678%0.782SS**  trans-75.1132163.1-69.7176.4179175.30109.1V14 F18V14-K16 PolarHBondContact O-N 3.28Å; K16-F18 PolarHBondContact O-N 3.27Å
17P28.8Very low31.4Very low131 Ų131142.5 Ų142.585%0.85178%0.78SS**  trans-73.4113.4171.427.4-29000109.9
18F28.1Very low31.6Very low212 Ų212140.5 Ų140.593%0.9377%0.765SS**  trans-65.2130.2164.9-92-98.9000109.9K16K16-F18 PolarHBondContact O-N 3.27Å
19G34.3Very low31.6Very low64 Ų64141.7 Ų141.766%0.6676%0.759SS**  trans-173.615.7176.100000119.6
20L32.3Very low31.9Very low166 Ų166144 Ų14487%0.86976%0.759SS**SBendtrans-132.8-0.5-179.6-93.3154.5000115.9
21R32.2Very low32.1Very low239 Ų239142.8 Ų142.890%0.90274%0.744SS**SBendtrans-97.9-8.4175.8-108.5-179.2178.5-1440.2115.2
22S35.5Very low32.2Very low82 Ų82145.6 Ų145.657%0.57374%0.738SS**THydrogen-bonded Turntrans-89.1-16-177.772.30000114.8
23K36.6Very low32.3Very low182 Ų182146 Ų14679%0.79174%0.738SS**THydrogen-bonded Turntrans-86.9-32.8178.1-78.5-178.2176179.10113.6G25 K26K23-G25 VanDerWaalsContact C-N 3.34Å; K23-K26 PolarHBondContact O-N 3.27Å
24M32.9Very low32.4Very low151 Ų151152.3 Ų152.374%0.74475%0.745SS**Hα-helixtrans-73.5-27.2173.4-126.5125.998.200112.8K26 C28M24-K26 VanDerWaalsContact C-N 3.29Å; M24-K26 PolarHBondContact O-N 3.19Å; M24-C28 PolarHBondContact O-N 2.89Å
25G33.1Very low32.5Very low32 Ų32151.9 Ų151.933%0.3375%0.746SS.*Hα-helixtrans-72.4-16.4174.800000114.8K23 R29K23-G25 VanDerWaalsContact C-N 3.34Å; G25-R29 WeakPolarHBondContact O-CD 3.49Å; G25-R29 VanDerWaalsContact O-CG 3.27Å; G25-R29 WeakPolarHBondContact O-CG 3.33Å
26K36.5Very low32.5Very low160 Ų160154.5 Ų154.570%0.69675%0.751SS**Hα-helixtrans-90.2-30.4175.5-72.2-176.7-179-173.30112.4K23 M24K23-K26 PolarHBondContact O-N 3.27Å; M24-K26 VanDerWaalsContact C-N 3.29Å; M24-K26 PolarHBondContact O-N 3.19Å
27W33.1Very low32.3Very low200 Ų200149.5 Ų149.576%0.75875%0.751SS**Hα-helixtrans-71.5-44.4175.6-14768.2000111.8R29 H30W27-R29 VanDerWaalsContact C-N 3.32Å; W27-R29 PolarHBondContact O-N 3.45Å; W27-H30 PolarHBondContact O-N 3.09Å
28C31.7Very low32.7Very low81 Ų81149.5 Ų149.555%0.54775%0.754SS.*Hα-helixtrans-69.8-21.7178-73.90000114.8M24M24-C28 PolarHBondContact O-N 2.89Å
29R32.9Very low32.7Very low207 Ų207143.1 Ų143.178%0.78175%0.748SS**Hα-helixtrans-78.7-21177.2-77.3179.4-165.9-117.13.7113.4G25 W27G25-R29 WeakPolarHBondContact O-CD 3.49Å; G25-R29 VanDerWaalsContact O-CG 3.27Å; G25-R29 WeakPolarHBondContact O-CG 3.33Å; W27-R29 VanDerWaalsContact C-N 3.32Å; W27-R29 PolarHBondContact O-N 3.45Å
30H36.3Very low32.7Very low174 Ų174150.4 Ų150.481%0.80676%0.761SS**Hα-helixtrans-90.8-20.5-178-137-64.3000113.1W27W27-H30 PolarHBondContact O-N 3.09Å
31C32.1Very low32.5Very low73 Ų73148.1 Ų148.149%0.49376%0.759SS.*Hα-helixtrans-100.1-18.4-179.1-61.60000114.5
32F32.2Very low32.6Very low152 Ų152144.4 Ų144.467%0.66776%0.757SS**  trans-147.396.8-177.1-67.2-80.7000113W34F32-W34 VanDerWaalsContact C-N 3.25Å; F32-W34 PolarHBondContact O-N 3.08Å
33P30Very low32.2Very low126 Ų126147.6 Ų147.682%0.81877%0.773SS**SBendtrans-73.7-6.1179.5-17.131.4000115.3
34W31.5Very low31.8Very low249 Ų249141.8 Ų141.894%0.94377%0.765SS**  trans-128.677.7-176.2-104-12.6000112.5F32F32-W34 VanDerWaalsContact C-N 3.25Å; F32-W34 PolarHBondContact O-N 3.08Å
35C30.3Very low31.9Very low124 Ų124141.3 Ų141.384%0.83877%0.771SS**  trans-146.979.1159.1-91.20000109.1
36R30.5Very low31.7Very low257 Ų257145.7 Ų145.797%0.9780%0.796SS**  trans-102.9123.3153-99.7-169.3175.6-1422.8106.9
37G28.1Very low31.7Very low78 Ų78141.1 Ų141.180%0.80480%0.795SS**  trans-179.193.1174.500000111.5
38S36.1Very low31.5Very low130 Ų130139 Ų13991%0.90980%0.798SS**  trans-64.9140.9168.7520000111.7
39G27.6Very low31.7Very low78 Ų78143.6 Ų143.680%0.80481%0.811SS**  trans-166.1108.8164.900000110.9
40K34.9Very low32Very low217 Ų217140.9 Ų140.994%0.94381%0.812SS**  trans-76.8141.2167.2-69.1176.3175.7177.30108.8
41S29.2Very low32.3Very low119 Ų119136.6 Ų136.683%0.83280%0.795SS**  trans-158.2124.3143.949.20000111.3
42N33.4Very low32.6Very low160 Ų160137.4 Ų137.486%0.85680%0.802SS**  trans-71.7143.6156.5-74.5-14.5000108.7
43V28.1Very low32.9Very low150 Ų150132.9 Ų132.991%0.90979%0.793SS**  trans-164.9139.8135176.40000107.6
44G26.4Very low33.1Very low60 Ų60132.3 Ų132.362%0.61978%0.78SS**  trans-87.3171.7-176.500000116.7
45T35.9Very low33.4Very low141 Ų141126.7 Ų126.787%0.86576%0.763SS**  trans20.6110.1155.458.20000120.2
46S28.7Very low33.9Very low123 Ų123123.9 Ų123.986%0.8674%0.741SS**  175.8147.9117.7560000109.2
47G36.9Very low34.1Very low65 Ų65116.4 Ų116.467%0.6772%0.72SS**  trans-60.8140.2-177.400000113.1
48D28.8Very low34.5Very low155 Ų155121.7 Ų121.783%0.82972%0.716SS**  trans172.3118134.9-83.2-24000109.3
49H34.9Very low34.8Very low177 Ų177118.4 Ų118.482%0.81969%0.693SS**  trans33.1116.1160-66.7-74.4000121.2D51H49-D51 VanDerWaalsContact C-N 3.28Å; H49-D51 PolarHBondContact O-N 3.24Å
50D41Very low35.4Very low150 Ų150121.6 Ų121.680%0.80269%0.685SS**SBendtrans-58.568.4165.5-79.2-48.7000114.7
51D40.8Very low35.5Very low85 Ų85116 Ų11646%0.45566%0.663SS.*  trans-102.4-16.9167.6-163.334.8000112H49 K55H49-D51 VanDerWaalsContact C-N 3.28Å; H49-D51 PolarHBondContact O-N 3.24Å; D51-K55 WeakPolarHBondContact O-CB 3.48Å; D51-K55 WeakPolarHBondContact O-CG 3.28Å; D51-K55 PolarHBondContact O-N 3.33Å; D51-K55 VanDerWaalsContact O-N 3.14Å; D51-K55 VanDerWaalsContact OD2-CE 3.23Å; D51-K55 WeakPolarHBondContact OD2-CE 3.41Å; D51-K55 IonicContact OD2-NZ 2.68Å; D51-K55 PolarHBondContact OD2-NZ 3.03Å
52S39.4Very low35.9Very low90 Ų90111.6 Ų111.663%0.62964%0.636SS**Hα-helixtrans-70.4-40.4177.8151.30000112.9K55 T56S52-K55 PolarHBondContact O-N 3.1Å; S52-T56 WeakPolarHBondContact O-CB 3.4Å; S52-T56 PolarHBondContact O-N 3.43Å; S52-T56 PolarHBondContact O-OG1 2.7Å
53A38.7Very low36.1Very low57 Ų57110.6 Ų110.647%0.47163%0.625SS.*Hα-helixtrans-68.1-40.9-179.800000111.9T56 L57A53-T56 PolarHBondContact O-N 2.77Å; A53-L57 WeakPolarHBondContact O-CB 3.39Å; A53-L57 PolarHBondContact O-N 3.06Å
54M34.6Very low36.5Very low114 Ų114112 Ų11256%0.56261%0.614SS**Hα-helixtrans-68.4-40.3176.1-98.8-76.6-140.400112.7T56 L57 R58M54-T56 VanDerWaalsContact C-N 3.31Å; M54-T56 PolarHBondContact O-N 3.27Å; M54-L57 PolarHBondContact O-N 3.39Å; M54-R58 WeakPolarHBondContact O-CB 3.49Å; M54-R58 WeakPolarHBondContact O-CG 3.41Å; M54-R58 PolarHBondContact O-N 3.05Å
55K36.2Very low36.9Very low131 Ų131111.7 Ų111.757%0.5760%0.601SS**Hα-helixtrans-63.2-37.9172.5-79.8169.3174.4156.30112D51 S52 S59D51-K55 WeakPolarHBondContact O-CB 3.48Å; D51-K55 WeakPolarHBondContact O-CG 3.28Å; D51-K55 PolarHBondContact O-N 3.33Å; D51-K55 VanDerWaalsContact O-N 3.14Å; D51-K55 VanDerWaalsContact OD2-CE 3.23Å; D51-K55 WeakPolarHBondContact OD2-CE 3.41Å; D51-K55 IonicContact OD2-NZ 2.68Å; D51-K55 PolarHBondContact OD2-NZ 3.03Å; S52-K55 PolarHBondContact O-N 3.1Å; K55-S59 VanDerWaalsContact O-CB 3.25Å; K55-S59 WeakPolarHBondContact O-CB 3.5Å; K55-S59 PolarHBondContact O-N 3.49Å
56T40.5Very low36.8Very low64 Ų64114.7 Ų114.739%0.39360%0.597SS.*Hα-helixtrans-67.5-38.7175.5-57.20000111.9S52 A53 M54 S59 K60S52-T56 WeakPolarHBondContact O-CB 3.4Å; S52-T56 PolarHBondContact O-N 3.43Å; S52-T56 PolarHBondContact O-OG1 2.7Å; A53-T56 PolarHBondContact O-N 2.77Å; M54-T56 VanDerWaalsContact C-N 3.31Å; M54-T56 PolarHBondContact O-N 3.27Å; T56-S59 PolarHBondContact O-N 3.35Å; T56-K60 HydrophobicContact CG2-CD 4.18Å; T56-K60 WeakPolarHBondContact O-CB 3.32Å; T56-K60 VanDerWaalsContact O-CG 3.28Å; T56-K60 WeakPolarHBondContact O-CG 3.3Å; T56-K60 PolarHBondContact O-N 3.3Å
57L35.4Very low37.2Very low101 Ų101116.7 Ų116.753%0.52959%0.592SS.*Hα-helixtrans-70.7-42.2177.2-144.1134.1000111.6A53 M54 S59 K60 M61A53-L57 WeakPolarHBondContact O-CB 3.39Å; A53-L57 PolarHBondContact O-N 3.06Å; M54-L57 PolarHBondContact O-N 3.39Å; L57-S59 PolarHBondContact O-N 2.97Å; L57-K60 PolarHBondContact O-N 3.34Å; L57-M61 HydrophobicContact CD2-CE 3.95Å; L57-M61 HydrophobicContact CD2-SD 4.27Å; L57-M61 WeakPolarHBondContact O-CB 3.16Å; L57-M61 PolarHBondContact O-N 2.99Å
58R37.8Very low37.1Very low189 Ų189116.6 Ų116.671%0.71358%0.581SS**Hα-helixtrans-61.8-40.3171.6-77.9-175-174.5-1593112.7M54 G62M54-R58 WeakPolarHBondContact O-CB 3.49Å; M54-R58 WeakPolarHBondContact O-CG 3.41Å; M54-R58 PolarHBondContact O-N 3.05Å; R58-G62 PolarHBondContact O-N 3.24Å
59S41.1Very low37.3Very low60 Ų60114.6 Ų114.642%0.4257%0.565SS.*Hα-helixtrans-66.7-40.8176.6179.30000112K55 T56 L57 G62 K63K55-S59 VanDerWaalsContact O-CB 3.25Å; K55-S59 WeakPolarHBondContact O-CB 3.5Å; K55-S59 PolarHBondContact O-N 3.49Å; T56-S59 PolarHBondContact O-N 3.35Å; L57-S59 PolarHBondContact O-N 2.97Å; S59-G62 PolarHBondContact O-N 3.01Å; S59-K63 WeakPolarHBondContact O-CG 3.37Å; S59-K63 PolarHBondContact O-N 3.03Å
60K40.8Very low37.2Very low145 Ų145112.2 Ų112.263%0.6357%0.565SS**Hα-helixtrans-69.2-39.4175.6-73.7174.7179.6178.90112.2T56 L57 K63 W64T56-K60 HydrophobicContact CG2-CD 4.18Å; T56-K60 WeakPolarHBondContact O-CB 3.32Å; T56-K60 VanDerWaalsContact O-CG 3.28Å; T56-K60 WeakPolarHBondContact O-CG 3.3Å; T56-K60 PolarHBondContact O-N 3.3Å; L57-K60 PolarHBondContact O-N 3.34Å; K60-K63 PolarHBondContact O-N 3.48Å; K60-W64 WeakPolarHBondContact O-CB 3.34Å; K60-W64 PolarHBondContact O-N 3.34Å
61M36.9Very low36.7Very low99 Ų99117 Ų11749%0.48857%0.572SS.*Hα-helixtrans-65.1-40.2172.5-131.8102.395.900111.7L57 K63 W64 C65L57-M61 HydrophobicContact CD2-CE 3.95Å; L57-M61 HydrophobicContact CD2-SD 4.27Å; L57-M61 WeakPolarHBondContact O-CB 3.16Å; L57-M61 PolarHBondContact O-N 2.99Å; M61-K63 VanDerWaalsContact C-N 3.31Å; M61-K63 PolarHBondContact O-N 3.42Å; M61-W64 PolarHBondContact O-N 2.66Å; M61-C65 PolarHBondContact O-N 3.37Å
62G36.5Very low36.3Very low27 Ų27118.6 Ų118.628%0.27859%0.589SS.*Hα-helixtrans-70-23.7177.400000114.2R58 S59 R66R58-G62 PolarHBondContact O-N 3.24Å; S59-G62 PolarHBondContact O-N 3.01Å; G62-R66 VanDerWaalsContact O-CG 3.3Å; G62-R66 WeakPolarHBondContact O-CG 3.26Å; G62-R66 PolarHBondContact O-NE 3.37Å
63K39.1Very low35.9Very low140 Ų140126.5 Ų126.561%0.60961%0.605SS**Hα-helixtrans-81.7-35.7170.4-73.6175.6-175.4-175.40111.8S59 K60 M61 R66 H67S59-K63 WeakPolarHBondContact O-CG 3.37Å; S59-K63 PolarHBondContact O-N 3.03Å; K60-K63 PolarHBondContact O-N 3.48Å; M61-K63 VanDerWaalsContact C-N 3.31Å; M61-K63 PolarHBondContact O-N 3.42Å; K63-R66 PolarHBondContact O-N 3.26Å; K63-H67 PolarHBondContact O-N 3.22Å
64W36.1Very low35.4Very low180 Ų180127.3 Ų127.368%0.68262%0.618SS**Hα-helixtrans-62.9-45.9174.2-162.567.9000111.8K60 M61 R66 H67 C68K60-W64 WeakPolarHBondContact O-CB 3.34Å; K60-W64 PolarHBondContact O-N 3.34Å; M61-W64 PolarHBondContact O-N 2.66Å; W64-R66 VanDerWaalsContact C-N 3.32Å; W64-R66 PolarHBondContact O-N 3.31Å; W64-H67 PolarHBondContact O-N 2.82Å; W64-C68 PolarHBondContact O-N 3.34Å; W64-C68 VanDerWaalsContact O-N 3.11Å
65C35.2Very low35.6Very low52 Ų52128.1 Ų128.135%0.35164%0.635SS.*Hα-helixtrans-61.8-34.3175-82.40000113.9M61 F69M61-C65 PolarHBondContact O-N 3.37Å; C65-F69 PolarHBondContact O-N 3.17Å
66R33.1Very low35.2Very low204 Ų204125.2 Ų125.277%0.7764%0.643SS**Hα-helixtrans-75.1-25.3178.8-72.4177.1-146-1114.1113.4G62 K63 W64G62-R66 VanDerWaalsContact O-CG 3.3Å; G62-R66 WeakPolarHBondContact O-CG 3.26Å; G62-R66 PolarHBondContact O-NE 3.37Å; K63-R66 PolarHBondContact O-N 3.26Å; W64-R66 VanDerWaalsContact C-N 3.32Å; W64-R66 PolarHBondContact O-N 3.31Å
67H38.2Very low34.9Very low165 Ų165132.5 Ų132.576%0.76467%0.669SS**Hα-helixtrans-89.4-25.3-179.6-157.7-59.4000112.5K63 W64K63-H67 PolarHBondContact O-N 3.22Å; W64-H67 PolarHBondContact O-N 2.82Å
68C34.3Very low34.6Very low64 Ų64133.1 Ų133.143%0.43268%0.681SS.*Hα-helixtrans-88-18.5177.4-66.30000114W64W64-C68 PolarHBondContact O-N 3.34Å; W64-C68 VanDerWaalsContact O-N 3.11Å
69F33.4Very low34.4Very low113 Ų113131.8 Ų131.850%0.49669%0.688SS.*  trans-14292.5-179-64.7-81.2000112.2C65 W71C65-F69 PolarHBondContact O-N 3.17Å; F69-W71 PolarHBondContact O-N 2.98Å; F69-W71 VanDerWaalsContact O-N 3.16Å
70P33Very low34Very low127 Ų127135.7 Ų135.783%0.82571%0.71SS**THydrogen-bonded Turntrans-68.2-9.8-178.6-19.632.2000115.1
71W30.5Very low33.5Very low251 Ų251132.1 Ų132.195%0.95171%0.714SS**THydrogen-bonded Turntrans-105.52.7-166.9-120.2-28.9000117.2F69 R73F69-W71 PolarHBondContact O-N 2.98Å; F69-W71 VanDerWaalsContact O-N 3.16Å; W71-R73 PolarHBondContact O-N 3.28Å; W71-R73 VanDerWaalsContact O-N 3.11Å
72C31.6Very low33.3Very low118 Ų118134.4 Ų134.480%0.79773%0.733SS**  trans-87.474.7175-68.70000111.9
73R31.4Very low33Very low256 Ų256138.6 Ų138.697%0.96676%0.759SS**  trans-90.5102.2156.3-101.6-170.4179.9-138.33.3108.1W71W71-R73 PolarHBondContact O-N 3.28Å; W71-R73 VanDerWaalsContact O-N 3.11Å
74G28Very low33.1Very low74 Ų74135.3 Ų135.376%0.76376%0.764SS**  trans-145.2105.117100000109.6
75S39.3Very low32.8Very low131 Ų131134 Ų13492%0.91677%0.77SS**  trans-71.2119.9174.651.50000110.3
76G27.8Very low32.9Very low70 Ų70141.2 Ų141.272%0.72280%0.799SS**  trans-149.998.4170.100000110
77K32.9Very low33.2Very low216 Ų216137 Ų13794%0.93979%0.792SS**  trans-67.8133.5167-70177.7177.1177.20108
78S29.6Very low33.5Very low114 Ų114133.9 Ų133.980%0.79778%0.78SS**  trans-137.5115.8153.848.70000109.3
79N34.2Very low33.9Very low161 Ų161133.8 Ų133.886%0.86178%0.781SS**  trans-74.4126.5163.9-78.9-12.8000107.8
80V32.8Very low34.1Very low143 Ų143131.3 Ų131.387%0.86778%0.781SS**  trans-143.3123.1148-172.80000108.1
81G28.7Very low34.3Very low69 Ų69131 Ų13171%0.71177%0.77SS**  trans-76.4178.1-175.200000115
82T34.2Very low34.6Very low147 Ų147125.4 Ų125.490%0.90275%0.752SS**  trans-69.6118.3179.448.60000111.9
83S29.6Very low34.9Very low116 Ų116122.8 Ų122.881%0.81173%0.733SS**  trans-156.8136148.148.40000108.1
84G41.3Very low35.1Very low70 Ų70115.5 Ų115.572%0.72271%0.712SS**  trans-72.7133.8-177.300000110.8
85D29.7Very low35.6Very low152 Ų152121 Ų12181%0.81371%0.71SS**  trans-165.1126.9133.5-85.7-31.8000105.8D87D85-D87 VanDerWaalsContact C-N 3.26Å; D85-D87 PolarHBondContact O-N 3.06Å
86H38.2Very low35.6Very low205 Ų205117.5 Ų117.595%0.94969%0.686SS**  trans-7579.9-176.5-86.1-68.3000110.4D88H86-D88 PolarHBondContact O-N 3.06Å
87D37.8Very low36Very low116 Ų116120.5 Ų120.562%0.6268%0.679SS**  trans-79.9110.6170-97.6-13.4000110.8D85 S89 A90D85-D87 VanDerWaalsContact C-N 3.26Å; D85-D87 PolarHBondContact O-N 3.06Å; D87-S89 PolarHBondContact O-N 3.3Å; D87-A90 PolarHBondContact O-N 2.97Å
88D45.6Very low36Very low98 Ų98115.5 Ų115.552%0.52466%0.66SS.*Hα-helixtrans-54.5-9.8164.7-17039.7000112.5H86 K92H86-D88 PolarHBondContact O-N 3.06Å; D88-K92 WeakPolarHBondContact O-CB 3.48Å; D88-K92 WeakPolarHBondContact O-CG 3.27Å; D88-K92 PolarHBondContact O-N 3.37Å; D88-K92 VanDerWaalsContact OD2-CE 3.25Å; D88-K92 WeakPolarHBondContact OD2-CE 3.42Å; D88-K92 IonicContact OD2-NZ 2.78Å; D88-K92 PolarHBondContact OD2-NZ 3.27Å
89S41.6Very low36.4Very low63 Ų63112.1 Ų112.144%0.44164%0.643SS.*Hα-helixtrans-64.6-34.6171.586.60000112.6D87 T93D87-S89 PolarHBondContact O-N 3.3Å; S89-T93 WeakPolarHBondContact O-CB 3.38Å; S89-T93 PolarHBondContact O-N 2.93Å; S89-T93 PolarHBondContact O-OG1 3.24Å
90A38.1Very low36.6Very low60 Ų60111.5 Ų111.550%0.49663%0.633SS.*Hα-helixtrans-72.3-38.7-178.600000111.6D87 T93 L94D87-A90 PolarHBondContact O-N 2.97Å; A90-T93 PolarHBondContact O-N 3.35Å; A90-L94 WeakPolarHBondContact O-CB 3.39Å; A90-L94 PolarHBondContact O-N 3.09Å
91M37.6Very low36.4Very low122 Ų122113.6 Ų113.660%0.60163%0.625SS**Hα-helixtrans-72.5-39.1175.5-117.8-62.1-147.800111.8T93 L94 R95M91-T93 VanDerWaalsContact C-N 3.32Å; M91-L94 PolarHBondContact O-N 3.38Å; M91-R95 VanDerWaalsContact O-CB 3.27Å; M91-R95 WeakPolarHBondContact O-CB 3.4Å; M91-R95 PolarHBondContact O-N 3.09Å
92K36.6Very low36.6Very low132 Ų132113.7 Ų113.757%0.57461%0.614SS**Hα-helixtrans-63.2-38170-78.8170.5174.3149.80112D88 S96D88-K92 WeakPolarHBondContact O-CB 3.48Å; D88-K92 WeakPolarHBondContact O-CG 3.27Å; D88-K92 PolarHBondContact O-N 3.37Å; D88-K92 VanDerWaalsContact OD2-CE 3.25Å; D88-K92 WeakPolarHBondContact OD2-CE 3.42Å; D88-K92 IonicContact OD2-NZ 2.78Å; D88-K92 PolarHBondContact OD2-NZ 3.27Å; K92-S96 WeakPolarHBondContact O-CB 3.4Å; K92-S96 PolarHBondContact O-N 3.09Å
93T38.5Very low36.5Very low64 Ų64110 Ų11039%0.39359%0.593SS.*Hα-helixtrans-71.5-36.3176.1-58.30000111.7S89 A90 M91 K97S89-T93 WeakPolarHBondContact O-CB 3.38Å; S89-T93 PolarHBondContact O-N 2.93Å; S89-T93 PolarHBondContact O-OG1 3.24Å; A90-T93 PolarHBondContact O-N 3.35Å; M91-T93 VanDerWaalsContact C-N 3.32Å; T93-K97 HydrophobicContact CG2-CD 4.01Å; T93-K97 HydrophobicContact CG2-CG 4.45Å; T93-K97 VanDerWaalsContact O-CB 3.23Å; T93-K97 WeakPolarHBondContact O-CB 3.48Å; T93-K97 WeakPolarHBondContact O-CG 3.24Å; T93-K97 PolarHBondContact O-N 3.38Å
94L34.9Very low36.8Very low103 Ų103113 Ų11354%0.53959%0.594SS.*Hα-helixtrans-68.7-42.7172.9-114.2146.9000111.6A90 M91 K97 M98A90-L94 WeakPolarHBondContact O-CB 3.39Å; A90-L94 PolarHBondContact O-N 3.09Å; M91-L94 PolarHBondContact O-N 3.38Å; L94-K97 PolarHBondContact O-N 3.41Å; L94-M98 HydrophobicContact CD2-SD 4.35Å; L94-M98 WeakPolarHBondContact O-CB 3.33Å; L94-M98 PolarHBondContact O-N 3.44Å
95R39.3Very low36.4Very low189 Ų189113.8 Ų113.871%0.71359%0.588SS**Hα-helixtrans-66.2-37.6174.6-162.9-177.7-80.1-125.24.6111.6M91 G99M91-R95 VanDerWaalsContact O-CB 3.27Å; M91-R95 WeakPolarHBondContact O-CB 3.4Å; M91-R95 PolarHBondContact O-N 3.09Å; R95-G99 PolarHBondContact O-N 2.94Å
96S38.8Very low36.3Very low58 Ų58113.6 Ų113.641%0.40658%0.58SS.*Hα-helixtrans-65.8-41.4171.8168.90000112.4K92 G99 K100K92-S96 WeakPolarHBondContact O-CB 3.4Å; K92-S96 PolarHBondContact O-N 3.09Å; S96-G99 PolarHBondContact O-N 3.26Å; S96-K100 WeakPolarHBondContact O-CB 3.49Å; S96-K100 WeakPolarHBondContact O-CG 3.34Å; S96-K100 PolarHBondContact O-N 3.02Å
97K36.1Very low36Very low133 Ų133109.9 Ų109.958%0.57857%0.574SS**Hα-helixtrans-73.1-35.9175.9-75174.2-179.8176.70112.1T93 L94 G99 K100 W101T93-K97 HydrophobicContact CG2-CD 4.01Å; T93-K97 HydrophobicContact CG2-CG 4.45Å; T93-K97 VanDerWaalsContact O-CB 3.23Å; T93-K97 WeakPolarHBondContact O-CB 3.48Å; T93-K97 WeakPolarHBondContact O-CG 3.24Å; T93-K97 PolarHBondContact O-N 3.38Å; L94-K97 PolarHBondContact O-N 3.41Å; K97-G99 VanDerWaalsContact C-N 3.34Å; K97-K100 PolarHBondContact O-N 3.42Å; K97-W101 WeakPolarHBondContact O-CB 3.31Å; K97-W101 PolarHBondContact O-N 3.21Å
98M34Very low35.9Very low111 Ų111109.9 Ų109.955%0.54758%0.582SS.*Hα-helixtrans-64.7-39.8170.1-129.195.1144.900110.9L94 W101 C102L94-M98 HydrophobicContact CD2-SD 4.35Å; L94-M98 WeakPolarHBondContact O-CB 3.33Å; L94-M98 PolarHBondContact O-N 3.44Å; M98-W101 PolarHBondContact O-N 3.25Å; M98-C102 PolarHBondContact O-N 3.33Å; M98-C102 PolarHBondContact O-SG 2.95Å
99G36.1Very low35.5Very low42 Ų42110.4 Ų110.443%0.43359%0.592SS.*Hα-helixtrans-62.5-42.5172.900000111.8R95 S96 K97 W101 C103R95-G99 PolarHBondContact O-N 2.94Å; S96-G99 PolarHBondContact O-N 3.26Å; K97-G99 VanDerWaalsContact C-N 3.34Å; G99-W101 VanDerWaalsContact C-N 3.35Å; G99-W101 PolarHBondContact O-N 3.26Å; G99-C103 PolarHBondContact O-N 3.01Å; G99-C103 PolarHBondContact O-SG 2.96Å
100K38.4Very low35Very low149 Ų149118.1 Ų118.165%0.64861%0.611SS**Hα-helixtrans-69.2-26174-75.8176.4-179.5-179.60114.1S96 K97 C103S96-K100 WeakPolarHBondContact O-CB 3.49Å; S96-K100 WeakPolarHBondContact O-CG 3.34Å; S96-K100 PolarHBondContact O-N 3.02Å; K97-K100 PolarHBondContact O-N 3.42Å; K100-C103 VanDerWaalsContact CA-SG 3.52Å; K100-C103 VanDerWaalsContact O-CB 3.24Å; K100-C103 WeakPolarHBondContact O-CB 3.42Å; K100-C103 PolarHBondContact O-SG 3.36Å
101W28.9Very low34.5Very low186 Ų186118.6 Ų118.671%0.70562%0.622SS**Hα-helixtrans-86.9-33.2177.3-108.142.1000113.3K97 M98 G99 C103 H104K97-W101 WeakPolarHBondContact O-CB 3.31Å; K97-W101 PolarHBondContact O-N 3.21Å; M98-W101 PolarHBondContact O-N 3.25Å; G99-W101 VanDerWaalsContact C-N 3.35Å; G99-W101 PolarHBondContact O-N 3.26Å; W101-C103 PolarHBondContact O-N 3.38Å; W101-H104 PolarHBondContact O-N 3.15Å; W101-H104 VanDerWaalsContact O-N 3.12Å
102C33.6Very low34.6Very low72 Ų72118.9 Ų118.949%0.48664%0.636SS.*Hα-helixtrans-61.8-21.5168.6-76.80000112.5M98 H104 C105 F106M98-C102 PolarHBondContact O-N 3.33Å; M98-C102 PolarHBondContact O-SG 2.95Å; C102-H104 PolarHBondContact O-N 2.83Å; C102-C105 PolarHBondContact O-N 3.18Å; C102-F106 PolarHBondContact O-N 2.84Å
103C32.4Very low34.2Very low68 Ų68115.1 Ų115.146%0.45964%0.635SS.*THydrogen-bonded Turntrans-59.7-22.1173.2-57.70000113.8G99 K100 W101G99-C103 PolarHBondContact O-N 3.01Å; G99-C103 PolarHBondContact O-SG 2.96Å; K100-C103 VanDerWaalsContact CA-SG 3.52Å; K100-C103 VanDerWaalsContact O-CB 3.24Å; K100-C103 WeakPolarHBondContact O-CB 3.42Å; K100-C103 PolarHBondContact O-SG 3.36Å; W101-C103 PolarHBondContact O-N 3.38Å
104H35Very low33.8Very low180 Ų180122.6 Ų122.683%0.83366%0.662SS**THydrogen-bonded Turntrans-99-13.1-176.6-125.926.2000113.7W101 C102W101-H104 PolarHBondContact O-N 3.15Å; W101-H104 VanDerWaalsContact O-N 3.12Å; C102-H104 PolarHBondContact O-N 2.83Å
105C33.5Very low33.7Very low86 Ų86121.5 Ų121.558%0.58166%0.663SS**THydrogen-bonded Turntrans-106.3-4.5177.5-62.60000113.9C102C102-C105 PolarHBondContact O-N 3.18Å
106F27.8Very low33.3Very low148 Ų148122.6 Ų122.665%0.64967%0.673SS**  trans-123.396.5171.8-81.2-85.8000110.6C102 C108C102-F106 PolarHBondContact O-N 2.84Å; F106-C108 PolarHBondContact O-N 2.91Å
107P31Very low33.4Very low127 Ų127122.7 Ų122.783%0.82567%0.671SS**THydrogen-bonded Turntrans-68.55.4-178-2032.5000116.1
108C35.9Very low33.5Very low116 Ų116118.9 Ų118.978%0.78467%0.669SS**THydrogen-bonded Turntrans-109.49.1-173.8-67.40000115.1F106F106-C108 PolarHBondContact O-N 2.91Å
109C37.4Very low33.8Very low110 Ų110119.6 Ų119.674%0.74368%0.682SS**SBendtrans-127.856.4176.3-73.30000112.1
110R30.5Very low34.6Very low224 Ų224123.6 Ų123.685%0.84568%0.684SS**  trans-177.391.9150.7-105.8172.3-176.2-123.5-1.6109.7S112R110-S112 PolarHBondContact O-N 3.07Å; R110-S112 VanDerWaalsContact O-N 3.16Å
111G28.1Very low35.2Very low70 Ų70117.5 Ų117.572%0.72266%0.664SS**  trans-73.294154.800000108.5G113G111-G113 PolarHBondContact O-N 3.2Å
112S39.4Very low36.3Very low129 Ų129115.8 Ų115.890%0.90267%0.669SS**  trans-71.787.2155.258.10000107.5R110R110-S112 PolarHBondContact O-N 3.07Å; R110-S112 VanDerWaalsContact O-N 3.16Å
113G28.8Very low37.8Very low52 Ų52114.8 Ų114.854%0.53666%0.655SS.*SBendtrans-169137175.600000104.9G111 S115G111-G113 PolarHBondContact O-N 3.2Å; G113-S115 PolarHBondContact O-N 2.95Å
114K30.2Very low39.5Very low222 Ų222115.1 Ų115.197%0.96565%0.652SS**  trans-62.960.4-174-61.3173.5176.9176.60112.7
115S33.5Very low41.3Very low80 Ų80109.5 Ų109.556%0.55963%0.629SS**  trans-86.4125.7168.1580000107.3G113 V117G113-S115 PolarHBondContact O-N 2.95Å; S115-V117 PolarHBondContact O-N 3.31Å; S115-V117 VanDerWaalsContact O-N 3.11Å
116K30.3Very low43.6Very low212 Ų212107.1 Ų107.192%0.92261%0.613SS**  trans-71.39.1176.5-73.3-175.8176.1179.70112.9G118K116-G118 PolarHBondContact O-N 2.96Å
117V39.9Very low46.1Very low59 Ų59100.2 Ų100.236%0.35858%0.583SS.*  trans-89.3104.1-175.7-173.70000108S115 Y344S115-V117 PolarHBondContact O-N 3.31Å; S115-V117 VanDerWaalsContact O-N 3.11Å; V117-Y344 HydrophobicContact CG1-CE1 3.74Å; V117-Y344 HydrophobicContact CG2-CE1 4.18Å
118G37.9Very low48.7Very low54 Ų5494.7 Ų94.756%0.55755%0.546SS*.  trans-59.4151.4177.900000112K116 W120K116-G118 PolarHBondContact O-N 2.96Å; G118-W120 PolarHBondContact O-N 2.71Å
119P41.1Very low50.7Low126 Ų12694.1 Ų94.182%0.81853%0.533SS*.  trans-52140.7165.5-16.228.2000108.9G121P119-G121 PolarHBondContact O-N 3.02Å
120W53.8Low52.5Low125 Ų12593.6 Ų93.647%0.47352%0.52SS..  trans-40.4104.7173.3-6389.6000110G118 D122 R306 L311 C314G118-W120 PolarHBondContact O-N 2.71Å; W120-D122 PolarHBondContact O-N 3.32Å; W120-R306 VanDerWaalsContact CH2-NH1 3.28Å; W120-R306 VanDerWaalsContact CZ3-NH2 3.32Å; W120-L311 HydrophobicContact CH2-CD1 4.18Å; W120-L311 HydrophobicContact CZ3-CD1 3.95Å; W120-C314 HydrophobicContact CH2-CB 3.33Å; W120-C314 HydrophobicContact CZ2-CB 3.42Å; W120-C314 VanDerWaalsContact CZ2-CB 3.42Å
121G49.4Very low54.9Low22 Ų2285.1 Ų85.123%0.22749%0.494CS..  trans-66.7120.7-176.100000109.4P119 Y123 Y304P119-G121 PolarHBondContact O-N 3.02Å; G121-Y123 VanDerWaalsContact C-N 3.31Å; G121-Y123 PolarHBondContact O-N 3.25Å; G121-Y304 WeakPolarHBondContact CA-OH 3.34Å; G121-Y304 PolarHBondContact N-OH 2.95Å; G121-Y304 PolarHBondContact O-OH 2.82Å
122D53.7Low57.7Low149 Ų14988.1 Ų88.180%0.79748%0.483SS*.  trans29.154.1158.5-50-25.8000116.1W120 D124W120-D122 PolarHBondContact O-N 3.32Å; D122-D124 PolarHBondContact O-N 3.22Å
123Y64.2Low60.1Low52 Ų5282.9 Ų82.920%0.20444%0.444CS..  trans-75.9106163.7178.7-103.9000107.5G121 D125 H271 L273 L278 H281 E282G121-Y123 VanDerWaalsContact C-N 3.31Å; G121-Y123 PolarHBondContact O-N 3.25Å; Y123-D125 HydrophobicContact CD1-CB 4.44Å; Y123-D125 HydrophobicContact CE1-CB 4.02Å; Y123-H271 HydrophobicContact CD2-CB 4.5Å; Y123-L273 HydrophobicContact CD2-CD1 4.32Å; Y123-L273 HydrophobicContact CE2-CD1 3.67Å; Y123-L278 WeakPolarHBondContact OH-CD1 3.48Å; Y123-H281 AromaticContact CD1-CE1 3.4Å; Y123-H281 VanDerWaalsContact CD1-CE1 3.4Å; Y123-H281 WeakPolarHBondContact CD1-CE1 3.47Å; Y123-H281 AromaticContact CE1-CE1 3.39Å; Y123-H281 WeakPolarHBondContact CE1-CE1 3.36Å; Y123-H281 AromaticContact CE1-ND1 3.68Å; Y123-H281 AromaticContact CG-CE1 3.85Å; Y123-H281 AromaticContact CZ-CE1 3.86Å; Y123-H281 AromaticContact CZ-ND1 3.8Å; Y123-E282 VanDerWaalsContact CE1-OE1 3.23Å; Y123-E282 WeakPolarHBondContact CE1-OE1 3.13Å; Y123-E282 PolarHBondContact OH-OE1 3.31Å
124D68.9Low62.7Low74 Ų7487.1 Ų87.140%0.39645%0.45SS..  trans-90.6104.4178.6178.920.6000109.6D122 S126D122-D124 PolarHBondContact O-N 3.22Å; D124-S126 PolarHBondContact O-N 2.89Å; D124-S126 WeakPolarHBondContact OD1-CB 3.46Å; D124-S126 PolarHBondContact OD1-N 2.95Å; D124-S126 PolarHBondContact OD1-OG 2.92Å; D124-S126 PolarHBondContact OD2-OG 3.39Å
125D72.7Confident65.3Low63 Ų6378.5 Ų78.534%0.33742%0.415SS..THydrogen-bonded Turntrans-82.87176.8683.3000113.3Y123 A127 F128 M129Y123-D125 HydrophobicContact CD1-CB 4.44Å; Y123-D125 HydrophobicContact CE1-CB 4.02Å; D125-A127 PolarHBondContact O-N 2.84Å; D125-F128 HydrophobicContact CB-CD2 4.46Å; D125-F128 PolarHBondContact O-N 3.1Å; D125-M129 HydrophobicContact CB-CE 4.3Å; D125-M129 PolarHBondContact O-N 3.03Å; D125-M129 WeakPolarHBondContact OD2-CE 3.27Å
126S80.9Confident67.6Low36 Ų3683.5 Ų83.525%0.25242%0.422SS..Hα-helixtrans-54.7-30.4-179.468.60000113.1D124 F128 Y238D124-S126 PolarHBondContact O-N 2.89Å; D124-S126 WeakPolarHBondContact OD1-CB 3.46Å; D124-S126 PolarHBondContact OD1-N 2.95Å; D124-S126 PolarHBondContact OD1-OG 2.92Å; D124-S126 PolarHBondContact OD2-OG 3.39Å; S126-F128 PolarHBondContact O-N 3.2Å; S126-Y238 PolarHBondContact OG-OH 3.48Å
127A79.8Confident69.6Low3 Ų382.8 Ų82.83%0.02541%0.413CS..Hα-helixtrans-57.5-30.2175.700000112.9D125 Q215 Y238 Y245D125-A127 PolarHBondContact O-N 2.84Å; A127-Q215 PolarHBondContact O-NE2 3.23Å; A127-Y238 HydrophobicContact CB-CD1 4.06Å; A127-Y238 HydrophobicContact CB-CD2 3.37Å; A127-Y238 HydrophobicContact CB-CE1 4.26Å; A127-Y238 HydrophobicContact CB-CE2 3.64Å; A127-Y238 HydrophobicContact CB-CG 3.59Å; A127-Y245 WeakPolarHBondContact O-CE1 3.3Å; A127-Y245 PolarHBondContact O-OH 3.3Å
128F85.2Confident71.4Confident11 Ų1187.9 Ų87.95%0.04843%0.433CS..Hα-helixtrans-100.8-29.5-174.1-56.5-75.5000113.7D125 S126 E130 Y245 Y248 L278D125-F128 HydrophobicContact CB-CD2 4.46Å; D125-F128 PolarHBondContact O-N 3.1Å; S126-F128 PolarHBondContact O-N 3.2Å; F128-E130 PolarHBondContact O-N 2.61Å; F128-Y245 AromaticContact CD1-CD1 3.62Å; F128-Y245 HydrophobicContact CD1-CD1 3.62Å; F128-Y245 AromaticContact CD1-CE1 3.58Å; F128-Y245 HydrophobicContact CD1-CE1 3.58Å; F128-Y245 AromaticContact CE1-CD1 3.91Å; F128-Y245 HydrophobicContact CE1-CD1 3.91Å; F128-Y245 AromaticContact CE1-CE1 3.96Å; F128-Y245 HydrophobicContact CE1-CE1 3.96Å; F128-Y245 HydrophobicContact CE1-CG 4.46Å; F128-Y245 HydrophobicContact CG-CE1 4.45Å; F128-Y248 HydrophobicContact CB-CD1 3.71Å; F128-Y248 HydrophobicContact CB-CD2 3.93Å; F128-Y248 HydrophobicContact CB-CE1 3.43Å; F128-Y248 VanDerWaalsContact CB-CE1 3.43Å; F128-Y248 HydrophobicContact CB-CE2 3.66Å; F128-Y248 HydrophobicContact CB-CG 3.96Å; F128-Y248 VanDerWaalsContact CB-CZ 3.4Å; F128-Y248 AromaticContact CD1-CD1 3.79Å; F128-Y248 HydrophobicContact CD1-CD1 3.79Å; F128-Y248 AromaticContact CD1-CD2 3.61Å; F128-Y248 HydrophobicContact CD1-CD2 3.61Å; F128-Y248 HydrophobicContact CD1-CE1 4.39Å; F128-Y248 HydrophobicContact CD1-CE2 4.23Å; F128-Y248 AromaticContact CD1-CG 3.36Å; F128-Y248 HydrophobicContact CD1-CG 3.36Å; F128-Y248 AromaticContact CD2-CD2 3.73Å; F128-Y248 HydrophobicContact CD2-CD2 3.73Å; F128-Y248 AromaticContact CD2-CE2 3.77Å; F128-Y248 HydrophobicContact CD2-CE2 3.77Å; F128-Y248 HydrophobicContact CD2-CG 4.34Å; F128-Y248 AromaticContact CE1-CD2 4Å; F128-Y248 HydrophobicContact CE1-CD2 4Å; F128-Y248 AromaticContact CE1-CG 3.89Å; F128-Y248 HydrophobicContact CE1-CG 3.89Å; F128-Y248 HydrophobicContact CE2-CD2 4.1Å; F128-Y248 HydrophobicContact CE2-CE2 4.48Å; F128-Y248 AromaticContact CG-CD1 3.93Å; F128-Y248 HydrophobicContact CG-CD1 3.93Å; F128-Y248 AromaticContact CG-CD2 3.48Å; F128-Y248 HydrophobicContact CG-CD2 3.48Å; F128-Y248 VanDerWaalsContact CG-CD2 3.48Å; F128-Y248 HydrophobicContact CG-CE1 4.07Å; F128-Y248 AromaticContact CG-CE2 3.63Å; F128-Y248 HydrophobicContact CG-CE2 3.63Å; F128-Y248 AromaticContact CG-CG 3.64Å; F128-Y248 HydrophobicContact CG-CG 3.64Å; F128-Y248 AromaticContact CG-CZ 3.93Å; F128-Y248 HydrophobicContact CZ-CD2 4.23Å; F128-L278 HydrophobicContact CE1-CD2 4.34Å; F128-L278 HydrophobicContact CE2-CD1 4.43Å; F128-L278 HydrophobicContact CZ-CD1 4.22Å; F128-L278 HydrophobicContact CZ-CD2 3.98Å
129M78.1Confident73.2Confident103 Ų10386.9 Ų86.951%0.50742%0.415SS..Hα-helixtrans-73.8-21.2-170.7-68.3-62.2168.900115.6D125 P131 Y248D125-M129 HydrophobicContact CB-CE 4.3Å; D125-M129 PolarHBondContact O-N 3.03Å; D125-M129 WeakPolarHBondContact OD2-CE 3.27Å; M129-P131 WeakPolarHBondContact O-CD 3.44Å; M129-Y248 WeakPolarHBondContact CE-OH 3.48Å
130E76.4Confident75.3Confident100 Ų10081 Ų8147%0.46738%0.377SS..  trans-113.774.2-179.7-65.5-174.2177.600111.9F128 H134F128-E130 PolarHBondContact O-N 2.61Å; E130-H134 IonicContact OE2-CE1 3.56Å; E130-H134 IonicContact OE2-ND1 3.12Å
131P80.1Confident76.9Confident46 Ų4678.1 Ų78.130%0.29937%0.371SS..  trans-70.5-38.3-172.926.8-34.4000112.1M129 K212 Q215 C216M129-P131 WeakPolarHBondContact O-CD 3.44Å; P131-K212 PolarHBondContact O-NZ 2.97Å; P131-Q215 HydrophobicContact CB-CG 3.92Å; P131-Q215 WeakPolarHBondContact CB-O 3.45Å; P131-C216 PolarHBondContact O-SG 2.9Å
132R87.9Confident78.8Confident133 Ų13384.1 Ų84.150%0.50239%0.391SS..SBendtrans-85.3149.5-179.2-65.1-172.3-176-86.9-7.5111.4E218R132-E218 IonicContact NH1-OE1 3.69Å; R132-E218 IonicContact NH2-OE1 2.66Å
133Y88.9Confident80.6Confident19 Ų1977.2 Ų77.28%0.07535%0.353CS..PPolyproline II helixtrans-68.8139.4171.4-74.1-63.6000111.2W148 R174 H178 L179 A182 D203 K212Y133-W148 HydrophobicContact CD2-CZ3 4.16Å; Y133-W148 HydrophobicContact CG-CZ3 4.4Å; Y133-W148 VanDerWaalsContact O-CH2 3.29Å; Y133-W148 WeakPolarHBondContact O-CH2 3.24Å; Y133-R174 HydrophobicContact CE1-CG 3.97Å; Y133-H178 HydrophobicContact CE2-CB 4.13Å; Y133-H178 PolarHBondContact OH-CD2 3.04Å; Y133-L179 HydrophobicContact CD2-CD2 3.95Å; Y133-L179 HydrophobicContact CE2-CD2 4.34Å; Y133-L179 HydrophobicContact CG-CD2 4.49Å; Y133-A182 HydrophobicContact CD2-CB 3.64Å; Y133-A182 HydrophobicContact CE2-CB 3.74Å; Y133-D203 VanDerWaalsContact CE1-OD2 3.22Å; Y133-D203 WeakPolarHBondContact CE1-OD2 3.13Å; Y133-D203 PolarHBondContact OH-OD2 3Å; Y133-K212 HydrophobicContact CE1-CD 4.31Å; Y133-K212 HydrophobicContact CE2-CD 4.31Å; Y133-K212 VanDerWaalsContact CE2-CE 3.49Å; Y133-K212 HydrophobicContact CE2-CG 4.14Å; Y133-K212 WeakPolarHBondContact OH-CG 3.43Å
134H84.4Confident81.9Confident141 Ų14174.9 Ų74.965%0.65334%0.344SS*.PPolyproline II helixtrans-84.5117.4162.7-64.597.5000108.3E130 R174E130-H134 IonicContact OE2-CE1 3.56Å; E130-H134 IonicContact OE2-ND1 3.12Å; H134-R174 PolarHBondContact O-NH1 3.23Å
135V83.6Confident83Confident40 Ų4075 Ų7524%0.24234%0.339CS..  trans-130.5128.6-174.5-179.40000109.7L140 W148 L179V135-L140 HydrophobicContact CG1-CD1 3.44Å; V135-L140 VanDerWaalsContact CG1-CD1 3.44Å; V135-L140 HydrophobicContact CG1-CD2 3.83Å; V135-L140 HydrophobicContact CG1-CG 3.47Å; V135-L140 VanDerWaalsContact CG1-CG 3.47Å; V135-W148 HydrophobicContact CB-CH2 4.25Å; V135-W148 HydrophobicContact CB-CZ2 4.02Å; V135-W148 HydrophobicContact CG2-CD2 4.09Å; V135-W148 HydrophobicContact CG2-CE3 3.84Å; V135-W148 HydrophobicContact CG2-CH2 3.46Å; V135-W148 VanDerWaalsContact CG2-CH2 3.46Å; V135-W148 HydrophobicContact CG2-CZ2 3.73Å; V135-W148 HydrophobicContact CG2-CZ3 3.53Å; V135-L179 HydrophobicContact CG2-CD2 4.36Å
136R81.3Confident83.8Confident186 Ų18672.2 Ų72.270%0.70233%0.325SS*.  trans-96.2146.3166.7-60.3-178174.5178.5-0.8109.9E138 D139R136-E138 PolarHBondContact O-N 2.87Å; R136-D139 PolarHBondContact O-N 3.3Å; R136-D139 VanDerWaalsContact O-N 3.09Å
137R72.9Confident84.4Confident196 Ų19670.5 Ų70.574%0.7431%0.313SS*.G310 helixtrans-60.5-31.5-173.2-161.5179.8-173.6-175.80.8113D139 W149R137-D139 VanDerWaalsContact C-N 3.33Å; R137-W149 HydrophobicContact CG-CH2 4.28Å; R137-W149 HydrophobicContact CG-CZ2 4.48Å
138E78.3Confident85Confident167 Ų16772.5 Ų72.578%0.7832%0.32SS*.G310 helixtrans-76.2-16.5-179.6-66138-14400113.7R136R136-E138 PolarHBondContact O-N 2.87Å
139D76.4Confident85.2Confident32 Ų3277.6 Ų77.617%0.17134%0.339CS..G310 helixtrans-88.3-11.4-173.9-70.2-33.6000113.8R136 R137 K171R136-D139 PolarHBondContact O-N 3.3Å; R136-D139 VanDerWaalsContact O-N 3.09Å; R137-D139 VanDerWaalsContact C-N 3.33Å; D139-K171 IonicContact OD1-NZ 3.15Å; D139-K171 PolarHBondContact OD1-NZ 2.86Å
140L85.1Confident85.6Confident3 Ų373.9 Ų73.92%0.01633%0.327CS..  trans-106.6133.4-174.6-63.7-165.6000112.1V135 H144 R145 W148 D170 L179V135-L140 HydrophobicContact CG1-CD1 3.44Å; V135-L140 VanDerWaalsContact CG1-CD1 3.44Å; V135-L140 HydrophobicContact CG1-CD2 3.83Å; V135-L140 HydrophobicContact CG1-CG 3.47Å; V135-L140 VanDerWaalsContact CG1-CG 3.47Å; L140-H144 HydrophobicContact CB-CB 3.91Å; L140-H144 HydrophobicContact CD1-CB 4.32Å; L140-H144 HydrophobicContact CD2-CB 3.98Å; L140-H144 HydrophobicContact CG-CB 4.29Å; L140-R145 HydrophobicContact CB-CG 3.55Å; L140-R145 HydrophobicContact CD1-CG 4.2Å; L140-R145 PolarHBondContact O-NH1 3.32Å; L140-W148 HydrophobicContact CD1-CB 3.93Å; L140-W148 HydrophobicContact CD1-CG 4.18Å; L140-D170 HydrophobicContact CD2-CB 4.47Å; L140-D170 WeakPolarHBondContact CD2-OD2 3.5Å; L140-L179 HydrophobicContact CD1-CD1 4.08Å; L140-L179 HydrophobicContact CD2-CD1 3.82Å
141D87.1Confident85.9Confident64 Ų6478.3 Ų78.334%0.34235%0.345SS..  trans-71.2173.6167.7-71-31.4000112.1L143 H144 R145 K168D141-L143 VanDerWaalsContact C-N 3.34Å; D141-L143 PolarHBondContact O-N 2.94Å; D141-H144 PolarHBondContact O-N 3.18Å; D141-R145 VanDerWaalsContact O-CB 3.29Å; D141-R145 WeakPolarHBondContact O-CB 3.48Å; D141-R145 WeakPolarHBondContact O-CG 3.38Å; D141-R145 PolarHBondContact O-N 3.35Å; D141-K168 WeakPolarHBondContact OD2-CD 3.48Å; D141-K168 WeakPolarHBondContact OD2-CE 3.43Å; D141-K168 IonicContact OD2-NZ 2.69Å; D141-K168 PolarHBondContact OD2-NZ 2.94Å
142K88.9Confident86.1Confident149 Ų14978 Ų7865%0.64834%0.342SS*.Hα-helixtrans-53-47.2-179.1-68.5-179.9-178.3176.40112.6R145 A146K142-R145 WeakPolarHBondContact O-CB 3.31Å; K142-R145 PolarHBondContact O-N 2.81Å; K142-A146 PolarHBondContact O-N 3.23Å
143L90.7Very high86Confident3 Ų374.9 Ų74.92%0.01634%0.339CS..Hα-helixtrans-68.7-44.9-179.8-179.762.6000112.1D141 R145 A146 A147 L157 L161 T164 A176D141-L143 VanDerWaalsContact C-N 3.34Å; D141-L143 PolarHBondContact O-N 2.94Å; L143-R145 VanDerWaalsContact C-N 3.27Å; L143-R145 PolarHBondContact O-N 2.77Å; L143-A146 WeakPolarHBondContact O-CB 3.33Å; L143-A146 PolarHBondContact O-N 3.27Å; L143-A147 WeakPolarHBondContact O-CB 3.48Å; L143-A147 PolarHBondContact O-N 3.2Å; L143-L157 HydrophobicContact CD1-CD1 3.84Å; L143-L161 HydrophobicContact CD1-CD2 3.58Å; L143-L161 HydrophobicContact CD1-CG 3.95Å; L143-L161 HydrophobicContact CD2-CD2 3.56Å; L143-L161 HydrophobicContact CG-CD2 4.22Å; L143-T164 HydrophobicContact CB-CG2 4.31Å; L143-T164 HydrophobicContact CD2-CG2 4.21Å; L143-A176 HydrophobicContact CD2-CB 3.94Å; L143-A176 HydrophobicContact CG-CB 3.79Å
144H92.4Very high85.8Confident3 Ų379.7 Ų79.71%0.01436%0.357CS..Hα-helixtrans-59.5-39.8176-65.198.4000112.3L140 D141 A147 W148 K168 R174 L179L140-H144 HydrophobicContact CB-CB 3.91Å; L140-H144 HydrophobicContact CD1-CB 4.32Å; L140-H144 HydrophobicContact CD2-CB 3.98Å; L140-H144 HydrophobicContact CG-CB 4.29Å; D141-H144 PolarHBondContact O-N 3.18Å; H144-A147 PolarHBondContact O-N 3.05Å; H144-W148 VanDerWaalsContact O-CB 3.32Å; H144-W148 WeakPolarHBondContact O-CB 3.5Å; H144-W148 PolarHBondContact O-N 3.2Å; H144-K168 PolarHBondContact CE1-O 3Å; H144-K168 VanDerWaalsContact CE1-O 3.28Å; H144-K168 PolarHBondContact NE2-O 3.31Å; H144-R174 PolarHBondContact NE2-O 3.26Å; H144-R174 VanDerWaalsContact NE2-O 3.15Å; H144-L179 HydrophobicContact CB-CD1 3.53Å; H144-L179 WeakPolarHBondContact O-CD1 3.35Å
145R90.9Very high85.8Confident78 Ų7880 Ų8029%0.29436%0.357SS..Hα-helixtrans-61.1-48.2173.6-84.4-167.3-55-11710.2112.2L140 D141 K142 L143 A147 W148 W149L140-R145 HydrophobicContact CB-CG 3.55Å; L140-R145 HydrophobicContact CD1-CG 4.2Å; L140-R145 PolarHBondContact O-NH1 3.32Å; D141-R145 VanDerWaalsContact O-CB 3.29Å; D141-R145 WeakPolarHBondContact O-CB 3.48Å; D141-R145 WeakPolarHBondContact O-CG 3.38Å; D141-R145 PolarHBondContact O-N 3.35Å; K142-R145 WeakPolarHBondContact O-CB 3.31Å; K142-R145 PolarHBondContact O-N 2.81Å; L143-R145 VanDerWaalsContact C-N 3.27Å; L143-R145 PolarHBondContact O-N 2.77Å; R145-A147 VanDerWaalsContact C-N 3.3Å; R145-A147 PolarHBondContact O-N 3.49Å; R145-W148 PolarHBondContact O-N 3.37Å; R145-W149 HydrophobicContact CB-CE3 3.78Å; R145-W149 HydrophobicContact CB-CH2 4Å; R145-W149 HydrophobicContact CB-CZ3 3.27Å; R145-W149 VanDerWaalsContact CD-CH2 3.49Å; R145-W149 VanDerWaalsContact CD-CZ3 3.47Å; R145-W149 HydrophobicContact CG-CE3 4.3Å; R145-W149 HydrophobicContact CG-CH2 3.58Å; R145-W149 HydrophobicContact CG-CZ3 3.4Å; R145-W149 PolarHBondContact O-N 3.42Å
146A91.3Very high85.9Confident4 Ų481.2 Ų81.23%0.03336%0.362CS..Hα-helixtrans-58.2-45.4175.800000111.4K142 L143 W148 G150 V152 L157 M160K142-A146 PolarHBondContact O-N 3.23Å; L143-A146 WeakPolarHBondContact O-CB 3.33Å; L143-A146 PolarHBondContact O-N 3.27Å; A146-W148 PolarHBondContact O-N 3.01Å; A146-G150 PolarHBondContact O-N 3.25Å; A146-V152 HydrophobicContact CB-CB 4.27Å; A146-V152 HydrophobicContact CB-CG2 3.64Å; A146-L157 HydrophobicContact CB-CD1 3.99Å; A146-M160 HydrophobicContact CB-SD 4.19Å
147A93.1Very high86Confident0 Ų072.6 Ų72.60%033%0.329CS..Hα-helixtrans-65.8-35177.400000114L143 H144 R145 A176 L179 A180 N185 V188L143-A147 WeakPolarHBondContact O-CB 3.48Å; L143-A147 PolarHBondContact O-N 3.2Å; H144-A147 PolarHBondContact O-N 3.05Å; R145-A147 VanDerWaalsContact C-N 3.3Å; R145-A147 PolarHBondContact O-N 3.49Å; A147-A176 HydrophobicContact CB-CB 3.91Å; A147-A176 VanDerWaalsContact CB-O 3.26Å; A147-A176 WeakPolarHBondContact CB-O 3.41Å; A147-L179 HydrophobicContact CB-CB 4.33Å; A147-A180 HydrophobicContact CB-CB 4.07Å; A147-A180 VanDerWaalsContact O-CA 3.27Å; A147-A180 WeakPolarHBondContact O-CA 3.42Å; A147-N185 PolarHBondContact O-ND2 2.99Å; A147-V188 HydrophobicContact CB-CG1 4.06Å
148W91.8Very high86.6Confident45 Ų4565.5 Ų65.517%0.1731%0.305CS..Hα-helixtrans-69.6-44.7177.2-179.4-98.7000112.7Y133 V135 L140 H144 R145 A146 L179 N183 N185Y133-W148 HydrophobicContact CD2-CZ3 4.16Å; Y133-W148 HydrophobicContact CG-CZ3 4.4Å; Y133-W148 VanDerWaalsContact O-CH2 3.29Å; Y133-W148 WeakPolarHBondContact O-CH2 3.24Å; V135-W148 HydrophobicContact CB-CH2 4.25Å; V135-W148 HydrophobicContact CB-CZ2 4.02Å; V135-W148 HydrophobicContact CG2-CD2 4.09Å; V135-W148 HydrophobicContact CG2-CE3 3.84Å; V135-W148 HydrophobicContact CG2-CH2 3.46Å; V135-W148 VanDerWaalsContact CG2-CH2 3.46Å; V135-W148 HydrophobicContact CG2-CZ2 3.73Å; V135-W148 HydrophobicContact CG2-CZ3 3.53Å; L140-W148 HydrophobicContact CD1-CB 3.93Å; L140-W148 HydrophobicContact CD1-CG 4.18Å; H144-W148 VanDerWaalsContact O-CB 3.32Å; H144-W148 WeakPolarHBondContact O-CB 3.5Å; H144-W148 PolarHBondContact O-N 3.2Å; R145-W148 PolarHBondContact O-N 3.37Å; A146-W148 PolarHBondContact O-N 3.01Å; W148-L179 HydrophobicContact CB-CB 4.46Å; W148-L179 HydrophobicContact CE3-CB 4.08Å; W148-L179 HydrophobicContact CE3-CD2 3.6Å; W148-L179 HydrophobicContact CE3-CG 4.34Å; W148-L179 HydrophobicContact CZ3-CD2 3.92Å; W148-N183 VanDerWaalsContact CZ3-OD1 3.23Å; W148-N183 WeakPolarHBondContact CZ3-OD1 3.39Å; W148-N183 PolarHBondContact O-ND2 3.42Å; W148-N185 PolarHBondContact O-ND2 2.85Å
149W89.3Confident86.9Confident118 Ų11861.4 Ų61.445%0.44729%0.292SS..Hα-helixtrans-87.1-27.2-175.6-69.8-58.4000114.4R137 R145 K151R137-W149 HydrophobicContact CG-CH2 4.28Å; R137-W149 HydrophobicContact CG-CZ2 4.48Å; R145-W149 HydrophobicContact CB-CE3 3.78Å; R145-W149 HydrophobicContact CB-CH2 4Å; R145-W149 HydrophobicContact CB-CZ3 3.27Å; R145-W149 VanDerWaalsContact CD-CH2 3.49Å; R145-W149 VanDerWaalsContact CD-CZ3 3.47Å; R145-W149 HydrophobicContact CG-CE3 4.3Å; R145-W149 HydrophobicContact CG-CH2 3.58Å; R145-W149 HydrophobicContact CG-CZ3 3.4Å; R145-W149 PolarHBondContact O-N 3.42Å; W149-K151 PolarHBondContact O-N 3.04Å
150G87.6Confident87.3Confident25 Ų2562.5 Ų62.526%0.25830%0.297SS..  trans68.6-13.2-17900000115.5A146 V152 N185A146-G150 PolarHBondContact O-N 3.25Å; G150-V152 PolarHBondContact O-N 3.19Å; G150-V152 VanDerWaalsContact O-N 3.08Å; G150-N185 VanDerWaalsContact CA-CG 3.45Å; G150-N185 WeakPolarHBondContact CA-OD1 3.33Å; G150-N185 PolarHBondContact N-ND2 3.34Å
151K82.1Confident87.2Confident193 Ų19363.2 Ų63.284%0.83930%0.3SS*.  trans-86.148.2-178.6-61.7-177.5-176.8-176.90112.7W149W149-K151 PolarHBondContact O-N 3.04Å
152V83.2Confident87Confident39 Ų3967.8 Ų67.824%0.23632%0.317CS..SBendtrans-119.1126.3177.9-176.70000108.7A146 G150 R154 D156 L157 M160A146-V152 HydrophobicContact CB-CB 4.27Å; A146-V152 HydrophobicContact CB-CG2 3.64Å; G150-V152 PolarHBondContact O-N 3.19Å; G150-V152 VanDerWaalsContact O-N 3.08Å; V152-R154 PolarHBondContact O-N 3.17Å; V152-D156 HydrophobicContact CG1-CB 3.89Å; V152-L157 HydrophobicContact CG1-CB 4.48Å; V152-M160 HydrophobicContact CG1-CE 4.42Å
153P86.4Confident86.3Confident68 Ų6867.4 Ų67.444%0.44232%0.322SS..  trans-53.2136.7175.4-25.834.6000111K155 D156 L157P153-K155 HydrophobicContact CB-CG 4.03Å; P153-K155 PolarHBondContact O-N 3.12Å; P153-K155 VanDerWaalsContact O-N 3.08Å; P153-D156 WeakPolarHBondContact CB-OD2 3.36Å; P153-D156 WeakPolarHBondContact CD-OD2 3.44Å; P153-D156 VanDerWaalsContact CG-OD2 3.31Å; P153-D156 WeakPolarHBondContact CG-OD2 3.4Å; P153-D156 PolarHBondContact O-N 3.03Å; P153-L157 PolarHBondContact O-N 2.96Å; P153-L157 VanDerWaalsContact O-N 3.16Å
154R84.1Confident86Confident120 Ų12069.4 Ų69.445%0.45333%0.334SS..Hα-helixtrans-50.8-39.9-177-174.4177.9173.486.80.7112.8V152 D156 L157 I158 L191 D194V152-R154 PolarHBondContact O-N 3.17Å; R154-D156 VanDerWaalsContact C-N 3.33Å; R154-D156 PolarHBondContact O-N 3Å; R154-L157 PolarHBondContact O-N 3.22Å; R154-I158 HydrophobicContact CG-CD1 4.12Å; R154-I158 VanDerWaalsContact O-CG1 3.31Å; R154-I158 WeakPolarHBondContact O-CG1 3.41Å; R154-I158 PolarHBondContact O-N 3.25Å; R154-L191 HydrophobicContact CG-CD1 3.81Å; R154-D194 IonicContact NH2-OD2 3.16Å
155K85.6Confident85.7Confident148 Ų14874 Ų7464%0.64336%0.359SS*.Hα-helixtrans-57.6-42.5176.558.7172.5-171.4177.60113P153 I158 V159P153-K155 HydrophobicContact CB-CG 4.03Å; P153-K155 PolarHBondContact O-N 3.12Å; P153-K155 VanDerWaalsContact O-N 3.08Å; K155-I158 PolarHBondContact O-N 3.19Å; K155-V159 WeakPolarHBondContact O-CG2 3.42Å; K155-V159 PolarHBondContact O-N 3.43Å; K155-V159 VanDerWaalsContact O-N 3.12Å
156D85.1Confident85.5Confident65 Ų6571.5 Ų71.535%0.34835%0.351SS..Hα-helixtrans-74.3-36.3-176.5-57.9-26.8000109.7V152 P153 R154 V159 M160V152-D156 HydrophobicContact CG1-CB 3.89Å; P153-D156 WeakPolarHBondContact CB-OD2 3.36Å; P153-D156 WeakPolarHBondContact CD-OD2 3.44Å; P153-D156 VanDerWaalsContact CG-OD2 3.31Å; P153-D156 WeakPolarHBondContact CG-OD2 3.4Å; P153-D156 PolarHBondContact O-N 3.03Å; R154-D156 VanDerWaalsContact C-N 3.33Å; R154-D156 PolarHBondContact O-N 3Å; D156-V159 PolarHBondContact O-N 3.44Å; D156-M160 WeakPolarHBondContact O-CG 3.34Å; D156-M160 PolarHBondContact O-N 2.71Å
157L84.7Confident85.5Confident5 Ų573.1 Ų73.13%0.02636%0.359CS..Hα-helixtrans-63.3-42173.4-171.266.5000111.9L143 A146 V152 P153 R154 V159 M160 L161 V188 L191L143-L157 HydrophobicContact CD1-CD1 3.84Å; A146-L157 HydrophobicContact CB-CD1 3.99Å; V152-L157 HydrophobicContact CG1-CB 4.48Å; P153-L157 PolarHBondContact O-N 2.96Å; P153-L157 VanDerWaalsContact O-N 3.16Å; R154-L157 PolarHBondContact O-N 3.22Å; L157-V159 VanDerWaalsContact C-N 3.33Å; L157-V159 PolarHBondContact O-N 2.83Å; L157-M160 PolarHBondContact O-N 3.17Å; L157-L161 HydrophobicContact CD1-CD1 4.44Å; L157-L161 HydrophobicContact CG-CD1 4.01Å; L157-L161 WeakPolarHBondContact O-CD1 3.42Å; L157-L161 VanDerWaalsContact O-CG 3.31Å; L157-L161 WeakPolarHBondContact O-CG 3.32Å; L157-L161 PolarHBondContact O-N 3.18Å; L157-V188 HydrophobicContact CD2-CB 4.31Å; L157-V188 HydrophobicContact CD2-CG1 4.01Å; L157-V188 HydrophobicContact CD2-CG2 4.06Å; L157-L191 HydrophobicContact CD2-CB 4.35Å; L157-L191 HydrophobicContact CD2-CD1 3.92Å; L157-L191 HydrophobicContact CD2-CD2 4Å; L157-L191 HydrophobicContact CD2-CG 4.33Å; L157-L191 HydrophobicContact CG-CD1 4.39Å; L157-L191 HydrophobicContact CG-CD2 4.19Å
158I84.4Confident85.5Confident46 Ų4677.5 Ų77.524%0.23638%0.378CS..Hα-helixtrans-60.6-43.4175.4-69.5167.1000110.9R154 K155 L161 K162 L191R154-I158 HydrophobicContact CG-CD1 4.12Å; R154-I158 VanDerWaalsContact O-CG1 3.31Å; R154-I158 WeakPolarHBondContact O-CG1 3.41Å; R154-I158 PolarHBondContact O-N 3.25Å; K155-I158 PolarHBondContact O-N 3.19Å; I158-L161 PolarHBondContact O-N 3.11Å; I158-K162 PolarHBondContact O-N 3.16Å; I158-L191 HydrophobicContact CD1-CD1 4.42Å; I158-L191 HydrophobicContact CG1-CD1 3.78Å
159V84.9Confident85.5Confident81 Ų8180.1 Ų80.149%0.49139%0.391SS..Hα-helixtrans-62.2-47.6177173.40000110.4K155 D156 L157 L161 K162K155-V159 WeakPolarHBondContact O-CG2 3.42Å; K155-V159 PolarHBondContact O-N 3.43Å; K155-V159 VanDerWaalsContact O-N 3.12Å; D156-V159 PolarHBondContact O-N 3.44Å; L157-V159 VanDerWaalsContact C-N 3.33Å; L157-V159 PolarHBondContact O-N 2.83Å; V159-L161 PolarHBondContact O-N 2.98Å; V159-K162 WeakPolarHBondContact O-CB 3.3Å; V159-K162 PolarHBondContact O-N 3.38Å; V159-K162 VanDerWaalsContact O-N 3.09Å
160M84.8Confident85.6Confident56 Ų5675.1 Ų75.128%0.27637%0.373SS..Hα-helixtrans-57.4-36.5178.1-70.2-178.3-163.500113.1A146 V152 D156 L157 K162 T164A146-M160 HydrophobicContact CB-SD 4.19Å; V152-M160 HydrophobicContact CG1-CE 4.42Å; D156-M160 WeakPolarHBondContact O-CG 3.34Å; D156-M160 PolarHBondContact O-N 2.71Å; L157-M160 PolarHBondContact O-N 3.17Å; M160-K162 VanDerWaalsContact C-N 3.34Å; M160-T164 WeakPolarHBondContact O-CB 3.36Å; M160-T164 PolarHBondContact O-N 2.9Å; M160-T164 PolarHBondContact O-OG1 2.98Å
161L83.4Confident85.7Confident17 Ų1780.9 Ų80.99%0.08939%0.391CS..Hα-helixtrans-79.4-11.8-178.6-71.3165.3000114.2L143 L157 I158 V159 M166 L191 L192L143-L161 HydrophobicContact CD1-CD2 3.58Å; L143-L161 HydrophobicContact CD1-CG 3.95Å; L143-L161 HydrophobicContact CD2-CD2 3.56Å; L143-L161 HydrophobicContact CG-CD2 4.22Å; L157-L161 HydrophobicContact CD1-CD1 4.44Å; L157-L161 HydrophobicContact CG-CD1 4.01Å; L157-L161 WeakPolarHBondContact O-CD1 3.42Å; L157-L161 VanDerWaalsContact O-CG 3.31Å; L157-L161 WeakPolarHBondContact O-CG 3.32Å; L157-L161 PolarHBondContact O-N 3.18Å; I158-L161 PolarHBondContact O-N 3.11Å; V159-L161 PolarHBondContact O-N 2.98Å; L161-M166 HydrophobicContact CB-SD 4.48Å; L161-M166 HydrophobicContact CD2-CB 4.07Å; L161-M166 HydrophobicContact CD2-CG 3.54Å; L161-M166 HydrophobicContact CD2-SD 3.77Å; L161-L191 HydrophobicContact CD1-CD2 2.95Å; L161-L191 HydrophobicContact CD1-CG 4.45Å; L161-L191 HydrophobicContact CG-CD2 4.45Å; L161-L192 HydrophobicContact CD1-CD2 4.29Å; L161-L192 HydrophobicContact CD2-CD2 3.77Å
162K81.6Confident86.1Confident160 Ų16074.3 Ų74.370%0.69636%0.363SS*.Hα-helixtrans-72.6-38.9170.7-73-179.3177.6-174.70111.6I158 V159 M160I158-K162 PolarHBondContact O-N 3.16Å; V159-K162 WeakPolarHBondContact O-CB 3.3Å; V159-K162 PolarHBondContact O-N 3.38Å; V159-K162 VanDerWaalsContact O-N 3.09Å; M160-K162 VanDerWaalsContact C-N 3.34Å
163D75.9Confident86.7Confident142 Ų14278 Ų7876%0.75938%0.376SS*.Hα-helixtrans-101.2-6.3-170.6-54.7-32.8000113.1
164T82.9Confident87.1Confident44 Ų4475 Ų7527%0.2736%0.356SS..SBendtrans-121.6134.2-174.8-47.80000111L143 M160 M166L143-T164 HydrophobicContact CB-CG2 4.31Å; L143-T164 HydrophobicContact CD2-CG2 4.21Å; M160-T164 WeakPolarHBondContact O-CB 3.36Å; M160-T164 PolarHBondContact O-N 2.9Å; M160-T164 PolarHBondContact O-OG1 2.98Å; T164-M166 PolarHBondContact O-N 3.41Å; T164-M166 VanDerWaalsContact O-N 3.14Å
165D87Confident87.6Confident100 Ų10069.4 Ų69.454%0.53534%0.335SS..  trans-59.4116.4166.2175.810.6000110.1N167 K168D165-N167 PolarHBondContact O-N 2.97Å; D165-N167 PolarHBondContact OD1-N 3.48Å; D165-K168 HydrophobicContact CB-CB 4.3Å; D165-K168 WeakPolarHBondContact O-CB 3.32Å; D165-K168 PolarHBondContact O-N 3.41Å; D165-K168 VanDerWaalsContact O-N 3.11Å
166M87Confident88.1Confident26 Ų2662.3 Ų62.313%0.12830%0.304CS..THydrogen-bonded Turntrans-67.3-24.5-177.5-43.3-166.8-1300112.8L161 T164 K168 L192 R195 C197L161-M166 HydrophobicContact CB-SD 4.48Å; L161-M166 HydrophobicContact CD2-CB 4.07Å; L161-M166 HydrophobicContact CD2-CG 3.54Å; L161-M166 HydrophobicContact CD2-SD 3.77Å; T164-M166 PolarHBondContact O-N 3.41Å; T164-M166 VanDerWaalsContact O-N 3.14Å; M166-K168 VanDerWaalsContact C-N 3.28Å; M166-L192 HydrophobicContact CB-CD2 4.47Å; M166-L192 HydrophobicContact CE-CD2 4.13Å; M166-L192 WeakPolarHBondContact CE-O 3.39Å; M166-R195 HydrophobicContact CE-CB 3.42Å; M166-R195 VanDerWaalsContact CE-CB 3.42Å; M166-R195 HydrophobicContact SD-CB 3.44Å; M166-R195 WeakPolarHBondContact SD-CB 3.49Å; M166-R195 HydrophobicContact SD-CG 4.12Å; M166-C197 HydrophobicContact CE-CB 3.5Å; M166-C197 VanDerWaalsContact CE-CB 3.5Å
167N91.2Very high88.6Confident37 Ų3759.4 Ų59.420%0.19829%0.289CS..THydrogen-bonded Turntrans-90.44.2178.5-60.7-45.3000112.1D165 K169 Q198 I201D165-N167 PolarHBondContact O-N 2.97Å; D165-N167 PolarHBondContact OD1-N 3.48Å; N167-K169 PolarHBondContact O-N 2.91Å; N167-Q198 PolarHBondContact OD1-N 3.32Å; N167-I201 HydrophobicContact CB-CD1 3.84Å
168K91.7Very high89.2Confident92 Ų9259.2 Ų59.240%0.429%0.288SS..  trans-55131.2177.4-170.6179-172.1-169.30110.3D141 H144 D165 M166D141-K168 WeakPolarHBondContact OD2-CD 3.48Å; D141-K168 WeakPolarHBondContact OD2-CE 3.43Å; D141-K168 IonicContact OD2-NZ 2.69Å; D141-K168 PolarHBondContact OD2-NZ 2.94Å; H144-K168 PolarHBondContact CE1-O 3Å; H144-K168 VanDerWaalsContact CE1-O 3.28Å; H144-K168 PolarHBondContact NE2-O 3.31Å; D165-K168 HydrophobicContact CB-CB 4.3Å; D165-K168 WeakPolarHBondContact O-CB 3.32Å; D165-K168 PolarHBondContact O-N 3.41Å; D165-K168 VanDerWaalsContact O-N 3.11Å; M166-K168 VanDerWaalsContact C-N 3.28Å
169K93.1Very high89.8Confident100 Ų10057 Ų5744%0.43528%0.276SS..  trans-95.6139.8179.1-69.5-177.9-178.2-172.40110.7N167 K173 R174 T175 I201N167-K169 PolarHBondContact O-N 2.91Å; K169-K173 HydrophobicContact CD-CB 4.25Å; K169-R174 CarbonylContact C-O 3.58Å; K169-R174 WeakPolarHBondContact CA-O 3.41Å; K169-T175 HydrophobicContact CG-CG2 4.18Å; K169-I201 HydrophobicContact CD-CG2 4.47Å
170D91.3Very high90.3Very high14 Ų1453.2 Ų53.28%0.07525%0.253CS..  trans-78.1-177166.773.94.5000111.6L140 Q172 K173 R174L140-D170 HydrophobicContact CD2-CB 4.47Å; L140-D170 WeakPolarHBondContact CD2-OD2 3.5Å; D170-Q172 PolarHBondContact O-N 3.32Å; D170-Q172 VanDerWaalsContact O-N 3.1Å; D170-Q172 VanDerWaalsContact OD1-C 3.28Å; D170-Q172 VanDerWaalsContact OD1-CA 3.31Å; D170-Q172 WeakPolarHBondContact OD1-CA 3.36Å; D170-Q172 PolarHBondContact OD1-N 3.43Å; D170-K173 WeakPolarHBondContact O-CA 3.43Å; D170-K173 PolarHBondContact O-N 3.07Å; D170-K173 PolarHBondContact OD1-N 3.2Å; D170-R174 PolarHBondContact N-O 2.77Å; D170-R174 WeakPolarHBondContact OD1-CB 3.35Å; D170-R174 PolarHBondContact OD1-N 2.97Å; D170-R174 IonicContact OD1-NE 2.69Å; D170-R174 IonicContact OD2-CZ 2.72Å; D170-R174 IonicContact OD2-NE 2.72Å; D170-R174 PolarHBondContact OD2-NE 3.3Å; D170-R174 IonicContact OD2-NH2 2.88Å; D170-R174 PolarHBondContact OD2-NH2 3.37Å
171K90Very high90.9Very high145 Ų14550.5 Ų50.563%0.6324%0.24SC*.THydrogen-bonded Turntrans-60.3-20.7179.5-62.7177.2-170.4163.90113.5D139 K173D139-K171 IonicContact OD1-NZ 3.15Å; D139-K171 PolarHBondContact OD1-NZ 2.86Å; K171-K173 VanDerWaalsContact C-N 3.34Å
172Q90.4Very high91.5Very high56 Ų5649.7 Ų49.726%0.26224%0.236SC..THydrogen-bonded Turntrans-99.516.5178.6-69.275.414.100112.1D170 R174 N204D170-Q172 PolarHBondContact O-N 3.32Å; D170-Q172 VanDerWaalsContact O-N 3.1Å; D170-Q172 VanDerWaalsContact OD1-C 3.28Å; D170-Q172 VanDerWaalsContact OD1-CA 3.31Å; D170-Q172 WeakPolarHBondContact OD1-CA 3.36Å; D170-Q172 PolarHBondContact OD1-N 3.43Å; Q172-R174 HydrophobicContact CB-CG 4.13Å; Q172-R174 PolarHBondContact O-N 3.19Å; Q172-N204 VanDerWaalsContact C-CG 3.42Å; Q172-N204 WeakPolarHBondContact CA-ND2 3.48Å; Q172-N204 WeakPolarHBondContact O-CB 3.48Å; Q172-N204 PolarHBondContact O-N 3.06Å; Q172-N204 PolarHBondContact O-OD1 3.44Å
173K94.1Very high92.1Very high116 Ų11643.7 Ų43.750%0.50421%0.211SC..SBendtrans61.216-177.4-64.7179-168.9177.10114.3K169 D170 K171 N204K169-K173 HydrophobicContact CD-CB 4.25Å; D170-K173 WeakPolarHBondContact O-CA 3.43Å; D170-K173 PolarHBondContact O-N 3.07Å; D170-K173 PolarHBondContact OD1-N 3.2Å; K171-K173 VanDerWaalsContact C-N 3.34Å; K173-N204 WeakPolarHBondContact CB-OD1 3.25Å; K173-N204 WeakPolarHBondContact CD-OD1 3.12Å; K173-N204 WeakPolarHBondContact CG-OD1 3.44Å
174R95.2Very high93Very high5 Ų538 Ų382%0.01919%0.186CC..  trans-84.2139.5-179.5-55.1173.3-61.9-154.7-1.5110Y133 H134 H144 K169 D170 Q172 H178 L179 D203Y133-R174 HydrophobicContact CE1-CG 3.97Å; H134-R174 PolarHBondContact O-NH1 3.23Å; H144-R174 PolarHBondContact NE2-O 3.26Å; H144-R174 VanDerWaalsContact NE2-O 3.15Å; K169-R174 CarbonylContact C-O 3.58Å; K169-R174 WeakPolarHBondContact CA-O 3.41Å; D170-R174 PolarHBondContact N-O 2.77Å; D170-R174 WeakPolarHBondContact OD1-CB 3.35Å; D170-R174 PolarHBondContact OD1-N 2.97Å; D170-R174 IonicContact OD1-NE 2.69Å; D170-R174 IonicContact OD2-CZ 2.72Å; D170-R174 IonicContact OD2-NE 2.72Å; D170-R174 PolarHBondContact OD2-NE 3.3Å; D170-R174 IonicContact OD2-NH2 2.88Å; D170-R174 PolarHBondContact OD2-NH2 3.37Å; Q172-R174 HydrophobicContact CB-CG 4.13Å; Q172-R174 PolarHBondContact O-N 3.19Å; R174-H178 HydrophobicContact CB-CB 4.13Å; R174-L179 HydrophobicContact CB-CD2 4.46Å; R174-D203 HydrophobicContact CG-CB 3.98Å
175T95.7Very high93.7Very high2 Ų237.5 Ų37.51%0.01218%0.182CC..  trans-90.4170.5169.564.40000110.8K169 L177 H178 L179 I201K169-T175 HydrophobicContact CG-CG2 4.18Å; T175-L177 PolarHBondContact O-N 2.88Å; T175-L177 PolarHBondContact OG1-N 2.85Å; T175-H178 PolarHBondContact N-ND1 2.69Å; T175-H178 PolarHBondContact O-N 2.76Å; T175-H178 PolarHBondContact OG1-N 3.45Å; T175-H178 PolarHBondContact OG1-ND1 3.36Å; T175-L179 PolarHBondContact O-N 3.4Å; T175-I201 HydrophobicContact CG2-CB 4.13Å; T175-I201 HydrophobicContact CG2-CD1 3.75Å; T175-I201 HydrophobicContact CG2-CG2 3.62Å
176A95.2Very high94.1Very high0 Ų033.6 Ų33.60%016%0.162CC..Hα-helixtrans-55.3-38169.800000111.7L143 A147 H178 L179 A180 L192L143-A176 HydrophobicContact CD2-CB 3.94Å; L143-A176 HydrophobicContact CG-CB 3.79Å; A147-A176 HydrophobicContact CB-CB 3.91Å; A147-A176 VanDerWaalsContact CB-O 3.26Å; A147-A176 WeakPolarHBondContact CB-O 3.41Å; A176-H178 PolarHBondContact O-N 3.28Å; A176-L179 PolarHBondContact O-N 3.37Å; A176-A180 WeakPolarHBondContact O-CB 3.4Å; A176-A180 PolarHBondContact O-N 3.2Å; A176-L192 HydrophobicContact CB-CD1 4Å; A176-L192 HydrophobicContact CB-CD2 4.42Å
177L97.1Very high94.4Very high4 Ų438.1 Ų38.12%0.02118%0.183CC..Hα-helixtrans-59.5-46.7177.4-168.567.2000111.8T175 L179 A180 S181 V189 L192 L193 L199 A209 L225T175-L177 PolarHBondContact O-N 2.88Å; T175-L177 PolarHBondContact OG1-N 2.85Å; L177-L179 VanDerWaalsContact C-N 3.31Å; L177-L179 PolarHBondContact O-N 3.39Å; L177-A180 PolarHBondContact O-N 3.22Å; L177-S181 VanDerWaalsContact O-CB 3.25Å; L177-S181 WeakPolarHBondContact O-CB 3.47Å; L177-S181 PolarHBondContact O-N 2.95Å; L177-S181 PolarHBondContact O-OG 2.92Å; L177-V189 HydrophobicContact CD1-CG1 4.12Å; L177-L192 HydrophobicContact CB-CD1 4.22Å; L177-L192 HydrophobicContact CD1-CB 4.15Å; L177-L192 HydrophobicContact CD1-CD1 4.11Å; L177-L193 HydrophobicContact CD1-CD2 4.45Å; L177-L199 HydrophobicContact CD2-CD2 4.16Å; L177-A209 HydrophobicContact CB-CB 4.31Å; L177-A209 HydrophobicContact CD2-CB 3.78Å; L177-A209 HydrophobicContact CG-CB 3.67Å; L177-L225 HydrophobicContact CD1-CD2 4.14Å; L177-L225 HydrophobicContact CD2-CD2 3.9Å; L177-L225 HydrophobicContact CG-CD2 4.24Å
178H97.2Very high94.5Very high1 Ų136.6 Ų36.61%0.00518%0.175CC..Hα-helixtrans-55.7-45.2177.2-72.685.2000112.7Y133 R174 T175 A176 A182 I201 R207 A209Y133-H178 HydrophobicContact CE2-CB 4.13Å; Y133-H178 PolarHBondContact OH-CD2 3.04Å; R174-H178 HydrophobicContact CB-CB 4.13Å; T175-H178 PolarHBondContact N-ND1 2.69Å; T175-H178 PolarHBondContact O-N 2.76Å; T175-H178 PolarHBondContact OG1-N 3.45Å; T175-H178 PolarHBondContact OG1-ND1 3.36Å; A176-H178 PolarHBondContact O-N 3.28Å; H178-A182 WeakPolarHBondContact O-CB 3.44Å; H178-A182 PolarHBondContact O-N 3.33Å; H178-I201 PolarHBondContact CE1-O 3.33Å; H178-I201 PolarHBondContact NE2-O 2.98Å; H178-I201 VanDerWaalsContact NE2-O 3.1Å; H178-R207 PolarHBondContact NE2-O 2.78Å; H178-A209 PolarHBondContact NE2-N 3.03Å
179L95.6Very high94.8Very high0 Ų032.2 Ų32.20%016%0.156CC..Hα-helixtrans-71.3-41-177.1-62.9175.3000111.8Y133 V135 L140 H144 A147 W148 R174 T175 A176 L177 N183Y133-L179 HydrophobicContact CD2-CD2 3.95Å; Y133-L179 HydrophobicContact CE2-CD2 4.34Å; Y133-L179 HydrophobicContact CG-CD2 4.49Å; V135-L179 HydrophobicContact CG2-CD2 4.36Å; L140-L179 HydrophobicContact CD1-CD1 4.08Å; L140-L179 HydrophobicContact CD2-CD1 3.82Å; H144-L179 HydrophobicContact CB-CD1 3.53Å; H144-L179 WeakPolarHBondContact O-CD1 3.35Å; A147-L179 HydrophobicContact CB-CB 4.33Å; W148-L179 HydrophobicContact CB-CB 4.46Å; W148-L179 HydrophobicContact CE3-CB 4.08Å; W148-L179 HydrophobicContact CE3-CD2 3.6Å; W148-L179 HydrophobicContact CE3-CG 4.34Å; W148-L179 HydrophobicContact CZ3-CD2 3.92Å; R174-L179 HydrophobicContact CB-CD2 4.46Å; T175-L179 PolarHBondContact O-N 3.4Å; A176-L179 PolarHBondContact O-N 3.37Å; L177-L179 VanDerWaalsContact C-N 3.31Å; L177-L179 PolarHBondContact O-N 3.39Å; L179-N183 WeakPolarHBondContact O-CB 3.48Å; L179-N183 PolarHBondContact O-N 2.58Å
180A96.4Very high94.8Very high0 Ų032.1 Ų32.10%016%0.156CC..Hα-helixtrans-64.4-47.5176.200000111.3A147 A176 L177 A182 N183 G184 N185 V188 V189A147-A180 HydrophobicContact CB-CB 4.07Å; A147-A180 VanDerWaalsContact O-CA 3.27Å; A147-A180 WeakPolarHBondContact O-CA 3.42Å; A176-A180 WeakPolarHBondContact O-CB 3.4Å; A176-A180 PolarHBondContact O-N 3.2Å; L177-A180 PolarHBondContact O-N 3.22Å; A180-A182 PolarHBondContact O-N 3.14Å; A180-N183 PolarHBondContact O-N 3.49Å; A180-G184 PolarHBondContact O-N 3.16Å; A180-G184 VanDerWaalsContact O-N 3.15Å; A180-N185 HydrophobicContact CB-CB 4.27Å; A180-N185 PolarHBondContact O-N 2.99Å; A180-V188 HydrophobicContact CB-CB 4.01Å; A180-V188 HydrophobicContact CB-CG1 3.88Å; A180-V189 HydrophobicContact CB-CG2 3.67Å
181S97.3Very high94.9Very high0 Ų031.6 Ų31.60%015%0.153CC..Hα-helixtrans-64-39.7179.3-62.50000112.9L177 N183L177-S181 VanDerWaalsContact O-CB 3.25Å; L177-S181 WeakPolarHBondContact O-CB 3.47Å; L177-S181 PolarHBondContact O-N 2.95Å; L177-S181 PolarHBondContact O-OG 2.92Å; S181-N183 VanDerWaalsContact C-N 3.26Å; S181-N183 PolarHBondContact O-N 3.24Å
182A96.1Very high95.1Very high0 Ų024.8 Ų24.80%012%0.123CC..Hα-helixtrans-71.6-18178.300000114.2Y133 H178 A180 K212 C216Y133-A182 HydrophobicContact CD2-CB 3.64Å; Y133-A182 HydrophobicContact CE2-CB 3.74Å; H178-A182 WeakPolarHBondContact O-CB 3.44Å; H178-A182 PolarHBondContact O-N 3.33Å; A180-A182 PolarHBondContact O-N 3.14Å; A182-K212 HydrophobicContact CB-CB 4.24Å; A182-C216 WeakPolarHBondContact O-CB 3.26Å; A182-C216 PolarHBondContact O-SG 3.23Å
183N94.5Very high95.3Very high33 Ų3322.4 Ų22.418%0.17611%0.112CC..THydrogen-bonded Turntrans-110.24.7-177.9-76.423.7000113.2W148 L179 A180 S181 N185W148-N183 VanDerWaalsContact CZ3-OD1 3.23Å; W148-N183 WeakPolarHBondContact CZ3-OD1 3.39Å; W148-N183 PolarHBondContact O-ND2 3.42Å; L179-N183 WeakPolarHBondContact O-CB 3.48Å; L179-N183 PolarHBondContact O-N 2.58Å; A180-N183 PolarHBondContact O-N 3.49Å; S181-N183 VanDerWaalsContact C-N 3.26Å; S181-N183 PolarHBondContact O-N 3.24Å; N183-N185 VanDerWaalsContact C-N 3.29Å; N183-N185 PolarHBondContact O-N 3.2Å
184G94.9Very high95.2Very high23 Ų2320.7 Ų20.724%0.23711%0.109CC..THydrogen-bonded Turntrans70.922.3178.900000114A180 S186 E218A180-G184 PolarHBondContact O-N 3.16Å; A180-G184 VanDerWaalsContact O-N 3.15Å; G184-S186 PolarHBondContact O-N 2.87Å; G184-E218 WeakPolarHBondContact CA-OE2 3.36Å
185N95.9Very high95Very high33 Ų3326.9 Ų26.918%0.17613%0.132CC..  trans-82.368.9-179-65.7-39.1000110.6A147 W148 G150 A180 N183 E187 V188 V189A147-N185 PolarHBondContact O-ND2 2.99Å; W148-N185 PolarHBondContact O-ND2 2.85Å; G150-N185 VanDerWaalsContact CA-CG 3.45Å; G150-N185 WeakPolarHBondContact CA-OD1 3.33Å; G150-N185 PolarHBondContact N-ND2 3.34Å; A180-N185 HydrophobicContact CB-CB 4.27Å; A180-N185 PolarHBondContact O-N 2.99Å; N183-N185 VanDerWaalsContact C-N 3.29Å; N183-N185 PolarHBondContact O-N 3.2Å; N185-E187 VanDerWaalsContact C-N 3.32Å; N185-E187 PolarHBondContact O-N 3.42Å; N185-V188 HydrophobicContact CB-CB 4.28Å; N185-V188 HydrophobicContact CB-CG2 4.19Å; N185-V188 WeakPolarHBondContact O-CB 3.18Å; N185-V188 PolarHBondContact O-N 3.06Å; N185-V189 PolarHBondContact O-N 3.22Å
186S95.3Very high94.7Very high18 Ų1837.7 Ų37.713%0.12617%0.173CC..Hα-helixtrans-56.7-40.3-171.360.20000113.6G184 V188 V189 K190 E220 M224G184-S186 PolarHBondContact O-N 2.87Å; S186-V188 VanDerWaalsContact C-N 3.29Å; S186-V188 PolarHBondContact O-N 2.99Å; S186-V189 WeakPolarHBondContact O-CB 3.28Å; S186-V189 PolarHBondContact O-N 2.91Å; S186-V189 VanDerWaalsContact O-N 3.15Å; S186-K190 WeakPolarHBondContact O-CB 3.33Å; S186-K190 PolarHBondContact O-N 3.31Å; S186-E220 VanDerWaalsContact CB-CD 3.45Å; S186-E220 WeakPolarHBondContact CB-OE1 3.21Å; S186-E220 PolarHBondContact OG-OE1 3.21Å; S186-M224 VanDerWaalsContact CB-CE 3.48Å
187E93.6Very high94.5Very high121 Ų12138.2 Ų38.257%0.56518%0.176SC*.Hα-helixtrans-59.9-36.4175.9-69.1-59.5146.500113.5N185 L191N185-E187 VanDerWaalsContact C-N 3.32Å; N185-E187 PolarHBondContact O-N 3.42Å; E187-L191 WeakPolarHBondContact O-CB 3.34Å; E187-L191 PolarHBondContact O-N 2.98Å
188V94.8Very high94.4Very high6 Ų643.7 Ų43.74%0.03620%0.202CC..Hα-helixtrans-73.5-42.6175.9-179.20000110.1A147 L157 A180 N185 S186 L191 L192A147-V188 HydrophobicContact CB-CG1 4.06Å; L157-V188 HydrophobicContact CD2-CB 4.31Å; L157-V188 HydrophobicContact CD2-CG1 4.01Å; L157-V188 HydrophobicContact CD2-CG2 4.06Å; A180-V188 HydrophobicContact CB-CB 4.01Å; A180-V188 HydrophobicContact CB-CG1 3.88Å; N185-V188 HydrophobicContact CB-CB 4.28Å; N185-V188 HydrophobicContact CB-CG2 4.19Å; N185-V188 WeakPolarHBondContact O-CB 3.18Å; N185-V188 PolarHBondContact O-N 3.06Å; S186-V188 VanDerWaalsContact C-N 3.29Å; S186-V188 PolarHBondContact O-N 2.99Å; V188-L191 PolarHBondContact O-N 3.38Å; V188-L192 HydrophobicContact CG1-CD1 3.96Å; V188-L192 HydrophobicContact CG1-CG 4.32Å; V188-L192 VanDerWaalsContact O-CG 3.29Å; V188-L192 WeakPolarHBondContact O-CG 3.13Å; V188-L192 PolarHBondContact O-N 3.23Å
189V96.4Very high94.3Very high0 Ų045 Ų450%021%0.208CC..Hα-helixtrans-56.7-53.4175173.10000110L177 A180 N185 S186 L191 L192 L193 C221 M224 L225L177-V189 HydrophobicContact CD1-CG1 4.12Å; A180-V189 HydrophobicContact CB-CG2 3.67Å; N185-V189 PolarHBondContact O-N 3.22Å; S186-V189 WeakPolarHBondContact O-CB 3.28Å; S186-V189 PolarHBondContact O-N 2.91Å; S186-V189 VanDerWaalsContact O-N 3.15Å; V189-L191 VanDerWaalsContact C-N 3.3Å; V189-L191 PolarHBondContact O-N 3.44Å; V189-L192 PolarHBondContact O-N 3.16Å; V189-L192 VanDerWaalsContact O-N 3.07Å; V189-L193 HydrophobicContact CG1-CD1 3.69Å; V189-L193 HydrophobicContact CG1-CG 4.18Å; V189-L193 VanDerWaalsContact O-CG 3.27Å; V189-L193 WeakPolarHBondContact O-CG 3.32Å; V189-L193 PolarHBondContact O-N 2.97Å; V189-C221 HydrophobicContact CG2-CB 4.37Å; V189-M224 HydrophobicContact CB-CE 3.95Å; V189-M224 HydrophobicContact CG1-CE 3.85Å; V189-L225 HydrophobicContact CG1-CG 4.48Å
190K94.6Very high94.2Very high97 Ų9748.4 Ų48.442%0.42223%0.227SC..Hα-helixtrans-52-48.1178.3-175.2173-175170.70112S186 L192 L193 D194 M224S186-K190 WeakPolarHBondContact O-CB 3.33Å; S186-K190 PolarHBondContact O-N 3.31Å; K190-L192 PolarHBondContact O-N 3.49Å; K190-L193 PolarHBondContact O-N 3.35Å; K190-D194 PolarHBondContact O-N 3.03Å; K190-M224 HydrophobicContact CB-SD 4.06Å
191L93.3Very high94.2Very high4 Ų449 Ų492%0.02123%0.23CC..Hα-helixtrans-66.3-38.8-179.7-170.6152.5000112.7R154 L157 I158 L161 E187 V188 V189 L193 R195R154-L191 HydrophobicContact CG-CD1 3.81Å; L157-L191 HydrophobicContact CD2-CB 4.35Å; L157-L191 HydrophobicContact CD2-CD1 3.92Å; L157-L191 HydrophobicContact CD2-CD2 4Å; L157-L191 HydrophobicContact CD2-CG 4.33Å; L157-L191 HydrophobicContact CG-CD1 4.39Å; L157-L191 HydrophobicContact CG-CD2 4.19Å; I158-L191 HydrophobicContact CD1-CD1 4.42Å; I158-L191 HydrophobicContact CG1-CD1 3.78Å; L161-L191 HydrophobicContact CD1-CD2 2.95Å; L161-L191 HydrophobicContact CD1-CG 4.45Å; L161-L191 HydrophobicContact CG-CD2 4.45Å; E187-L191 WeakPolarHBondContact O-CB 3.34Å; E187-L191 PolarHBondContact O-N 2.98Å; V188-L191 PolarHBondContact O-N 3.38Å; V189-L191 VanDerWaalsContact C-N 3.3Å; V189-L191 PolarHBondContact O-N 3.44Å; L191-L193 VanDerWaalsContact C-N 3.31Å; L191-R195 WeakPolarHBondContact O-CG 3.39Å; L191-R195 PolarHBondContact O-N 3.28Å
192L94Very high94.2Very high1 Ų152 Ų521%0.00525%0.245CC..Hα-helixtrans-65.2-35.8175-69.9170.8000111.7L161 M166 A176 L177 V188 V189 K190 R195 R196 C197L161-L192 HydrophobicContact CD1-CD2 4.29Å; L161-L192 HydrophobicContact CD2-CD2 3.77Å; M166-L192 HydrophobicContact CB-CD2 4.47Å; M166-L192 HydrophobicContact CE-CD2 4.13Å; M166-L192 WeakPolarHBondContact CE-O 3.39Å; A176-L192 HydrophobicContact CB-CD1 4Å; A176-L192 HydrophobicContact CB-CD2 4.42Å; L177-L192 HydrophobicContact CB-CD1 4.22Å; L177-L192 HydrophobicContact CD1-CB 4.15Å; L177-L192 HydrophobicContact CD1-CD1 4.11Å; V188-L192 HydrophobicContact CG1-CD1 3.96Å; V188-L192 HydrophobicContact CG1-CG 4.32Å; V188-L192 VanDerWaalsContact O-CG 3.29Å; V188-L192 WeakPolarHBondContact O-CG 3.13Å; V188-L192 PolarHBondContact O-N 3.23Å; V189-L192 PolarHBondContact O-N 3.16Å; V189-L192 VanDerWaalsContact O-N 3.07Å; K190-L192 PolarHBondContact O-N 3.49Å; L192-R195 PolarHBondContact O-N 3.42Å; L192-R196 PolarHBondContact O-N 3.13Å; L192-C197 PolarHBondContact O-N 3.2Å; L192-C197 PolarHBondContact O-SG 3.14Å
193L94.3Very high94.2Very high6 Ų652.2 Ų52.23%0.03125%0.247CC..Hα-helixtrans-70.9-43.8175.8-64.5176000112.2L177 V189 K190 L191 R195 R196 L199 M224 L225 H228L177-L193 HydrophobicContact CD1-CD2 4.45Å; V189-L193 HydrophobicContact CG1-CD1 3.69Å; V189-L193 HydrophobicContact CG1-CG 4.18Å; V189-L193 VanDerWaalsContact O-CG 3.27Å; V189-L193 WeakPolarHBondContact O-CG 3.32Å; V189-L193 PolarHBondContact O-N 2.97Å; K190-L193 PolarHBondContact O-N 3.35Å; L191-L193 VanDerWaalsContact C-N 3.31Å; L193-R195 PolarHBondContact O-N 2.86Å; L193-R195 VanDerWaalsContact O-N 3.09Å; L193-R196 PolarHBondContact O-N 3.31Å; L193-L199 HydrophobicContact CD2-CD2 3.22Å; L193-M224 HydrophobicContact CD1-CB 4.04Å; L193-L225 HydrophobicContact CD1-CD2 4.48Å; L193-L225 HydrophobicContact CD2-CD2 4.05Å; L193-H228 HydrophobicContact CD1-CB 4.38Å; L193-H228 HydrophobicContact CD2-CB 4.17Å
194D92Very high94.1Very high80 Ų8054.5 Ų54.543%0.42826%0.259SS..Hα-helixtrans-54.6-30.6174-71.3-20.4000112R154 K190R154-D194 IonicContact NH2-OD2 3.16Å; K190-D194 PolarHBondContact O-N 3.03Å
195R90.2Very high94.1Very high136 Ų13656.1 Ų56.151%0.51326%0.259SS..THydrogen-bonded Turntrans-92.810.3179.1-71.5-77.6-171.3-104.6-0.4113.7M166 L191 L192 L193 C197M166-R195 HydrophobicContact CE-CB 3.42Å; M166-R195 VanDerWaalsContact CE-CB 3.42Å; M166-R195 HydrophobicContact SD-CB 3.44Å; M166-R195 WeakPolarHBondContact SD-CB 3.49Å; M166-R195 HydrophobicContact SD-CG 4.12Å; L191-R195 WeakPolarHBondContact O-CG 3.39Å; L191-R195 PolarHBondContact O-N 3.28Å; L192-R195 PolarHBondContact O-N 3.42Å; L193-R195 PolarHBondContact O-N 2.86Å; L193-R195 VanDerWaalsContact O-N 3.09Å; R195-C197 PolarHBondContact O-N 3.41Å
196R89.8Confident94.1Very high229 Ų22960.3 Ų60.386%0.86428%0.276SS*.THydrogen-bonded Turntrans56.645175.8-55-175178.6-167-1.5113.8L192 L193L192-R196 PolarHBondContact O-N 3.13Å; L193-R196 PolarHBondContact O-N 3.31Å
197C91.6Very high94.2Very high11 Ų1160.1 Ų60.17%0.07427%0.273CS..  trans-59.3158.116965.30000112M166 L192 R195 L199M166-C197 HydrophobicContact CE-CB 3.5Å; M166-C197 VanDerWaalsContact CE-CB 3.5Å; L192-C197 PolarHBondContact O-N 3.2Å; L192-C197 PolarHBondContact O-SG 3.14Å; R195-C197 PolarHBondContact O-N 3.41Å; C197-L199 PolarHBondContact O-N 2.86Å
198Q94.7Very high94.3Very high118 Ų11854.4 Ų54.455%0.55125%0.246SC*.  trans-75125.1174.6-68.3178.611.100110.2N167 I201N167-Q198 PolarHBondContact OD1-N 3.32Å; Q198-I201 HydrophobicContact CB-CD1 3.59Å; Q198-I201 HydrophobicContact CB-CG1 3.75Å; Q198-I201 HydrophobicContact CG-CD1 4.46Å
199L94.3Very high94.5Very high28 Ų2854.1 Ų54.115%0.14724%0.244CC..SBendtrans-84.2-39.4-172.1-52.6-178.9000113L177 L193 C197 I201 L225 H228 T230L177-L199 HydrophobicContact CD2-CD2 4.16Å; L193-L199 HydrophobicContact CD2-CD2 3.22Å; C197-L199 PolarHBondContact O-N 2.86Å; L199-I201 VanDerWaalsContact C-N 3.27Å; L199-I201 PolarHBondContact O-N 2.95Å; L199-L225 HydrophobicContact CD2-CD2 4.48Å; L199-H228 HydrophobicContact CD1-CB 4.16Å; L199-H228 WeakPolarHBondContact CD1-O 3.47Å; L199-T230 HydrophobicContact CB-CG2 4.32Å
200N94.6Very high94.6Very high72 Ų7254.1 Ų54.139%0.38524%0.244SC..SBendtrans-91.825.7-171.2-64.9-20000113.2T230 D231 I234N200-T230 WeakPolarHBondContact OD1-CG2 3.38Å; N200-D231 PolarHBondContact OD1-N 3.47Å; N200-I234 HydrophobicContact CB-CD1 3.55Å; N200-I234 VanDerWaalsContact CG-CD1 3.47Å
201I96.5Very high94.7Very high13 Ų1349.6 Ų49.67%0.06723%0.225CC..  trans-71.1142.3173.6-68.4178.3000109.4N167 K169 T175 H178 Q198 L199N167-I201 HydrophobicContact CB-CD1 3.84Å; K169-I201 HydrophobicContact CD-CG2 4.47Å; T175-I201 HydrophobicContact CG2-CB 4.13Å; T175-I201 HydrophobicContact CG2-CD1 3.75Å; T175-I201 HydrophobicContact CG2-CG2 3.62Å; H178-I201 PolarHBondContact CE1-O 3.33Å; H178-I201 PolarHBondContact NE2-O 2.98Å; H178-I201 VanDerWaalsContact NE2-O 3.1Å; Q198-I201 HydrophobicContact CB-CD1 3.59Å; Q198-I201 HydrophobicContact CB-CG1 3.75Å; Q198-I201 HydrophobicContact CG-CD1 4.46Å; L199-I201 VanDerWaalsContact C-N 3.27Å; L199-I201 PolarHBondContact O-N 2.95Å
202L97.1Very high94.9Very high62 Ų6249.4 Ų49.433%0.32522%0.224SC..  trans-103.8136.3-179.4-49.3-176.9000112.8K206 R207 T208 I234L202-K206 HydrophobicContact CD1-CB 4.4Å; L202-R207 WeakPolarHBondContact CA-O 3.25Å; L202-T208 HydrophobicContact CD2-CG2 3.8Å; L202-I234 HydrophobicContact CD2-CG2 3.68Å
203D95.3Very high95.1Very high6 Ų649.3 Ų49.33%0.03222%0.223CC..  trans-75.8-178.9166.882.3-0.1000112.8Y133 R174 K205 K206 R207Y133-D203 VanDerWaalsContact CE1-OD2 3.22Å; Y133-D203 WeakPolarHBondContact CE1-OD2 3.13Å; Y133-D203 PolarHBondContact OH-OD2 3Å; R174-D203 HydrophobicContact CG-CB 3.98Å; D203-K205 PolarHBondContact O-N 2.96Å; D203-K205 WeakPolarHBondContact OD1-CA 3.36Å; D203-K205 PolarHBondContact OD1-N 3.17Å; D203-K206 WeakPolarHBondContact O-CA 3.36Å; D203-K206 PolarHBondContact O-N 3.18Å; D203-K206 PolarHBondContact OD1-N 3.48Å; D203-R207 PolarHBondContact N-O 3.22Å; D203-R207 WeakPolarHBondContact OD1-CB 3.48Å; D203-R207 PolarHBondContact OD1-N 3.19Å; D203-R207 IonicContact OD1-NE 3.58Å; D203-R207 IonicContact OD2-CZ 3.82Å; D203-R207 IonicContact OD2-NE 3.78Å; D203-R207 PolarHBondContact OD2-NE 2.81Å; D203-R207 VanDerWaalsContact OD2-NE 3.16Å; D203-R207 IonicContact OD2-NH2 3.7Å; D203-R207 PolarHBondContact OD2-NH2 3.13Å
204N93.8Very high95.3Very high81 Ų8149.2 Ų49.243%0.43322%0.223SC..THydrogen-bonded Turntrans-58.4-26.7179.1-91.73.2000114.8Q172 K173 K206Q172-N204 VanDerWaalsContact C-CG 3.42Å; Q172-N204 WeakPolarHBondContact CA-ND2 3.48Å; Q172-N204 WeakPolarHBondContact O-CB 3.48Å; Q172-N204 PolarHBondContact O-N 3.06Å; Q172-N204 PolarHBondContact O-OD1 3.44Å; K173-N204 WeakPolarHBondContact CB-OD1 3.25Å; K173-N204 WeakPolarHBondContact CD-OD1 3.12Å; K173-N204 WeakPolarHBondContact CG-OD1 3.44Å; N204-K206 VanDerWaalsContact C-N 3.28Å
205K93.7Very high95.5Very high56 Ų5645.5 Ų45.524%0.24320%0.203CC..THydrogen-bonded Turntrans-95.117.7176.6-62.2-161.2166.1-166.20112D203 R207 E237D203-K205 PolarHBondContact O-N 2.96Å; D203-K205 WeakPolarHBondContact OD1-CA 3.36Å; D203-K205 PolarHBondContact OD1-N 3.17Å; K205-R207 HydrophobicContact CB-CG 4.31Å; K205-R207 PolarHBondContact O-N 3.44Å; K205-E237 HydrophobicContact CB-CG 4.21Å; K205-E237 VanDerWaalsContact CB-OE1 3.28Å; K205-E237 WeakPolarHBondContact CB-OE1 3.41Å; K205-E237 WeakPolarHBondContact CD-OE1 3.18Å; K205-E237 WeakPolarHBondContact CG-OE1 3.4Å; K205-E237 WeakPolarHBondContact O-CB 3.4Å; K205-E237 PolarHBondContact O-N 3.27Å
206K96.3Very high95.7Very high122 Ų12239.6 Ų39.653%0.5318%0.182SC..SBendtrans59.223.7-175.8-54.9-174.1177.6-174.10114.7L202 D203 N204 E237L202-K206 HydrophobicContact CD1-CB 4.4Å; D203-K206 WeakPolarHBondContact O-CA 3.36Å; D203-K206 PolarHBondContact O-N 3.18Å; D203-K206 PolarHBondContact OD1-N 3.48Å; N204-K206 VanDerWaalsContact C-N 3.28Å; K206-E237 HydrophobicContact CG-CB 4.46Å
207R96.6Very high96Very high14 Ų1434 Ų345%0.05317%0.166CC..  trans-89.9145178.9-62.8171-60.5-175.80.9110.4H178 L202 D203 K205 T211 K212 D236H178-R207 PolarHBondContact NE2-O 2.78Å; L202-R207 WeakPolarHBondContact CA-O 3.25Å; D203-R207 PolarHBondContact N-O 3.22Å; D203-R207 WeakPolarHBondContact OD1-CB 3.48Å; D203-R207 PolarHBondContact OD1-N 3.19Å; D203-R207 IonicContact OD1-NE 3.58Å; D203-R207 IonicContact OD2-CZ 3.82Å; D203-R207 IonicContact OD2-NE 3.78Å; D203-R207 PolarHBondContact OD2-NE 2.81Å; D203-R207 VanDerWaalsContact OD2-NE 3.16Å; D203-R207 IonicContact OD2-NH2 3.7Å; D203-R207 PolarHBondContact OD2-NH2 3.13Å; K205-R207 HydrophobicContact CB-CG 4.31Å; K205-R207 PolarHBondContact O-N 3.44Å; R207-T211 HydrophobicContact CB-CG2 4.26Å; R207-T211 HydrophobicContact CG-CG2 4.15Å; R207-K212 HydrophobicContact CB-CD 4.16Å; R207-K212 HydrophobicContact CB-CG 4.19Å; R207-D236 HydrophobicContact CG-CB 3.54Å
208T97.7Very high96.3Very high1 Ų135.5 Ų35.51%0.00617%0.172CC..  trans-84.5169.2169.265.50000111L202 L210 T211 K212 I234L202-T208 HydrophobicContact CD2-CG2 3.8Å; T208-L210 PolarHBondContact O-N 2.92Å; T208-L210 PolarHBondContact OG1-N 3.13Å; T208-T211 PolarHBondContact O-N 2.91Å; T208-T211 PolarHBondContact OG1-N 3.15Å; T208-T211 VanDerWaalsContact OG1-N 3.11Å; T208-T211 PolarHBondContact OG1-OG1 3.4Å; T208-T211 VanDerWaalsContact OG1-OG1 3.07Å; T208-K212 WeakPolarHBondContact O-CG 3.39Å; T208-K212 PolarHBondContact O-N 3.36Å; T208-K212 VanDerWaalsContact O-N 3.13Å; T208-I234 HydrophobicContact CG2-CB 3.85Å; T208-I234 HydrophobicContact CG2-CD1 3.81Å; T208-I234 HydrophobicContact CG2-CG1 4.41Å; T208-I234 HydrophobicContact CG2-CG2 3.7Å
209A97.7Very high96.4Very high0 Ų033 Ų330%016%0.163CC..Hα-helixtrans-60-35.4171.700000112.3L177 H178 K212 A213 L225L177-A209 HydrophobicContact CB-CB 4.31Å; L177-A209 HydrophobicContact CD2-CB 3.78Å; L177-A209 HydrophobicContact CG-CB 3.67Å; H178-A209 PolarHBondContact NE2-N 3.03Å; A209-K212 PolarHBondContact O-N 3.18Å; A209-A213 PolarHBondContact O-N 3.04Å; A209-L225 HydrophobicContact CB-CD1 4.15Å
210L98.5Very high96.5Very high0 Ų036.3 Ų36.30%018%0.177CC..Hα-helixtrans-64.4-51175.7171.665.6000111.2T208 K212 A213 V214 A222 L225 L226 T230 P232 A242 L258T208-L210 PolarHBondContact O-N 2.92Å; T208-L210 PolarHBondContact OG1-N 3.13Å; L210-K212 PolarHBondContact O-N 3.31Å; L210-K212 VanDerWaalsContact O-N 3.15Å; L210-A213 PolarHBondContact O-N 3.41Å; L210-A213 VanDerWaalsContact O-N 3.08Å; L210-V214 HydrophobicContact CD1-CG2 4.13Å; L210-V214 WeakPolarHBondContact O-CG2 3.45Å; L210-V214 PolarHBondContact O-N 3.35Å; L210-A222 HydrophobicContact CD1-CB 4.06Å; L210-L225 HydrophobicContact CB-CB 4.47Å; L210-L225 HydrophobicContact CB-CD1 4.15Å; L210-L225 HydrophobicContact CD1-CB 4.28Å; L210-L226 HydrophobicContact CD1-CD1 4.4Å; L210-L226 HydrophobicContact CD1-CD2 4.03Å; L210-L226 HydrophobicContact CD1-CG 3.87Å; L210-L226 HydrophobicContact CD2-CD2 3.6Å; L210-L226 HydrophobicContact CD2-CG 4.36Å; L210-L226 HydrophobicContact CG-CD2 4.48Å; L210-T230 HydrophobicContact CB-CG2 3.68Å; L210-T230 HydrophobicContact CD2-CG2 3.85Å; L210-T230 HydrophobicContact CG-CG2 4.41Å; L210-P232 HydrophobicContact CD2-CB 4.04Å; L210-A242 HydrophobicContact CD2-CB 4.36Å; L210-A242 HydrophobicContact CG-CB 4.27Å; L210-L258 HydrophobicContact CD2-CD2 4.36Å
211T97.8Very high96.7Very high1 Ų133 Ų331%0.00616%0.159CC..Hα-helixtrans-55.1-37.1177.5-55.90000110.9R207 T208 Q215 Y245R207-T211 HydrophobicContact CB-CG2 4.26Å; R207-T211 HydrophobicContact CG-CG2 4.15Å; T208-T211 PolarHBondContact O-N 2.91Å; T208-T211 PolarHBondContact OG1-N 3.15Å; T208-T211 VanDerWaalsContact OG1-N 3.11Å; T208-T211 PolarHBondContact OG1-OG1 3.4Å; T208-T211 VanDerWaalsContact OG1-OG1 3.07Å; T211-Q215 WeakPolarHBondContact O-CB 3.49Å; T211-Q215 PolarHBondContact O-N 3.4Å; T211-Y245 HydrophobicContact CG2-CD2 3.51Å; T211-Y245 HydrophobicContact CG2-CE2 3.4Å
212K96.9Very high96.8Very high0 Ų032.3 Ų32.30%016%0.156CC..Hα-helixtrans-73.6-39.1176.5-66.5-63.5-69.2155.20114.6P131 Y133 A182 R207 T208 A209 L210 V214 Q215 C216P131-K212 PolarHBondContact O-NZ 2.97Å; Y133-K212 HydrophobicContact CE1-CD 4.31Å; Y133-K212 HydrophobicContact CE2-CD 4.31Å; Y133-K212 VanDerWaalsContact CE2-CE 3.49Å; Y133-K212 HydrophobicContact CE2-CG 4.14Å; Y133-K212 WeakPolarHBondContact OH-CG 3.43Å; A182-K212 HydrophobicContact CB-CB 4.24Å; R207-K212 HydrophobicContact CB-CD 4.16Å; R207-K212 HydrophobicContact CB-CG 4.19Å; T208-K212 WeakPolarHBondContact O-CG 3.39Å; T208-K212 PolarHBondContact O-N 3.36Å; T208-K212 VanDerWaalsContact O-N 3.13Å; A209-K212 PolarHBondContact O-N 3.18Å; L210-K212 PolarHBondContact O-N 3.31Å; L210-K212 VanDerWaalsContact O-N 3.15Å; K212-V214 VanDerWaalsContact C-N 3.32Å; K212-Q215 PolarHBondContact O-N 3.16Å; K212-C216 WeakPolarHBondContact O-CB 3.41Å; K212-C216 PolarHBondContact O-N 2.83Å
213A97.9Very high96.8Very high0 Ų030.8 Ų30.80%015%0.148CC..Hα-helixtrans-57.7-49.1173.100000110.2A209 L210 C216 Q217 E218 C221 A222 L225A209-A213 PolarHBondContact O-N 3.04Å; L210-A213 PolarHBondContact O-N 3.41Å; L210-A213 VanDerWaalsContact O-N 3.08Å; A213-C216 CarbonylContact O-C 3.38Å; A213-C216 PolarHBondContact O-N 3.32Å; A213-Q217 PolarHBondContact O-N 3.18Å; A213-E218 PolarHBondContact O-N 3.18Å; A213-C221 HydrophobicContact CB-CB 4.15Å; A213-A222 HydrophobicContact CB-CB 3.79Å; A213-L225 HydrophobicContact CB-CD1 4.35Å
214V98.1Very high96.9Very high3 Ų331.4 Ų31.42%0.01815%0.151CC..Hα-helixtrans-63.9-45.1178.3179.20000111.6L210 K212 C216 Q217 A222 A242 A246 N249 M254 L258L210-V214 HydrophobicContact CD1-CG2 4.13Å; L210-V214 WeakPolarHBondContact O-CG2 3.45Å; L210-V214 PolarHBondContact O-N 3.35Å; K212-V214 VanDerWaalsContact C-N 3.32Å; V214-C216 VanDerWaalsContact C-N 3.27Å; V214-C216 PolarHBondContact O-N 3.48Å; V214-Q217 PolarHBondContact O-N 3.08Å; V214-A222 HydrophobicContact CG2-CB 3.97Å; V214-A242 WeakPolarHBondContact CG1-O 3.3Å; V214-A242 HydrophobicContact CG2-CB 4.32Å; V214-A246 HydrophobicContact CG1-CB 3.9Å; V214-N249 PolarHBondContact O-ND2 3.36Å; V214-M254 HydrophobicContact CG1-CG 4Å; V214-M254 HydrophobicContact CG2-CG 3.97Å; V214-M254 HydrophobicContact CG2-SD 4.08Å; V214-L258 HydrophobicContact CG1-CD1 4.48Å; V214-L258 HydrophobicContact CG2-CD1 4.39Å
215Q96.1Very high97.1Very high3 Ų327.6 Ų27.61%0.01413%0.13CC..Hα-helixtrans-59.3-39.1178-174.9179.326.500111.8A127 P131 T211 K212 Q217 Y245A127-Q215 PolarHBondContact O-NE2 3.23Å; P131-Q215 HydrophobicContact CB-CG 3.92Å; P131-Q215 WeakPolarHBondContact CB-O 3.45Å; T211-Q215 WeakPolarHBondContact O-CB 3.49Å; T211-Q215 PolarHBondContact O-N 3.4Å; K212-Q215 PolarHBondContact O-N 3.16Å; Q215-Q217 VanDerWaalsContact C-N 3.33Å; Q215-Y245 HydrophobicContact CB-CD1 3.88Å; Q215-Y245 HydrophobicContact CB-CE1 4.17Å; Q215-Y245 HydrophobicContact CB-CG 4.22Å; Q215-Y245 HydrophobicContact CG-CD1 3.71Å; Q215-Y245 HydrophobicContact CG-CE1 3.68Å
216C95.7Very high97.3Very high12 Ų1225 Ų258%0.08112%0.119CC..Hα-helixtrans-82.4-3.7177.1-71.50000114.5P131 A182 K212 A213 V214 E218P131-C216 PolarHBondContact O-SG 2.9Å; A182-C216 WeakPolarHBondContact O-CB 3.26Å; A182-C216 PolarHBondContact O-SG 3.23Å; K212-C216 WeakPolarHBondContact O-CB 3.41Å; K212-C216 PolarHBondContact O-N 2.83Å; A213-C216 CarbonylContact O-C 3.38Å; A213-C216 PolarHBondContact O-N 3.32Å; V214-C216 VanDerWaalsContact C-N 3.27Å; V214-C216 PolarHBondContact O-N 3.48Å; C216-E218 VanDerWaalsContact C-N 3.32Å; C216-E218 HydrophobicContact CB-CG 3.67Å
217Q96.1Very high97.4Very high112 Ų11222.6 Ų22.652%0.52311%0.11SC..THydrogen-bonded Turntrans59.539.3-174.1-59.1169.160.200112.9A213 V214 Q215 D219 N249A213-Q217 PolarHBondContact O-N 3.18Å; V214-Q217 PolarHBondContact O-N 3.08Å; Q215-Q217 VanDerWaalsContact C-N 3.33Å; Q217-D219 PolarHBondContact O-N 3.25Å; Q217-N249 HydrophobicContact CG-CB 4.23Å; Q217-N249 WeakPolarHBondContact CG-ND2 3.31Å
218E97.4Very high97.4Very high42 Ų4226.3 Ų26.320%0.19613%0.127CC..  trans-97.372.7177.6-55.2-65.1174.200109.5R132 G184 A213 C216 E220 C221 A222R132-E218 IonicContact NH1-OE1 3.69Å; R132-E218 IonicContact NH2-OE1 2.66Å; G184-E218 WeakPolarHBondContact CA-OE2 3.36Å; A213-E218 PolarHBondContact O-N 3.18Å; C216-E218 VanDerWaalsContact C-N 3.32Å; C216-E218 HydrophobicContact CB-CG 3.67Å; E218-E220 PolarHBondContact O-N 3.02Å; E218-C221 HydrophobicContact CB-CB 4.35Å; E218-C221 WeakPolarHBondContact O-CB 3.39Å; E218-C221 PolarHBondContact O-N 3.34Å; E218-C221 VanDerWaalsContact O-N 3.12Å; E218-A222 PolarHBondContact O-N 3.12Å; E218-A222 VanDerWaalsContact O-N 3.08Å
219D96Very high97.2Very high66 Ų6629 Ų2935%0.35316%0.156SC..Hα-helixtrans-58.4-42.7-166-61.9-16.1000114Q217 C221 A222 L223 M254Q217-D219 PolarHBondContact O-N 3.25Å; D219-C221 VanDerWaalsContact C-N 3.29Å; D219-C221 PolarHBondContact O-N 3.46Å; D219-A222 PolarHBondContact O-N 2.95Å; D219-L223 WeakPolarHBondContact O-CB 3.29Å; D219-L223 VanDerWaalsContact O-CG 3.3Å; D219-L223 WeakPolarHBondContact O-CG 3.31Å; D219-L223 PolarHBondContact O-N 3Å; D219-M254 HydrophobicContact CB-CE 3.76Å; D219-M254 WeakPolarHBondContact OD1-CE 3.39Å
220E97.3Very high97.1Very high97 Ų9729.3 Ų29.345%0.45316%0.157SC..Hα-helixtrans-59.5-41.9179-170.8-175.3157.200111.2S186 E218 M224S186-E220 VanDerWaalsContact CB-CD 3.45Å; S186-E220 WeakPolarHBondContact CB-OE1 3.21Å; S186-E220 PolarHBondContact OG-OE1 3.21Å; E218-E220 PolarHBondContact O-N 3.02Å; E220-M224 HydrophobicContact CG-CE 4.4Å; E220-M224 WeakPolarHBondContact O-CG 3.22Å; E220-M224 PolarHBondContact O-N 2.87Å; E220-M224 VanDerWaalsContact O-N 3.1Å
221C97.9Very high97Very high1 Ų132.3 Ų32.31%0.00717%0.174CC..Hα-helixtrans-68-41.3176.6-69.50000111.8V189 A213 E218 D219 L225V189-C221 HydrophobicContact CG2-CB 4.37Å; A213-C221 HydrophobicContact CB-CB 4.15Å; E218-C221 HydrophobicContact CB-CB 4.35Å; E218-C221 WeakPolarHBondContact O-CB 3.39Å; E218-C221 PolarHBondContact O-N 3.34Å; E218-C221 VanDerWaalsContact O-N 3.12Å; D219-C221 VanDerWaalsContact C-N 3.29Å; D219-C221 PolarHBondContact O-N 3.46Å; C221-L225 WeakPolarHBondContact O-CB 3.41Å; C221-L225 WeakPolarHBondContact O-CD1 3.32Å; C221-L225 VanDerWaalsContact O-CG 3.22Å; C221-L225 WeakPolarHBondContact O-CG 3.45Å; C221-L225 PolarHBondContact O-N 3.33Å; C221-L225 VanDerWaalsContact O-N 3.11Å
222A98.3Very high97.1Very high0 Ų032.6 Ų32.60%018%0.176CC..Hα-helixtrans-64.3-43.717800000111.7L210 A213 V214 E218 D219 L225 L226 M254L210-A222 HydrophobicContact CD1-CB 4.06Å; A213-A222 HydrophobicContact CB-CB 3.79Å; V214-A222 HydrophobicContact CG2-CB 3.97Å; E218-A222 PolarHBondContact O-N 3.12Å; E218-A222 VanDerWaalsContact O-N 3.08Å; D219-A222 PolarHBondContact O-N 2.95Å; A222-L225 PolarHBondContact O-N 3.11Å; A222-L226 WeakPolarHBondContact O-CG 3.27Å; A222-L226 PolarHBondContact O-N 3.24Å; A222-M254 HydrophobicContact CB-CE 3.61Å; A222-M254 HydrophobicContact CB-SD 3.81Å
223L98.2Very high97.1Very high30 Ų3035.2 Ų35.216%0.15719%0.19CC..Hα-helixtrans-63.1-47.4178-70.2173.8000111.9D219 L225 L226 E227 M254 A257D219-L223 WeakPolarHBondContact O-CB 3.29Å; D219-L223 VanDerWaalsContact O-CG 3.3Å; D219-L223 WeakPolarHBondContact O-CG 3.31Å; D219-L223 PolarHBondContact O-N 3Å; L223-L225 VanDerWaalsContact C-N 3.28Å; L223-L225 PolarHBondContact O-N 2.97Å; L223-L226 PolarHBondContact O-N 3.37Å; L223-L226 VanDerWaalsContact O-N 3.15Å; L223-E227 WeakPolarHBondContact O-CG 3.05Å; L223-E227 PolarHBondContact O-N 2.64Å; L223-M254 HydrophobicContact CG-CE 4.44Å; L223-A257 HydrophobicContact CD2-CB 3.71Å
224M97.9Very high97.1Very high19 Ų1936.6 Ų36.69%0.09420%0.196CC..Hα-helixtrans-58.6-39.9175.3-73.6-172.5-65.400112.3S186 V189 K190 L193 E220 L226 E227 H228S186-M224 VanDerWaalsContact CB-CE 3.48Å; V189-M224 HydrophobicContact CB-CE 3.95Å; V189-M224 HydrophobicContact CG1-CE 3.85Å; K190-M224 HydrophobicContact CB-SD 4.06Å; L193-M224 HydrophobicContact CD1-CB 4.04Å; E220-M224 HydrophobicContact CG-CE 4.4Å; E220-M224 WeakPolarHBondContact O-CG 3.22Å; E220-M224 PolarHBondContact O-N 2.87Å; E220-M224 VanDerWaalsContact O-N 3.1Å; M224-L226 VanDerWaalsContact C-N 3.35Å; M224-E227 PolarHBondContact O-N 3.11Å; M224-H228 PolarHBondContact O-CD2 3.09Å; M224-H228 VanDerWaalsContact O-CD2 3.26Å; M224-H228 PolarHBondContact O-N 2.88Å; M224-H228 VanDerWaalsContact O-N 3.15Å
225L98Very high97.1Very high0 Ų039.7 Ų39.70%022%0.217CC..Hα-helixtrans-64.6-39.5177.7-75.1168.9000112.3L177 V189 L193 L199 A209 L210 A213 C221 A222 L223 H228 G229 T230L177-L225 HydrophobicContact CD1-CD2 4.14Å; L177-L225 HydrophobicContact CD2-CD2 3.9Å; L177-L225 HydrophobicContact CG-CD2 4.24Å; V189-L225 HydrophobicContact CG1-CG 4.48Å; L193-L225 HydrophobicContact CD1-CD2 4.48Å; L193-L225 HydrophobicContact CD2-CD2 4.05Å; L199-L225 HydrophobicContact CD2-CD2 4.48Å; A209-L225 HydrophobicContact CB-CD1 4.15Å; L210-L225 HydrophobicContact CB-CB 4.47Å; L210-L225 HydrophobicContact CB-CD1 4.15Å; L210-L225 HydrophobicContact CD1-CB 4.28Å; A213-L225 HydrophobicContact CB-CD1 4.35Å; C221-L225 WeakPolarHBondContact O-CB 3.41Å; C221-L225 WeakPolarHBondContact O-CD1 3.32Å; C221-L225 VanDerWaalsContact O-CG 3.22Å; C221-L225 WeakPolarHBondContact O-CG 3.45Å; C221-L225 PolarHBondContact O-N 3.33Å; C221-L225 VanDerWaalsContact O-N 3.11Å; A222-L225 PolarHBondContact O-N 3.11Å; L223-L225 VanDerWaalsContact C-N 3.28Å; L223-L225 PolarHBondContact O-N 2.97Å; L225-H228 PolarHBondContact O-N 3.41Å; L225-G229 PolarHBondContact O-N 3.2Å; L225-T230 VanDerWaalsContact O-CB 3.25Å; L225-T230 WeakPolarHBondContact O-CB 3.46Å; L225-T230 PolarHBondContact O-N 3.23Å; L225-T230 VanDerWaalsContact O-N 3.11Å; L225-T230 PolarHBondContact O-OG1 2.99Å
226L98Very high97.1Very high2 Ų239.9 Ų39.91%0.0122%0.218CC..Hα-helixtrans-67.2-44.1176.7-70.1170.1000111.7L210 A222 L223 M224 H228 G229 P232 A257 L258 Y261L210-L226 HydrophobicContact CD1-CD1 4.4Å; L210-L226 HydrophobicContact CD1-CD2 4.03Å; L210-L226 HydrophobicContact CD1-CG 3.87Å; L210-L226 HydrophobicContact CD2-CD2 3.6Å; L210-L226 HydrophobicContact CD2-CG 4.36Å; L210-L226 HydrophobicContact CG-CD2 4.48Å; A222-L226 WeakPolarHBondContact O-CG 3.27Å; A222-L226 PolarHBondContact O-N 3.24Å; L223-L226 PolarHBondContact O-N 3.37Å; L223-L226 VanDerWaalsContact O-N 3.15Å; M224-L226 VanDerWaalsContact C-N 3.35Å; L226-H228 PolarHBondContact O-N 3.37Å; L226-G229 PolarHBondContact O-N 3.11Å; L226-P232 HydrophobicContact CD2-CB 4.28Å; L226-A257 HydrophobicContact CD1-CB 4.39Å; L226-L258 HydrophobicContact CD1-CD2 4Å; L226-L258 HydrophobicContact CD1-CG 4.48Å; L226-L258 HydrophobicContact CD2-CD2 4.02Å; L226-Y261 HydrophobicContact CB-CD1 4.07Å; L226-Y261 HydrophobicContact CB-CD2 3.67Å; L226-Y261 HydrophobicContact CB-CE1 4.29Å; L226-Y261 HydrophobicContact CB-CE2 3.9Å; L226-Y261 HydrophobicContact CB-CG 3.77Å; L226-Y261 HydrophobicContact CD1-CD2 3.95Å; L226-Y261 HydrophobicContact CD1-CG 4.49Å; L226-Y261 HydrophobicContact CD2-CG 4.25Å; L226-Y261 HydrophobicContact CG-CD2 4.25Å; L226-Y261 HydrophobicContact CG-CG 4.39Å; L226-Y261 WeakPolarHBondContact O-CE1 3.47Å
227E97Very high97.1Very high71 Ų7142.2 Ų42.233%0.33223%0.227SC..Hα-helixtrans-58.1-32.4175.7-74.6171.4178.900112.5L223 M224 G229 Y261L223-E227 WeakPolarHBondContact O-CG 3.05Å; L223-E227 PolarHBondContact O-N 2.64Å; M224-E227 PolarHBondContact O-N 3.11Å; E227-G229 VanDerWaalsContact C-N 3.31Å; E227-G229 PolarHBondContact O-N 3.2Å; E227-Y261 WeakPolarHBondContact CG-OH 3.45Å
228H96.7Very high97Very high92 Ų9238.8 Ų38.843%0.42621%0.21SC..THydrogen-bonded Turntrans-85.76.8176.3-82.7-95.7000114.6L193 L199 M224 L225 L226L193-H228 HydrophobicContact CD1-CB 4.38Å; L193-H228 HydrophobicContact CD2-CB 4.17Å; L199-H228 HydrophobicContact CD1-CB 4.16Å; L199-H228 WeakPolarHBondContact CD1-O 3.47Å; M224-H228 PolarHBondContact O-CD2 3.09Å; M224-H228 VanDerWaalsContact O-CD2 3.26Å; M224-H228 PolarHBondContact O-N 2.88Å; M224-H228 VanDerWaalsContact O-N 3.15Å; L225-H228 PolarHBondContact O-N 3.41Å; L226-H228 PolarHBondContact O-N 3.37Å
229G93.8Very high96.9Very high58 Ų5837.3 Ų37.360%0.59821%0.206SC*.THydrogen-bonded Turntrans82.930.2173.100000114.9L225 L226 E227L225-G229 PolarHBondContact O-N 3.2Å; L226-G229 PolarHBondContact O-N 3.11Å; E227-G229 VanDerWaalsContact C-N 3.31Å; E227-G229 PolarHBondContact O-N 3.2Å
230T95.6Very high96.9Very high6 Ų634.2 Ų34.24%0.03719%0.19CC..  trans-64.8139.7169.4-54.50000110.1L199 N200 L210 L225 P232L199-T230 HydrophobicContact CB-CG2 4.32Å; N200-T230 WeakPolarHBondContact OD1-CG2 3.38Å; L210-T230 HydrophobicContact CB-CG2 3.68Å; L210-T230 HydrophobicContact CD2-CG2 3.85Å; L210-T230 HydrophobicContact CG-CG2 4.41Å; L225-T230 VanDerWaalsContact O-CB 3.25Å; L225-T230 WeakPolarHBondContact O-CB 3.46Å; L225-T230 PolarHBondContact O-N 3.23Å; L225-T230 VanDerWaalsContact O-N 3.11Å; L225-T230 PolarHBondContact O-OG1 2.99Å; T230-P232 VanDerWaalsContact O-CD 3.28Å; T230-P232 WeakPolarHBondContact O-CD 3.49Å
231D97.3Very high97Very high64 Ų6429.8 Ų29.834%0.34217%0.169SC..  trans-78114.8176.91801.6000110.6N200 N233 I234N200-D231 PolarHBondContact OD1-N 3.47Å; D231-N233 VanDerWaalsContact C-N 3.25Å; D231-N233 PolarHBondContact O-N 2.69Å; D231-N233 WeakPolarHBondContact OD1-CB 3.42Å; D231-N233 PolarHBondContact OD1-N 3.26Å; D231-I234 HydrophobicContact CB-CD1 3.89Å; D231-I234 HydrophobicContact CB-CG1 4Å
232P98Very high97Very high7 Ų729.8 Ų29.85%0.04517%0.169CC..THydrogen-bonded Turntrans-76.3-10.4-179.833.4-36.7000113.9L210 L226 T230 L258 A263L210-P232 HydrophobicContact CD2-CB 4.04Å; L226-P232 HydrophobicContact CD2-CB 4.28Å; T230-P232 VanDerWaalsContact O-CD 3.28Å; T230-P232 WeakPolarHBondContact O-CD 3.49Å; P232-L258 HydrophobicContact CB-CD2 3.96Å; P232-A263 HydrophobicContact CB-CB 3.99Å; P232-A263 HydrophobicContact CG-CB 4Å
233N98.3Very high97Very high55 Ų5529.8 Ų29.829%0.29417%0.169SC..THydrogen-bonded Turntrans-92.6-2.1-172.5-63.4-50.5000113.9D231 P235 G262 A263 D264D231-N233 VanDerWaalsContact C-N 3.25Å; D231-N233 PolarHBondContact O-N 2.69Å; D231-N233 WeakPolarHBondContact OD1-CB 3.42Å; D231-N233 PolarHBondContact OD1-N 3.26Å; N233-P235 WeakPolarHBondContact O-CD 3.21Å; N233-G262 PolarHBondContact ND2-O 3.46Å; N233-A263 WeakPolarHBondContact OD1-CA 3.47Å; N233-D264 WeakPolarHBondContact OD1-CB 3Å; N233-D264 PolarHBondContact OD1-N 3.39Å
234I97.9Very high97Very high28 Ų2828.3 Ų28.314%0.14416%0.162CC..  trans-67.7116178.8-62.7175.4000109.6N200 L202 T208 D231N200-I234 HydrophobicContact CB-CD1 3.55Å; N200-I234 VanDerWaalsContact CG-CD1 3.47Å; L202-I234 HydrophobicContact CD2-CG2 3.68Å; T208-I234 HydrophobicContact CG2-CB 3.85Å; T208-I234 HydrophobicContact CG2-CD1 3.81Å; T208-I234 HydrophobicContact CG2-CG1 4.41Å; T208-I234 HydrophobicContact CG2-CG2 3.7Å; D231-I234 HydrophobicContact CB-CD1 3.89Å; D231-I234 HydrophobicContact CB-CG1 4Å
235P97.1Very high97Very high69 Ų6927.5 Ų27.545%0.44816%0.158SC..  trans-83146.5-178.933.1-32.6000111.6N233N233-P235 WeakPolarHBondContact O-CD 3.21Å
236D96.1Very high97Very high7 Ų727.5 Ų27.54%0.03716%0.158CC..  trans-76.9-172.8171.778-5.5000113R207 Y238 G239 N240 Y245R207-D236 HydrophobicContact CG-CB 3.54Å; D236-Y238 PolarHBondContact O-N 3.44Å; D236-Y238 VanDerWaalsContact O-N 3.13Å; D236-Y238 VanDerWaalsContact OD1-CA 3.27Å; D236-Y238 WeakPolarHBondContact OD1-CA 3.35Å; D236-Y238 WeakPolarHBondContact OD1-CB 3.46Å; D236-Y238 PolarHBondContact OD1-N 3.04Å; D236-G239 PolarHBondContact O-N 3.15Å; D236-G239 PolarHBondContact OD1-N 3.15Å; D236-N240 PolarHBondContact N-O 3.49Å; D236-N240 PolarHBondContact OD1-N 3.34Å; D236-Y245 PolarHBondContact OD2-OH 3.1Å
237E95.3Very high97Very high60 Ų6027.4 Ų27.428%0.2816%0.157SC..THydrogen-bonded Turntrans-63.1-15.9177.873.4-178.8151.500114.3K205 K206 K270K205-E237 HydrophobicContact CB-CG 4.21Å; K205-E237 VanDerWaalsContact CB-OE1 3.28Å; K205-E237 WeakPolarHBondContact CB-OE1 3.41Å; K205-E237 WeakPolarHBondContact CD-OE1 3.18Å; K205-E237 WeakPolarHBondContact CG-OE1 3.4Å; K205-E237 WeakPolarHBondContact O-CB 3.4Å; K205-E237 PolarHBondContact O-N 3.27Å; K206-E237 HydrophobicContact CG-CB 4.46Å; E237-K270 WeakPolarHBondContact O-CD 3.4Å; E237-K270 WeakPolarHBondContact O-CE 3.27Å; E237-K270 PolarHBondContact O-NZ 2.92Å
238Y93.9Very high97Very high40 Ų4025.6 Ų25.616%0.15715%0.147CC..THydrogen-bonded Turntrans-100.10.8177-56.4-87.6000112.3S126 A127 D236 N240 K270S126-Y238 PolarHBondContact OG-OH 3.48Å; A127-Y238 HydrophobicContact CB-CD1 4.06Å; A127-Y238 HydrophobicContact CB-CD2 3.37Å; A127-Y238 HydrophobicContact CB-CE1 4.26Å; A127-Y238 HydrophobicContact CB-CE2 3.64Å; A127-Y238 HydrophobicContact CB-CG 3.59Å; D236-Y238 PolarHBondContact O-N 3.44Å; D236-Y238 VanDerWaalsContact O-N 3.13Å; D236-Y238 VanDerWaalsContact OD1-CA 3.27Å; D236-Y238 WeakPolarHBondContact OD1-CA 3.35Å; D236-Y238 WeakPolarHBondContact OD1-CB 3.46Å; D236-Y238 PolarHBondContact OD1-N 3.04Å; Y238-N240 VanDerWaalsContact C-N 3.26Å; Y238-N240 WeakPolarHBondContact CB-ND2 3.46Å; Y238-K270 VanDerWaalsContact O-CB 3.26Å; Y238-K270 WeakPolarHBondContact O-CB 3.25Å; Y238-K270 VanDerWaalsContact O-CG 3.3Å; Y238-K270 WeakPolarHBondContact O-CG 3.44Å; Y238-K270 PolarHBondContact O-N 2.86Å
239G95.4Very high96.9Very high11 Ų1122.9 Ų22.911%0.11314%0.136CC..SBendtrans79.65.6-174.500000113.6D236 N269D236-G239 PolarHBondContact O-N 3.15Å; D236-G239 PolarHBondContact OD1-N 3.15Å; G239-N269 WeakPolarHBondContact O-CA 3.26Å
240N97Very high97Very high2 Ų223.9 Ų23.91%0.01113%0.125CC..  trans-80.2128.2179.3-65.3-48.3000109.9D236 Y238 H244 Y245 N269D236-N240 PolarHBondContact N-O 3.49Å; D236-N240 PolarHBondContact OD1-N 3.34Å; Y238-N240 VanDerWaalsContact C-N 3.26Å; Y238-N240 WeakPolarHBondContact CB-ND2 3.46Å; N240-H244 HydrophobicContact CB-CB 3.92Å; N240-Y245 HydrophobicContact CB-CD2 4.36Å; N240-Y245 HydrophobicContact CB-CE2 3.87Å; N240-N269 VanDerWaalsContact OD1-CB 3.3Å; N240-N269 WeakPolarHBondContact OD1-CB 3.48Å; N240-N269 PolarHBondContact OD1-ND2 3.21Å
241T98.3Very high97Very high4 Ų424.9 Ų24.93%0.02513%0.13CC..  trans-87.5173170.563.40000110.8L243 H244 Y245 S267T241-L243 PolarHBondContact O-N 3.06Å; T241-H244 PolarHBondContact N-ND1 2.99Å; T241-H244 WeakPolarHBondContact O-CB 3.42Å; T241-H244 PolarHBondContact O-N 2.93Å; T241-H244 VanDerWaalsContact O-N 3.09Å; T241-H244 PolarHBondContact OG1-ND1 3.32Å; T241-Y245 WeakPolarHBondContact O-CD2 3.44Å; T241-Y245 PolarHBondContact O-N 3.38Å; T241-S267 PolarHBondContact OG1-OG 3.03Å
242A98.2Very high97Very high0 Ų026.4 Ų26.40%013%0.134CC..Hα-helixtrans-55.4-35.3173.600000112L210 V214 H244 Y245 A246 L258L210-A242 HydrophobicContact CD2-CB 4.36Å; L210-A242 HydrophobicContact CG-CB 4.27Å; V214-A242 WeakPolarHBondContact CG1-O 3.3Å; V214-A242 HydrophobicContact CG2-CB 4.32Å; A242-H244 PolarHBondContact O-N 3.32Å; A242-Y245 PolarHBondContact O-N 2.93Å; A242-A246 PolarHBondContact O-N 2.92Å; A242-L258 HydrophobicContact CB-CD1 4.1Å; A242-L258 HydrophobicContact CB-CD2 3.73Å
243L98.6Very high97Very high0 Ų030.2 Ų30.20%015%0.153CC..Hα-helixtrans-63.7-40.9177.5-175.258.4000112T241 Y245 A246 I247 A255 L258 L259 A263 P275T241-L243 PolarHBondContact O-N 3.06Å; L243-Y245 VanDerWaalsContact C-N 3.29Å; L243-Y245 PolarHBondContact O-N 3.33Å; L243-A246 PolarHBondContact O-N 3.2Å; L243-I247 HydrophobicContact CD1-CD1 4.4Å; L243-I247 HydrophobicContact CD1-CG1 4.33Å; L243-I247 HydrophobicContact CG-CG1 4.48Å; L243-I247 VanDerWaalsContact O-CG1 3.3Å; L243-I247 WeakPolarHBondContact O-CG1 3.5Å; L243-I247 PolarHBondContact O-N 3.5Å; L243-A255 HydrophobicContact CD1-CB 3.92Å; L243-L258 HydrophobicContact CB-CD1 4.49Å; L243-L258 HydrophobicContact CD1-CB 4.44Å; L243-L258 HydrophobicContact CD1-CD1 4.48Å; L243-L259 HydrophobicContact CD1-CG 4.45Å; L243-L259 HydrophobicContact CD2-CD2 3.72Å; L243-L259 HydrophobicContact CD2-CG 4.44Å; L243-A263 HydrophobicContact CB-CB 4.35Å; L243-A263 HydrophobicContact CD2-CB 4.4Å; L243-P275 HydrophobicContact CD2-CB 4.06Å; L243-P275 HydrophobicContact CD2-CG 3.68Å; L243-P275 HydrophobicContact CG-CB 4.1Å; L243-P275 HydrophobicContact CG-CG 3.94Å
244H98.3Very high97Very high0 Ų027.8 Ų27.80%014%0.14CC..Hα-helixtrans-57.3-43.3175.7-7180.9000111.8N240 T241 A242 I247 Y248 S267 L273 L278N240-H244 HydrophobicContact CB-CB 3.92Å; T241-H244 PolarHBondContact N-ND1 2.99Å; T241-H244 WeakPolarHBondContact O-CB 3.42Å; T241-H244 PolarHBondContact O-N 2.93Å; T241-H244 VanDerWaalsContact O-N 3.09Å; T241-H244 PolarHBondContact OG1-ND1 3.32Å; A242-H244 PolarHBondContact O-N 3.32Å; H244-I247 PolarHBondContact O-N 3.49Å; H244-Y248 WeakPolarHBondContact O-CB 3.32Å; H244-Y248 PolarHBondContact O-N 3.47Å; H244-S267 PolarHBondContact CE1-O 2.86Å; H244-S267 VanDerWaalsContact CE1-O 3.22Å; H244-S267 PolarHBondContact CE1-OG 3.16Å; H244-S267 PolarHBondContact NE2-O 3Å; H244-L273 PolarHBondContact NE2-O 2.9Å; H244-L278 HydrophobicContact CB-CD2 3.87Å; H244-L278 VanDerWaalsContact O-CD2 3.31Å; H244-L278 WeakPolarHBondContact O-CD2 3.5Å
245Y97.9Very high97Very high2 Ų226.5 Ų26.51%0.00813%0.134CC..Hα-helixtrans-65.8-41.7177.2-77.4-73.4000113A127 F128 T211 Q215 D236 N240 T241 A242 L243 I247 Y248 N249A127-Y245 WeakPolarHBondContact O-CE1 3.3Å; A127-Y245 PolarHBondContact O-OH 3.3Å; F128-Y245 AromaticContact CD1-CD1 3.62Å; F128-Y245 HydrophobicContact CD1-CD1 3.62Å; F128-Y245 AromaticContact CD1-CE1 3.58Å; F128-Y245 HydrophobicContact CD1-CE1 3.58Å; F128-Y245 AromaticContact CE1-CD1 3.91Å; F128-Y245 HydrophobicContact CE1-CD1 3.91Å; F128-Y245 AromaticContact CE1-CE1 3.96Å; F128-Y245 HydrophobicContact CE1-CE1 3.96Å; F128-Y245 HydrophobicContact CE1-CG 4.46Å; F128-Y245 HydrophobicContact CG-CE1 4.45Å; T211-Y245 HydrophobicContact CG2-CD2 3.51Å; T211-Y245 HydrophobicContact CG2-CE2 3.4Å; Q215-Y245 HydrophobicContact CB-CD1 3.88Å; Q215-Y245 HydrophobicContact CB-CE1 4.17Å; Q215-Y245 HydrophobicContact CB-CG 4.22Å; Q215-Y245 HydrophobicContact CG-CD1 3.71Å; Q215-Y245 HydrophobicContact CG-CE1 3.68Å; D236-Y245 PolarHBondContact OD2-OH 3.1Å; N240-Y245 HydrophobicContact CB-CD2 4.36Å; N240-Y245 HydrophobicContact CB-CE2 3.87Å; T241-Y245 WeakPolarHBondContact O-CD2 3.44Å; T241-Y245 PolarHBondContact O-N 3.38Å; A242-Y245 PolarHBondContact O-N 2.93Å; L243-Y245 VanDerWaalsContact C-N 3.29Å; L243-Y245 PolarHBondContact O-N 3.33Å; Y245-I247 VanDerWaalsContact C-N 3.31Å; Y245-I247 PolarHBondContact O-N 2.97Å; Y245-Y248 PolarHBondContact O-N 2.92Å; Y245-N249 WeakPolarHBondContact O-CB 3.32Å; Y245-N249 PolarHBondContact O-N 3.11Å; Y245-N249 PolarHBondContact O-ND2 3.45Å
246A98.2Very high97.1Very high0 Ų024.5 Ų24.50%012%0.118CC..Hα-helixtrans-61.1-41.5175.800000111.6V214 A242 L243 N249 E250 D251 M254 A255 L258V214-A246 HydrophobicContact CG1-CB 3.9Å; A242-A246 PolarHBondContact O-N 2.92Å; L243-A246 PolarHBondContact O-N 3.2Å; A246-N249 PolarHBondContact O-N 2.85Å; A246-E250 PolarHBondContact O-N 3.33Å; A246-D251 PolarHBondContact O-N 3.33Å; A246-M254 HydrophobicContact CB-CB 4.24Å; A246-M254 HydrophobicContact CB-CG 4.14Å; A246-A255 HydrophobicContact CB-CB 4.16Å; A246-L258 HydrophobicContact CB-CD1 3.76Å
247I97.9Very high97.2Very high0 Ų024.3 Ų24.30%012%0.117CC..Hα-helixtrans-65.5-45.9175.9-62.3-53.4000111.6L243 H244 Y245 N249 E250 A255 P275 G279 V287 L291L243-I247 HydrophobicContact CD1-CD1 4.4Å; L243-I247 HydrophobicContact CD1-CG1 4.33Å; L243-I247 HydrophobicContact CG-CG1 4.48Å; L243-I247 VanDerWaalsContact O-CG1 3.3Å; L243-I247 WeakPolarHBondContact O-CG1 3.5Å; L243-I247 PolarHBondContact O-N 3.5Å; H244-I247 PolarHBondContact O-N 3.49Å; Y245-I247 VanDerWaalsContact C-N 3.31Å; Y245-I247 PolarHBondContact O-N 2.97Å; I247-N249 VanDerWaalsContact C-N 3.25Å; I247-N249 PolarHBondContact O-N 3.44Å; I247-E250 PolarHBondContact O-N 3.44Å; I247-A255 HydrophobicContact CD1-CB 3.97Å; I247-P275 HydrophobicContact CG1-CB 4.09Å; I247-P275 WeakPolarHBondContact CG2-O 3.39Å; I247-G279 VanDerWaalsContact CG2-CA 3.49Å; I247-V287 HydrophobicContact CD1-CB 3.78Å; I247-V287 HydrophobicContact CD1-CG1 4.31Å; I247-V287 HydrophobicContact CD1-CG2 4.23Å; I247-V287 HydrophobicContact CG2-CG2 3.86Å; I247-L291 HydrophobicContact CD1-CD1 3.65Å; I247-L291 HydrophobicContact CD1-CD2 4.13Å; I247-L291 HydrophobicContact CD1-CG 3.98Å; I247-L291 HydrophobicContact CG1-CD1 4.1Å
248Y96.3Very high97.3Very high32 Ų3221.5 Ų21.513%0.12510%0.104CC..Hα-helixtrans-57.1-41.3177.3-176.8-87.9000112.1F128 M129 H244 Y245 E250 E282 K284F128-Y248 HydrophobicContact CB-CD1 3.71Å; F128-Y248 HydrophobicContact CB-CD2 3.93Å; F128-Y248 HydrophobicContact CB-CE1 3.43Å; F128-Y248 VanDerWaalsContact CB-CE1 3.43Å; F128-Y248 HydrophobicContact CB-CE2 3.66Å; F128-Y248 HydrophobicContact CB-CG 3.96Å; F128-Y248 VanDerWaalsContact CB-CZ 3.4Å; F128-Y248 AromaticContact CD1-CD1 3.79Å; F128-Y248 HydrophobicContact CD1-CD1 3.79Å; F128-Y248 AromaticContact CD1-CD2 3.61Å; F128-Y248 HydrophobicContact CD1-CD2 3.61Å; F128-Y248 HydrophobicContact CD1-CE1 4.39Å; F128-Y248 HydrophobicContact CD1-CE2 4.23Å; F128-Y248 AromaticContact CD1-CG 3.36Å; F128-Y248 HydrophobicContact CD1-CG 3.36Å; F128-Y248 AromaticContact CD2-CD2 3.73Å; F128-Y248 HydrophobicContact CD2-CD2 3.73Å; F128-Y248 AromaticContact CD2-CE2 3.77Å; F128-Y248 HydrophobicContact CD2-CE2 3.77Å; F128-Y248 HydrophobicContact CD2-CG 4.34Å; F128-Y248 AromaticContact CE1-CD2 4Å; F128-Y248 HydrophobicContact CE1-CD2 4Å; F128-Y248 AromaticContact CE1-CG 3.89Å; F128-Y248 HydrophobicContact CE1-CG 3.89Å; F128-Y248 HydrophobicContact CE2-CD2 4.1Å; F128-Y248 HydrophobicContact CE2-CE2 4.48Å; F128-Y248 AromaticContact CG-CD1 3.93Å; F128-Y248 HydrophobicContact CG-CD1 3.93Å; F128-Y248 AromaticContact CG-CD2 3.48Å; F128-Y248 HydrophobicContact CG-CD2 3.48Å; F128-Y248 VanDerWaalsContact CG-CD2 3.48Å; F128-Y248 HydrophobicContact CG-CE1 4.07Å; F128-Y248 AromaticContact CG-CE2 3.63Å; F128-Y248 HydrophobicContact CG-CE2 3.63Å; F128-Y248 AromaticContact CG-CG 3.64Å; F128-Y248 HydrophobicContact CG-CG 3.64Å; F128-Y248 AromaticContact CG-CZ 3.93Å; F128-Y248 HydrophobicContact CZ-CD2 4.23Å; M129-Y248 WeakPolarHBondContact CE-OH 3.48Å; H244-Y248 WeakPolarHBondContact O-CB 3.32Å; H244-Y248 PolarHBondContact O-N 3.47Å; Y245-Y248 PolarHBondContact O-N 2.92Å; Y248-E250 PolarHBondContact O-N 3.3Å; Y248-E282 HydrophobicContact CD2-CG 3.84Å; Y248-E282 HydrophobicContact CE2-CG 4.08Å; Y248-K284 WeakPolarHBondContact O-CE 3.48Å; Y248-K284 PolarHBondContact O-NZ 3.28Å
249N94.9Very high97.5Very high36 Ų3621.3 Ų21.319%0.19311%0.106CC..THydrogen-bonded Turntrans-73.6-4.3177.5-71.1-20.6000114V214 Q217 Y245 A246 I247 D251V214-N249 PolarHBondContact O-ND2 3.36Å; Q217-N249 HydrophobicContact CG-CB 4.23Å; Q217-N249 WeakPolarHBondContact CG-ND2 3.31Å; Y245-N249 WeakPolarHBondContact O-CB 3.32Å; Y245-N249 PolarHBondContact O-N 3.11Å; Y245-N249 PolarHBondContact O-ND2 3.45Å; A246-N249 PolarHBondContact O-N 2.85Å; I247-N249 VanDerWaalsContact C-N 3.25Å; I247-N249 PolarHBondContact O-N 3.44Å; N249-D251 HydrophobicContact CB-CB 4.42Å; N249-D251 PolarHBondContact O-N 2.81Å
250E95.8Very high97.7Very high78 Ų7825.9 Ų25.936%0.36413%0.127SC..THydrogen-bonded Turntrans58.624.5-170.4-155.2166-168.200113.7A246 I247 Y248 K252 K284 Q286 V287A246-E250 PolarHBondContact O-N 3.33Å; I247-E250 PolarHBondContact O-N 3.44Å; Y248-E250 PolarHBondContact O-N 3.3Å; E250-K252 PolarHBondContact O-N 2.95Å; E250-K252 VanDerWaalsContact O-N 3.14Å; E250-K284 HydrophobicContact CB-CD 4.13Å; E250-K284 HydrophobicContact CG-CB 4.16Å; E250-K284 HydrophobicContact CG-CD 4.39Å; E250-Q286 HydrophobicContact CG-CB 4.34Å; E250-Q286 PolarHBondContact OE1-N 2.97Å; E250-V287 HydrophobicContact CG-CG1 4.26Å; E250-V287 HydrophobicContact CG-CG2 4.43Å
251D96.8Very high97.7Very high27 Ų2729.3 Ų29.314%0.14414%0.14CC..  trans-87.189-179-169.8-14000111.4A246 N249 L253 M254 A255A246-D251 PolarHBondContact O-N 3.33Å; N249-D251 HydrophobicContact CB-CB 4.42Å; N249-D251 PolarHBondContact O-N 2.81Å; D251-L253 VanDerWaalsContact C-N 3.29Å; D251-L253 PolarHBondContact O-N 3.14Å; D251-L253 PolarHBondContact OD1-N 3.31Å; D251-M254 HydrophobicContact CB-CB 4.08Å; D251-M254 VanDerWaalsContact CG-CB 3.4Å; D251-M254 PolarHBondContact OD1-N 2.82Å; D251-M254 VanDerWaalsContact OD2-CB 3.23Å; D251-M254 WeakPolarHBondContact OD2-CB 3.45Å; D251-A255 VanDerWaalsContact O-CB 3.31Å; D251-A255 WeakPolarHBondContact O-CB 3.13Å; D251-A255 PolarHBondContact O-N 3.1Å
252K97.4Very high97.7Very high96 Ų9631.3 Ų31.342%0.41716%0.162SC..Hα-helixtrans-62.4-33.3176.6-177.7-175.8169.1-166.60113.1E250 K256 V287 F290E250-K252 PolarHBondContact O-N 2.95Å; E250-K252 VanDerWaalsContact O-N 3.14Å; K252-K256 WeakPolarHBondContact O-CB 3.45Å; K252-K256 PolarHBondContact O-N 3.06Å; K252-V287 HydrophobicContact CB-CG1 4.11Å; K252-F290 HydrophobicContact CD-CB 4.16Å; K252-F290 HydrophobicContact CD-CD2 4.46Å; K252-F290 HydrophobicContact CD-CG 4.4Å; K252-F290 HydrophobicContact CG-CB 4Å; K252-F290 HydrophobicContact CG-CD1 4.32Å; K252-F290 HydrophobicContact CG-CD2 4.11Å; K252-F290 HydrophobicContact CG-CG 3.87Å
253L97.3Very high97.7Very high87 Ų8731.8 Ų31.846%0.45517%0.166SC..Hα-helixtrans-73.2-45.2-176.4-66.2178.8000109.9D251 K256 A257 V415D251-L253 VanDerWaalsContact C-N 3.29Å; D251-L253 PolarHBondContact O-N 3.14Å; D251-L253 PolarHBondContact OD1-N 3.31Å; L253-K256 WeakPolarHBondContact O-CB 3.5Å; L253-K256 PolarHBondContact O-N 3.27Å; L253-A257 PolarHBondContact O-N 2.8Å; L253-V415 HydrophobicContact CD2-CG2 3.83Å
254M98.4Very high97.7Very high5 Ų535.4 Ų35.43%0.02519%0.185CC..Hα-helixtrans-64.9-41.9174.3-171.353.959.800111.8V214 D219 A222 L223 A246 D251 K256 A257 L258V214-M254 HydrophobicContact CG1-CG 4Å; V214-M254 HydrophobicContact CG2-CG 3.97Å; V214-M254 HydrophobicContact CG2-SD 4.08Å; D219-M254 HydrophobicContact CB-CE 3.76Å; D219-M254 WeakPolarHBondContact OD1-CE 3.39Å; A222-M254 HydrophobicContact CB-CE 3.61Å; A222-M254 HydrophobicContact CB-SD 3.81Å; L223-M254 HydrophobicContact CG-CE 4.44Å; A246-M254 HydrophobicContact CB-CB 4.24Å; A246-M254 HydrophobicContact CB-CG 4.14Å; D251-M254 HydrophobicContact CB-CB 4.08Å; D251-M254 VanDerWaalsContact CG-CB 3.4Å; D251-M254 PolarHBondContact OD1-N 2.82Å; D251-M254 VanDerWaalsContact OD2-CB 3.23Å; D251-M254 WeakPolarHBondContact OD2-CB 3.45Å; M254-K256 VanDerWaalsContact C-N 3.27Å; M254-K256 PolarHBondContact O-N 2.63Å; M254-A257 PolarHBondContact O-N 2.99Å; M254-A257 VanDerWaalsContact O-N 3.14Å; M254-A257 HydrophobicContact SD-CB 4.49Å; M254-L258 HydrophobicContact CG-CD1 4.03Å; M254-L258 HydrophobicContact CG-CG 4.38Å; M254-L258 WeakPolarHBondContact O-CB 3.43Å; M254-L258 WeakPolarHBondContact O-CG 3.38Å; M254-L258 PolarHBondContact O-N 2.78Å; M254-L258 HydrophobicContact SD-CG 4.35Å
255A98.4Very high97.7Very high0 Ų036.9 Ų36.90%019%0.192CC..Hα-helixtrans-58.4-40173.600000111.9L243 A246 I247 D251 L259 F290L243-A255 HydrophobicContact CD1-CB 3.92Å; A246-A255 HydrophobicContact CB-CB 4.16Å; I247-A255 HydrophobicContact CD1-CB 3.97Å; D251-A255 VanDerWaalsContact O-CB 3.31Å; D251-A255 WeakPolarHBondContact O-CB 3.13Å; D251-A255 PolarHBondContact O-N 3.1Å; A255-L259 WeakPolarHBondContact O-CG 3.48Å; A255-L259 PolarHBondContact O-N 3.13Å; A255-L259 VanDerWaalsContact O-N 3.14Å; A255-F290 HydrophobicContact CB-CD1 4.37Å; A255-F290 HydrophobicContact CB-CE1 3.99Å
256K98.3Very high97.7Very high28 Ų2839.4 Ų39.412%0.12220%0.204CC..Hα-helixtrans-63.9-44.6174.2179.4178.3168.1-179.80112.1K252 L253 M254 L260 F290 D412 V415K252-K256 WeakPolarHBondContact O-CB 3.45Å; K252-K256 PolarHBondContact O-N 3.06Å; L253-K256 WeakPolarHBondContact O-CB 3.5Å; L253-K256 PolarHBondContact O-N 3.27Å; M254-K256 VanDerWaalsContact C-N 3.27Å; M254-K256 PolarHBondContact O-N 2.63Å; K256-L260 PolarHBondContact O-N 3.27Å; K256-L260 VanDerWaalsContact O-N 3.12Å; K256-F290 HydrophobicContact CB-CE1 4.5Å; K256-F290 HydrophobicContact CB-CE2 4.13Å; K256-F290 HydrophobicContact CB-CZ 3.71Å; K256-F290 HydrophobicContact CG-CE2 4.45Å; K256-F290 HydrophobicContact CG-CZ 4.27Å; K256-D412 VanDerWaalsContact NZ-CA 3.27Å; K256-D412 PolarHBondContact NZ-O 2.9Å; K256-D412 IonicContact NZ-OD1 3.95Å; K256-D412 PolarHBondContact NZ-OD1 2.94Å; K256-V415 HydrophobicContact CD-CB 4.44Å; K256-V415 HydrophobicContact CD-CG2 4.04Å
257A98.3Very high97.6Very high3 Ų340.1 Ų40.13%0.02521%0.209CC..Hα-helixtrans-61.9-48.6177.700000111.1L223 L226 L253 M254 L259 L260 Y261L223-A257 HydrophobicContact CD2-CB 3.71Å; L226-A257 HydrophobicContact CD1-CB 4.39Å; L253-A257 PolarHBondContact O-N 2.8Å; M254-A257 PolarHBondContact O-N 2.99Å; M254-A257 VanDerWaalsContact O-N 3.14Å; M254-A257 HydrophobicContact SD-CB 4.49Å; A257-L259 VanDerWaalsContact C-N 3.34Å; A257-L259 PolarHBondContact O-N 2.94Å; A257-L260 WeakPolarHBondContact O-CB 3.23Å; A257-L260 PolarHBondContact O-N 3.21Å; A257-Y261 VanDerWaalsContact O-CD2 3.29Å; A257-Y261 WeakPolarHBondContact O-CD2 3.4Å; A257-Y261 PolarHBondContact O-N 2.91Å
258L98.6Very high97.5Very high0 Ų046 Ų460%024%0.235CC..Hα-helixtrans-56.2-45.8178.7-72.1166.7000112.4L210 V214 L226 P232 A242 L243 A246 M254 L260 Y261 G262 A263L210-L258 HydrophobicContact CD2-CD2 4.36Å; V214-L258 HydrophobicContact CG1-CD1 4.48Å; V214-L258 HydrophobicContact CG2-CD1 4.39Å; L226-L258 HydrophobicContact CD1-CD2 4Å; L226-L258 HydrophobicContact CD1-CG 4.48Å; L226-L258 HydrophobicContact CD2-CD2 4.02Å; P232-L258 HydrophobicContact CB-CD2 3.96Å; A242-L258 HydrophobicContact CB-CD1 4.1Å; A242-L258 HydrophobicContact CB-CD2 3.73Å; L243-L258 HydrophobicContact CB-CD1 4.49Å; L243-L258 HydrophobicContact CD1-CB 4.44Å; L243-L258 HydrophobicContact CD1-CD1 4.48Å; A246-L258 HydrophobicContact CB-CD1 3.76Å; M254-L258 HydrophobicContact CG-CD1 4.03Å; M254-L258 HydrophobicContact CG-CG 4.38Å; M254-L258 WeakPolarHBondContact O-CB 3.43Å; M254-L258 WeakPolarHBondContact O-CG 3.38Å; M254-L258 PolarHBondContact O-N 2.78Å; M254-L258 HydrophobicContact SD-CG 4.35Å; L258-L260 VanDerWaalsContact C-N 3.31Å; L258-L260 PolarHBondContact O-N 3.04Å; L258-Y261 CarbonylContact O-C 3.58Å; L258-Y261 PolarHBondContact O-N 2.82Å; L258-G262 PolarHBondContact O-N 2.86Å; L258-A263 VanDerWaalsContact C-CB 3.45Å; L258-A263 HydrophobicContact CB-CB 3.87Å; L258-A263 WeakPolarHBondContact O-CB 3.3Å; L258-A263 PolarHBondContact O-N 3.2Å
259L98.3Very high97.4Very high36 Ų3644.8 Ų44.819%0.18823%0.231CC..Hα-helixtrans-63.8-35.3176.4-69.6176.9000112.7L243 A255 A257 Y261 G262 A263 I265 F290 K294L243-L259 HydrophobicContact CD1-CG 4.45Å; L243-L259 HydrophobicContact CD2-CD2 3.72Å; L243-L259 HydrophobicContact CD2-CG 4.44Å; A255-L259 WeakPolarHBondContact O-CG 3.48Å; A255-L259 PolarHBondContact O-N 3.13Å; A255-L259 VanDerWaalsContact O-N 3.14Å; A257-L259 VanDerWaalsContact C-N 3.34Å; A257-L259 PolarHBondContact O-N 2.94Å; L259-Y261 VanDerWaalsContact C-N 3.29Å; L259-Y261 PolarHBondContact O-N 3.5Å; L259-G262 PolarHBondContact O-N 3.45Å; L259-A263 WeakPolarHBondContact CD2-O 3.46Å; L259-I265 HydrophobicContact CD1-CD1 4.21Å; L259-I265 HydrophobicContact CD2-CB 3.81Å; L259-I265 HydrophobicContact CD2-CD1 4.35Å; L259-I265 HydrophobicContact CD2-CG1 4.17Å; L259-F290 HydrophobicContact CD1-CE1 3.77Å; L259-F290 HydrophobicContact CD1-CZ 3.92Å; L259-K294 HydrophobicContact CD1-CB 4.37Å; L259-K294 HydrophobicContact CD1-CG 4.07Å
260L98Very high97.3Very high107 Ų10750.5 Ų50.556%0.5625%0.254SS*.Hα-helixtrans-65.2-35.4175.8-177.763.7000111.9K256 A257 L258 G262 M419K256-L260 PolarHBondContact O-N 3.27Å; K256-L260 VanDerWaalsContact O-N 3.12Å; A257-L260 WeakPolarHBondContact O-CB 3.23Å; A257-L260 PolarHBondContact O-N 3.21Å; L258-L260 VanDerWaalsContact C-N 3.31Å; L258-L260 PolarHBondContact O-N 3.04Å; L260-G262 VanDerWaalsContact C-N 3.26Å; L260-G262 PolarHBondContact O-N 3.23Å; L260-M419 HydrophobicContact CD2-CE 3.51Å; L260-M419 HydrophobicContact CD2-SD 3.71Å
261Y98.1Very high96.9Very high74 Ų7448.2 Ų48.229%0.2924%0.243SC..THydrogen-bonded Turntrans-89.321.6176.4-74.1-81.7000113.4L226 E227 A257 L258 L259 M419L226-Y261 HydrophobicContact CB-CD1 4.07Å; L226-Y261 HydrophobicContact CB-CD2 3.67Å; L226-Y261 HydrophobicContact CB-CE1 4.29Å; L226-Y261 HydrophobicContact CB-CE2 3.9Å; L226-Y261 HydrophobicContact CB-CG 3.77Å; L226-Y261 HydrophobicContact CD1-CD2 3.95Å; L226-Y261 HydrophobicContact CD1-CG 4.49Å; L226-Y261 HydrophobicContact CD2-CG 4.25Å; L226-Y261 HydrophobicContact CG-CD2 4.25Å; L226-Y261 HydrophobicContact CG-CG 4.39Å; L226-Y261 WeakPolarHBondContact O-CE1 3.47Å; E227-Y261 WeakPolarHBondContact CG-OH 3.45Å; A257-Y261 VanDerWaalsContact O-CD2 3.29Å; A257-Y261 WeakPolarHBondContact O-CD2 3.4Å; A257-Y261 PolarHBondContact O-N 2.91Å; L258-Y261 CarbonylContact O-C 3.58Å; L258-Y261 PolarHBondContact O-N 2.82Å; L259-Y261 VanDerWaalsContact C-N 3.29Å; L259-Y261 PolarHBondContact O-N 3.5Å; Y261-M419 HydrophobicContact CE2-CE 4.29Å
262G97.5Very high96.6Very high47 Ų4747.7 Ų47.749%0.48524%0.244SC..THydrogen-bonded Turntrans83.821.517000000115.6N233 L258 L259 L260N233-G262 PolarHBondContact ND2-O 3.46Å; L258-G262 PolarHBondContact O-N 2.86Å; L259-G262 PolarHBondContact O-N 3.45Å; L260-G262 VanDerWaalsContact C-N 3.26Å; L260-G262 PolarHBondContact O-N 3.23Å
263A98.4Very high96.4Very high9 Ų943.5 Ų43.57%0.07423%0.226CC..  trans-64.3136.2169.500000111.5P232 N233 L243 L258 L259 I265P232-A263 HydrophobicContact CB-CB 3.99Å; P232-A263 HydrophobicContact CG-CB 4Å; N233-A263 WeakPolarHBondContact OD1-CA 3.47Å; L243-A263 HydrophobicContact CB-CB 4.35Å; L243-A263 HydrophobicContact CD2-CB 4.4Å; L258-A263 VanDerWaalsContact C-CB 3.45Å; L258-A263 HydrophobicContact CB-CB 3.87Å; L258-A263 WeakPolarHBondContact O-CB 3.3Å; L258-A263 PolarHBondContact O-N 3.2Å; L259-A263 WeakPolarHBondContact CD2-O 3.46Å; A263-I265 PolarHBondContact O-N 3.44Å
264D98.3Very high96.5Very high76 Ų7639.3 Ų39.341%0.40620%0.204SC..  trans-77.9111.4178.7178.213.3000111N233 E266 S267N233-D264 WeakPolarHBondContact OD1-CB 3Å; N233-D264 PolarHBondContact OD1-N 3.39Å; D264-E266 PolarHBondContact O-N 3.13Å; D264-E266 PolarHBondContact OD1-N 3.35Å; D264-S267 PolarHBondContact O-N 3.07Å; D264-S267 PolarHBondContact O-OG 3.48Å; D264-S267 WeakPolarHBondContact OD2-CA 3.48Å; D264-S267 PolarHBondContact OD2-N 3.11Å
265I98.3Very high96.5Very high31 Ų3139.1 Ų39.116%0.15920%0.203CC..THydrogen-bonded Turntrans-66.6-18.5178.5-162169000113.1L259 A263 P275 L291 K294 A296L259-I265 HydrophobicContact CD1-CD1 4.21Å; L259-I265 HydrophobicContact CD2-CB 3.81Å; L259-I265 HydrophobicContact CD2-CD1 4.35Å; L259-I265 HydrophobicContact CD2-CG1 4.17Å; A263-I265 PolarHBondContact O-N 3.44Å; I265-P275 WeakPolarHBondContact O-CD 3.39Å; I265-P275 WeakPolarHBondContact O-CG 3.38Å; I265-L291 HydrophobicContact CD1-CD2 3.86Å; I265-L291 HydrophobicContact CG1-CD2 3.86Å; I265-K294 HydrophobicContact CD1-CB 3.77Å; I265-A296 HydrophobicContact CD1-CB 3.8Å; I265-A296 HydrophobicContact CG1-CB 4.04Å
266E98.1Very high96.4Very high55 Ų5539.1 Ų39.126%0.25720%0.203SC..THydrogen-bonded Turntrans-107.74.8-178.2-59.6-53.2141.300113.6D264 K268 A296 N297D264-E266 PolarHBondContact O-N 3.13Å; D264-E266 PolarHBondContact OD1-N 3.35Å; E266-K268 PolarHBondContact O-N 3.28Å; E266-A296 WeakPolarHBondContact OE1-CA 3.27Å; E266-N297 PolarHBondContact OE1-N 3.37Å; E266-N297 VanDerWaalsContact OE2-CB 3.27Å; E266-N297 WeakPolarHBondContact OE2-CB 3.44Å
267S97.3Very high96.4Very high15 Ų1537.8 Ų37.811%0.10520%0.198CC..  trans-55.2132.5178.153.80000111.2T241 H244 D264 T274 P275T241-S267 PolarHBondContact OG1-OG 3.03Å; H244-S267 PolarHBondContact CE1-O 2.86Å; H244-S267 VanDerWaalsContact CE1-O 3.22Å; H244-S267 PolarHBondContact CE1-OG 3.16Å; H244-S267 PolarHBondContact NE2-O 3Å; D264-S267 PolarHBondContact O-N 3.07Å; D264-S267 PolarHBondContact O-OG 3.48Å; D264-S267 WeakPolarHBondContact OD2-CA 3.48Å; D264-S267 PolarHBondContact OD2-N 3.11Å; S267-T274 WeakPolarHBondContact O-CA 3.38Å; S267-P275 WeakPolarHBondContact O-CD 3.38Å
268K95.7Very high96.2Very high123 Ų12337.7 Ų37.754%0.53520%0.196SC..  trans-104.2130.8179.7-69-170.4-179.2-164.60111.6E266 L273 T274 L301E266-K268 PolarHBondContact O-N 3.28Å; K268-L273 WeakPolarHBondContact CA-O 3.3Å; K268-T274 HydrophobicContact CG-CG2 3.86Å; K268-L301 PolarHBondContact NZ-O 3.27Å
269N94.5Very high96.1Very high7 Ų737.7 Ų37.74%0.03720%0.196CC..  trans-77.3177.9168.974.810.6000112.4G239 N240 H271 G272 L273G239-N269 WeakPolarHBondContact O-CA 3.26Å; N240-N269 VanDerWaalsContact OD1-CB 3.3Å; N240-N269 WeakPolarHBondContact OD1-CB 3.48Å; N240-N269 PolarHBondContact OD1-ND2 3.21Å; N269-H271 PolarHBondContact O-N 3.23Å; N269-H271 VanDerWaalsContact O-N 3.11Å; N269-H271 WeakPolarHBondContact OD1-CA 3.46Å; N269-H271 WeakPolarHBondContact OD1-CB 3.22Å; N269-H271 PolarHBondContact OD1-N 2.92Å; N269-G272 WeakPolarHBondContact O-CA 3.19Å; N269-G272 PolarHBondContact O-N 3.35Å; N269-G272 PolarHBondContact OD1-N 3.08Å; N269-L273 PolarHBondContact N-O 3.09Å; N269-L273 WeakPolarHBondContact OD1-CB 3.43Å; N269-L273 PolarHBondContact OD1-N 3.15Å
270K91.9Very high96Very high157 Ų15736 Ų3668%0.68319%0.187SC*.THydrogen-bonded Turntrans-63.4-17.1-179.4-74.1-175.3175.7-177.80114.4E237 Y238 G272E237-K270 WeakPolarHBondContact O-CD 3.4Å; E237-K270 WeakPolarHBondContact O-CE 3.27Å; E237-K270 PolarHBondContact O-NZ 2.92Å; Y238-K270 VanDerWaalsContact O-CB 3.26Å; Y238-K270 WeakPolarHBondContact O-CB 3.25Å; Y238-K270 VanDerWaalsContact O-CG 3.3Å; Y238-K270 WeakPolarHBondContact O-CG 3.44Å; Y238-K270 PolarHBondContact O-N 2.86Å; K270-G272 VanDerWaalsContact C-N 3.27Å
271H87.1Confident95.8Very high30 Ų3032.5 Ų32.514%0.13917%0.168CC..THydrogen-bonded Turntrans-871.1173.6-56.5-77.8000112.5Y123 N269 L273 R303Y123-H271 HydrophobicContact CD2-CB 4.5Å; N269-H271 PolarHBondContact O-N 3.23Å; N269-H271 VanDerWaalsContact O-N 3.11Å; N269-H271 WeakPolarHBondContact OD1-CA 3.46Å; N269-H271 WeakPolarHBondContact OD1-CB 3.22Å; N269-H271 PolarHBondContact OD1-N 2.92Å; H271-L273 VanDerWaalsContact C-N 3.26Å; H271-L273 HydrophobicContact CB-CD1 4.29Å; H271-L273 HydrophobicContact CB-CG 4.09Å; H271-R303 WeakPolarHBondContact O-CG 3.49Å
272G90.8Very high95.5Very high16 Ų1631 Ų3117%0.16516%0.164CC..SBendtrans75.413.9-176.600000113.4N269 K270N269-G272 WeakPolarHBondContact O-CA 3.19Å; N269-G272 PolarHBondContact O-N 3.35Å; N269-G272 PolarHBondContact OD1-N 3.08Å; K270-G272 VanDerWaalsContact C-N 3.27Å
273L94.3Very high95.3Very high7 Ų733.6 Ų33.64%0.03716%0.163CC..  trans-87128.3179.5-55.7177.9000109.4Y123 H244 K268 N269 H271 L277 L278 D302Y123-L273 HydrophobicContact CD2-CD1 4.32Å; Y123-L273 HydrophobicContact CE2-CD1 3.67Å; H244-L273 PolarHBondContact NE2-O 2.9Å; K268-L273 WeakPolarHBondContact CA-O 3.3Å; N269-L273 PolarHBondContact N-O 3.09Å; N269-L273 WeakPolarHBondContact OD1-CB 3.43Å; N269-L273 PolarHBondContact OD1-N 3.15Å; H271-L273 VanDerWaalsContact C-N 3.26Å; H271-L273 HydrophobicContact CB-CD1 4.29Å; H271-L273 HydrophobicContact CB-CG 4.09Å; L273-L277 HydrophobicContact CB-CB 4.21Å; L273-L277 HydrophobicContact CD2-CB 3.96Å; L273-L278 HydrophobicContact CB-CB 4.46Å; L273-L278 HydrophobicContact CD1-CD1 4.25Å; L273-D302 HydrophobicContact CD2-CB 3.98Å
274T97.8Very high95.1Very high0 Ų035.4 Ų35.40%017%0.17CC..  trans-76.9165.4161.963.20000110S267 K268 L276 L277 L278 A300S267-T274 WeakPolarHBondContact O-CA 3.38Å; K268-T274 HydrophobicContact CG-CG2 3.86Å; T274-L276 PolarHBondContact O-N 2.89Å; T274-L276 VanDerWaalsContact O-N 3.16Å; T274-L277 HydrophobicContact CG2-CD1 4.43Å; T274-L277 PolarHBondContact O-N 3.18Å; T274-L277 WeakPolarHBondContact OG1-CG 3.17Å; T274-L277 PolarHBondContact OG1-N 2.99Å; T274-L278 WeakPolarHBondContact O-CB 3.23Å; T274-L278 PolarHBondContact O-N 3.32Å; T274-A300 HydrophobicContact CG2-CB 4.06Å
275P98Very high94.9Very high0 Ų035.1 Ų35.10%017%0.166CC..Hα-helixtrans-47.5-40.8170-31.933.2000113.5L243 I247 I265 S267 G279 L291L243-P275 HydrophobicContact CD2-CB 4.06Å; L243-P275 HydrophobicContact CD2-CG 3.68Å; L243-P275 HydrophobicContact CG-CB 4.1Å; L243-P275 HydrophobicContact CG-CG 3.94Å; I247-P275 HydrophobicContact CG1-CB 4.09Å; I247-P275 WeakPolarHBondContact CG2-O 3.39Å; I265-P275 WeakPolarHBondContact O-CD 3.39Å; I265-P275 WeakPolarHBondContact O-CG 3.38Å; S267-P275 WeakPolarHBondContact O-CD 3.38Å; P275-G279 PolarHBondContact O-N 3.42Å; P275-L291 HydrophobicContact CB-CD1 4.14Å
276L98Very high94.8Very high1 Ų138.7 Ų38.71%0.00518%0.182CC..Hα-helixtrans-65.7-49.4176.8178.965.4000111.9T274 L278 G279 V280 V288 L291 I292 A296 L298 V308T274-L276 PolarHBondContact O-N 2.89Å; T274-L276 VanDerWaalsContact O-N 3.16Å; L276-L278 VanDerWaalsContact C-N 3.31Å; L276-L278 PolarHBondContact O-N 2.89Å; L276-G279 PolarHBondContact O-N 3.07Å; L276-V280 WeakPolarHBondContact O-CG2 3.47Å; L276-V280 PolarHBondContact O-N 3.08Å; L276-V288 HydrophobicContact CD1-CG1 4.12Å; L276-L291 HydrophobicContact CB-CD1 4.22Å; L276-L291 HydrophobicContact CD1-CB 4.05Å; L276-L291 HydrophobicContact CD1-CD1 4.42Å; L276-I292 HydrophobicContact CD1-CG1 4.17Å; L276-A296 HydrophobicContact CB-CB 4.15Å; L276-A296 HydrophobicContact CD2-CB 4.06Å; L276-L298 HydrophobicContact CD2-CD2 3.71Å; L276-V308 HydrophobicContact CD2-CG1 4.17Å; L276-V308 HydrophobicContact CD2-CG2 3.85Å; L276-V308 HydrophobicContact CG-CG1 4.24Å; L276-V308 HydrophobicContact CG-CG2 4.39Å
277L96.4Very high94.7Very high0 Ų036 Ų360%017%0.17CC..Hα-helixtrans-62-39.5179.3-69.3171.7000111.6L273 T274 V280 H281 A300 D302 V308 L311L273-L277 HydrophobicContact CB-CB 4.21Å; L273-L277 HydrophobicContact CD2-CB 3.96Å; T274-L277 HydrophobicContact CG2-CD1 4.43Å; T274-L277 PolarHBondContact O-N 3.18Å; T274-L277 WeakPolarHBondContact OG1-CG 3.17Å; T274-L277 PolarHBondContact OG1-N 2.99Å; L277-V280 PolarHBondContact O-N 3.12Å; L277-H281 WeakPolarHBondContact O-CB 3.44Å; L277-H281 PolarHBondContact O-N 3.37Å; L277-A300 HydrophobicContact CD1-CB 4.06Å; L277-A300 HydrophobicContact CG-CB 4.4Å; L277-D302 HydrophobicContact CD1-CB 4.27Å; L277-V308 HydrophobicContact CD2-CB 4.23Å; L277-V308 HydrophobicContact CD2-CG2 3.6Å; L277-V308 HydrophobicContact CG-CG2 4.39Å; L277-L311 HydrophobicContact CB-CD2 4.08Å; L277-L311 HydrophobicContact CD2-CD2 3.77Å; L277-L311 WeakPolarHBondContact O-CD2 3.42Å
278L96.1Very high94.7Very high0 Ų035.3 Ų35.30%017%0.165CC..Hα-helixtrans-61.2-47.7173.6179.365.4000111.2Y123 F128 H244 L273 T274 L276 V280 H281 E282Y123-L278 WeakPolarHBondContact OH-CD1 3.48Å; F128-L278 HydrophobicContact CE1-CD2 4.34Å; F128-L278 HydrophobicContact CE2-CD1 4.43Å; F128-L278 HydrophobicContact CZ-CD1 4.22Å; F128-L278 HydrophobicContact CZ-CD2 3.98Å; H244-L278 HydrophobicContact CB-CD2 3.87Å; H244-L278 VanDerWaalsContact O-CD2 3.31Å; H244-L278 WeakPolarHBondContact O-CD2 3.5Å; L273-L278 HydrophobicContact CB-CB 4.46Å; L273-L278 HydrophobicContact CD1-CD1 4.25Å; T274-L278 WeakPolarHBondContact O-CB 3.23Å; T274-L278 PolarHBondContact O-N 3.32Å; L276-L278 VanDerWaalsContact C-N 3.31Å; L276-L278 PolarHBondContact O-N 2.89Å; L278-V280 VanDerWaalsContact C-N 3.26Å; L278-V280 PolarHBondContact O-N 3.04Å; L278-H281 WeakPolarHBondContact O-CB 3.1Å; L278-H281 PolarHBondContact O-N 3.3Å; L278-E282 HydrophobicContact CD1-CG 3.89Å; L278-E282 HydrophobicContact CG-CG 4.38Å; L278-E282 WeakPolarHBondContact O-CB 3.44Å; L278-E282 WeakPolarHBondContact O-CG 3.07Å; L278-E282 PolarHBondContact O-N 3.43Å
279G96.3Very high94.8Very high0 Ų033.9 Ų33.90%016%0.158CC..Hα-helixtrans-60.1-36.4177.700000112.9I247 P275 L276 Q283 K284 V288I247-G279 VanDerWaalsContact CG2-CA 3.49Å; P275-G279 PolarHBondContact O-N 3.42Å; L276-G279 PolarHBondContact O-N 3.07Å; G279-Q283 PolarHBondContact O-N 2.99Å; G279-Q283 VanDerWaalsContact O-N 3.13Å; G279-K284 PolarHBondContact O-N 3.05Å; G279-V288 WeakPolarHBondContact O-CG2 3.22Å
280V95.5Very high95Very high0 Ų034.2 Ų34.20%016%0.159CC..Hα-helixtrans-70.1-45.6174.41720000111.5L276 L277 L278 E282 Q283 V288 V308 L311 A312 I320L276-V280 WeakPolarHBondContact O-CG2 3.47Å; L276-V280 PolarHBondContact O-N 3.08Å; L277-V280 PolarHBondContact O-N 3.12Å; L278-V280 VanDerWaalsContact C-N 3.26Å; L278-V280 PolarHBondContact O-N 3.04Å; V280-E282 VanDerWaalsContact C-N 3.35Å; V280-E282 PolarHBondContact O-N 3.33Å; V280-Q283 PolarHBondContact O-N 3.26Å; V280-V288 HydrophobicContact CG2-CG1 4.08Å; V280-V288 HydrophobicContact CG2-CG2 3.89Å; V280-V308 HydrophobicContact CG2-CG1 3.76Å; V280-L311 HydrophobicContact CB-CD2 4.39Å; V280-L311 HydrophobicContact CG1-CB 4.28Å; V280-L311 HydrophobicContact CG1-CD2 4.25Å; V280-L311 HydrophobicContact CG1-CG 4.09Å; V280-A312 VanDerWaalsContact CG1-CA 3.48Å; V280-A312 HydrophobicContact CG1-CB 3.61Å; V280-I320 HydrophobicContact CG1-CG2 4.24Å; V280-I320 HydrophobicContact CG2-CG2 3.92Å
281H92.8Very high95.2Very high34 Ų3426.7 Ų26.716%0.15713%0.127CC..Hα-helixtrans-56.7-47.8177.9-176.4-94.6000112Y123 L277 L278 Q283 L311Y123-H281 AromaticContact CD1-CE1 3.4Å; Y123-H281 VanDerWaalsContact CD1-CE1 3.4Å; Y123-H281 WeakPolarHBondContact CD1-CE1 3.47Å; Y123-H281 AromaticContact CE1-CE1 3.39Å; Y123-H281 WeakPolarHBondContact CE1-CE1 3.36Å; Y123-H281 AromaticContact CE1-ND1 3.68Å; Y123-H281 AromaticContact CG-CE1 3.85Å; Y123-H281 AromaticContact CZ-CE1 3.86Å; Y123-H281 AromaticContact CZ-ND1 3.8Å; L277-H281 WeakPolarHBondContact O-CB 3.44Å; L277-H281 PolarHBondContact O-N 3.37Å; L278-H281 WeakPolarHBondContact O-CB 3.1Å; L278-H281 PolarHBondContact O-N 3.3Å; H281-Q283 PolarHBondContact O-N 2.98Å; H281-L311 HydrophobicContact CB-CD2 4.38Å
282E92.3Very high95.7Very high42 Ų4226 Ų2620%0.19612%0.124CC..THydrogen-bonded Turntrans-81.92.8179.1-59.8-56.9141.200113.3Y123 Y248 L278 V280 K284Y123-E282 VanDerWaalsContact CE1-OE1 3.23Å; Y123-E282 WeakPolarHBondContact CE1-OE1 3.13Å; Y123-E282 PolarHBondContact OH-OE1 3.31Å; Y248-E282 HydrophobicContact CD2-CG 3.84Å; Y248-E282 HydrophobicContact CE2-CG 4.08Å; L278-E282 HydrophobicContact CD1-CG 3.89Å; L278-E282 HydrophobicContact CG-CG 4.38Å; L278-E282 WeakPolarHBondContact O-CB 3.44Å; L278-E282 WeakPolarHBondContact O-CG 3.07Å; L278-E282 PolarHBondContact O-N 3.43Å; V280-E282 VanDerWaalsContact C-N 3.35Å; V280-E282 PolarHBondContact O-N 3.33Å; E282-K284 VanDerWaalsContact C-N 3.29Å; E282-K284 HydrophobicContact CB-CD 4.27Å; E282-K284 HydrophobicContact CB-CG 3.72Å; E282-K284 WeakPolarHBondContact O-CD 3.43Å; E282-K284 WeakPolarHBondContact O-CE 3.28Å; E282-K284 PolarHBondContact O-N 2.82Å
283Q93.8Very high96Very high102 Ų10232.8 Ų32.848%0.47715%0.149SC..THydrogen-bonded Turntrans57.434177.8-55.2178.154.100114.7G279 V280 H281 Q285 C315 I320G279-Q283 PolarHBondContact O-N 2.99Å; G279-Q283 VanDerWaalsContact O-N 3.13Å; V280-Q283 PolarHBondContact O-N 3.26Å; H281-Q283 PolarHBondContact O-N 2.98Å; Q283-Q285 PolarHBondContact O-N 3.42Å; Q283-Q285 VanDerWaalsContact O-N 3.08Å; Q283-C315 HydrophobicContact CG-CB 4.19Å; Q283-C315 PolarHBondContact NE2-O 3.3Å; Q283-I320 HydrophobicContact CB-CD1 4.48Å
284K93.9Very high96.1Very high47 Ų4737.4 Ų37.420%0.20417%0.169CC..  trans-85.176.6-176.3-52.6-58.2-172.7158.40111.5Y248 E250 G279 E282 Q286 V287 V288Y248-K284 WeakPolarHBondContact O-CE 3.48Å; Y248-K284 PolarHBondContact O-NZ 3.28Å; E250-K284 HydrophobicContact CB-CD 4.13Å; E250-K284 HydrophobicContact CG-CB 4.16Å; E250-K284 HydrophobicContact CG-CD 4.39Å; G279-K284 PolarHBondContact O-N 3.05Å; E282-K284 VanDerWaalsContact C-N 3.29Å; E282-K284 HydrophobicContact CB-CD 4.27Å; E282-K284 HydrophobicContact CB-CG 3.72Å; E282-K284 WeakPolarHBondContact O-CD 3.43Å; E282-K284 WeakPolarHBondContact O-CE 3.28Å; E282-K284 PolarHBondContact O-N 2.82Å; K284-Q286 VanDerWaalsContact C-N 3.3Å; K284-Q286 PolarHBondContact O-N 2.9Å; K284-V287 HydrophobicContact CB-CG2 3.34Å; K284-V287 HydrophobicContact CG-CG2 4.41Å; K284-V287 VanDerWaalsContact O-CG2 3.22Å; K284-V287 WeakPolarHBondContact O-CG2 3.41Å; K284-V287 PolarHBondContact O-N 3.25Å; K284-V288 VanDerWaalsContact O-CG2 3.32Å; K284-V288 WeakPolarHBondContact O-CG2 3.33Å; K284-V288 PolarHBondContact O-N 2.95Å
285Q94.3Very high96Very high71 Ų7146.5 Ų46.533%0.33221%0.208SC..Hα-helixtrans-54.4-40.4-169.8-171.4-175.90.100113.9Q283 K289 I320 L323Q283-Q285 PolarHBondContact O-N 3.42Å; Q283-Q285 VanDerWaalsContact O-N 3.08Å; Q285-K289 WeakPolarHBondContact O-CB 3.01Å; Q285-K289 PolarHBondContact O-N 3.18Å; Q285-I320 HydrophobicContact CB-CG1 4.48Å; Q285-I320 HydrophobicContact CG-CG1 4.5Å; Q285-L323 HydrophobicContact CG-CD1 3.72Å
286Q95.6Very high95.9Very high105 Ų10546.8 Ų46.849%0.49121%0.21SC..Hα-helixtrans-67.8-42.9-174.8-65.1-56.5-39.300112.6E250 K284 F290E250-Q286 HydrophobicContact CG-CB 4.34Å; E250-Q286 PolarHBondContact OE1-N 2.97Å; K284-Q286 VanDerWaalsContact C-N 3.3Å; K284-Q286 PolarHBondContact O-N 2.9Å; Q286-F290 PolarHBondContact O-N 2.92Å; Q286-F290 VanDerWaalsContact O-N 3.11Å
287V96.7Very high95.8Very high0 Ų050.3 Ų50.30%023%0.229CC..Hα-helixtrans-76.8-33178.5-65.50000111.7I247 E250 K252 K284 F290 L291I247-V287 HydrophobicContact CD1-CB 3.78Å; I247-V287 HydrophobicContact CD1-CG1 4.31Å; I247-V287 HydrophobicContact CD1-CG2 4.23Å; I247-V287 HydrophobicContact CG2-CG2 3.86Å; E250-V287 HydrophobicContact CG-CG1 4.26Å; E250-V287 HydrophobicContact CG-CG2 4.43Å; K252-V287 HydrophobicContact CB-CG1 4.11Å; K284-V287 HydrophobicContact CB-CG2 3.34Å; K284-V287 HydrophobicContact CG-CG2 4.41Å; K284-V287 VanDerWaalsContact O-CG2 3.22Å; K284-V287 WeakPolarHBondContact O-CG2 3.41Å; K284-V287 PolarHBondContact O-N 3.25Å; V287-F290 WeakPolarHBondContact O-CB 3.44Å; V287-F290 PolarHBondContact O-N 3.24Å; V287-F290 VanDerWaalsContact O-N 3.17Å; V287-L291 WeakPolarHBondContact O-CG 3.29Å; V287-L291 PolarHBondContact O-N 3.15Å
288V97.5Very high95.7Very high0 Ų051.8 Ų51.80%024%0.237CC..Hα-helixtrans-59.1-50.5170.4169.50000110.5L276 G279 V280 K284 F290 L291 I292 I320L276-V288 HydrophobicContact CD1-CG1 4.12Å; G279-V288 WeakPolarHBondContact O-CG2 3.22Å; V280-V288 HydrophobicContact CG2-CG1 4.08Å; V280-V288 HydrophobicContact CG2-CG2 3.89Å; K284-V288 VanDerWaalsContact O-CG2 3.32Å; K284-V288 WeakPolarHBondContact O-CG2 3.33Å; K284-V288 PolarHBondContact O-N 2.95Å; V288-F290 PolarHBondContact O-N 2.84Å; V288-L291 PolarHBondContact O-N 2.71Å; V288-I292 HydrophobicContact CG1-CD1 3.87Å; V288-I292 HydrophobicContact CG1-CG1 4.44Å; V288-I292 VanDerWaalsContact O-CG1 3.3Å; V288-I292 WeakPolarHBondContact O-CG1 3.25Å; V288-I292 PolarHBondContact O-N 3.41Å; V288-I320 HydrophobicContact CG1-CG2 4.22Å; V288-I320 HydrophobicContact CG2-CD1 4.34Å
289K97.3Very high95.5Very high93 Ų9356.9 Ų56.940%0.40426%0.264SS..Hα-helixtrans-58.6-35.9176.1-174.9170.6-176.2165.80112.2Q285 K293 L323Q285-K289 WeakPolarHBondContact O-CB 3.01Å; Q285-K289 PolarHBondContact O-N 3.18Å; K289-K293 WeakPolarHBondContact O-CG 3.22Å; K289-K293 PolarHBondContact O-N 3.44Å; K289-L323 HydrophobicContact CB-CD1 4.26Å; K289-L323 HydrophobicContact CD-CD2 4.15Å; K289-L323 HydrophobicContact CG-CD2 4.47Å
290F97.9Very high95.2Very high13 Ų1357.1 Ų57.16%0.05727%0.267CS..Hα-helixtrans-67.9-45.9175.7168.6-106.5000112.5K252 A255 K256 L259 Q286 V287 V288 K293 K294K252-F290 HydrophobicContact CD-CB 4.16Å; K252-F290 HydrophobicContact CD-CD2 4.46Å; K252-F290 HydrophobicContact CD-CG 4.4Å; K252-F290 HydrophobicContact CG-CB 4Å; K252-F290 HydrophobicContact CG-CD1 4.32Å; K252-F290 HydrophobicContact CG-CD2 4.11Å; K252-F290 HydrophobicContact CG-CG 3.87Å; A255-F290 HydrophobicContact CB-CD1 4.37Å; A255-F290 HydrophobicContact CB-CE1 3.99Å; K256-F290 HydrophobicContact CB-CE1 4.5Å; K256-F290 HydrophobicContact CB-CE2 4.13Å; K256-F290 HydrophobicContact CB-CZ 3.71Å; K256-F290 HydrophobicContact CG-CE2 4.45Å; K256-F290 HydrophobicContact CG-CZ 4.27Å; L259-F290 HydrophobicContact CD1-CE1 3.77Å; L259-F290 HydrophobicContact CD1-CZ 3.92Å; Q286-F290 PolarHBondContact O-N 2.92Å; Q286-F290 VanDerWaalsContact O-N 3.11Å; V287-F290 WeakPolarHBondContact O-CB 3.44Å; V287-F290 PolarHBondContact O-N 3.24Å; V287-F290 VanDerWaalsContact O-N 3.17Å; V288-F290 PolarHBondContact O-N 2.84Å; F290-K293 WeakPolarHBondContact O-CB 3.44Å; F290-K293 PolarHBondContact O-N 2.83Å; F290-K294 HydrophobicContact CD2-CG 4.37Å; F290-K294 HydrophobicContact CE1-CG 4.29Å; F290-K294 HydrophobicContact CE2-CD 4.42Å; F290-K294 HydrophobicContact CE2-CG 3.84Å; F290-K294 HydrophobicContact CZ-CD 4.46Å; F290-K294 HydrophobicContact CZ-CG 3.79Å; F290-K294 PolarHBondContact O-N 3.26Å
291L97.9Very high95.1Very high0 Ų060.9 Ų60.90%029%0.286CS..Hα-helixtrans-64-40.8178.8-71.2174.8000112.1I247 I265 P275 L276 V287 V288 K293 K294 K295 A296I247-L291 HydrophobicContact CD1-CD1 3.65Å; I247-L291 HydrophobicContact CD1-CD2 4.13Å; I247-L291 HydrophobicContact CD1-CG 3.98Å; I247-L291 HydrophobicContact CG1-CD1 4.1Å; I265-L291 HydrophobicContact CD1-CD2 3.86Å; I265-L291 HydrophobicContact CG1-CD2 3.86Å; P275-L291 HydrophobicContact CB-CD1 4.14Å; L276-L291 HydrophobicContact CB-CD1 4.22Å; L276-L291 HydrophobicContact CD1-CB 4.05Å; L276-L291 HydrophobicContact CD1-CD1 4.42Å; V287-L291 WeakPolarHBondContact O-CG 3.29Å; V287-L291 PolarHBondContact O-N 3.15Å; V288-L291 PolarHBondContact O-N 2.71Å; L291-K293 VanDerWaalsContact C-N 3.32Å; L291-K293 PolarHBondContact O-N 3.06Å; L291-K294 CarbonylContact O-C 3.44Å; L291-K294 WeakPolarHBondContact O-CA 3.37Å; L291-K294 PolarHBondContact O-N 3.42Å; L291-K295 PolarHBondContact O-N 3.16Å; L291-A296 HydrophobicContact CB-CB 4.09Å; L291-A296 WeakPolarHBondContact O-CB 3.04Å; L291-A296 PolarHBondContact O-N 2.96Å; L291-A296 VanDerWaalsContact O-N 3.09Å
292I96.6Very high94.8Very high16 Ų1659.8 Ų59.88%0.08228%0.282CS..Hα-helixtrans-57.5-46.4172.9-66.6171.6000110.4L276 V288 K294 K295 L298 L324 Q327L276-I292 HydrophobicContact CD1-CG1 4.17Å; V288-I292 HydrophobicContact CG1-CD1 3.87Å; V288-I292 HydrophobicContact CG1-CG1 4.44Å; V288-I292 VanDerWaalsContact O-CG1 3.3Å; V288-I292 WeakPolarHBondContact O-CG1 3.25Å; V288-I292 PolarHBondContact O-N 3.41Å; I292-K294 PolarHBondContact O-N 2.72Å; I292-K295 WeakPolarHBondContact O-CA 3.02Å; I292-K295 PolarHBondContact O-N 3.05Å; I292-L298 HydrophobicContact CG1-CD2 4.07Å; I292-L324 HydrophobicContact CD1-CD2 3.81Å; I292-Q327 HydrophobicContact CG2-CG 3.66Å
293K96.9Very high94.6Very high157 Ų15763.9 Ų63.968%0.68330%0.295SS*.Hα-helixtrans-62.4-28.1175.5-74.9-180174.6-161.40113.3K289 F290 L291 K295K289-K293 WeakPolarHBondContact O-CG 3.22Å; K289-K293 PolarHBondContact O-N 3.44Å; F290-K293 WeakPolarHBondContact O-CB 3.44Å; F290-K293 PolarHBondContact O-N 2.83Å; L291-K293 VanDerWaalsContact C-N 3.32Å; L291-K293 PolarHBondContact O-N 3.06Å; K293-K295 PolarHBondContact O-N 3.21Å
294K96.7Very high94.3Very high105 Ų10562.4 Ų62.446%0.45729%0.286SS..THydrogen-bonded Turntrans-84.612.8173.8-69.6-65.8-177.2-179.40113.2L259 I265 F290 L291 I292 A296L259-K294 HydrophobicContact CD1-CB 4.37Å; L259-K294 HydrophobicContact CD1-CG 4.07Å; I265-K294 HydrophobicContact CD1-CB 3.77Å; F290-K294 HydrophobicContact CD2-CG 4.37Å; F290-K294 HydrophobicContact CE1-CG 4.29Å; F290-K294 HydrophobicContact CE2-CD 4.42Å; F290-K294 HydrophobicContact CE2-CG 3.84Å; F290-K294 HydrophobicContact CZ-CD 4.46Å; F290-K294 HydrophobicContact CZ-CG 3.79Å; F290-K294 PolarHBondContact O-N 3.26Å; L291-K294 CarbonylContact O-C 3.44Å; L291-K294 WeakPolarHBondContact O-CA 3.37Å; L291-K294 PolarHBondContact O-N 3.42Å; I292-K294 PolarHBondContact O-N 2.72Å; K294-A296 VanDerWaalsContact C-N 3.29Å; K294-A296 PolarHBondContact O-N 2.88Å
295K95.1Very high94Very high191 Ų19160.7 Ų60.783%0.8328%0.281SS*.THydrogen-bonded Turntrans59.934.1177.4-56.3-176.2177.4-178.80113.4L291 I292 K293L291-K295 PolarHBondContact O-N 3.16Å; I292-K295 WeakPolarHBondContact O-CA 3.02Å; I292-K295 PolarHBondContact O-N 3.05Å; K293-K295 PolarHBondContact O-N 3.21Å
296A96.3Very high93.8Very high5 Ų558.1 Ų58.14%0.04127%0.269CS..  trans-56143.716900000110.7I265 E266 L276 L291 K294 L298I265-A296 HydrophobicContact CD1-CB 3.8Å; I265-A296 HydrophobicContact CG1-CB 4.04Å; E266-A296 WeakPolarHBondContact OE1-CA 3.27Å; L276-A296 HydrophobicContact CB-CB 4.15Å; L276-A296 HydrophobicContact CD2-CB 4.06Å; L291-A296 HydrophobicContact CB-CB 4.09Å; L291-A296 WeakPolarHBondContact O-CB 3.04Å; L291-A296 PolarHBondContact O-N 2.96Å; L291-A296 VanDerWaalsContact O-N 3.09Å; K294-A296 VanDerWaalsContact C-N 3.29Å; K294-A296 PolarHBondContact O-N 2.88Å; A296-L298 PolarHBondContact O-N 2.99Å; A296-L298 VanDerWaalsContact O-N 3.09Å
297N95.3Very high93.7Very high75 Ų7553.7 Ų53.740%0.40125%0.249SC..  trans-67.3108.9-173.7-176.15.1000111.9E266 N299 A300E266-N297 PolarHBondContact OE1-N 3.37Å; E266-N297 VanDerWaalsContact OE2-CB 3.27Å; E266-N297 WeakPolarHBondContact OE2-CB 3.44Å; N297-N299 PolarHBondContact O-N 3.4Å; N297-N299 WeakPolarHBondContact OD1-CA 3.47Å; N297-N299 WeakPolarHBondContact OD1-CB 3.46Å; N297-N299 PolarHBondContact OD1-N 3.07Å; N297-A300 WeakPolarHBondContact O-CB 3.43Å; N297-A300 PolarHBondContact O-N 3.47Å
298L94.5Very high93.7Very high31 Ų3153.7 Ų53.716%0.16225%0.249CC..THydrogen-bonded Turntrans-71.2-18.2177.8-58.2-174.8000113.5L276 I292 A296 A300 V308 L324 Q327 I329L276-L298 HydrophobicContact CD2-CD2 3.71Å; I292-L298 HydrophobicContact CG1-CD2 4.07Å; A296-L298 PolarHBondContact O-N 2.99Å; A296-L298 VanDerWaalsContact O-N 3.09Å; L298-A300 VanDerWaalsContact C-N 3.3Å; L298-V308 VanDerWaalsContact O-CG2 3.24Å; L298-V308 WeakPolarHBondContact O-CG2 3.49Å; L298-L324 HydrophobicContact CD2-CD2 4.14Å; L298-Q327 HydrophobicContact CD1-CB 3.61Å; L298-Q327 HydrophobicContact CD1-CG 4.11Å; L298-I329 HydrophobicContact CB-CD1 3.9Å; L298-I329 HydrophobicContact CB-CG1 4.47Å
299N91.6Very high93.6Very high107 Ų10753.8 Ų53.857%0.57225%0.249SC*.THydrogen-bonded Turntrans-90.34.6177.8-60.7-34.1000112.3N297 L301N297-N299 PolarHBondContact O-N 3.4Å; N297-N299 WeakPolarHBondContact OD1-CA 3.47Å; N297-N299 WeakPolarHBondContact OD1-CB 3.46Å; N297-N299 PolarHBondContact OD1-N 3.07Å; N299-L301 PolarHBondContact O-N 2.99Å
300A91.5Very high93.3Very high6 Ų649.4 Ų49.45%0.0523%0.23CC..  trans-58.3133.6174.900000110.5T274 L277 N297 L298T274-A300 HydrophobicContact CG2-CB 4.06Å; L277-A300 HydrophobicContact CD1-CB 4.06Å; L277-A300 HydrophobicContact CG-CB 4.4Å; N297-A300 WeakPolarHBondContact O-CB 3.43Å; N297-A300 PolarHBondContact O-N 3.47Å; L298-A300 VanDerWaalsContact C-N 3.3Å
301L92.1Very high93.1Very high79 Ų7948.8 Ų48.841%0.41423%0.227SC..  trans-107.6137.8178.4-54.4-178.7000110.4K268 N299 R306 T307K268-L301 PolarHBondContact NZ-O 3.27Å; N299-L301 PolarHBondContact O-N 2.99Å; L301-R306 WeakPolarHBondContact CA-O 3.33Å; L301-T307 HydrophobicContact CD2-CG2 3.76Å
302D87.9Confident92.9Very high11 Ų1148.8 Ų48.86%0.05923%0.227CC..  trans-78-178.9169.180.8-6.2000112.1L273 L277 Y304 G305 R306L273-D302 HydrophobicContact CD2-CB 3.98Å; L277-D302 HydrophobicContact CD1-CB 4.27Å; D302-Y304 PolarHBondContact O-N 3.32Å; D302-Y304 VanDerWaalsContact O-N 3.07Å; D302-Y304 WeakPolarHBondContact OD1-CA 3.07Å; D302-Y304 WeakPolarHBondContact OD1-CB 3.12Å; D302-Y304 PolarHBondContact OD1-N 3.31Å; D302-G305 PolarHBondContact O-N 3.5Å; D302-G305 PolarHBondContact OD1-N 2.95Å; D302-R306 PolarHBondContact N-O 2.99Å; D302-R306 WeakPolarHBondContact OD1-CB 3.12Å; D302-R306 PolarHBondContact OD1-N 2.61Å; D302-R306 IonicContact OD1-NE 2.82Å; D302-R306 IonicContact OD2-CZ 3.62Å; D302-R306 IonicContact OD2-NE 2.88Å; D302-R306 PolarHBondContact OD2-NE 2.89Å; D302-R306 IonicContact OD2-NH2 3.76Å; D302-R306 PolarHBondContact OD2-NH2 3.47Å
303R88.2Confident92.7Very high128 Ų12848 Ų4848%0.48322%0.223SC..THydrogen-bonded Turntrans-60.9-14.8178.864.6177.9-98.5-168.4-7.4115.2H271H271-R303 WeakPolarHBondContact O-CG 3.49Å
304Y86.6Confident92.4Very high70 Ų7041.3 Ų41.328%0.27520%0.196SC..THydrogen-bonded Turntrans-101.97.8177.7-55.5-73.5000111.7G121 D302 R306 L336G121-Y304 WeakPolarHBondContact CA-OH 3.34Å; G121-Y304 PolarHBondContact N-OH 2.95Å; G121-Y304 PolarHBondContact O-OH 2.82Å; D302-Y304 PolarHBondContact O-N 3.32Å; D302-Y304 VanDerWaalsContact O-N 3.07Å; D302-Y304 WeakPolarHBondContact OD1-CA 3.07Å; D302-Y304 WeakPolarHBondContact OD1-CB 3.12Å; D302-Y304 PolarHBondContact OD1-N 3.31Å; Y304-R306 PolarHBondContact O-N 3.32Å; Y304-L336 WeakPolarHBondContact O-CB 3.31Å; Y304-L336 VanDerWaalsContact O-CG 3.27Å; Y304-L336 WeakPolarHBondContact O-CG 3.2Å; Y304-L336 PolarHBondContact O-N 3.42Å
305G88.6Confident91.9Very high11 Ų1137.4 Ų37.411%0.11318%0.182CC..  trans68.817.9-175.700000113.6D302 D335D302-G305 PolarHBondContact O-N 3.5Å; D302-G305 PolarHBondContact OD1-N 2.95Å; G305-D335 WeakPolarHBondContact O-CA 3.47Å
306R90Very high91.6Very high18 Ų1829.5 Ų29.57%0.06815%0.154CC..  trans-79.7132.7179.5-61.5179-61.5179.91.8109.5W120 L301 D302 Y304 I310 D335W120-R306 VanDerWaalsContact CH2-NH1 3.28Å; W120-R306 VanDerWaalsContact CZ3-NH2 3.32Å; L301-R306 WeakPolarHBondContact CA-O 3.33Å; D302-R306 PolarHBondContact N-O 2.99Å; D302-R306 WeakPolarHBondContact OD1-CB 3.12Å; D302-R306 PolarHBondContact OD1-N 2.61Å; D302-R306 IonicContact OD1-NE 2.82Å; D302-R306 IonicContact OD2-CZ 3.62Å; D302-R306 IonicContact OD2-NE 2.88Å; D302-R306 PolarHBondContact OD2-NE 2.89Å; D302-R306 IonicContact OD2-NH2 3.76Å; D302-R306 PolarHBondContact OD2-NH2 3.47Å; Y304-R306 PolarHBondContact O-N 3.32Å; R306-I310 HydrophobicContact CB-CB 4.1Å; R306-I310 HydrophobicContact CB-CG2 3.88Å; R306-I310 HydrophobicContact CG-CG2 3.82Å; R306-D335 HydrophobicContact CG-CB 3.75Å
307T93.3Very high91.3Very high12 Ų1229.9 Ų29.97%0.07416%0.157CC..  trans-69165.7169.166.60000110.8L301 L309 I310 L311L301-T307 HydrophobicContact CD2-CG2 3.76Å; T307-L309 PolarHBondContact O-N 3.41Å; T307-I310 HydrophobicContact CG2-CD1 4.44Å; T307-I310 PolarHBondContact O-N 2.87Å; T307-I310 WeakPolarHBondContact OG1-CG1 3.36Å; T307-I310 PolarHBondContact OG1-N 3.2Å; T307-L311 WeakPolarHBondContact O-CB 3.38Å; T307-L311 PolarHBondContact O-N 3.35Å
308V95.2Very high91.2Very high0 Ų027.7 Ų27.70%015%0.149CC..Hα-helixtrans-54.3-38.5174.5-1760000111.6L276 L277 V280 L298 A312 L324L276-V308 HydrophobicContact CD2-CG1 4.17Å; L276-V308 HydrophobicContact CD2-CG2 3.85Å; L276-V308 HydrophobicContact CG-CG1 4.24Å; L276-V308 HydrophobicContact CG-CG2 4.39Å; L277-V308 HydrophobicContact CD2-CB 4.23Å; L277-V308 HydrophobicContact CD2-CG2 3.6Å; L277-V308 HydrophobicContact CG-CG2 4.39Å; V280-V308 HydrophobicContact CG2-CG1 3.76Å; L298-V308 VanDerWaalsContact O-CG2 3.24Å; L298-V308 WeakPolarHBondContact O-CG2 3.49Å; V308-A312 WeakPolarHBondContact O-CB 3.5Å; V308-A312 PolarHBondContact O-N 2.79Å; V308-L324 HydrophobicContact CG1-CD1 3.81Å; V308-L324 HydrophobicContact CG1-CD2 3.75Å; V308-L324 HydrophobicContact CG1-CG 4.46Å
309L95.3Very high91.2Very high1 Ų129.1 Ų29.11%0.00516%0.162CC..Hα-helixtrans-67.6-48.9177.4-179.666.5000112T307 L311 A312 V313 V321 L324 L325 I329 V331 A341 L357T307-L309 PolarHBondContact O-N 3.41Å; L309-L311 VanDerWaalsContact C-N 3.26Å; L309-L311 PolarHBondContact O-N 3.15Å; L309-A312 PolarHBondContact O-N 3.06Å; L309-V313 WeakPolarHBondContact O-CG2 3.39Å; L309-V313 PolarHBondContact O-N 3.31Å; L309-V321 HydrophobicContact CD1-CG1 4.12Å; L309-L324 HydrophobicContact CD1-CB 4.46Å; L309-L324 HydrophobicContact CD1-CD1 4.49Å; L309-L325 HydrophobicContact CD1-CD2 4.38Å; L309-I329 HydrophobicContact CB-CD1 4.33Å; L309-I329 HydrophobicContact CD2-CG2 4.13Å; L309-V331 HydrophobicContact CD2-CB 4.13Å; L309-V331 HydrophobicContact CD2-CG1 3.76Å; L309-A341 HydrophobicContact CD2-CB 3.88Å; L309-A341 HydrophobicContact CG-CB 3.88Å; L309-L357 HydrophobicContact CD2-CD2 4.35Å
310I92.8Very high91.4Very high1 Ų124 Ų241%0.00513%0.134CC..Hα-helixtrans-57.6-45.7178.1-65.9170.9000109.4R306 T307 A312 V313 C314 D335 A341 Y344R306-I310 HydrophobicContact CB-CB 4.1Å; R306-I310 HydrophobicContact CB-CG2 3.88Å; R306-I310 HydrophobicContact CG-CG2 3.82Å; T307-I310 HydrophobicContact CG2-CD1 4.44Å; T307-I310 PolarHBondContact O-N 2.87Å; T307-I310 WeakPolarHBondContact OG1-CG1 3.36Å; T307-I310 PolarHBondContact OG1-N 3.2Å; I310-A312 PolarHBondContact O-N 3.37Å; I310-V313 PolarHBondContact O-N 3.01Å; I310-C314 PolarHBondContact O-N 3.32Å; I310-C314 PolarHBondContact O-SG 3.28Å; I310-D335 HydrophobicContact CD1-CB 4.18Å; I310-A341 HydrophobicContact CG1-CB 4.02Å; I310-Y344 HydrophobicContact CG2-CD2 3.65Å; I310-Y344 HydrophobicContact CG2-CE2 3.66Å
311L92.3Very high91.6Very high0 Ų023.7 Ų23.70%013%0.132CC..Hα-helixtrans-58.8-46.2177.5-172.663.5000112.2W120 L277 V280 H281 T307 L309 V313 C314 C315W120-L311 HydrophobicContact CH2-CD1 4.18Å; W120-L311 HydrophobicContact CZ3-CD1 3.95Å; L277-L311 HydrophobicContact CB-CD2 4.08Å; L277-L311 HydrophobicContact CD2-CD2 3.77Å; L277-L311 WeakPolarHBondContact O-CD2 3.42Å; V280-L311 HydrophobicContact CB-CD2 4.39Å; V280-L311 HydrophobicContact CG1-CB 4.28Å; V280-L311 HydrophobicContact CG1-CD2 4.25Å; V280-L311 HydrophobicContact CG1-CG 4.09Å; H281-L311 HydrophobicContact CB-CD2 4.38Å; T307-L311 WeakPolarHBondContact O-CB 3.38Å; T307-L311 PolarHBondContact O-N 3.35Å; L309-L311 VanDerWaalsContact C-N 3.26Å; L309-L311 PolarHBondContact O-N 3.15Å; L311-V313 VanDerWaalsContact C-N 3.3Å; L311-V313 PolarHBondContact O-N 2.97Å; L311-C314 PolarHBondContact O-N 2.93Å; L311-C315 PolarHBondContact O-N 3.43Å; L311-C315 PolarHBondContact O-SG 3.15Å
312A94Very high91.8Very high0 Ų022 Ų220%013%0.127CC..Hα-helixtrans-60.5-3917800000112.7V280 V308 L309 I310 C315 G316 S317 I320 V321 L324V280-A312 VanDerWaalsContact CG1-CA 3.48Å; V280-A312 HydrophobicContact CG1-CB 3.61Å; V308-A312 WeakPolarHBondContact O-CB 3.5Å; V308-A312 PolarHBondContact O-N 2.79Å; L309-A312 PolarHBondContact O-N 3.06Å; I310-A312 PolarHBondContact O-N 3.37Å; A312-C315 PolarHBondContact O-N 3.31Å; A312-G316 PolarHBondContact O-N 3.26Å; A312-S317 PolarHBondContact O-N 3.28Å; A312-I320 HydrophobicContact CB-CB 4.5Å; A312-I320 HydrophobicContact CB-CG2 3.82Å; A312-V321 HydrophobicContact CB-CG2 3.89Å; A312-L324 HydrophobicContact CB-CD1 3.83Å
313V93Very high92.1Very high0 Ų022.2 Ų22.20%013%0.128CC..Hα-helixtrans-67.3-45.5175.1174.10000111.3L309 I310 L311 C315 G316 V321 A341 A345 H350 I353 L357L309-V313 WeakPolarHBondContact O-CG2 3.39Å; L309-V313 PolarHBondContact O-N 3.31Å; I310-V313 PolarHBondContact O-N 3.01Å; L311-V313 VanDerWaalsContact C-N 3.3Å; L311-V313 PolarHBondContact O-N 2.97Å; V313-C315 PolarHBondContact O-N 3.11Å; V313-G316 WeakPolarHBondContact O-CA 3.49Å; V313-G316 PolarHBondContact O-N 3.18Å; V313-V321 HydrophobicContact CG2-CG2 3.89Å; V313-A341 WeakPolarHBondContact CG1-O 3.41Å; V313-A341 HydrophobicContact CG2-CB 4.05Å; V313-A345 HydrophobicContact CG1-CB 3.67Å; V313-H350 PolarHBondContact O-CD2 3.03Å; V313-I353 HydrophobicContact CB-CG2 4.39Å; V313-I353 HydrophobicContact CG1-CG2 4.07Å; V313-I353 HydrophobicContact CG2-CG2 3.7Å; V313-L357 HydrophobicContact CG2-CD1 4.45Å
314C89.5Confident92.4Very high16 Ų1616.1 Ų16.111%0.10811%0.105CC..Hα-helixtrans-60.5-35.1178.2-64.30000111.7W120 I310 L311 G316 Y344W120-C314 HydrophobicContact CH2-CB 3.33Å; W120-C314 HydrophobicContact CZ2-CB 3.42Å; W120-C314 VanDerWaalsContact CZ2-CB 3.42Å; I310-C314 PolarHBondContact O-N 3.32Å; I310-C314 PolarHBondContact O-SG 3.28Å; L311-C314 PolarHBondContact O-N 2.93Å; C314-G316 VanDerWaalsContact C-N 3.27Å; C314-G316 PolarHBondContact O-N 2.91Å; C314-Y344 VanDerWaalsContact SG-CD1 3.6Å
315C87.4Confident92.7Very high23 Ų2313.4 Ų13.416%0.15510%0.095CC..THydrogen-bonded Turntrans-76.6-10.2174-64.80000113.7Q283 L311 A312 V313 S317Q283-C315 HydrophobicContact CG-CB 4.19Å; Q283-C315 PolarHBondContact NE2-O 3.3Å; L311-C315 PolarHBondContact O-N 3.43Å; L311-C315 PolarHBondContact O-SG 3.15Å; A312-C315 PolarHBondContact O-N 3.31Å; V313-C315 PolarHBondContact O-N 3.11Å; C315-S317 PolarHBondContact O-N 2.92Å
316G88.2Confident92.9Very high25 Ų2518.7 Ų18.726%0.25812%0.117SC..THydrogen-bonded Turntrans74.817.5177.500000115.1A312 V313 C314 A318A312-G316 PolarHBondContact O-N 3.26Å; V313-G316 WeakPolarHBondContact O-CA 3.49Å; V313-G316 PolarHBondContact O-N 3.18Å; C314-G316 VanDerWaalsContact C-N 3.27Å; C314-G316 PolarHBondContact O-N 2.91Å; G316-A318 PolarHBondContact O-N 2.83Å
317S90.2Very high92.9Very high14 Ų1422.2 Ų22.210%0.09813%0.134CC..  trans-89.288.7-175.2-171.70000112.2A312 C315 S319 I320 V321A312-S317 PolarHBondContact O-N 3.28Å; C315-S317 PolarHBondContact O-N 2.92Å; S317-S319 PolarHBondContact O-N 3.2Å; S317-I320 PolarHBondContact O-N 3.18Å; S317-I320 VanDerWaalsContact O-N 3.16Å; S317-I320 WeakPolarHBondContact OG-CG1 3.31Å; S317-V321 WeakPolarHBondContact O-CG2 3.49Å; S317-V321 PolarHBondContact O-N 3Å
318A93.8Very high92.5Very high28 Ų2827 Ų2723%0.23116%0.159CC..Hα-helixtrans-56.3-36178.200000113.1G316 V321 S322 V352 I353 L356G316-A318 PolarHBondContact O-N 2.83Å; A318-V321 PolarHBondContact O-N 3.14Å; A318-S322 PolarHBondContact O-N 3.09Å; A318-V352 HydrophobicContact CB-CG1 3.96Å; A318-I353 HydrophobicContact CB-CG1 4Å; A318-L356 HydrophobicContact CB-CD1 4.09Å
319S94.7Very high92.2Very high61 Ų6127.6 Ų27.643%0.42716%0.162SC..Hα-helixtrans-64.1-42.9177.9-55.70000112.6S317 L323S317-S319 PolarHBondContact O-N 3.2Å; S319-L323 WeakPolarHBondContact O-CG 3.26Å; S319-L323 PolarHBondContact O-N 3.28Å; S319-L323 VanDerWaalsContact O-N 3.16Å
320I95.4Very high91.9Very high0 Ų031.3 Ų31.30%018%0.182CC..Hα-helixtrans-71.5-40.1177.4-68.4175.4000110.1V280 Q283 Q285 V288 A312 S317 S322 L323 L324V280-I320 HydrophobicContact CG1-CG2 4.24Å; V280-I320 HydrophobicContact CG2-CG2 3.92Å; Q283-I320 HydrophobicContact CB-CD1 4.48Å; Q285-I320 HydrophobicContact CB-CG1 4.48Å; Q285-I320 HydrophobicContact CG-CG1 4.5Å; V288-I320 HydrophobicContact CG1-CG2 4.22Å; V288-I320 HydrophobicContact CG2-CD1 4.34Å; A312-I320 HydrophobicContact CB-CB 4.5Å; A312-I320 HydrophobicContact CB-CG2 3.82Å; S317-I320 PolarHBondContact O-N 3.18Å; S317-I320 VanDerWaalsContact O-N 3.16Å; S317-I320 WeakPolarHBondContact OG-CG1 3.31Å; I320-S322 VanDerWaalsContact C-N 3.33Å; I320-S322 PolarHBondContact O-N 2.95Å; I320-L323 WeakPolarHBondContact O-CB 3.44Å; I320-L323 PolarHBondContact O-N 3.32Å; I320-L324 HydrophobicContact CG2-CD1 3.87Å; I320-L324 HydrophobicContact CG2-CG 4.28Å; I320-L324 VanDerWaalsContact O-CG 3.32Å; I320-L324 WeakPolarHBondContact O-CG 3.45Å; I320-L324 PolarHBondContact O-N 3.39Å
321V95.9Very high91.7Very high0 Ų033.4 Ų33.40%020%0.195CC..Hα-helixtrans-56.4-48.6173.8171.20000110.8L309 A312 V313 S317 A318 L323 L324 L325 I353 L356L309-V321 HydrophobicContact CD1-CG1 4.12Å; A312-V321 HydrophobicContact CB-CG2 3.89Å; V313-V321 HydrophobicContact CG2-CG2 3.89Å; S317-V321 WeakPolarHBondContact O-CG2 3.49Å; S317-V321 PolarHBondContact O-N 3Å; A318-V321 PolarHBondContact O-N 3.14Å; V321-L323 VanDerWaalsContact C-N 3.33Å; V321-L323 PolarHBondContact O-N 3.15Å; V321-L324 PolarHBondContact O-N 3.23Å; V321-L324 VanDerWaalsContact O-N 3.15Å; V321-L325 HydrophobicContact CG1-CD1 3.79Å; V321-L325 HydrophobicContact CG1-CG 4.2Å; V321-L325 VanDerWaalsContact O-CG 3.31Å; V321-L325 WeakPolarHBondContact O-CG 3.1Å; V321-L325 PolarHBondContact O-N 3.06Å; V321-I353 HydrophobicContact CG1-CG2 4.29Å; V321-I353 HydrophobicContact CG2-CD1 4.34Å; V321-I353 HydrophobicContact CG2-CG2 4.25Å; V321-L356 HydrophobicContact CG1-CD1 4.46Å
322S95.1Very high91.6Very high43 Ų4337.1 Ų37.130%0.30122%0.221SC..Hα-helixtrans-56.6-46.6176.6-170.50000111.8A318 I320 L324 L325 E326A318-S322 PolarHBondContact O-N 3.09Å; I320-S322 VanDerWaalsContact C-N 3.33Å; I320-S322 PolarHBondContact O-N 2.95Å; S322-L324 VanDerWaalsContact C-N 3.29Å; S322-L324 PolarHBondContact O-N 3.31Å; S322-L325 PolarHBondContact O-N 3.21Å; S322-E326 WeakPolarHBondContact O-CG 3.24Å; S322-E326 PolarHBondContact O-N 3.31Å
323L95.1Very high91.4Very high16 Ų1638.7 Ų38.78%0.08423%0.232CC..Hα-helixtrans-60.8-36.5178.1-74.1171000112.8Q285 K289 S319 I320 V321Q285-L323 HydrophobicContact CG-CD1 3.72Å; K289-L323 HydrophobicContact CB-CD1 4.26Å; K289-L323 HydrophobicContact CD-CD2 4.15Å; K289-L323 HydrophobicContact CG-CD2 4.47Å; S319-L323 WeakPolarHBondContact O-CG 3.26Å; S319-L323 PolarHBondContact O-N 3.28Å; S319-L323 VanDerWaalsContact O-N 3.16Å; I320-L323 WeakPolarHBondContact O-CB 3.44Å; I320-L323 PolarHBondContact O-N 3.32Å; V321-L323 VanDerWaalsContact C-N 3.33Å; V321-L323 PolarHBondContact O-N 3.15Å
324L94.6Very high91.4Very high0 Ų044.5 Ų44.50%026%0.259CS..Hα-helixtrans-74.7-38.6179.1-68.3168.7000112.1I292 L298 V308 L309 A312 I320 V321 S322 E326 Q327I292-L324 HydrophobicContact CD1-CD2 3.81Å; L298-L324 HydrophobicContact CD2-CD2 4.14Å; V308-L324 HydrophobicContact CG1-CD1 3.81Å; V308-L324 HydrophobicContact CG1-CD2 3.75Å; V308-L324 HydrophobicContact CG1-CG 4.46Å; L309-L324 HydrophobicContact CD1-CB 4.46Å; L309-L324 HydrophobicContact CD1-CD1 4.49Å; A312-L324 HydrophobicContact CB-CD1 3.83Å; I320-L324 HydrophobicContact CG2-CD1 3.87Å; I320-L324 HydrophobicContact CG2-CG 4.28Å; I320-L324 VanDerWaalsContact O-CG 3.32Å; I320-L324 WeakPolarHBondContact O-CG 3.45Å; I320-L324 PolarHBondContact O-N 3.39Å; V321-L324 PolarHBondContact O-N 3.23Å; V321-L324 VanDerWaalsContact O-N 3.15Å; S322-L324 VanDerWaalsContact C-N 3.29Å; S322-L324 PolarHBondContact O-N 3.31Å; L324-E326 PolarHBondContact O-N 3.36Å; L324-Q327 WeakPolarHBondContact O-CB 3.31Å; L324-Q327 PolarHBondContact O-N 3.47Å
325L93.3Very high91.4Very high13 Ų1344.4 Ų44.47%0.06826%0.257CS..Hα-helixtrans-64.3-31.2177-67.5174000112L309 V321 S322 Q327 N328 V331 L356 L357 Y360L309-L325 HydrophobicContact CD1-CD2 4.38Å; V321-L325 HydrophobicContact CG1-CD1 3.79Å; V321-L325 HydrophobicContact CG1-CG 4.2Å; V321-L325 VanDerWaalsContact O-CG 3.31Å; V321-L325 WeakPolarHBondContact O-CG 3.1Å; V321-L325 PolarHBondContact O-N 3.06Å; S322-L325 PolarHBondContact O-N 3.21Å; L325-Q327 PolarHBondContact O-N 2.97Å; L325-N328 PolarHBondContact O-N 3.27Å; L325-V331 HydrophobicContact CD2-CG1 3.61Å; L325-L356 HydrophobicContact CD1-CB 4.2Å; L325-L357 HydrophobicContact CD1-CD2 4.22Å; L325-L357 HydrophobicContact CD2-CD2 4.01Å; L325-Y360 HydrophobicContact CB-CD2 3.93Å; L325-Y360 HydrophobicContact CB-CE2 4.27Å; L325-Y360 HydrophobicContact CB-CG 4.33Å; L325-Y360 HydrophobicContact CD1-CG 4.47Å; L325-Y360 HydrophobicContact CD2-CD1 3.86Å; L325-Y360 HydrophobicContact CD2-CD2 4.21Å; L325-Y360 HydrophobicContact CD2-CE1 4.15Å; L325-Y360 HydrophobicContact CD2-CG 3.86Å; L325-Y360 HydrophobicContact CG-CG 4.44Å; L325-Y360 WeakPolarHBondContact O-CE2 3.45Å
326E91.8Very high91.5Very high121 Ų12150.1 Ų50.157%0.56529%0.285SS*.THydrogen-bonded Turntrans-62-17.6171.4-71.5167.8-16300113.4S322 L324S322-E326 WeakPolarHBondContact O-CG 3.24Å; S322-E326 PolarHBondContact O-N 3.31Å; L324-E326 PolarHBondContact O-N 3.36Å
327Q90.8Very high91.5Very high92 Ų9251.9 Ų51.943%0.4329%0.294SS..THydrogen-bonded Turntrans-9414-178.8-54.2-55.7-63.400113.9I292 L298 L324 L325 I329I292-Q327 HydrophobicContact CG2-CG 3.66Å; L298-Q327 HydrophobicContact CD1-CB 3.61Å; L298-Q327 HydrophobicContact CD1-CG 4.11Å; L324-Q327 WeakPolarHBondContact O-CB 3.31Å; L324-Q327 PolarHBondContact O-N 3.47Å; L325-Q327 PolarHBondContact O-N 2.97Å; Q327-I329 PolarHBondContact O-N 3.31Å
328N84.1Confident91.5Very high112 Ų11252.5 Ų52.560%0.59930%0.303SS*.THydrogen-bonded Turntrans54.236.2-177.2-62.2-49.9000114.2L325 Y360L325-N328 PolarHBondContact O-N 3.27Å; N328-Y360 WeakPolarHBondContact CA-OH 3.27Å
329I89.1Confident91.3Very high13 Ų1354 Ų547%0.06731%0.305CS..  trans-67.3150.6179.9-157.2168.9000111.4L298 L309 Q327 V331 Y360L298-I329 HydrophobicContact CB-CD1 3.9Å; L298-I329 HydrophobicContact CB-CG1 4.47Å; L309-I329 HydrophobicContact CB-CD1 4.33Å; L309-I329 HydrophobicContact CD2-CG2 4.13Å; Q327-I329 PolarHBondContact O-N 3.31Å; I329-V331 PolarHBondContact O-N 3.46Å; I329-Y360 PolarHBondContact O-OH 3.06Å
330D88.1Confident91.3Very high79 Ų7952.1 Ų52.142%0.42229%0.291SS..  trans-68.7118.9171.4-175.16.3000110.4S332 S333D330-S332 WeakPolarHBondContact OD1-CB 3.38Å; D330-S332 PolarHBondContact OD1-N 2.98Å; D330-S332 PolarHBondContact OD1-OG 2.99Å; D330-S332 PolarHBondContact OD2-OG 3.43Å; D330-S333 PolarHBondContact OD2-OG 3.5Å
331V89.4Confident91.1Very high45 Ų4552.2 Ų52.227%0.27329%0.292SS..SBendtrans-91.8-9.3179.6-61.90000113L309 L325 I329 L357 Y360L309-V331 HydrophobicContact CD2-CB 4.13Å; L309-V331 HydrophobicContact CD2-CG1 3.76Å; L325-V331 HydrophobicContact CD2-CG1 3.61Å; I329-V331 PolarHBondContact O-N 3.46Å; V331-L357 HydrophobicContact CG1-CD2 4.49Å; V331-Y360 HydrophobicContact CG1-CD1 3.75Å; V331-Y360 HydrophobicContact CG1-CE1 3.53Å; V331-Y360 HydrophobicContact CG2-CD1 4.47Å; V331-Y360 HydrophobicContact CG2-CE1 4.28Å
332S89.8Confident91Very high79 Ų7957.7 Ų57.755%0.55231%0.312SS*.SBendtrans-92.4-12.3-175.972.10000113.9D330D330-S332 WeakPolarHBondContact OD1-CB 3.38Å; D330-S332 PolarHBondContact OD1-N 2.98Å; D330-S332 PolarHBondContact OD1-OG 2.99Å; D330-S332 PolarHBondContact OD2-OG 3.43Å
333S91.1Very high90.8Very high33 Ų3359.4 Ų59.423%0.23132%0.316CS..  trans-52.6140.7176.9-57.80000112.6D330D330-S333 PolarHBondContact OD2-OG 3.5Å
334Q91.8Very high90.6Very high121 Ų12159.4 Ų59.457%0.56532%0.315SS*.BIsolated β-bridgetrans-111.9147178.6-69.6178.7-24.300110.6G338 Q339 T340Q334-G338 PolarHBondContact NE2-O 3.38Å; Q334-Q339 WeakPolarHBondContact CA-O 3.27Å; Q334-T340 HydrophobicContact CG-CG2 3.67Å
335D89.8Confident90.4Very high14 Ų1459.4 Ų59.48%0.07532%0.315CS..  trans-81.7-175.5170.273.93.3000112.5G305 R306 I310 S337 G338 Q339 Y344G305-D335 WeakPolarHBondContact O-CA 3.47Å; R306-D335 HydrophobicContact CG-CB 3.75Å; I310-D335 HydrophobicContact CD1-CB 4.18Å; D335-S337 VanDerWaalsContact CG-OG 3.29Å; D335-S337 PolarHBondContact O-N 2.75Å; D335-S337 VanDerWaalsContact O-N 3.1Å; D335-S337 VanDerWaalsContact OD1-CA 3.31Å; D335-S337 WeakPolarHBondContact OD1-CA 3.1Å; D335-S337 WeakPolarHBondContact OD1-CB 3.39Å; D335-S337 PolarHBondContact OD1-N 3.02Å; D335-S337 PolarHBondContact OD1-OG 3.34Å; D335-S337 PolarHBondContact OD2-OG 3.29Å; D335-G338 PolarHBondContact O-N 3.49Å; D335-G338 PolarHBondContact OD1-N 3.33Å; D335-Q339 PolarHBondContact N-O 3.08Å; D335-Q339 PolarHBondContact OD1-N 3.18Å; D335-Y344 VanDerWaalsContact OD2-CE2 3.25Å; D335-Y344 WeakPolarHBondContact OD2-CE2 3.32Å; D335-Y344 VanDerWaalsContact OD2-CZ 3.31Å; D335-Y344 PolarHBondContact OD2-OH 2.9Å
336L89.9Confident90.3Very high143 Ų14363 Ų6375%0.74934%0.337SS*.THydrogen-bonded Turntrans-62.7-16.6178.5-66.4177.2000114.1Y304 G338Y304-L336 WeakPolarHBondContact O-CB 3.31Å; Y304-L336 VanDerWaalsContact O-CG 3.27Å; Y304-L336 WeakPolarHBondContact O-CG 3.2Å; Y304-L336 PolarHBondContact O-N 3.42Å; L336-G338 VanDerWaalsContact C-N 3.34Å
337S88Confident90.1Very high62 Ų6260.8 Ų60.843%0.43434%0.335SS..THydrogen-bonded Turntrans-91.51.7174.874.20000113.2D335 Q339D335-S337 VanDerWaalsContact CG-OG 3.29Å; D335-S337 PolarHBondContact O-N 2.75Å; D335-S337 VanDerWaalsContact O-N 3.1Å; D335-S337 VanDerWaalsContact OD1-CA 3.31Å; D335-S337 WeakPolarHBondContact OD1-CA 3.1Å; D335-S337 WeakPolarHBondContact OD1-CB 3.39Å; D335-S337 PolarHBondContact OD1-N 3.02Å; D335-S337 PolarHBondContact OD1-OG 3.34Å; D335-S337 PolarHBondContact OD2-OG 3.29Å; S337-Q339 VanDerWaalsContact C-N 3.27Å; S337-Q339 WeakPolarHBondContact OG-CG 3.43Å
338G90.3Very high89.8Confident28 Ų2858.8 Ų58.829%0.28933%0.331SS..SBendtrans74.417-175.700000113Q334 D335 L336Q334-G338 PolarHBondContact NE2-O 3.38Å; D335-G338 PolarHBondContact O-N 3.49Å; D335-G338 PolarHBondContact OD1-N 3.33Å; L336-G338 VanDerWaalsContact C-N 3.34Å
339Q89.9Confident90.1Very high58 Ų5863.4 Ų63.427%0.27134%0.34SS..  trans-96.2134.9-176.6-64.8-66.5-83.500111.5Q334 D335 S337 E343 Y344Q334-Q339 WeakPolarHBondContact CA-O 3.27Å; D335-Q339 PolarHBondContact N-O 3.08Å; D335-Q339 PolarHBondContact OD1-N 3.18Å; S337-Q339 VanDerWaalsContact C-N 3.27Å; S337-Q339 WeakPolarHBondContact OG-CG 3.43Å; Q339-E343 VanDerWaalsContact CA-OE2 3.24Å; Q339-E343 WeakPolarHBondContact CA-OE2 3.05Å; Q339-Y344 HydrophobicContact CB-CD2 3.96Å; Q339-Y344 HydrophobicContact CB-CE2 3.38Å; Q339-Y344 HydrophobicContact CG-CE2 4.34Å
340T93.5Very high90.1Very high22 Ų2265.5 Ų65.514%0.13535%0.349CS..BIsolated β-bridgetrans-91164.1175.764.40000111.8Q334 R342 E343 Y344Q334-T340 HydrophobicContact CG-CG2 3.67Å; T340-R342 PolarHBondContact O-N 3.33Å; T340-E343 PolarHBondContact N-OE2 3.12Å; T340-E343 PolarHBondContact O-N 3.2Å; T340-E343 WeakPolarHBondContact OG1-CG 3.37Å; T340-E343 PolarHBondContact OG1-N 3.4Å; T340-E343 PolarHBondContact OG1-OE2 3.33Å; T340-Y344 WeakPolarHBondContact O-CD2 3.48Å; T340-Y344 PolarHBondContact O-N 2.87Å
341A92.1Very high90.2Very high2 Ų267.3 Ų67.32%0.01736%0.359CS..Hα-helixtrans-56.8-37.1175.300000112.5L309 I310 V313 A345L309-A341 HydrophobicContact CD2-CB 3.88Å; L309-A341 HydrophobicContact CG-CB 3.88Å; I310-A341 HydrophobicContact CG1-CB 4.02Å; V313-A341 WeakPolarHBondContact CG1-O 3.41Å; V313-A341 HydrophobicContact CG2-CB 4.05Å; A341-A345 PolarHBondContact O-N 3.33Å
342R93.1Very high90.5Very high115 Ų11569.2 Ų69.243%0.43437%0.371SS..Hα-helixtrans-66.9-41.5178.4-174.6-179.2179.396.10.3112T340 Y344 A345 V346 L357 S358T340-R342 PolarHBondContact O-N 3.33Å; R342-Y344 VanDerWaalsContact C-N 3.34Å; R342-A345 PolarHBondContact O-N 3.4Å; R342-V346 WeakPolarHBondContact O-CG2 3.34Å; R342-V346 PolarHBondContact O-N 3.42Å; R342-L357 HydrophobicContact CB-CD1 4.3Å; R342-S358 PolarHBondContact NH1-OG 3.22Å
343E90.9Very high90.7Very high79 Ų7965.6 Ų65.637%0.36935%0.345SS..Hα-helixtrans-63.2-43.1179.5-71.8163.9163.200111Q339 T340 A345 V346 S347Q339-E343 VanDerWaalsContact CA-OE2 3.24Å; Q339-E343 WeakPolarHBondContact CA-OE2 3.05Å; T340-E343 PolarHBondContact N-OE2 3.12Å; T340-E343 PolarHBondContact O-N 3.2Å; T340-E343 WeakPolarHBondContact OG1-CG 3.37Å; T340-E343 PolarHBondContact OG1-N 3.4Å; T340-E343 PolarHBondContact OG1-OE2 3.33Å; E343-A345 PolarHBondContact O-N 2.81Å; E343-V346 PolarHBondContact O-N 2.66Å; E343-S347 WeakPolarHBondContact O-CB 3.23Å; E343-S347 PolarHBondContact O-N 3.22Å; E343-S347 PolarHBondContact O-OG 3.28Å
344Y90.5Very high90.8Very high17 Ų1765.1 Ų65.17%0.06734%0.341CS..Hα-helixtrans-61-42.6172.2-82.1-70.2000113V117 I310 C314 D335 Q339 T340 R342 V346 S347 S348V117-Y344 HydrophobicContact CG1-CE1 3.74Å; V117-Y344 HydrophobicContact CG2-CE1 4.18Å; I310-Y344 HydrophobicContact CG2-CD2 3.65Å; I310-Y344 HydrophobicContact CG2-CE2 3.66Å; C314-Y344 VanDerWaalsContact SG-CD1 3.6Å; D335-Y344 VanDerWaalsContact OD2-CE2 3.25Å; D335-Y344 WeakPolarHBondContact OD2-CE2 3.32Å; D335-Y344 VanDerWaalsContact OD2-CZ 3.31Å; D335-Y344 PolarHBondContact OD2-OH 2.9Å; Q339-Y344 HydrophobicContact CB-CD2 3.96Å; Q339-Y344 HydrophobicContact CB-CE2 3.38Å; Q339-Y344 HydrophobicContact CG-CE2 4.34Å; T340-Y344 WeakPolarHBondContact O-CD2 3.48Å; T340-Y344 PolarHBondContact O-N 2.87Å; R342-Y344 VanDerWaalsContact C-N 3.34Å; Y344-V346 VanDerWaalsContact C-N 3.3Å; Y344-V346 PolarHBondContact O-N 2.88Å; Y344-S347 WeakPolarHBondContact CA-OG 3.47Å; Y344-S347 PolarHBondContact O-N 3.32Å; Y344-S347 PolarHBondContact O-OG 2.69Å; Y344-S348 VanDerWaalsContact O-CB 3.26Å; Y344-S348 WeakPolarHBondContact O-CB 3.44Å; Y344-S348 PolarHBondContact O-N 2.72Å; Y344-S348 PolarHBondContact O-OG 3.1Å; Y344-S348 VanDerWaalsContact O-OG 3.13Å
345A91.8Very high90.8Very high0 Ų065 Ų650%034%0.341CS..Hα-helixtrans-61.1-41.8178.200000111.4V313 A341 R342 E343 R349 H350 I353 C354 L357V313-A345 HydrophobicContact CG1-CB 3.67Å; A341-A345 PolarHBondContact O-N 3.33Å; R342-A345 PolarHBondContact O-N 3.4Å; E343-A345 PolarHBondContact O-N 2.81Å; A345-R349 PolarHBondContact O-N 2.8Å; A345-R349 VanDerWaalsContact O-N 3.15Å; A345-H350 PolarHBondContact O-N 3.32Å; A345-I353 HydrophobicContact CB-CB 4.35Å; A345-I353 HydrophobicContact CB-CG2 3.84Å; A345-C354 VanDerWaalsContact C-SG 3.52Å; A345-C354 VanDerWaalsContact CB-SG 3.53Å; A345-L357 HydrophobicContact CB-CD1 4.19Å
346V90.5Very high91Very high89 Ų8966.5 Ų66.554%0.53935%0.349SS..Hα-helixtrans-69.3-47.4177.9173.70000111.1R342 E343 Y344 S348 R349R342-V346 WeakPolarHBondContact O-CG2 3.34Å; R342-V346 PolarHBondContact O-N 3.42Å; E343-V346 PolarHBondContact O-N 2.66Å; Y344-V346 VanDerWaalsContact C-N 3.3Å; Y344-V346 PolarHBondContact O-N 2.88Å; V346-S348 VanDerWaalsContact C-N 3.28Å; V346-S348 PolarHBondContact O-N 3.23Å; V346-R349 PolarHBondContact O-N 2.97Å; V346-R349 VanDerWaalsContact O-N 3.13Å
347S88.8Confident91.2Very high73 Ų7360.2 Ų60.251%0.5132%0.316SS..Hα-helixtrans-62.6-36.8-179.165.70000112.4E343 Y344 R349E343-S347 WeakPolarHBondContact O-CB 3.23Å; E343-S347 PolarHBondContact O-N 3.22Å; E343-S347 PolarHBondContact O-OG 3.28Å; Y344-S347 WeakPolarHBondContact CA-OG 3.47Å; Y344-S347 PolarHBondContact O-N 3.32Å; Y344-S347 PolarHBondContact O-OG 2.69Å; S347-R349 VanDerWaalsContact C-N 3.33Å
348S84.2Confident91.3Very high51 Ų5158.5 Ų58.536%0.35730%0.304SS..THydrogen-bonded Turntrans-87.30.2179.5-58.40000113.5Y344 V346 H350Y344-S348 VanDerWaalsContact O-CB 3.26Å; Y344-S348 WeakPolarHBondContact O-CB 3.44Å; Y344-S348 PolarHBondContact O-N 2.72Å; Y344-S348 PolarHBondContact O-OG 3.1Å; Y344-S348 VanDerWaalsContact O-OG 3.13Å; V346-S348 VanDerWaalsContact C-N 3.28Å; V346-S348 PolarHBondContact O-N 3.23Å; S348-H350 VanDerWaalsContact C-N 3.28Å; S348-H350 WeakPolarHBondContact CB-CD2 3.29Å; S348-H350 WeakPolarHBondContact CB-NE2 3.33Å; S348-H350 PolarHBondContact O-N 3.12Å
349R89.8Confident91.4Very high209 Ų20960.7 Ų60.779%0.78931%0.309SS*.THydrogen-bonded Turntrans57.435.4-179.4-54.4-179.4178-174.1-1.9113.7A345 V346 S347 N351A345-R349 PolarHBondContact O-N 2.8Å; A345-R349 VanDerWaalsContact O-N 3.15Å; V346-R349 PolarHBondContact O-N 2.97Å; V346-R349 VanDerWaalsContact O-N 3.13Å; S347-R349 VanDerWaalsContact C-N 3.33Å; R349-N351 VanDerWaalsContact C-N 3.3Å; R349-N351 PolarHBondContact O-N 3.48Å
350H88.8Confident91.4Very high56 Ų5659.1 Ų59.126%0.25930%0.301SS..  trans-81.873.5175.1-65.9-50000110.9V313 A345 S348 V352 I353 C354V313-H350 PolarHBondContact O-CD2 3.03Å; A345-H350 PolarHBondContact O-N 3.32Å; S348-H350 VanDerWaalsContact C-N 3.28Å; S348-H350 WeakPolarHBondContact CB-CD2 3.29Å; S348-H350 WeakPolarHBondContact CB-NE2 3.33Å; S348-H350 PolarHBondContact O-N 3.12Å; H350-V352 VanDerWaalsContact C-N 3.29Å; H350-V352 PolarHBondContact O-N 2.85Å; H350-I353 HydrophobicContact CB-CB 3.88Å; H350-I353 HydrophobicContact CB-CD1 3.78Å; H350-I353 HydrophobicContact CB-CG1 4.02Å; H350-I353 WeakPolarHBondContact O-CB 3.45Å; H350-I353 PolarHBondContact O-N 3.27Å; H350-C354 PolarHBondContact O-N 3.44Å; H350-C354 PolarHBondContact O-SG 3.36Å
351N91.4Very high91.1Very high117 Ų11764.3 Ų64.363%0.62632%0.322SS*.Hα-helixtrans-52.5-42.5-173.5-64-20.5000113.8R349 I353 C354 Q355R349-N351 VanDerWaalsContact C-N 3.3Å; R349-N351 PolarHBondContact O-N 3.48Å; N351-I353 VanDerWaalsContact C-N 3.34Å; N351-I353 PolarHBondContact O-N 3.39Å; N351-C354 WeakPolarHBondContact O-CB 3.45Å; N351-C354 PolarHBondContact O-N 3.19Å; N351-Q355 WeakPolarHBondContact O-CG 3.29Å; N351-Q355 PolarHBondContact O-N 2.82Å
352V94.1Very high90.8Very high86 Ų8670 Ų7052%0.52135%0.347SS..Hα-helixtrans-63.2-41.6178.2179.60000111.1A318 H350 Q355 L356A318-V352 HydrophobicContact CB-CG1 3.96Å; H350-V352 VanDerWaalsContact C-N 3.29Å; H350-V352 PolarHBondContact O-N 2.85Å; V352-Q355 WeakPolarHBondContact O-CB 3.47Å; V352-Q355 PolarHBondContact O-N 3.49Å; V352-L356 HydrophobicContact CG1-CD1 4.37Å; V352-L356 WeakPolarHBondContact O-CG 3.38Å; V352-L356 PolarHBondContact O-N 3.41Å
353I93.7Very high90.5Very high3 Ų371.5 Ų71.52%0.01536%0.357CS..Hα-helixtrans-68.7-39.6178.2-62.3178.9000110.5V313 A318 V321 A345 H350 N351 Q355 L356 L357V313-I353 HydrophobicContact CB-CG2 4.39Å; V313-I353 HydrophobicContact CG1-CG2 4.07Å; V313-I353 HydrophobicContact CG2-CG2 3.7Å; A318-I353 HydrophobicContact CB-CG1 4Å; V321-I353 HydrophobicContact CG1-CG2 4.29Å; V321-I353 HydrophobicContact CG2-CD1 4.34Å; V321-I353 HydrophobicContact CG2-CG2 4.25Å; A345-I353 HydrophobicContact CB-CB 4.35Å; A345-I353 HydrophobicContact CB-CG2 3.84Å; H350-I353 HydrophobicContact CB-CB 3.88Å; H350-I353 HydrophobicContact CB-CD1 3.78Å; H350-I353 HydrophobicContact CB-CG1 4.02Å; H350-I353 WeakPolarHBondContact O-CB 3.45Å; H350-I353 PolarHBondContact O-N 3.27Å; N351-I353 VanDerWaalsContact C-N 3.34Å; N351-I353 PolarHBondContact O-N 3.39Å; I353-Q355 VanDerWaalsContact C-N 3.29Å; I353-Q355 PolarHBondContact O-N 2.91Å; I353-L356 PolarHBondContact O-N 2.75Å; I353-L357 HydrophobicContact CG2-CD1 4.04Å; I353-L357 HydrophobicContact CG2-CG 4.37Å; I353-L357 WeakPolarHBondContact O-CB 3.38Å; I353-L357 WeakPolarHBondContact O-CG 3.19Å; I353-L357 PolarHBondContact O-N 2.91Å
354C93.1Very high90Very high22 Ų2270.8 Ų70.815%0.14935%0.354CS..Hα-helixtrans-58.6-41.1173.4-66.70000112.2A345 H350 N351 S358A345-C354 VanDerWaalsContact C-SG 3.52Å; A345-C354 VanDerWaalsContact CB-SG 3.53Å; H350-C354 PolarHBondContact O-N 3.44Å; H350-C354 PolarHBondContact O-SG 3.36Å; N351-C354 WeakPolarHBondContact O-CB 3.45Å; N351-C354 PolarHBondContact O-N 3.19Å; C354-S358 WeakPolarHBondContact O-CB 3.23Å; C354-S358 PolarHBondContact O-N 3.32Å; C354-S358 PolarHBondContact O-OG 3.16Å
355Q93.6Very high89.5Confident120 Ų12074.9 Ų74.956%0.56138%0.376SS*.Hα-helixtrans-64.2-52.8174.6-73.4172.8-22.100110.7N351 V352 I353 L357 S358 D359N351-Q355 WeakPolarHBondContact O-CG 3.29Å; N351-Q355 PolarHBondContact O-N 2.82Å; V352-Q355 WeakPolarHBondContact O-CB 3.47Å; V352-Q355 PolarHBondContact O-N 3.49Å; I353-Q355 VanDerWaalsContact C-N 3.29Å; I353-Q355 PolarHBondContact O-N 2.91Å; Q355-L357 VanDerWaalsContact C-N 3.28Å; Q355-L357 PolarHBondContact O-N 3.28Å; Q355-S358 WeakPolarHBondContact O-CA 3.25Å; Q355-S358 WeakPolarHBondContact O-CB 3.36Å; Q355-S358 PolarHBondContact O-N 2.87Å; Q355-D359 VanDerWaalsContact O-CG 3.26Å; Q355-D359 PolarHBondContact O-N 2.9Å
356L94.2Very high88.8Confident45 Ų4580.4 Ų80.424%0.23641%0.405CS..Hα-helixtrans-53-43.6178.2-71.4172.5000113A318 V321 L325 V352 I353 Y360A318-L356 HydrophobicContact CB-CD1 4.09Å; V321-L356 HydrophobicContact CG1-CD1 4.46Å; L325-L356 HydrophobicContact CD1-CB 4.2Å; V352-L356 HydrophobicContact CG1-CD1 4.37Å; V352-L356 WeakPolarHBondContact O-CG 3.38Å; V352-L356 PolarHBondContact O-N 3.41Å; I353-L356 PolarHBondContact O-N 2.75Å; L356-Y360 WeakPolarHBondContact O-CB 3.17Å; L356-Y360 PolarHBondContact O-N 2.93Å
357L92.4Very high88.2Confident10 Ų1081.1 Ų81.15%0.05240%0.401CS..Hα-helixtrans-69.1-32.5177.2-69173000112.9L309 V313 L325 V331 R342 A345 I353 Q355 K361L309-L357 HydrophobicContact CD2-CD2 4.35Å; V313-L357 HydrophobicContact CG2-CD1 4.45Å; L325-L357 HydrophobicContact CD1-CD2 4.22Å; L325-L357 HydrophobicContact CD2-CD2 4.01Å; V331-L357 HydrophobicContact CG1-CD2 4.49Å; R342-L357 HydrophobicContact CB-CD1 4.3Å; A345-L357 HydrophobicContact CB-CD1 4.19Å; I353-L357 HydrophobicContact CG2-CD1 4.04Å; I353-L357 HydrophobicContact CG2-CG 4.37Å; I353-L357 WeakPolarHBondContact O-CB 3.38Å; I353-L357 WeakPolarHBondContact O-CG 3.19Å; I353-L357 PolarHBondContact O-N 2.91Å; Q355-L357 VanDerWaalsContact C-N 3.28Å; Q355-L357 PolarHBondContact O-N 3.28Å; L357-K361 PolarHBondContact O-N 2.82Å
358S91.3Very high87.3Confident27 Ų2781.3 Ų81.319%0.18940%0.398CS..Hα-helixtrans-72.4-49176.8-55.50000110.7R342 C354 Q355 Y360 K361 E362R342-S358 PolarHBondContact NH1-OG 3.22Å; C354-S358 WeakPolarHBondContact O-CB 3.23Å; C354-S358 PolarHBondContact O-N 3.32Å; C354-S358 PolarHBondContact O-OG 3.16Å; Q355-S358 WeakPolarHBondContact O-CA 3.25Å; Q355-S358 WeakPolarHBondContact O-CB 3.36Å; Q355-S358 PolarHBondContact O-N 2.87Å; S358-Y360 VanDerWaalsContact C-N 3.27Å; S358-Y360 PolarHBondContact O-N 3.06Å; S358-K361 PolarHBondContact O-N 3.08Å; S358-E362 PolarHBondContact O-N 3.38Å
359D91.3Very high86.4Confident74 Ų7481.8 Ų81.840%0.39640%0.402SS..Hα-helixtrans-57.9-40.2177.6-62.5-2.1000111.5Q355 K363Q355-D359 VanDerWaalsContact O-CG 3.26Å; Q355-D359 PolarHBondContact O-N 2.9Å; D359-K363 WeakPolarHBondContact O-CB 3.31Å; D359-K363 VanDerWaalsContact O-CG 3.26Å; D359-K363 WeakPolarHBondContact O-CG 3.49Å; D359-K363 PolarHBondContact O-N 3.11Å
360Y90.9Very high85.1Confident25 Ų2575.2 Ų75.210%0.09839%0.388CS..Hα-helixtrans-65-41.9176.1178-99000112.3L325 N328 I329 V331 L356 S358 K363 Q364L325-Y360 HydrophobicContact CB-CD2 3.93Å; L325-Y360 HydrophobicContact CB-CE2 4.27Å; L325-Y360 HydrophobicContact CB-CG 4.33Å; L325-Y360 HydrophobicContact CD1-CG 4.47Å; L325-Y360 HydrophobicContact CD2-CD1 3.86Å; L325-Y360 HydrophobicContact CD2-CD2 4.21Å; L325-Y360 HydrophobicContact CD2-CE1 4.15Å; L325-Y360 HydrophobicContact CD2-CG 3.86Å; L325-Y360 HydrophobicContact CG-CG 4.44Å; L325-Y360 WeakPolarHBondContact O-CE2 3.45Å; N328-Y360 WeakPolarHBondContact CA-OH 3.27Å; I329-Y360 PolarHBondContact O-OH 3.06Å; V331-Y360 HydrophobicContact CG1-CD1 3.75Å; V331-Y360 HydrophobicContact CG1-CE1 3.53Å; V331-Y360 HydrophobicContact CG2-CD1 4.47Å; V331-Y360 HydrophobicContact CG2-CE1 4.28Å; L356-Y360 WeakPolarHBondContact O-CB 3.17Å; L356-Y360 PolarHBondContact O-N 2.93Å; S358-Y360 VanDerWaalsContact C-N 3.27Å; S358-Y360 PolarHBondContact O-N 3.06Å; Y360-K363 PolarHBondContact O-N 3.28Å; Y360-Q364 HydrophobicContact CD1-CG 4.32Å; Y360-Q364 HydrophobicContact CE1-CG 3.94Å; Y360-Q364 HydrophobicContact CE2-CG 4.39Å; Y360-Q364 WeakPolarHBondContact O-CG 3.4Å; Y360-Q364 PolarHBondContact O-N 3.21Å; Y360-Q364 PolarHBondContact OH-NE2 2.7Å
361K86.1Confident83.5Confident131 Ų13178.1 Ų78.157%0.5740%0.402SS*.Hα-helixtrans-65.1-41.6177.7-170.8176.2-179178.40111.6L357 S358 Q364 I365L357-K361 PolarHBondContact O-N 2.82Å; S358-K361 PolarHBondContact O-N 3.08Å; K361-Q364 PolarHBondContact O-N 2.9Å; K361-I365 HydrophobicContact CG-CD1 4.21Å; K361-I365 VanDerWaalsContact O-CG1 3.3Å; K361-I365 WeakPolarHBondContact O-CG1 3.27Å; K361-I365 PolarHBondContact O-N 2.89Å
362E86.8Confident81.8Confident120 Ų12078.9 Ų78.956%0.56141%0.406SS*.Hα-helixtrans-61.6-44.6175.1-71.5175.6-169.800111.7S358 Q364 I365 L366S358-E362 PolarHBondContact O-N 3.38Å; E362-Q364 VanDerWaalsContact C-N 3.34Å; E362-Q364 PolarHBondContact O-N 3.39Å; E362-I365 PolarHBondContact O-N 3.09Å; E362-L366 WeakPolarHBondContact O-CG 3.49Å; E362-L366 PolarHBondContact O-N 3.05Å
363K85.9Confident79.8Confident147 Ų14778.9 Ų78.964%0.63941%0.409SS*.Hα-helixtrans-60.5-40.6175.4-73.9172-175.5177.30112.9D359 Y360 L366 K367D359-K363 WeakPolarHBondContact O-CB 3.31Å; D359-K363 VanDerWaalsContact O-CG 3.26Å; D359-K363 WeakPolarHBondContact O-CG 3.49Å; D359-K363 PolarHBondContact O-N 3.11Å; Y360-K363 PolarHBondContact O-N 3.28Å; K363-L366 PolarHBondContact O-N 2.65Å; K363-K367 WeakPolarHBondContact O-CB 3.37Å; K363-K367 PolarHBondContact O-N 2.81Å
364Q81.2Confident77.4Confident65 Ų6585.7 Ų85.730%0.30445%0.446SS..Hα-helixtrans-64.4-42.6176-74-7723.200111.7Y360 K361 E362 L366 K367 V368Y360-Q364 HydrophobicContact CD1-CG 4.32Å; Y360-Q364 HydrophobicContact CE1-CG 3.94Å; Y360-Q364 HydrophobicContact CE2-CG 4.39Å; Y360-Q364 WeakPolarHBondContact O-CG 3.4Å; Y360-Q364 PolarHBondContact O-N 3.21Å; Y360-Q364 PolarHBondContact OH-NE2 2.7Å; K361-Q364 PolarHBondContact O-N 2.9Å; E362-Q364 VanDerWaalsContact C-N 3.34Å; E362-Q364 PolarHBondContact O-N 3.39Å; Q364-L366 PolarHBondContact O-N 2.88Å; Q364-K367 PolarHBondContact O-N 2.72Å; Q364-V368 WeakPolarHBondContact O-CG2 3.47Å; Q364-V368 PolarHBondContact O-N 3.42Å; Q364-V368 VanDerWaalsContact O-N 3.1Å
365I80.7Confident75Confident102 Ų10290.1 Ų90.152%0.52347%0.474SS..Hα-helixtrans-62.1-44.9177.2-67.6163.6000111.1K361 E362 K367 V368 S369K361-I365 HydrophobicContact CG-CD1 4.21Å; K361-I365 VanDerWaalsContact O-CG1 3.3Å; K361-I365 WeakPolarHBondContact O-CG1 3.27Å; K361-I365 PolarHBondContact O-N 2.89Å; E362-I365 PolarHBondContact O-N 3.09Å; I365-K367 VanDerWaalsContact C-N 3.31Å; I365-K367 PolarHBondContact O-N 3.2Å; I365-V368 PolarHBondContact O-N 2.82Å; I365-S369 PolarHBondContact O-N 3.31Å
366L77.1Confident72.5Confident116 Ų11693.4 Ų93.461%0.60749%0.49SS*.Hα-helixtrans-62.3-39.2178.1-70.6170.5000111.8E362 K363 Q364 S369 S370E362-L366 WeakPolarHBondContact O-CG 3.49Å; E362-L366 PolarHBondContact O-N 3.05Å; K363-L366 PolarHBondContact O-N 2.65Å; Q364-L366 PolarHBondContact O-N 2.88Å; L366-S369 WeakPolarHBondContact CA-OG 3.42Å; L366-S369 PolarHBondContact O-N 3.35Å; L366-S369 PolarHBondContact O-OG 3Å; L366-S370 PolarHBondContact O-N 3.23Å; L366-S370 VanDerWaalsContact O-N 3.08Å; L366-S370 PolarHBondContact O-OG 3.29Å
367K76.4Confident69.8Low105 Ų105100.6 Ų100.646%0.45752%0.522SS..Hα-helixtrans-62.4-45.8176.4-167.8177.3178.8-172.20112.3K363 Q364 I365 S369 S370 E371K363-K367 WeakPolarHBondContact O-CB 3.37Å; K363-K367 PolarHBondContact O-N 2.81Å; Q364-K367 PolarHBondContact O-N 2.72Å; I365-K367 VanDerWaalsContact C-N 3.31Å; I365-K367 PolarHBondContact O-N 3.2Å; K367-S369 VanDerWaalsContact C-N 3.3Å; K367-S369 PolarHBondContact O-N 3.11Å; K367-S370 PolarHBondContact O-N 3.33Å; K367-S370 PolarHBondContact O-OG 2.99Å; K367-E371 VanDerWaalsContact CE-OE1 3.28Å; K367-E371 WeakPolarHBondContact CE-OE1 3.28Å; K367-E371 WeakPolarHBondContact O-CG 3.4Å; K367-E371 PolarHBondContact O-N 3.45Å; K367-E371 VanDerWaalsContact O-N 3.09Å
368V71.1Confident67Low76 Ų76107 Ų10746%0.46156%0.557SS.*Hα-helixtrans-61.9-37.7175.8174.90000111.4Q364 I365 E371 N372Q364-V368 WeakPolarHBondContact O-CG2 3.47Å; Q364-V368 PolarHBondContact O-N 3.42Å; Q364-V368 VanDerWaalsContact O-N 3.1Å; I365-V368 PolarHBondContact O-N 2.82Å; V368-E371 PolarHBondContact O-N 2.81Å; V368-N372 PolarHBondContact O-N 3.16Å; V368-N372 PolarHBondContact O-ND2 3.18Å
369S65.1Low64.6Low62 Ų62113.7 Ų113.743%0.43459%0.589SS.*Hα-helixtrans-68.4-33.6177.365.10000113.9I365 L366 K367 S373I365-S369 PolarHBondContact O-N 3.31Å; L366-S369 WeakPolarHBondContact CA-OG 3.42Å; L366-S369 PolarHBondContact O-N 3.35Å; L366-S369 PolarHBondContact O-OG 3Å; K367-S369 VanDerWaalsContact C-N 3.3Å; K367-S369 PolarHBondContact O-N 3.11Å; S369-S373 PolarHBondContact O-OG 3.3Å
370S61.1Low61.7Low70 Ų70119.1 Ų119.149%0.4961%0.609SS.*Hα-helixtrans-73.6-33.3174.952.60000113.3L366 K367 S373L366-S370 PolarHBondContact O-N 3.23Å; L366-S370 VanDerWaalsContact O-N 3.08Å; L366-S370 PolarHBondContact O-OG 3.29Å; K367-S370 PolarHBondContact O-N 3.33Å; K367-S370 PolarHBondContact O-OG 2.99Å; S370-S373 WeakPolarHBondContact O-CB 3.3Å; S370-S373 PolarHBondContact O-N 3.3Å
371E56.5Low58.7Low117 Ų117123.9 Ų123.955%0.54764%0.636SS.*Hα-helixtrans-71.3-31.7177.6-72.6171-176.900111.7K367 V368 S373K367-E371 VanDerWaalsContact CE-OE1 3.28Å; K367-E371 WeakPolarHBondContact CE-OE1 3.28Å; K367-E371 WeakPolarHBondContact O-CG 3.4Å; K367-E371 PolarHBondContact O-N 3.45Å; K367-E371 VanDerWaalsContact O-N 3.09Å; V368-E371 PolarHBondContact O-N 2.81Å; E371-S373 PolarHBondContact O-N 3.34Å
372N55Low56Low133 Ų133124.6 Ų124.671%0.71165%0.651SS**THydrogen-bonded Turntrans-77.12.2174-67.6-23.2000114.4V368V368-N372 PolarHBondContact O-N 3.16Å; V368-N372 PolarHBondContact O-ND2 3.18Å
373S52Low53.5Low86 Ų86122.7 Ų122.760%0.60165%0.651SS**THydrogen-bonded Turntrans-100.59.8-179.5-55.80000113.8S369 S370 E371 P375S369-S373 PolarHBondContact O-OG 3.3Å; S370-S373 WeakPolarHBondContact O-CB 3.3Å; S370-S373 PolarHBondContact O-N 3.3Å; E371-S373 PolarHBondContact O-N 3.34Å; S373-P375 WeakPolarHBondContact O-CD 3.34Å
374N43.1Very low50.8Low146 Ų146124.8 Ų124.878%0.78166%0.663SS**  trans-99.999.9167.3-83.2-13.4000109.9
375P43.8Very low48.4Very low115 Ų115130.3 Ų130.375%0.74769%0.689SS**  trans-98.290175.135.2-23000109.1S373S373-P375 WeakPolarHBondContact O-CD 3.34Å
376E40.7Very low46.1Very low189 Ų189134.5 Ų134.588%0.88371%0.706SS**  trans-133.573155-80.1-162.7164.700109
377Q36.8Very low43.8Very low197 Ų197133.6 Ų133.692%0.92171%0.71SS**SBend-170.5105.6127.2-99.4169.22000108.8
378D33.1Very low41.5Very low145 Ų145136.9 Ų136.978%0.77573%0.727SS**  trans-56.7142.2-178.9-87.6-39.5000113.9K380D378-K380 PolarHBondContact O-N 2.95Å; D378-K380 VanDerWaalsContact O-N 3.11Å
379L42.3Very low39.5Very low166 Ų166144.3 Ų144.387%0.86975%0.747SS**  11.890.7126.2-73157.6000115.1
380K29.7Very low37.7Very low188 Ų188147.9 Ų147.982%0.81776%0.76SS**  trans-134.3112.2143.7-121.6176.1175.2175.60109.6D378D378-K380 PolarHBondContact O-N 2.95Å; D378-K380 VanDerWaalsContact O-N 3.11Å
381L27.9Very low36.2Very low125 Ų125153.7 Ų153.765%0.65478%0.777SS**  trans81.979.3150.4-57.8157.3000117.2S383L381-S383 PolarHBondContact O-N 3.4Å
382T29.5Very low34.7Very low146 Ų146151.4 Ų151.490%0.89678%0.784SS**SBend-74.283.7127.654.10000108
383S34.3Very low33.4Very low80 Ų80149.8 Ų149.856%0.55978%0.783SS**  trans172.287.3154.435.10000107.6L381L381-S383 PolarHBondContact O-N 3.4Å
384E29.3Very low32.1Very low191 Ų191153.7 Ų153.789%0.89379%0.792SS**  trans-164.3117.5130.4-103.4165.1-161.200106.8
385E30.1Very low31.3Very low182 Ų182153.9 Ų153.985%0.8579%0.793SS**  trans-57.7154.7172.5-67167.8138.700110.6S387E385-S387 PolarHBondContact O-N 3.05Å
386E33.6Very low30.5Very low189 Ų189154 Ų15488%0.88380%0.796SS**  trans1699.2148.9-64.3-173.6138.900117.2
387S27.4Very low29.9Very low97 Ų97153.8 Ų153.868%0.67880%0.796SS**  trans-155.3116.1142.9-96.20000113.3E385E385-S387 PolarHBondContact O-N 3.05Å
388Q30.1Very low30Very low175 Ų175149.6 Ų149.682%0.81879%0.785SS**  trans74.3104.3137.2-56.5171.531.600115.6
389R27.6Very low29.7Very low232 Ų232151.4 Ų151.488%0.87579%0.789SS**  56.2120.881.5-141-173.3-153.41807112.2
390L28.1Very low29Very low137 Ų137152.2 Ų152.272%0.71779%0.788SS**  trans89.9123.7155.8-75142.6000119.9
391K29.2Very low28.7Very low192 Ų192151.6 Ų151.684%0.83579%0.791SS**  trans71.2119.7153.4-60.2174.1-177.9-175.80114
392G25.1Very low28.7Very low68 Ų68150.5 Ų150.570%0.70179%0.793SS**  cis98.8115.43800000108.3
393S27.4Very low28.6Very low99 Ų99152.8 Ų152.869%0.69279%0.794SS**  trans153.1140.114351.60000111.9
394E25.2Very low28.3Very low168 Ų168157.8 Ų157.879%0.78581%0.808SS**  trans70.1107.7140.7-67.5162.7-162.500118.4
395N25.4Very low28.5Very low151 Ų151154.5 Ų154.581%0.80780%0.804SS**  66.6107.386.5-86-2.5000112.9
396S27Very low28.5Very low116 Ų116154.7 Ų154.781%0.81181%0.805SS**  157136.9109.2-63.30000110.9
397Q28.7Very low28.4Very low186 Ų186151.9 Ų151.987%0.86979%0.794SS**  trans-50.3174.1156.8-66.7178.4-79.800111
398P39.8Very low28.6Very low108 Ų108154.4 Ų154.470%0.70180%0.8SS**  cis-150.7-175.228.529.2-0.8000116.8
399E25.2Very low29.2Very low184 Ų184153.4 Ų153.486%0.8679%0.793SS**  trans134.6126.4131.8-65.8-158.4160.300116.6
400E27.6Very low29.4Very low182 Ų182145.7 Ų145.785%0.8579%0.785SS**  trans-65.6149170.2-69.9173.2121.200112.2
401M23.5Very low29.9Very low176 Ų176141.8 Ų141.887%0.86778%0.778SS**  trans-162107131.6-116.7-176.2-57.900111.6
402S28.4Very low30.7Very low101 Ų101135.9 Ų135.971%0.70676%0.756SS**  trans28.4123132-41.50000119.8
403Q28Very low32Very low195 Ų195140.6 Ų140.691%0.91175%0.752SS**  175.2114.6110.3-92.2165800111.1
404E28.1Very low33.1Very low185 Ų185142.5 Ų142.586%0.86475%0.748SS**  trans-80151.3167-66-174145.700111.1
405P33.3Very low34.5Very low122 Ų122135.3 Ų135.379%0.79272%0.715SS**  trans-107.5114.315729.7-16.5000112.4
406E29.3Very low35.8Very low186 Ų186133 Ų13387%0.86970%0.7SS**  trans31.9115.3138.3-74.1-78.6149.800119.8
407I32.6Very low37.2Very low130 Ų130133.3 Ų133.367%0.66769%0.688SS**  trans-85.1127.1-178.3-63.4165.6000111.3K409I407-K409 PolarHBondContact O-N 2.83Å; I407-K409 VanDerWaalsContact O-N 3.09Å
408N30.1Very low38.3Very low149 Ų149128 Ų12880%0.79766%0.664SS**  trans-73.595.9172.1-164.1-15.5000111.7G410N408-G410 PolarHBondContact O-N 2.88Å
409K43.1Very low39Very low155 Ų155125.1 Ų125.167%0.67464%0.641SS**THydrogen-bonded Turntrans-73.129.4-177.2-69-175.7177174.70116.2I407I407-K409 PolarHBondContact O-N 2.83Å; I407-K409 VanDerWaalsContact O-N 3.09Å
410G31.4Very low40.3Very low69 Ų69124 Ų12471%0.71163%0.634SS**THydrogen-bonded Turntrans-90.7-23.4-171.900000116.4N408N408-G410 PolarHBondContact O-N 2.88Å
411G40.1Very low41.6Very low55 Ų55122 Ų12257%0.56762%0.622SS**SBendtrans-111.9-13.4-170.300000115.7
412D45.6Very low42.7Very low68 Ų68117 Ų11736%0.36460%0.596SS.*SBendtrans-87.5-24.5-167.2-70.2-47.4000114.9K256 K414K256-D412 VanDerWaalsContact NZ-CA 3.27Å; K256-D412 PolarHBondContact NZ-O 2.9Å; K256-D412 IonicContact NZ-OD1 3.95Å; K256-D412 PolarHBondContact NZ-OD1 2.94Å; D412-K414 VanDerWaalsContact C-N 3.33Å; D412-K414 PolarHBondContact O-N 3.35Å
413R52.9Low43.1Very low167 Ų167114.7 Ų114.763%0.6359%0.589SS**Hα-helixtrans-64.5-30.3-176-64.5-174.1-153.3179.54.6114.1V415 E416 E417R413-V415 PolarHBondContact O-N 2.87Å; R413-E416 PolarHBondContact O-N 3.49Å; R413-E417 WeakPolarHBondContact O-CB 3.49Å; R413-E417 PolarHBondContact O-N 2.98Å
414K50.3Low43.3Very low140 Ų140110.6 Ų110.661%0.60958%0.582SS**Hα-helixtrans-68.6-35.7-171.2-166.2174.1-178.3-176.20113.5D412 E418D412-K414 VanDerWaalsContact C-N 3.33Å; D412-K414 PolarHBondContact O-N 3.35Å; K414-E418 WeakPolarHBondContact O-CB 3.25Å; K414-E418 WeakPolarHBondContact O-CG 3.48Å; K414-E418 PolarHBondContact O-N 3.25Å; K414-E418 VanDerWaalsContact O-N 3.12Å
415V54.3Low43.6Very low16 Ų16107.7 Ų107.710%0.09758%0.577CS.*Hα-helixtrans-75.2-43.5175-179.60000109.5L253 K256 R413 E417 E418 M419L253-V415 HydrophobicContact CD2-CG2 3.83Å; K256-V415 HydrophobicContact CD-CB 4.44Å; K256-V415 HydrophobicContact CD-CG2 4.04Å; R413-V415 PolarHBondContact O-N 2.87Å; V415-E417 VanDerWaalsContact C-N 3.27Å; V415-E417 PolarHBondContact O-N 3.35Å; V415-E418 PolarHBondContact O-N 2.96Å; V415-M419 HydrophobicContact CG1-CG 4.23Å; V415-M419 HydrophobicContact CG1-SD 3.78Å; V415-M419 VanDerWaalsContact O-CB 3.27Å; V415-M419 WeakPolarHBondContact O-CB 3.23Å; V415-M419 WeakPolarHBondContact O-CG 3.43Å; V415-M419 PolarHBondContact O-N 2.85Å
416E53.3Low43.3Very low103 Ų103110.2 Ų110.248%0.48158%0.578SS.*Hα-helixtrans-60.7-33.8174.6-72.8175.3-171.300113.3R413 K420R413-E416 PolarHBondContact O-N 3.49Å; E416-K420 WeakPolarHBondContact O-CB 3.4Å; E416-K420 VanDerWaalsContact O-CG 3.25Å; E416-K420 WeakPolarHBondContact O-CG 3.36Å; E416-K420 PolarHBondContact O-N 3.49Å
417E55.8Low43.3Very low122 Ų122109.6 Ų109.657%0.5758%0.577SS**Hα-helixtrans-78.8-38.4-179.4-167.4174.2-167.600112.2R413 V415 K420 K421R413-E417 WeakPolarHBondContact O-CB 3.49Å; R413-E417 PolarHBondContact O-N 2.98Å; V415-E417 VanDerWaalsContact C-N 3.27Å; V415-E417 PolarHBondContact O-N 3.35Å; E417-K420 PolarHBondContact O-N 3.48Å; E417-K421 PolarHBondContact O-N 3.3Å
418E52.5Low43.1Very low74 Ų74106 Ų10635%0.34657%0.573SS.*Hα-helixtrans-67.5-35.6168.6-75.3-69.613000111.4K414 V415 K421 H422K414-E418 WeakPolarHBondContact O-CB 3.25Å; K414-E418 WeakPolarHBondContact O-CG 3.48Å; K414-E418 PolarHBondContact O-N 3.25Å; K414-E418 VanDerWaalsContact O-N 3.12Å; V415-E418 PolarHBondContact O-N 2.96Å; E418-K421 PolarHBondContact O-N 2.78Å; E418-K421 IonicContact OE1-NZ 3.45Å; E418-K421 PolarHBondContact OE1-NZ 2.86Å; E418-H422 PolarHBondContact O-N 3.41Å; E418-H422 PolarHBondContact O-ND1 3.36Å; E418-H422 IonicContact OE2-CE1 2.71Å
419M53.3Low42.8Very low48 Ų48108.5 Ų108.524%0.23658%0.577CS.*Hα-helixtrans-64.2-37.7171.2-71.5171.280.500112.1L260 Y261 V415 K421 H422 G423L260-M419 HydrophobicContact CD2-CE 3.51Å; L260-M419 HydrophobicContact CD2-SD 3.71Å; Y261-M419 HydrophobicContact CE2-CE 4.29Å; V415-M419 HydrophobicContact CG1-CG 4.23Å; V415-M419 HydrophobicContact CG1-SD 3.78Å; V415-M419 VanDerWaalsContact O-CB 3.27Å; V415-M419 WeakPolarHBondContact O-CB 3.23Å; V415-M419 WeakPolarHBondContact O-CG 3.43Å; V415-M419 PolarHBondContact O-N 2.85Å; M419-K421 VanDerWaalsContact C-N 3.3Å; M419-K421 PolarHBondContact O-N 3.14Å; M419-H422 PolarHBondContact O-N 3.5Å; M419-G423 PolarHBondContact O-N 3Å
420K53.3Low42.3Very low161 Ų161107.1 Ų107.170%0.758%0.583SS**Hα-helixtrans-66.8-26.5174.9-80.5172.1-176.71790113.6E416 E417E416-K420 WeakPolarHBondContact O-CB 3.4Å; E416-K420 VanDerWaalsContact O-CG 3.25Å; E416-K420 WeakPolarHBondContact O-CG 3.36Å; E416-K420 PolarHBondContact O-N 3.49Å; E417-K420 PolarHBondContact O-N 3.48Å
421K54.4Low42.3Very low141 Ų141112.3 Ų112.361%0.61359%0.589SS**Hα-helixtrans-71.7-34.7174.7-78.2-180-174.2163.60113.1E417 E418 M419E417-K421 PolarHBondContact O-N 3.3Å; E418-K421 PolarHBondContact O-N 2.78Å; E418-K421 IonicContact OE1-NZ 3.45Å; E418-K421 PolarHBondContact OE1-NZ 2.86Å; M419-K421 VanDerWaalsContact C-N 3.3Å; M419-K421 PolarHBondContact O-N 3.14Å
422H47.1Very low41.8Very low69 Ų69117.7 Ų117.732%0.31961%0.605SS.*Hα-helixtrans-90.1-23-177-61.684.8000112.6E418 M419 S424E418-H422 PolarHBondContact O-N 3.41Å; E418-H422 PolarHBondContact O-ND1 3.36Å; E418-H422 IonicContact OE2-CE1 2.71Å; M419-H422 PolarHBondContact O-N 3.5Å; H422-S424 VanDerWaalsContact C-N 3.29Å; H422-S424 PolarHBondContact O-N 2.92Å
423G35.5Very low41.2Very low54 Ų54121.9 Ų121.956%0.55763%0.627SS**  trans-74.68.518000000117.8M419 T425M419-G423 PolarHBondContact O-N 3Å; G423-T425 PolarHBondContact O-N 2.81Å
424S32Very low40.4Very low109 Ų109120 Ų12076%0.76264%0.636SS**  trans-85.354.7177.6-153.10000112.5H422H422-S424 VanDerWaalsContact C-N 3.29Å; H422-S424 PolarHBondContact O-N 2.92Å
425T35.8Very low39.6Very low123 Ų123121 Ų12176%0.75565%0.648SS**  trans-150.482.5160.118.60000108.1G423 M427G423-T425 PolarHBondContact O-N 2.81Å; T425-M427 PolarHBondContact O-N 2.68Å
426H27.5Very low38.3Very low175 Ų175124 Ų12481%0.8168%0.683SS**  trans-70.3102.9178.2-165.3-65.9000110
427M28.8Very low37.2Very low173 Ų173123.7 Ų123.785%0.85270%0.697SS**  trans-103.7103.8159.5-72.3-67.9-94.300107T425T425-M427 PolarHBondContact O-N 2.68Å
428G27.4Very low35.9Very low56 Ų56125.1 Ų125.158%0.57772%0.715SS**PPolyproline II helixtrans-64.7134.5-176.600000112.1
429F24.7Very low34.8Very low200 Ų200126 Ų12688%0.87774%0.735SS**PPolyproline II helixtrans-83.7137.1157.8-73.6-88.3000108.4
430P31.8Very low33.5Very low126 Ų126130.1 Ų130.182%0.81876%0.757SS**PPolyproline II helixtrans-89.1120.3162.231.3-23.3000109.2
431E31.4Very low32.5Very low179 Ų179129 Ų12984%0.83676%0.76SS**PPolyproline II helixtrans-80.6134.1155.5-75.2-178.7157.800108.7
432N29.3Very low31.3Very low167 Ų167126.1 Ų126.189%0.89377%0.769SS**  trans-173.8114.7135.9-88.4-29.5000110.1
433L32.7Very low30.4Very low157 Ų157130.3 Ų130.382%0.82279%0.794SS**  trans-73.7156.6159.6-83.8160.4000109.2
434P37.6Very low30.2Very low126 Ų126135.2 Ų135.282%0.81881%0.807SS**  -146.7163.384.933.2-12.4000116.6
435N33.3Very low30.1Very low161 Ų161133.1 Ų133.186%0.86180%0.803SS**  trans-60.3149172.5-73.2-31.7000113.7
436G26.2Very low29.7Very low81 Ų81135.7 Ų135.784%0.83581%0.811SS**  trans177.6110.3161.200000112.3
437A30Very low29.8Very low95 Ų95134.9 Ų134.979%0.78581%0.811SS**  trans-81.8141.3169.700000110.6
438T28.7Very low30.4Very low153 Ų153131.9 Ų131.994%0.93981%0.805SS**  trans178160.8135.524.70000111.3
439A30Very low31.2Very low92 Ų92134.1 Ų134.176%0.7681%0.809SS**  trans-74.6166.4-163.900000116.3
440D26.8Very low31.2Very low134 Ų134134.7 Ų134.772%0.71781%0.805SS**  115.8125.4125.8-141.238.5000118.6
441N31.8Very low30.9Very low139 Ų139136.3 Ų136.374%0.74380%0.8SS**  trans45.4121.3147.9-67.7-29.5000122.7
442G28.4Very low30.7Very low79 Ų79132.5 Ų132.581%0.81479%0.793SS**  97.4121.6111.400000118.5
443D29.3Very low30.6Very low157 Ų157136.4 Ų136.484%0.8480%0.795SS**  128.5150.3126-148.413.5000116.7
444D31.1Very low30.3Very low157 Ų157135.5 Ų135.584%0.8480%0.796SS**  trans-78.1167-150.7-74.6-46.1000116.9
445G28.7Very low30.2Very low65 Ų65135 Ų13567%0.6779%0.793SS**  trans137.394.1130.500000120
446L28.9Very low29.8Very low178 Ų178135.7 Ų135.793%0.93279%0.791SS**  trans72.4144.9130.1-59.5173000122
447I27.8Very low29.8Very low157 Ų157136.9 Ų136.981%0.80579%0.786SS**  trans-101.2-169.6-161.7-31.8177.4000112.1
448P42.5Very low29.8Very low111 Ų111141.9 Ų141.972%0.72179%0.793SS**  -111.2-136.3-121.944.5-21.6000111.3
449P43.3Very low29.8Very low103 Ų103143.6 Ų143.667%0.66979%0.791SS**  cis-134.4-167.8-23.934.9-13.6000114
450R25.1Very low29.6Very low211 Ų211147.6 Ų147.680%0.79679%0.791SS**  trans123.6143.3155.4-72.7172171.4-171.40.5112.3
451K26.8Very low29.9Very low160 Ų160147 Ų14770%0.69680%0.795SS**  cis-166.6142.215.5-118.6162.2-175.5-174.60109.1
452S25.2Very low29.6Very low100 Ų100147.1 Ų147.170%0.69980%0.795SS**  trans14.3131.3139.859.40000120.9
453R28Very low29.7Very low249 Ų249149.8 Ų149.894%0.9480%0.796SS**  trans-167.8105.5131.8-104.9169.1-171.9-175.92.1112
454T27.2Very low29.8Very low137 Ų137151 Ų15184%0.8480%0.797SS**  trans-113.9150.1137.542.40000105.4
455P35.1Very low29.6Very low115 Ų115151.6 Ų151.675%0.74780%0.8SS**  -154178.484.137.9-16.4000116.1
456E25.3Very low29.8Very low177 Ų177156.6 Ų156.683%0.82781%0.806SS**  trans129.492.8153.9-73.2-178.817900111.1
457S26.3Very low29.7Very low105 Ų105154.9 Ų154.973%0.73479%0.793SS**  65.898.671.175.30000114.6
458Q29.2Very low29.6Very low200 Ų200158.8 Ų158.894%0.93580%0.8SS**  trans-136128.6144-75.3-167.5-16.900109.4
459Q28.1Very low29.1Very low190 Ų190160.2 Ų160.289%0.88880%0.796SS**  trans-79.8161.9-172.3-83.3159.1-51.600113.5
460F27.1Very low28.6Very low175 Ų175164.5 Ų164.577%0.76880%0.799SS**  trans-54174.9175.3-65.8-93.1000115.6
461P31.7Very low29Very low121 Ų121159.9 Ų159.979%0.78679%0.79SS**  -132.8142.2104.134.4-23.6000114.7
462D27.3Very low29.3Very low142 Ų142159.9 Ų159.976%0.75979%0.791SS**  trans-73.8138.2159.9-66.8-52.5000109.9
463T30.1Very low29.6Very low136 Ų136160.6 Ų160.683%0.83480%0.795SS**  trans-142.9116.5152.742.50000108.8
464E30.2Very low29.6Very low183 Ų183151.6 Ų151.686%0.85578%0.78SS**  trans-53.3145.7159.7-64.8172.6144.900110.4
465N28.5Very low30.1Very low169 Ų169153.1 Ų153.190%0.90478%0.778SS**  trans-157.6118.1141-98.5-23.7000110
466E31.8Very low30.9Very low169 Ų169152.4 Ų152.479%0.7977%0.773SS**  trans-64152.2166.8-73.8-168.8134.400112
467Q26.2Very low31.2Very low143 Ų143151.6 Ų151.667%0.66877%0.774SS**  trans68.7106.3134.4-162.2161.957.100119.2
468Y26.7Very low31.5Very low239 Ų239156.2 Ų156.294%0.93778%0.781SS**  trans-132.3109.6135.3-101.8-85.4000110.2
469H31.7Very low32.4Very low141 Ų141152.3 Ų152.365%0.65377%0.773SS**  trans-84.5158.6162.8-109.3-68.8000109.5
470R33.8Very low32.8Very low192 Ų192149.2 Ų149.273%0.72577%0.767SS**  trans82.8145.6142.2-92.6-166.4-110-177.6-2.9116.5F472R470-F472 HydrophobicContact CG-CD2 4.29Å; R470-F472 HydrophobicContact CG-CE2 4.22Å
471D32.4Very low33.5Very low115 Ų115147.6 Ų147.662%0.61577%0.772SS**  cis-160136.934.8-105.9-30.4000111
472F33.2Very low33.8Very low160 Ų160149.5 Ų149.570%0.70278%0.775SS**  71.6135.297.6-86.2-112.4000114.7R470R470-F472 HydrophobicContact CG-CD2 4.29Å; R470-F472 HydrophobicContact CG-CE2 4.22Å
473S31.7Very low35.3Very low114 Ų114148.8 Ų148.880%0.79778%0.778SS**  179166.25543.50000107.5
474G28.6Very low36.1Very low60 Ų60149.5 Ų149.562%0.61978%0.775SS**  cis-176.1146.77.800000107.8
475H36.3Very low37Very low170 Ų170150.2 Ų150.279%0.78778%0.775SS**  98.5161.785.9-92.3-32.3000112.8
476P51.9Low38Very low99 Ų99154.3 Ų154.364%0.64379%0.789SS**  -137.2-174.8-65.633.5-11.7000111.8
477N32.8Very low38.4Very low160 Ų160153.6 Ų153.686%0.85679%0.789SS**  trans-177.7129.3133.7-91.3-21.9000112.6
478F32Very low39Very low203 Ų203154.1 Ų154.189%0.8980%0.795SS**  trans-116164.7162-93.2-79.9000108.1
479P49.1Very low39.7Very low118 Ų118149.4 Ų149.477%0.76679%0.787SS**  -141.7143.211029.3-10.7000116.3
480T36.6Very low40.2Very low124 Ų124149.9 Ų149.976%0.76180%0.795SS**  trans-0.1139.7141.610.90000121.6
481T41.3Very low40.6Very low141 Ų141147.3 Ų147.387%0.86580%0.8SS**  -174.1130.5115.423.80000112
482L38.1Very low41.1Very low162 Ų162149.4 Ų149.485%0.84881%0.812SS**  trans-111.9163.5159.1-83.2169.3000107.7
483P59.1Low41.7Very low127 Ų127148.6 Ų148.683%0.82582%0.82SS**  -136158.3129.134.5-20.7000115
484I47.3Very low42.4Very low150 Ų150151.3 Ų151.377%0.76982%0.822SS**  trans-85152.8-180-65.4156.4000111.2
485K48.8Very low43.6Very low199 Ų199158.9 Ų158.987%0.86584%0.839SS**  trans-168.6135.9134.9-100.7174.3-175-176.80107
486Q49.8Very low44.3Very low254 Ų254157.9 Ų157.9100%1.18784%0.843SS**  cis-122.3024.1-75.4174.3-2300113.4

Retrieved 486 of 486 residues in 77.6 ms (Link to these results)