G4VIU5_SCHMA Loading...

Ovule protein

AlphaFold DB , UniProt , Accession G4VIU5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 180 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
1M46.8Very low40.7Very low243 Ų243153.7 Ų153.7100%1.19784%0.842SS**  0115.50-70.6-176.3176.600106.6
2S40Very low41Very low111 Ų111150.2 Ų150.278%0.77684%0.836SS**  trans-94.2131.9-147.3-56.40000114.4F4S2-F4 PolarHBondContact O-N 3.35Å
3F48.8Very low41.4Very low206 Ų206151.5 Ų151.590%0.90483%0.832SS**  trans-47.270.4169.4-132-98.6000115.4
4F40.5Very low42.1Very low187 Ų187150.7 Ų150.782%0.8283%0.826SS**  trans-142.1107.2166.7-67.2-78000110.6S2S2-F4 PolarHBondContact O-N 3.35Å
5S44.7Very low42.6Very low123 Ų123153.4 Ų153.486%0.8683%0.831SS**  trans-142.197.5166.4-54.20000108.8
6N37.9Very low42.8Very low147 Ų147148.1 Ų148.179%0.78682%0.823SS**  trans34.498.1151.1-86.316.7000119.6S8N6-S8 PolarHBondContact O-N 3.07Å
7W38.6Very low43.6Very low249 Ų249149.9 Ų149.994%0.94382%0.82SS**  trans-58.8111138.4-175.1-59.3000109.6
8S39.4Very low44.7Very low89 Ų89154.6 Ų154.662%0.62282%0.824SS**  trans-156.897.4168.9-71.50000111.2N6N6-S8 PolarHBondContact O-N 3.07Å
9S35.8Very low45.7Very low110 Ų110152.2 Ų152.277%0.76982%0.818SS**  trans45.5114.2135.7-55.50000121.9
10S34.4Very low46.5Very low116 Ų116150.2 Ų150.281%0.81181%0.813SS**  73.391.6116.2-1620000118.4
11S40.3Very low47.3Very low110 Ų110149.9 Ų149.977%0.76982%0.819SS**  trans-120.4101156.7172.10000108E13S11-E13 PolarHBondContact O-N 3.22Å
12S44.8Very low47.6Very low111 Ų111141.1 Ų141.178%0.77679%0.791SS**  trans-73.997.4-179.3520000110.7D14S12-D14 PolarHBondContact O-N 3Å
13E46.8Very low48.1Very low168 Ų168147.5 Ų147.579%0.78580%0.798SS**  trans-81.697.7165.6-59.2-163.112700108.4S11 E15S11-E13 PolarHBondContact O-N 3.22Å; E13-E15 VanDerWaalsContact C-N 3.28Å; E13-E15 PolarHBondContact O-N 3.43Å
14D50.9Low48.5Very low140 Ų140149.5 Ų149.575%0.74980%0.8SS**SBendtrans32.244134.4-150.443.1000119.3S12S12-D14 PolarHBondContact O-N 3Å
15E48.9Very low49.6Very low191 Ų191149.9 Ų149.989%0.89380%0.801SS**  trans-115.182.3169.2-73.8-121.1133.800109.1E13E13-E15 VanDerWaalsContact C-N 3.28Å; E13-E15 PolarHBondContact O-N 3.43Å
16G46.2Very low50.5Low68 Ų68155.4 Ų155.470%0.70180%0.803SS**  trans-164.98.3-174.700000119.2W18G16-W18 VanDerWaalsContact C-N 3.35Å; G16-W18 PolarHBondContact O-N 3.24Å
17F56.6Low51.6Low179 Ų179156.7 Ų156.779%0.78580%0.804SS**  trans-86.98.7-174.1-92.8-79.3000116.3
18W62.9Low52.8Low235 Ų235150.3 Ų150.389%0.8980%0.795SS**SBendtrans-102.3121173-65.3100.8000110.1G16G16-W18 VanDerWaalsContact C-N 3.35Å; G16-W18 PolarHBondContact O-N 3.24Å
19P65Low53.7Low109 Ų109150.5 Ų150.571%0.70880%0.802SS**PPolyproline II helixtrans-60.1134174.723.8-30.4000108.8
20P61.5Low54.4Low111 Ų111148.5 Ų148.572%0.72180%0.798SS**PPolyproline II helixtrans-57.6149.4-179.220.9-30.8000110.4G22P20-G22 PolarHBondContact O-N 3.11Å
21P62.8Low55.4Low145 Ų145150.9 Ų150.994%0.94280%0.802SS**SBendtrans-66.987.7177.827.3-32.2000108.9
22G51.9Low56.2Low59 Ų59156.7 Ų156.761%0.60881%0.807SS**  trans-158.3106.6-168.700000111.3P20P20-G22 PolarHBondContact O-N 3.11Å
23R50.7Low56.8Low244 Ų244159.5 Ų159.592%0.92181%0.808SS**  trans51.290.1168-72.5-180164179-4.2115K25R23-K25 PolarHBondContact O-N 3.16Å
24R57.5Low57.3Low248 Ų248156.2 Ų156.294%0.93680%0.801SS**  trans-49.7110.6153.8-67.8177.477.3137.20.2107.3R26R24-R26 PolarHBondContact O-N 2.7Å
25K63.6Low57.6Low195 Ų195156.3 Ų156.385%0.84880%0.802SS**  trans-53.8113.5167.4-81.8-173.9177.11790105.8R23 H27R23-K25 PolarHBondContact O-N 3.16Å; K25-H27 PolarHBondContact O-N 3.12Å
26R65Low57.7Low240 Ų240154.9 Ų154.991%0.90680%0.8SS**PPolyproline II helixtrans-57116.7168.1-71.5-177.4171.2-139.1-1.2105.3R24R24-R26 PolarHBondContact O-N 2.7Å
27H60.8Low58.2Low173 Ų173156.2 Ų156.280%0.80180%0.799SS**PPolyproline II helixtrans-55.2133166.6-82.9-95.4000106.6K25 A29K25-H27 PolarHBondContact O-N 3.12Å; H27-A29 PolarHBondContact O-N 2.79Å; H27-A29 VanDerWaalsContact O-N 3.17Å
28P62.6Low57.6Low115 Ų115154.5 Ų154.575%0.74780%0.798SS**PPolyproline II helixtrans-53.9129.1171.722.3-29.5000106.6G30P28-G30 VanDerWaalsContact C-N 3.33Å; P28-G30 PolarHBondContact O-N 2.03Å
29A58.5Low56.6Low94 Ų94149.4 Ų149.478%0.77780%0.798SS**  trans-54.5103.817500000106.7H27 N31H27-A29 PolarHBondContact O-N 2.79Å; H27-A29 VanDerWaalsContact O-N 3.17Å; A29-N31 PolarHBondContact O-N 3.4Å; A29-N31 VanDerWaalsContact O-N 3.12Å
30G51.5Low55.7Low67 Ų67150.2 Ų150.269%0.69180%0.801SS**  trans-67.7112.8-177.900000107.8P28 R32P28-G30 VanDerWaalsContact C-N 3.33Å; P28-G30 PolarHBondContact O-N 2.03Å; G30-R32 PolarHBondContact O-N 3.32Å
31N54Low54.8Low167 Ų167148.8 Ų148.889%0.89379%0.794SS**  trans-69.753.7166.6-78.3-10.4000110.8A29A29-N31 PolarHBondContact O-N 3.4Å; A29-N31 VanDerWaalsContact O-N 3.12Å
32R57.9Low54Low232 Ų232147.9 Ų147.988%0.87579%0.791SS**  trans-108.697.6168.3-76-171176.1175.2-1.5107.4G30G30-R32 PolarHBondContact O-N 3.32Å
33Q57.9Low53.9Low170 Ų170148.3 Ų148.379%0.79478%0.784SS**  trans-51.6122.8161.9-166.6174.4-41.300107.1D35Q33-D35 PolarHBondContact O-N 3.42Å
34P57.3Low53.6Low99 Ų99141.7 Ų141.764%0.64377%0.768SS**  trans-65122.7173.624.7-28.6000107.6D36P34-D36 PolarHBondContact O-N 3.27Å
35D55.6Low53Low141 Ų141135.7 Ų135.775%0.75476%0.762SS**  trans-62.6114.8166.7-76-44.8000107.8Q33 S37Q33-D35 PolarHBondContact O-N 3.42Å; D35-S37 PolarHBondContact O-N 2.83Å
36D52Low52.1Low161 Ų161132.6 Ų132.686%0.86176%0.759SS**THydrogen-bonded Turntrans-67.224.1-177.4-72.7-47.9000114.2P34P34-D36 PolarHBondContact O-N 3.27Å
37S56.4Low51.1Low96 Ų96124.5 Ų124.567%0.67174%0.739SS**THydrogen-bonded Turntrans-123.26.2-16740.90000115.8D35D35-S37 PolarHBondContact O-N 2.83Å
38N43.9Very low50.2Low144 Ų144122.9 Ų122.977%0.7774%0.737SS**  trans-11898.2170.3-87-16000111.5T40N38-T40 VanDerWaalsContact C-N 3.31Å; N38-T40 PolarHBondContact O-N 3.5Å
39S42.2Very low49.4Very low127 Ų127125.1 Ų125.189%0.88874%0.74SS**  trans-58.289166.3530000110.2
40T45.9Very low48.8Very low126 Ų126126.7 Ų126.777%0.77374%0.735SS**  trans-94.2103.8163.939.30000106.7N38 S42N38-T40 VanDerWaalsContact C-N 3.31Å; N38-T40 PolarHBondContact O-N 3.5Å; T40-S42 PolarHBondContact O-N 2.91Å; T40-S42 VanDerWaalsContact O-N 3.15Å
41S42.8Very low48.2Very low82 Ų82132.8 Ų132.857%0.57374%0.743SS**  trans-47.4117.5170.444.10000109.8S43S41-S43 PolarHBondContact O-N 3.13Å
42S46.7Very low47.5Very low126 Ų126136.9 Ų136.988%0.88175%0.746SS**THydrogen-bonded Turntrans-7330.6178.4500000113.6T40T40-S42 PolarHBondContact O-N 2.91Å; T40-S42 VanDerWaalsContact O-N 3.15Å
43S49Very low46.7Very low67 Ų67130.9 Ų130.947%0.46974%0.74SS.*THydrogen-bonded Turntrans-92.3-10.3173.854.20000113.8S41 S47S41-S43 PolarHBondContact O-N 3.13Å; S43-S47 PolarHBondContact O-OG 3.24Å
44D45.4Very low46.1Very low106 Ų106128.5 Ų128.557%0.56774%0.742SS**SBendtrans-99.21.6-164.7-66-13.7000115
45C45Very low45.4Very low121 Ų121131.5 Ų131.582%0.81875%0.753SS**SBendtrans-102.6-10.4-178.6-132.70000114.7
46V44.7Very low44.7Very low130 Ų130129.8 Ų129.879%0.78875%0.749SS**SBendtrans-109.6-4.4177.6-167.40000111.9
47S44.1Very low44.3Very low70 Ų70127.6 Ų127.649%0.4974%0.741SS.*SBendtrans-99-1.2-170-47.80000114.6S43S43-S47 PolarHBondContact O-OG 3.24Å
48N40.7Very low43.7Very low140 Ų140131.6 Ų131.675%0.74975%0.747SS**SBendtrans-1115.6-171.3-80.8-33.9000115.3
49I46.9Very low43.6Very low161 Ų161133.2 Ų133.283%0.82675%0.754SS**SBendtrans-92.2-16.7174.8-67172.5000111.7
50L44.7Very low43.7Very low127 Ų127130.4 Ų130.467%0.66574%0.738SS**SBendtrans-120.3141.9176.6-71.3148.4000106.7
51F39.1Very low43.6Very low196 Ų196133.3 Ų133.386%0.8674%0.742SS**  trans83.759.5178.5-51.9-80.9000117
52R39.3Very low43.4Very low253 Ų253137.2 Ų137.296%0.95576%0.757SS**  trans-127.755.5146-79.2-165.7173.1-157-0.3111.2
53S42Very low43.1Very low106 Ų106134.8 Ų134.874%0.74175%0.752SS**SBendtrans-155.1106.9153.456.10000108.5D55S53-D55 PolarHBondContact O-N 3.29Å; S53-D55 VanDerWaalsContact O-N 3.16Å
54S44.7Very low43.1Very low120 Ų120139.7 Ų139.784%0.83977%0.772SS**  trans-59.610017145.70000111
55D42.2Very low43.3Very low162 Ų162144.1 Ų144.187%0.86679%0.786SS**  trans-156.495.9134.9-122.3-18.6000109.4S53S53-D55 PolarHBondContact O-N 3.29Å; S53-D55 VanDerWaalsContact O-N 3.16Å
56P41.3Very low43.7Very low104 Ų104144 Ų14468%0.67578%0.784SS**  trans-88.3153.9-175.235-30.7000110.9
57V43.8Very low43.8Very low115 Ų115145 Ų14570%0.69778%0.78SS**SBendtrans128.3-31.9155.2-176.10000116.7
58F42.9Very low43.8Very low181 Ų181151.1 Ų151.179%0.79479%0.792SS**  trans-122.64.6-158-85.5-77.3000122.2A60F58-A60 WeakPolarHBondContact O-CB 3.09Å; F58-A60 PolarHBondContact O-N 3.16Å
59I42Very low44.3Very low178 Ų178152.2 Ų152.291%0.91379%0.79SS**SBendtrans-101.661167.2-48.7176.2000108.3
60A44.2Very low44.2Very low67 Ų67151.8 Ų151.855%0.55479%0.785SS**  72.368.695.800000111.3F58 N62F58-A60 WeakPolarHBondContact O-CB 3.09Å; F58-A60 PolarHBondContact O-N 3.16Å; A60-N62 VanDerWaalsContact C-N 3.31Å; A60-N62 PolarHBondContact O-N 3.36Å
61Q43.4Very low44.3Very low187 Ų187152.5 Ų152.587%0.87479%0.788SS**SBend74.2-9.499.3-73.3-172.87.100118
62N40Very low44.8Very low164 Ų164150.4 Ų150.488%0.87779%0.786SS**  trans-140.5112174.5-83.1-18000112.2A60A60-N62 VanDerWaalsContact C-N 3.31Å; A60-N62 PolarHBondContact O-N 3.36Å
63G39.2Very low45.1Very low75 Ų75146.4 Ų146.477%0.77378%0.778SS**SBendtrans152.6-23.5154.700000118.5
64L48.6Very low45.2Very low170 Ų170144.9 Ų144.989%0.8977%0.768SS**  trans-114.281.9-170.5-66.3167.9000110.9P66L64-P66 VanDerWaalsContact O-CD 3.29Å; L64-P66 WeakPolarHBondContact O-CD 3.02Å
65K51.5Low45.6Very low199 Ų199145.1 Ų145.187%0.86577%0.767SS**  trans-61.9119.1153-99.2-175.8178.4177.30106H67K65-H67 PolarHBondContact O-N 2.87Å
66P52.6Low46Very low119 Ų119144 Ų14477%0.77376%0.76SS**  trans-62114.3174.123.9-30.6000107.9L64 R68L64-P66 VanDerWaalsContact O-CD 3.29Å; L64-P66 WeakPolarHBondContact O-CD 3.02Å; P66-R68 VanDerWaalsContact C-N 3.28Å; P66-R68 PolarHBondContact O-N 3.16Å
67H45.7Very low45.9Very low151 Ų151144.5 Ų144.570%0.69977%0.766SS**  trans-69.192.7172.7-164.48.7000107.5K65 F69K65-H67 PolarHBondContact O-N 2.87Å; H67-F69 PolarHBondContact O-N 3.47Å
68R44.1Very low45.9Very low199 Ų199143.9 Ų143.975%0.75177%0.767SS**  trans-75.4102.9173.6-166.1174179147.1-1.3107.1P66 H70P66-R68 VanDerWaalsContact C-N 3.28Å; P66-R68 PolarHBondContact O-N 3.16Å; R68-H70 PolarHBondContact O-N 2.67Å
69F51.6Low46.2Very low162 Ų162140.8 Ų140.871%0.71177%0.768SS**  trans-61.4110.2166.4-68.9-80.8000107.8H67 L71H67-F69 PolarHBondContact O-N 3.47Å; F69-L71 VanDerWaalsContact C-N 3.32Å; F69-L71 PolarHBondContact O-N 2.78Å
70H44.4Very low46Very low152 Ų152135.2 Ų135.270%0.70476%0.755SS**  trans-73.392168.2-78.7-90.9000107.7R68 N72R68-H70 PolarHBondContact O-N 2.67Å; H70-N72 PolarHBondContact O-N 3.09Å; H70-N72 VanDerWaalsContact O-N 3.08Å
71L48.9Very low46.2Very low142 Ų142139.8 Ų139.874%0.74377%0.768SS**  trans-67.2101.4161.3-108.1134.1000106.8F69 Q73F69-L71 VanDerWaalsContact C-N 3.32Å; F69-L71 PolarHBondContact O-N 2.78Å; L71-Q73 PolarHBondContact O-N 2.92Å
72N48Very low46.2Very low152 Ų152140.9 Ų140.981%0.81377%0.77SS**  trans-65.485.5165.6-71.5-25.3000107.5H70 S74H70-N72 PolarHBondContact O-N 3.09Å; H70-N72 VanDerWaalsContact O-N 3.08Å; N72-S74 VanDerWaalsContact C-N 3.33Å; N72-S74 PolarHBondContact O-N 2.79Å
73Q47.2Very low46.9Very low169 Ų169138.3 Ų138.379%0.7977%0.765SS**  trans-69.697.2167.9-68.2-172.67.500107.1L71L71-Q73 PolarHBondContact O-N 2.92Å
74S43.6Very low47.5Very low74 Ų74143 Ų14352%0.51777%0.767SS.*  trans-56.7129.9164165.10000108.6N72 N76N72-S74 VanDerWaalsContact C-N 3.33Å; N72-S74 PolarHBondContact O-N 2.79Å; S74-N76 PolarHBondContact O-N 3.29Å; S74-N76 PolarHBondContact OG-N 3.08Å
75P52.9Low47.9Very low126 Ų126140.4 Ų140.482%0.81876%0.76SS**THydrogen-bonded Turntrans-67.80.8-178.6-4.914.6000114.9
76N49.4Very low47.8Very low137 Ų137133.5 Ų133.573%0.73375%0.746SS**THydrogen-bonded Turntrans-114.312.2-166.3-767.5000115.8S74 S78S74-N76 PolarHBondContact O-N 3.29Å; S74-N76 PolarHBondContact OG-N 3.08Å; N76-S78 PolarHBondContact O-N 2.72Å
77S40.4Very low47.5Very low115 Ų115136.2 Ų136.280%0.80475%0.753SS**  trans-93.279.8178.2-72.20000112.1
78S43.4Very low47.5Very low102 Ų102137.4 Ų137.471%0.71376%0.757SS**  trans-82.8143.8162.462.30000110.8N76N76-S78 PolarHBondContact O-N 2.72Å
79S48.7Very low47.6Very low117 Ų117133 Ų13382%0.81876%0.757SS**  trans66.2112.7-178.4720000112.8
80G38.9Very low47.3Very low61 Ų61135.8 Ų135.863%0.62976%0.764SS**  86.7120.763.200000107
81I47.7Very low47.3Very low162 Ų162136.9 Ų136.983%0.83177%0.769SS**SBendtrans97.2116.4-177.6-44.1150.3000113.4S83I81-S83 PolarHBondContact O-N 3.03Å; I81-S83 PolarHBondContact O-OG 3.46Å; I81-S83 VanDerWaalsContact O-OG 3.11Å
82F42.6Very low46.9Very low210 Ų210134.4 Ų134.492%0.92176%0.764SS**  trans-41.590.9174.7-134.6-99.5000111.5
83S55.6Low47Very low111 Ų111132.3 Ų132.378%0.77676%0.762SS**  trans-93110.2174.5-57.70000106.7I81I81-S83 PolarHBondContact O-N 3.03Å; I81-S83 PolarHBondContact O-OG 3.46Å; I81-S83 VanDerWaalsContact O-OG 3.11Å
84Q52.7Low46.7Very low174 Ų174132.5 Ų132.581%0.81376%0.762SS**PPolyproline II helixtrans-49.2137.8169.8-74.1177-24.100108.8G86Q84-G86 PolarHBondContact O-N 3.12Å
85P56.7Low47Very low115 Ų115136.3 Ų136.375%0.74777%0.774SS**PPolyproline II helixtrans-58.9120.1172.724.5-30.3000107.5
86G48.6Very low46.8Very low54 Ų54138.1 Ų138.156%0.55778%0.777SS**PPolyproline II helixtrans-53.3146.1177.800000110.5Q84 F88Q84-G86 PolarHBondContact O-N 3.12Å; G86-F88 VanDerWaalsContact O-CD2 3.23Å; G86-F88 WeakPolarHBondContact O-CD2 3.43Å; G86-F88 PolarHBondContact O-N 2.57Å
87N46.2Very low46.8Very low175 Ų175139.9 Ų139.994%0.93678%0.778SS**  trans-33.592.5177.3-92.1-21.7000112.5S89N87-S89 VanDerWaalsContact C-N 3.35Å; N87-S89 PolarHBondContact O-N 3.29Å; N87-S89 VanDerWaalsContact O-N 3.15Å
88F46.5Very low47.4Very low177 Ų177139.2 Ų139.278%0.77677%0.771SS**  trans-7997.1160.7-80.3-82000105.7G86 Y90G86-F88 VanDerWaalsContact O-CD2 3.23Å; G86-F88 WeakPolarHBondContact O-CD2 3.43Å; G86-F88 PolarHBondContact O-N 2.57Å; F88-Y90 PolarHBondContact O-N 2.88Å
89S45.4Very low47.8Very low106 Ų106137.4 Ų137.474%0.74176%0.759SS**  trans-55.7105.6162.5-171.70000106.9N87 Q91N87-S89 VanDerWaalsContact C-N 3.35Å; N87-S89 PolarHBondContact O-N 3.29Å; N87-S89 VanDerWaalsContact O-N 3.15Å; S89-Q91 PolarHBondContact O-N 3.29Å
90Y45.6Very low48.1Very low220 Ų220138.6 Ų138.686%0.86376%0.755SS**  trans-64.586.8168.3-104.7-97.4000106.8F88 S92F88-Y90 PolarHBondContact O-N 2.88Å; Y90-S92 VanDerWaalsContact C-N 3.26Å; Y90-S92 PolarHBondContact O-N 3.05Å
91Q43.9Very low48.7Very low175 Ų175143 Ų14382%0.81876%0.757SS**  trans-68.996.8154.1-81.5-171.6-12.800105.9S89 S93S89-Q91 PolarHBondContact O-N 3.29Å; Q91-S93 PolarHBondContact O-N 3.29Å
92S41.1Very low48.7Very low90 Ų90139 Ų13963%0.62974%0.744SS**  trans-63.291.2168.460.10000108.1Y90 E94Y90-S92 VanDerWaalsContact C-N 3.26Å; Y90-S92 PolarHBondContact O-N 3.05Å; S92-E94 PolarHBondContact O-N 2.79Å
93S49.1Very low48.9Very low109 Ų109137.5 Ų137.576%0.76274%0.74SS**  trans-72.182.6146.246.50000105.1Q91 M95Q91-S93 PolarHBondContact O-N 3.29Å; S93-M95 PolarHBondContact O-N 2.82Å
94E41.7Very low48.7Very low172 Ų172135 Ų13580%0.80472%0.722SS**  trans-56.493.6169.1-88.6179.6157.900107.1S92 N96S92-E94 PolarHBondContact O-N 2.79Å; E94-N96 PolarHBondContact O-N 3.02Å
95M49.2Very low48.5Very low155 Ų155134 Ų13476%0.76472%0.715SS**  trans-61.2121150.7-85.9-173.3176.700104.9S93 F97S93-M95 PolarHBondContact O-N 2.82Å; M95-F97 WeakPolarHBondContact O-CD2 3.25Å; M95-F97 PolarHBondContact O-N 3.46Å
96N49.5Very low48.1Very low164 Ų164134.2 Ų134.288%0.87771%0.71SS**  trans-48.594.4163.6-93-39.6000107.8E94 P98E94-N96 PolarHBondContact O-N 3.02Å; N96-P98 VanDerWaalsContact O-CD 3.3Å; N96-P98 WeakPolarHBondContact O-CD 3.1Å
97F49.4Very low48.1Very low173 Ų173134.9 Ų134.976%0.75971%0.71SS**  trans-70.1117.1165.6-83.9-85.2000104.8M95 S99M95-F97 WeakPolarHBondContact O-CD2 3.25Å; M95-F97 PolarHBondContact O-N 3.46Å; F97-S99 PolarHBondContact O-N 2.74Å; F97-S99 VanDerWaalsContact O-N 3.08Å
98P52.2Low48.3Very low101 Ų101129.1 Ų129.166%0.65668%0.681SS**  trans-56.6124.5166.325.1-29.7000105.4N96 L100N96-P98 VanDerWaalsContact O-CD 3.3Å; N96-P98 WeakPolarHBondContact O-CD 3.1Å; P98-L100 PolarHBondContact O-N 3.04Å
99S53.3Low48.6Very low65 Ų65128.2 Ų128.246%0.45568%0.679SS.*  trans-56.2104.9-1801710000108.1F97 F101 S102F97-S99 PolarHBondContact O-N 2.74Å; F97-S99 VanDerWaalsContact O-N 3.08Å; S99-F101 PolarHBondContact O-N 2.84Å; S99-F101 PolarHBondContact OG-N 2.83Å; S99-S102 WeakPolarHBondContact CB-OG 3.45Å; S99-S102 PolarHBondContact O-N 3.06Å; S99-S102 VanDerWaalsContact O-N 3.09Å; S99-S102 VanDerWaalsContact OG-CB 3.3Å; S99-S102 WeakPolarHBondContact OG-CB 3.3Å; S99-S102 PolarHBondContact OG-N 3.03Å; S99-S102 PolarHBondContact OG-OG 2.81Å
100L54.6Low48.9Very low141 Ų141129.6 Ų129.674%0.73868%0.678SS**THydrogen-bonded Turntrans-61.6-5.7177-66.8172.4000111.9P98P98-L100 PolarHBondContact O-N 3.04Å
101F50.3Low49.1Very low154 Ų154122.2 Ų122.268%0.67566%0.658SS**THydrogen-bonded Turntrans-120.3-0.3-178.9-64.1-78.7000114S99 F105S99-F101 PolarHBondContact O-N 2.84Å; S99-F101 PolarHBondContact OG-N 2.83Å; F101-F105 WeakPolarHBondContact O-CD2 3.4Å
102S48.2Very low49.6Very low79 Ų79117.7 Ų117.755%0.55265%0.646SS**THydrogen-bonded Turntrans-88.6-31.4-178.4-71.70000113.8S99S99-S102 WeakPolarHBondContact CB-OG 3.45Å; S99-S102 PolarHBondContact O-N 3.06Å; S99-S102 VanDerWaalsContact O-N 3.09Å; S99-S102 VanDerWaalsContact OG-CB 3.3Å; S99-S102 WeakPolarHBondContact OG-CB 3.3Å; S99-S102 PolarHBondContact OG-N 3.03Å; S99-S102 PolarHBondContact OG-OG 2.81Å
103E46.8Very low50.3Low178 Ų178123 Ų12383%0.83266%0.661SS**Hα-helixtrans-83.2-20.1176.9-100.9178.516300113.4
104S52Low50.7Low57 Ų57127.3 Ų127.340%0.39967%0.666SS.*Hα-helixtrans-86.3-10-174.848.20000114.3V108S104-V108 VanDerWaalsContact O-CG2 3.25Å; S104-V108 WeakPolarHBondContact O-CG2 3.3Å
105F48.2Very low51.3Low153 Ų153123 Ų12367%0.67165%0.651SS**Hα-helixtrans-91-36.4175.5-90.2-91000113.3F101 V108F101-F105 WeakPolarHBondContact O-CD2 3.4Å; F105-V108 PolarHBondContact O-N 3.05Å
106D48Very low51.3Low121 Ų121121.3 Ų121.365%0.64765%0.645SS**Hα-helixtrans-75.3-27.9177.5-84.6-19.7000113.1V108 Q109D106-V108 PolarHBondContact O-N 3Å; D106-Q109 PolarHBondContact O-N 2.98Å
107A49.1Very low51.5Low67 Ų67117.5 Ų117.555%0.55464%0.636SS**Hα-helixtrans-71.8-15175.700000113.6
108V51.2Low51.8Low54 Ų54115.3 Ų115.333%0.32763%0.633SS.*Hα-helixtrans-78.7-24.9177.8173.50000111.6S104 F105 D106 N110 F123S104-V108 VanDerWaalsContact O-CG2 3.25Å; S104-V108 WeakPolarHBondContact O-CG2 3.3Å; F105-V108 PolarHBondContact O-N 3.05Å; D106-V108 PolarHBondContact O-N 3Å; V108-N110 VanDerWaalsContact C-N 3.33Å; V108-F123 HydrophobicContact CG1-CB 3.7Å; V108-F123 HydrophobicContact CG1-CG 4.47Å
109Q52.4Low51.9Low159 Ų159115.4 Ų115.474%0.74363%0.627SS**Hα-helixtrans-74-22.9175.9-89.3-175.5-800113.6D106D106-Q109 PolarHBondContact O-N 2.98Å
110N51.5Low51.7Low134 Ų134113.1 Ų113.172%0.71761%0.611SS**  trans-117.877.3-178.9-71-35.2000110.5V108 S112V108-N110 VanDerWaalsContact C-N 3.33Å; N110-S112 VanDerWaalsContact C-N 3.26Å; N110-S112 PolarHBondContact O-N 2.94Å
111C49Very low51.7Low66 Ų66110.3 Ų110.345%0.44660%0.603SS.*  trans-61.893.2163.3-89.70000109.5C120C111-C120 HydrophobicContact CB-CB 4.13Å; C111-C120 WeakPolarHBondContact CB-SG 3.34Å; C111-C120 WeakPolarHBondContact SG-CB 3.25Å; C111-C120 CovalentContact SG-SG 2.03Å; C111-C120 PolarHBondContact SG-SG 2.65Å
112S54.1Low51.9Low80 Ų80113 Ų11356%0.55961%0.609SS**  trans-54.5135.2166.61670000109.4N110 K114 T115N110-S112 VanDerWaalsContact C-N 3.26Å; N110-S112 PolarHBondContact O-N 2.94Å; S112-K114 PolarHBondContact O-N 3.23Å; S112-T115 PolarHBondContact O-N 2.69Å; S112-T115 VanDerWaalsContact O-N 3.16Å; S112-T115 PolarHBondContact O-OG1 3.32Å; S112-T115 VanDerWaalsContact O-OG1 3.11Å
113E57.2Low52.3Low201 Ų201115.7 Ų115.794%0.93961%0.611SS**THydrogen-bonded Turntrans-53.2-2.1-172.3-66.3177149.600116.3
114K57.7Low52.4Low199 Ų199113.1 Ų113.187%0.86560%0.603SS**THydrogen-bonded Turntrans-104.6-5.1-177.4-66.7-178180176.70114.8S112S112-K114 PolarHBondContact O-N 3.23Å
115T53.2Low52.4Low81 Ų81114.4 Ų114.450%0.49762%0.617SS.*SBendtrans-95128.2176.944.70000111S112 A117S112-T115 PolarHBondContact O-N 2.69Å; S112-T115 VanDerWaalsContact O-N 3.16Å; S112-T115 PolarHBondContact O-OG1 3.32Å; S112-T115 VanDerWaalsContact O-OG1 3.11Å; T115-A117 PolarHBondContact O-N 3.3Å; T115-A117 VanDerWaalsContact O-N 3.12Å
116N49.8Very low52.2Low121 Ų121112.6 Ų112.665%0.64762%0.622SS**  trans-35.2115.2177.7-117.8-41.4000111.4N118 L119 C120N116-N118 PolarHBondContact O-N 3.31Å; N116-L119 HydrophobicContact CB-CD1 4.13Å; N116-L119 PolarHBondContact O-N 2.84Å; N116-C120 PolarHBondContact O-N 3.35Å
117A52.6Low52.3Low83 Ų83117.5 Ų117.569%0.68663%0.631SS**Hα-helixtrans-52.2-25.7-17800000113.2T115 S121T115-A117 PolarHBondContact O-N 3.3Å; T115-A117 VanDerWaalsContact O-N 3.12Å; A117-S121 PolarHBondContact O-N 3.16Å; A117-S121 VanDerWaalsContact O-N 3.16Å
118N56.4Low52.4Low128 Ų128120.8 Ų120.868%0.68464%0.638SS**Hα-helixtrans-71.6-24.6177.8-138.7-15.4000113.9N116N116-N118 PolarHBondContact O-N 3.31Å
119L54.3Low52.1Low102 Ų102123.7 Ų123.753%0.53465%0.652SS.*Hα-helixtrans-81.9-40.6173.3-78.4162.6000111.4N116 S121 R122 F123N116-L119 HydrophobicContact CB-CD1 4.13Å; N116-L119 PolarHBondContact O-N 2.84Å; L119-S121 VanDerWaalsContact C-N 3.27Å; L119-S121 PolarHBondContact O-N 2.98Å; L119-R122 PolarHBondContact O-N 3.24Å; L119-R122 VanDerWaalsContact O-N 3.16Å; L119-F123 WeakPolarHBondContact O-CD2 3.49Å
120C49.2Very low52.3Low17 Ų17123.3 Ų123.312%0.11566%0.655CS.*Hα-helixtrans-62.4-33.5176.1-69.70000112.4C111 N116 R122 F123 N124C111-C120 HydrophobicContact CB-CB 4.13Å; C111-C120 WeakPolarHBondContact CB-SG 3.34Å; C111-C120 WeakPolarHBondContact SG-CB 3.25Å; C111-C120 CovalentContact SG-SG 2.03Å; C111-C120 PolarHBondContact SG-SG 2.65Å; N116-C120 PolarHBondContact O-N 3.35Å; C120-R122 PolarHBondContact O-N 3.08Å; C120-F123 PolarHBondContact O-N 3.37Å; C120-N124 PolarHBondContact O-N 3.48Å; C120-N124 VanDerWaalsContact O-N 3.13Å
121S55.5Low52.2Low82 Ų82124.7 Ų124.757%0.57366%0.662SS**Hα-helixtrans-61.2-30.2175.8-173.40000113.5A117 L119 F123A117-S121 PolarHBondContact O-N 3.16Å; A117-S121 VanDerWaalsContact O-N 3.16Å; L119-S121 VanDerWaalsContact C-N 3.27Å; L119-S121 PolarHBondContact O-N 2.98Å; S121-F123 VanDerWaalsContact C-N 3.33Å; S121-F123 PolarHBondContact O-N 2.98Å
122R54.7Low52.1Low210 Ų210129 Ų12979%0.79268%0.676SS**Hα-helixtrans-76.4-18.5179.8-75.9-176.7158.6-170.8-5.3114.2L119 C120L119-R122 PolarHBondContact O-N 3.24Å; L119-R122 VanDerWaalsContact O-N 3.16Å; C120-R122 PolarHBondContact O-N 3.08Å
123F56.1Low51.7Low136 Ų136130.8 Ų130.860%0.59669%0.686SS**Hα-helixtrans-110-6.9-179.8-65.6-80.1000113.6V108 L119 C120 S121 A125V108-F123 HydrophobicContact CG1-CB 3.7Å; V108-F123 HydrophobicContact CG1-CG 4.47Å; L119-F123 WeakPolarHBondContact O-CD2 3.49Å; C120-F123 PolarHBondContact O-N 3.37Å; S121-F123 VanDerWaalsContact C-N 3.33Å; S121-F123 PolarHBondContact O-N 2.98Å; F123-A125 PolarHBondContact O-N 3.07Å
124N48.5Very low50.7Low124 Ų124129 Ų12966%0.66368%0.682SS**  trans-75.264.6168.6-85.4-20.4000111C120C120-N124 PolarHBondContact O-N 3.48Å; C120-N124 VanDerWaalsContact O-N 3.13Å
125A50.9Low50.1Low85 Ų85123.7 Ų123.770%0.70268%0.676SS**  trans-96.2110.6165.600000108.7F123F123-A125 PolarHBondContact O-N 3.07Å
126C45.2Very low49.7Very low114 Ų114128.3 Ų128.377%0.7769%0.692SS**  trans66.189.1168.5-62.90000117.1I128C126-I128 PolarHBondContact O-N 2.7Å
127R50.2Low49.5Very low225 Ų225130.2 Ų130.285%0.84970%0.702SS**  trans-70.7106.7141.8-75.6-159.5176.6-160.3-0.8107.5N129R127-N129 PolarHBondContact O-N 3.14Å
128I51.1Low49.1Very low136 Ų136133.4 Ų133.470%0.69770%0.703SS**  trans-72.8104.1162.6-60.8171000104.5C126 D130C126-I128 PolarHBondContact O-N 2.7Å; I128-D130 PolarHBondContact O-N 2.82Å
129N44.9Very low48.6Very low114 Ų114132.1 Ų132.161%0.6170%0.703SS**  trans-74.1112.4166.4-74.1-32.5000106.4R127 D131R127-N129 PolarHBondContact O-N 3.14Å; N129-D131 PolarHBondContact O-N 2.82Å
130D55.4Low48.4Very low152 Ų152133.4 Ų133.481%0.81371%0.711SS**THydrogen-bonded Turntrans-65.3-4.1179.9-74.2-47.6000114I128I128-D130 PolarHBondContact O-N 2.82Å
131D51.1Low48.6Very low162 Ų162134.5 Ų134.587%0.86672%0.719SS**THydrogen-bonded Turntrans-107.311-173.9-75-40.7000115.2N129N129-D131 PolarHBondContact O-N 2.82Å
132Q46.3Very low49.2Very low158 Ų158136.7 Ų136.774%0.73873%0.734SS**SBendtrans-106.7119.5179.8-145.2177.91.700112.4N134Q132-N134 PolarHBondContact O-N 3.16Å
133P44.9Very low49.6Very low117 Ų117128.6 Ų128.676%0.7671%0.708SS**  trans-66.4133.1-177.927.1-32.9000110.3A135P133-A135 PolarHBondContact O-N 3.02Å
134N37.9Very low50.5Low163 Ų163125.8 Ų125.887%0.87270%0.704SS**  trans-37.2105.3177.6-82.6-35.2000112.4Q132 E136Q132-N134 PolarHBondContact O-N 3.16Å; N134-E136 PolarHBondContact O-N 2.88Å
135A45.1Very low51.5Low88 Ų88125 Ų12573%0.72771%0.705SS**  trans-76.5101.5157.700000106.9P133P133-A135 PolarHBondContact O-N 3.02Å
136E44.7Very low52.6Low177 Ų177128.6 Ų128.683%0.82771%0.709SS**THydrogen-bonded Turntrans-49.9143.7161.9-61.1-178.7133.300108.8N134N134-E136 PolarHBondContact O-N 2.88Å
137D43.8Very low53.9Low161 Ų161127.5 Ų127.586%0.86170%0.695SS**THydrogen-bonded Turntrans89.623172.7-58.3-24.9000121.2
138Q44Very low54.9Low151 Ų151121 Ų12171%0.70667%0.671SS**  trans-126.188.6157.9-72.5-175.452.400111.6N140Q138-N140 PolarHBondContact O-N 2.97Å
139S47.6Very low56Low100 Ų100123.7 Ų123.770%0.69967%0.672SS**  trans-69.769.9165.355.80000110.1S141 R148S139-S141 PolarHBondContact O-N 3.15Å; S139-R148 PolarHBondContact O-NH2 3.27Å
140N50.4Low57.5Low130 Ų130124 Ų12470%0.69567%0.668SS**  trans-71.567.8162.8-70.2-28.2000107.9Q138 S142Q138-N140 PolarHBondContact O-N 2.97Å; N140-S142 PolarHBondContact O-N 3.36Å; N140-S142 VanDerWaalsContact O-N 3.12Å
141S53.3Low58.4Low40 Ų40121.2 Ų121.228%0.2865%0.653SS.*  trans-68.3116.3174.5105.10000107.4S139 T143 R148S139-S141 PolarHBondContact O-N 3.15Å; S141-T143 VanDerWaalsContact CB-OG1 3.25Å; S141-T143 WeakPolarHBondContact CB-OG1 3.45Å; S141-T143 PolarHBondContact O-N 3.41Å; S141-T143 PolarHBondContact OG-OG1 2.98Å; S141-R148 PolarHBondContact O-NH1 3.09Å; S141-R148 WeakPolarHBondContact OG-CD 3.46Å; S141-R148 PolarHBondContact OG-NE 2.97Å; S141-R148 PolarHBondContact OG-NH1 2.82Å; S141-R148 PolarHBondContact OG-NH2 2.9Å
142S66.3Low59.4Low127 Ų127119.7 Ų119.789%0.88864%0.644SS**  trans-66.25.917157.20000112.4N140N140-S142 PolarHBondContact O-N 3.36Å; N140-S142 VanDerWaalsContact O-N 3.12Å
143T63.8Low60.5Low41 Ų41115.9 Ų115.925%0.25264%0.636SS.*SBendtrans-71.3126.2180-1.40000109.6S141 L147S141-T143 VanDerWaalsContact CB-OG1 3.25Å; S141-T143 WeakPolarHBondContact CB-OG1 3.45Å; S141-T143 PolarHBondContact O-N 3.41Å; S141-T143 PolarHBondContact OG-OG1 2.98Å; T143-L147 HydrophobicContact CG2-CB 3.93Å; T143-L147 HydrophobicContact CG2-CD2 3.42Å; T143-L147 VanDerWaalsContact CG2-CD2 3.42Å; T143-L147 HydrophobicContact CG2-CG 4.28Å
144P74.7Confident61.4Low77 Ų77115.4 Ų115.450%0.562%0.623SS.*  trans-50.5143.4174.3-25.632.7000110.4M146 L147 R148P144-M146 PolarHBondContact O-N 3.19Å; P144-L147 WeakPolarHBondContact O-CA 3.5Å; P144-L147 WeakPolarHBondContact O-CB 3.27Å; P144-L147 PolarHBondContact O-N 2.76Å; P144-R148 PolarHBondContact O-N 2.8Å
145P70Confident62.1Low106 Ų106114.3 Ų114.369%0.68862%0.617SS**Hα-helixtrans-52.7-32.2-174.9-25.731.3000113.7R149P145-R149 WeakPolarHBondContact O-CB 3.45Å; P145-R149 WeakPolarHBondContact O-CG 3.4Å; P145-R149 PolarHBondContact O-N 3.06Å
146M73.7Confident62.6Low162 Ų162117.9 Ų117.980%0.79862%0.624SS**Hα-helixtrans-66.6-42.3175.5-169.3-167.7-63.200112.4P144 F150P144-M146 PolarHBondContact O-N 3.19Å; M146-F150 WeakPolarHBondContact O-CB 3.36Å; M146-F150 PolarHBondContact O-N 3.27Å
147L73.1Confident62.7Low90 Ų90113.5 Ų113.547%0.47161%0.613SS.*Hα-helixtrans-70.5-37.8178.8-138.2107.1000110.8T143 P144 F150 L151T143-L147 HydrophobicContact CG2-CB 3.93Å; T143-L147 HydrophobicContact CG2-CD2 3.42Å; T143-L147 VanDerWaalsContact CG2-CD2 3.42Å; T143-L147 HydrophobicContact CG2-CG 4.28Å; P144-L147 WeakPolarHBondContact O-CA 3.5Å; P144-L147 WeakPolarHBondContact O-CB 3.27Å; P144-L147 PolarHBondContact O-N 2.76Å; L147-F150 PolarHBondContact O-N 3.11Å; L147-L151 HydrophobicContact CD2-CD1 4.17Å; L147-L151 WeakPolarHBondContact O-CB 3.27Å; L147-L151 VanDerWaalsContact O-CG 3.27Å; L147-L151 WeakPolarHBondContact O-CG 3.36Å; L147-L151 PolarHBondContact O-N 3.04Å
148R71.5Confident62.7Low90 Ų90117.4 Ų117.434%0.3462%0.616SS.*Hα-helixtrans-58.9-51.9174-123.8176.1168.9153.40.4111.1S139 S141 P144 F150 L151 D152S139-R148 PolarHBondContact O-NH2 3.27Å; S141-R148 PolarHBondContact O-NH1 3.09Å; S141-R148 WeakPolarHBondContact OG-CD 3.46Å; S141-R148 PolarHBondContact OG-NE 2.97Å; S141-R148 PolarHBondContact OG-NH1 2.82Å; S141-R148 PolarHBondContact OG-NH2 2.9Å; P144-R148 PolarHBondContact O-N 2.8Å; R148-F150 VanDerWaalsContact C-N 3.31Å; R148-F150 PolarHBondContact O-N 3.07Å; R148-L151 PolarHBondContact O-N 3.4Å; R148-D152 WeakPolarHBondContact O-CB 3.29Å; R148-D152 VanDerWaalsContact O-CG 3.25Å; R148-D152 PolarHBondContact O-N 3.35Å
149R74Confident62.8Low191 Ų191115.3 Ų115.372%0.72161%0.614SS**Hα-helixtrans-59.1-39.5175.2-75.9178.8161.6-161-6.8113.2P145 S153P145-R149 WeakPolarHBondContact O-CB 3.45Å; P145-R149 WeakPolarHBondContact O-CG 3.4Å; P145-R149 PolarHBondContact O-N 3.06Å; R149-S153 VanDerWaalsContact O-CB 3.27Å; R149-S153 WeakPolarHBondContact O-CB 3.49Å; R149-S153 PolarHBondContact O-N 3.09Å; R149-S153 PolarHBondContact O-OG 3.21Å
150F76.4Confident62.7Low122 Ų122116.6 Ų116.654%0.53561%0.613SS.*Hα-helixtrans-64.3-46.6177.4178.5-99.1000111.5M146 L147 R148 S153 Q154M146-F150 WeakPolarHBondContact O-CB 3.36Å; M146-F150 PolarHBondContact O-N 3.27Å; L147-F150 PolarHBondContact O-N 3.11Å; R148-F150 VanDerWaalsContact C-N 3.31Å; R148-F150 PolarHBondContact O-N 3.07Å; F150-S153 PolarHBondContact O-N 2.86Å; F150-S153 PolarHBondContact O-OG 2.74Å; F150-Q154 PolarHBondContact O-N 3.08Å
151L74.5Confident62.3Low92 Ų92117.3 Ų117.348%0.48263%0.626SS.*Hα-helixtrans-68.5-40.1178.8-66.6172.5000112.1L147 R148 S153 Q154L147-L151 HydrophobicContact CD2-CD1 4.17Å; L147-L151 WeakPolarHBondContact O-CB 3.27Å; L147-L151 VanDerWaalsContact O-CG 3.27Å; L147-L151 WeakPolarHBondContact O-CG 3.36Å; L147-L151 PolarHBondContact O-N 3.04Å; R148-L151 PolarHBondContact O-N 3.4Å; L151-S153 PolarHBondContact O-N 3.05Å; L151-Q154 WeakPolarHBondContact O-CB 3.23Å; L151-Q154 PolarHBondContact O-N 2.82Å; L151-Q154 VanDerWaalsContact O-N 3.08Å
152D71.4Confident62.1Low130 Ų130119.6 Ų119.670%0.69564%0.642SS**Hα-helixtrans-66.5-27.2175.6-69.3-23.5000112.1R148 Q154R148-D152 WeakPolarHBondContact O-CB 3.29Å; R148-D152 VanDerWaalsContact O-CG 3.25Å; R148-D152 PolarHBondContact O-N 3.35Å; D152-Q154 VanDerWaalsContact C-N 3.3Å
153S68.8Low61.2Low79 Ų79121.7 Ų121.755%0.55264%0.638SS**THydrogen-bonded Turntrans-80.2-8.9173.873.80000114R149 F150 L151 D155R149-S153 VanDerWaalsContact O-CB 3.27Å; R149-S153 WeakPolarHBondContact O-CB 3.49Å; R149-S153 PolarHBondContact O-N 3.09Å; R149-S153 PolarHBondContact O-OG 3.21Å; F150-S153 PolarHBondContact O-N 2.86Å; F150-S153 PolarHBondContact O-OG 2.74Å; L151-S153 PolarHBondContact O-N 3.05Å; S153-D155 VanDerWaalsContact C-N 3.34Å; S153-D155 PolarHBondContact O-N 3.16Å; S153-D155 VanDerWaalsContact O-N 3.09Å
154Q65.2Low60.2Low106 Ų106125 Ų12550%0.49566%0.663SS.*SBendtrans-7892.4168.1-62-67.9-57.500107F150 L151 D152 N156F150-Q154 PolarHBondContact O-N 3.08Å; L151-Q154 WeakPolarHBondContact O-CB 3.23Å; L151-Q154 PolarHBondContact O-N 2.82Å; L151-Q154 VanDerWaalsContact O-N 3.08Å; D152-Q154 VanDerWaalsContact C-N 3.3Å; Q154-N156 PolarHBondContact O-N 3Å; Q154-N156 VanDerWaalsContact O-N 3.16Å
155D51.9Low59.2Low140 Ų140128.9 Ų128.975%0.74968%0.678SS**  trans-46.1127164.9-88-41000108.3S153 S157S153-D155 VanDerWaalsContact C-N 3.34Å; S153-D155 PolarHBondContact O-N 3.16Å; S153-D155 VanDerWaalsContact O-N 3.09Å; D155-S157 PolarHBondContact O-N 2.72Å; D155-S157 PolarHBondContact O-OG 2.89Å
156N54.8Low58.4Low164 Ų164128.6 Ų128.688%0.87768%0.676SS**  trans-60.426.2179.4-75.5-55.7000114.3Q154 R158Q154-N156 PolarHBondContact O-N 3Å; Q154-N156 VanDerWaalsContact O-N 3.16Å; N156-R158 PolarHBondContact O-N 3.5Å
157S48.5Very low57.6Low84 Ų84126.7 Ų126.759%0.58768%0.676SS**  trans-66.383.1162.469.90000108.9D155 T159D155-S157 PolarHBondContact O-N 2.72Å; D155-S157 PolarHBondContact O-OG 2.89Å; S157-T159 PolarHBondContact O-N 3.01Å; S157-T159 PolarHBondContact O-OG1 3.15Å; S157-T159 VanDerWaalsContact O-OG1 3.14Å
158R42.9Very low56.6Low243 Ų243127.5 Ų127.592%0.91769%0.685SS**  trans-40.985.3144-77.9172.5152.6161.2-5.9108.2N156N156-R158 PolarHBondContact O-N 3.5Å
159T46.2Very low55.7Low108 Ų108133.5 Ų133.566%0.66371%0.707SS**  trans-94.597.2167.619.80000105.2S157 C161S157-T159 PolarHBondContact O-N 3.01Å; S157-T159 PolarHBondContact O-OG1 3.15Å; S157-T159 VanDerWaalsContact O-OG1 3.14Å; T159-C161 PolarHBondContact O-N 3.11Å
160D44.5Very low55Low127 Ų127132.7 Ų132.768%0.67971%0.709SS**  trans1089.3152-69.1-61.3000114.7S162D160-S162 PolarHBondContact O-N 2.85Å
161C43.6Very low53.8Low145 Ų145134 Ų13498%0.9872%0.717SS**SBendtrans-71.742.8165.9-70.80000111.5T159T159-C161 PolarHBondContact O-N 3.11Å
162S48.6Very low52.7Low87 Ų87135 Ų13561%0.60873%0.727SS**  trans-136.854.4-178.252.90000109.8D160D160-S162 PolarHBondContact O-N 2.85Å
163Q46.3Very low51.6Low172 Ų172139.4 Ų139.480%0.80473%0.734SS**SBendtrans-128.687.8159.7-67.5-162.919.800108.9L165Q163-L165 PolarHBondContact O-N 2.91Å
164S43.9Very low50.8Low111 Ų111141.4 Ų141.478%0.77674%0.743SS**  trans18.696.2148.2590000115.7
165L52.6Low50Low158 Ų158144 Ų14483%0.82776%0.76SS**  trans-58.9129.5157.2-77.1160.6000108Q163Q163-L165 PolarHBondContact O-N 2.91Å
166P54.9Low49.9Very low99 Ų99140.5 Ų140.564%0.64376%0.757SS**  trans-60.2144.8168.926.9-31.7000108V168P166-V168 PolarHBondContact O-N 2.86Å
167P55.4Low49.6Very low122 Ų122137.7 Ų137.779%0.79275%0.75SS**  trans-57.7112.3-17722.3-31.2000108.8R169P167-R169 PolarHBondContact O-N 3.23Å
168V53.5Low49.7Very low108 Ų108139.6 Ų139.666%0.65576%0.76SS**  trans-62.694.7166.7177.90000105.3P166 F170P166-V168 PolarHBondContact O-N 2.86Å; V168-F170 VanDerWaalsContact C-N 3.34Å; V168-F170 PolarHBondContact O-N 3.05Å
169R51.9Low49.8Very low216 Ų216136.3 Ų136.382%0.81576%0.76SS**  trans-63.1103.3165.8-85.3-175.9157.4149.8-3.6105.7P167 Q171P167-R169 PolarHBondContact O-N 3.23Å; R169-Q171 VanDerWaalsContact C-N 3.25Å; R169-Q171 PolarHBondContact O-N 2.99Å
170F58.9Low49.9Very low174 Ų174140 Ų14076%0.76379%0.791SS**  trans-59.297.3162-69.4-83.8000106.9V168 T172V168-F170 VanDerWaalsContact C-N 3.34Å; V168-F170 PolarHBondContact O-N 3.05Å; F170-T172 PolarHBondContact O-N 2.79Å
171Q51.1Low50.1Low150 Ų150140.7 Ų140.770%0.70180%0.796SS**  trans-76.181.4168.3-152.3102.84500106R169 W173R169-Q171 VanDerWaalsContact C-N 3.25Å; R169-Q171 PolarHBondContact O-N 2.99Å; Q171-W173 PolarHBondContact O-N 3.17Å
172T50.8Low50.5Low113 Ų113140.5 Ų140.569%0.69379%0.786SS**  trans-66.6103.1165.346.30000106.7F170 V174F170-T172 PolarHBondContact O-N 2.79Å; T172-V174 PolarHBondContact O-N 2.81Å; T172-V174 VanDerWaalsContact O-N 3.11Å
173W49.3Very low50.6Low221 Ų221143.4 Ų143.484%0.83780%0.796SS**  trans-64.1108.6165.2-67.182.9000106.7Q171 D175Q171-W173 PolarHBondContact O-N 3.17Å; W173-D175 PolarHBondContact O-N 3.18Å
174V52.2Low50.8Low122 Ų122141.8 Ų141.874%0.73980%0.796SS**  trans-77.297.9166179.60000105.5T172 G176T172-V174 PolarHBondContact O-N 2.81Å; T172-V174 VanDerWaalsContact O-N 3.11Å; V174-G176 PolarHBondContact O-N 3.25Å; V174-G176 VanDerWaalsContact O-N 3.09Å
175D48.4Very low51.2Low161 Ų161143.7 Ų143.786%0.86180%0.797SS**THydrogen-bonded Turntrans-60.7105.5166.1-80.1-26.6000107.7W173W173-D175 PolarHBondContact O-N 3.18Å
176G50.3Low51.2Low65 Ų65142.7 Ų142.767%0.6780%0.795SS**THydrogen-bonded Turntrans165.71.6175.700000120.2V174V174-G176 PolarHBondContact O-N 3.25Å; V174-G176 VanDerWaalsContact O-N 3.09Å
177S47.8Very low50.9Low105 Ų105145.9 Ų145.973%0.73481%0.806SS**  trans-112.8110.6-179.4-63.50000112.1L179S177-L179 PolarHBondContact O-N 2.83Å
178P50.3Low50.5Low124 Ų124147.7 Ų147.781%0.80581%0.807SS**  trans-71.1118.7166.329.6-29000107.9S180P178-S180 PolarHBondContact O-N 3.12Å; P178-S180 VanDerWaalsContact O-N 3.16Å
179L45Very low50.3Low174 Ų174151 Ų15191%0.91182%0.82SS**  trans-71.2106.3163.6-72167.8000107.1S177S177-L179 PolarHBondContact O-N 2.83Å
180S47.8Very low50.2Low187 Ų187145.1 Ų145.1100%1.30882%0.82SS**  trans-65.60157.866.60000110.8P178P178-S180 PolarHBondContact O-N 3.12Å; P178-S180 VanDerWaalsContact O-N 3.16Å

Retrieved 180 of 180 residues in 22.1 ms (Link to these results)