A0A077Z760_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z760, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 586 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
1M55.1Low52.7Low228 Ų228147.2 Ų147.2100%1.12379%0.794SS**  094.30-79.4-52.9-166.200105.4
2D44Very low52.4Low159 Ų159152.6 Ų152.685%0.8580%0.795SS**  trans-131.5114.4-157.3-57.2-97.1000106.4
3E59.9Low51.9Low192 Ų192152.2 Ų152.290%0.89779%0.794SS**  trans-136.280.7-178.4-169164.4-142.300108.3
4I57.6Low51.8Low168 Ų168152.4 Ų152.486%0.86279%0.794SS**  trans-10297.3171.3-59.1179000106.2S6I4-S6 PolarHBondContact O-N 3.34Å
5A55.7Low51.5Low88 Ų88152.5 Ų152.573%0.72780%0.796SS**  trans-63122.8178.900000110.8V7A5-V7 PolarHBondContact O-N 3.29Å
6S49.4Very low51.5Low100 Ų100148.6 Ų148.670%0.69979%0.793SS**  trans-79.599.7175.853.90000110.6I4 T8I4-S6 PolarHBondContact O-N 3.34Å; S6-T8 PolarHBondContact O-N 3.46Å
7V52.6Low51.4Low118 Ų118146.9 Ų146.972%0.71579%0.792SS**  trans-76.4104168.7-179.40000108.6A5A5-V7 PolarHBondContact O-N 3.29Å
8T48.7Very low50.7Low120 Ų120148.9 Ų148.974%0.73680%0.798SS**  trans-111.389.2171.351.10000109.1S6S6-T8 PolarHBondContact O-N 3.46Å
9D51.6Low50.3Low138 Ų138150.3 Ų150.374%0.73880%0.804SS**  trans-69.9131.3175.7-72.9-41000110.9
10P50.5Low49.9Very low80 Ų80147.4 Ų147.452%0.51980%0.802SS.*  trans-83.1137.7176.7-0.719000111.5W12P10-W12 HydrophobicContact CB-CD2 3.84Å; P10-W12 HydrophobicContact CB-CE3 4.47Å; P10-W12 HydrophobicContact CB-CG 4.31Å; P10-W12 HydrophobicContact CB-CH2 4.1Å; P10-W12 HydrophobicContact CB-CZ2 3.4Å; P10-W12 HydrophobicContact CG-CH2 4.22Å; P10-W12 HydrophobicContact CG-CZ2 3.78Å
11W54.7Low49.1Very low228 Ų228149.4 Ų149.486%0.86481%0.806SS**  trans-10824.4-17257.2-80.6000113.8D13W11-D13 PolarHBondContact O-N 3.38Å
12W48.5Very low48.4Very low212 Ų212144.2 Ų144.280%0.80379%0.788SS**  trans-97.635.3-172.230.7-110.1000114.9P10P10-W12 HydrophobicContact CB-CD2 3.84Å; P10-W12 HydrophobicContact CB-CE3 4.47Å; P10-W12 HydrophobicContact CB-CG 4.31Å; P10-W12 HydrophobicContact CB-CH2 4.1Å; P10-W12 HydrophobicContact CB-CZ2 3.4Å; P10-W12 HydrophobicContact CG-CH2 4.22Å; P10-W12 HydrophobicContact CG-CZ2 3.78Å
13D46.3Very low48.4Very low147 Ų147146.5 Ų146.579%0.78679%0.79SS**  trans-141.777.8179.7-143.45.9000111.2W11W11-D13 PolarHBondContact O-N 3.38Å
14I50.9Low47.1Very low155 Ų155140.9 Ų140.980%0.79578%0.784SS**  trans-138.5102.4173.8-57.5-178.8000108.8
15D47.1Very low45.9Very low155 Ų155138.5 Ų138.583%0.82978%0.782SS**PPolyproline II helixtrans-60.1135.1172.1-84.2-49.6000112.2
16A50.9Low44.7Very low90 Ų90140.1 Ų140.174%0.74479%0.788SS**PPolyproline II helixtrans-87.3128.1174.800000110.6M18A16-M18 PolarHBondContact O-N 3.48Å
17P49.8Very low44.2Very low120 Ų120140.4 Ų140.478%0.77980%0.797SS**PPolyproline II helixtrans-70.7122-18027.8-33.7000111.4L19P17-L19 PolarHBondContact O-N 2.99Å
18M38.6Very low43.4Very low183 Ų183142.1 Ų142.190%0.90181%0.807SS**PPolyproline II helixtrans-60.7121.8168.5-76.4170.448.900110.8A16A16-M18 PolarHBondContact O-N 3.48Å
19L44.7Very low42.6Very low174 Ų174139.3 Ų139.391%0.91180%0.802SS**  trans-91112.8164-72.4175.3000109.4P17P17-L19 PolarHBondContact O-N 2.99Å
20A40.8Very low42Very low92 Ų92142.3 Ų142.376%0.7681%0.809SS**  trans-79.2156.3173.900000111.8
21E34.1Very low41.1Very low191 Ų191142.3 Ų142.389%0.89382%0.823SS**  trans-69.3131-179.2-55.3174.2127.200112
22T40.1Very low40.3Very low119 Ų119137.9 Ų137.973%0.7382%0.817SS**  trans-164.5161.4149-1.10000112.4
23F43.2Very low39.8Very low207 Ų207133 Ų13391%0.90882%0.815SS**  trans71.292.9179.3-53.2-68.6000116.6
24G32.9Very low40.1Very low74 Ų74136.4 Ų136.476%0.76382%0.817SS**  trans-102-164.8162.900000113
25S33.5Very low39.4Very low117 Ų117137.5 Ų137.582%0.81882%0.816SS**  trans71.6101.2168.9-59.90000118.7
26S30.3Very low38.9Very low122 Ų122137.5 Ų137.585%0.85382%0.816SS**  trans55.6103.6141.562.20000120.1
27A38.6Very low38.1Very low107 Ų107139.5 Ų139.588%0.88482%0.819SS**  trans-140.7121.5142.600000109.2
28T35.7Very low37.6Very low153 Ų153140.4 Ų140.494%0.93982%0.823SS**  trans-83.4123.2175.5480000110.8
29G32.1Very low37.5Very low61 Ų61139.8 Ų139.863%0.62982%0.822SS**  trans167151.316700000115.3
30F38.5Very low37.2Very low202 Ų202140.3 Ų140.389%0.88683%0.825SS**  trans55.678.7161.8-57.9-77.3000117.9
31G32.7Very low36.9Very low79 Ų79139.3 Ų139.381%0.81482%0.824SS**  trans-102.5102.8155.200000111.1
32D37.6Very low36.8Very low136 Ų136137.4 Ų137.473%0.72782%0.819SS**  trans-107.485.1170.1-79.8-48.5000109.8W34D32-W34 PolarHBondContact O-N 3.39Å
33S38.2Very low36.6Very low109 Ų109137.6 Ų137.676%0.76282%0.82SS**  trans-85.9109.2174.5-173.50000110.6F35S33-F35 PolarHBondContact O-N 3.27Å
34W51.1Low36.2Very low219 Ų219133.8 Ų133.883%0.8381%0.808SS**  trans-79.15.7-174.9-124.5-65.1000115.2D32D32-W34 PolarHBondContact O-N 3.39Å
35F37.5Very low36.2Very low177 Ų177138.7 Ų138.778%0.77681%0.809SS**SBendtrans-134.779.4-172.4-67.2-84.6000112.3S33S33-F35 PolarHBondContact O-N 3.27Å
36D35.6Very low36.1Very low156 Ų156139 Ų13983%0.83481%0.805SS**  trans-179.4104141-100.8-25.9000110.1
37T34.2Very low36.3Very low132 Ų132138.8 Ų138.881%0.8180%0.798SS**  trans-153.330.2-179.7-16.50000114.6
38T40Very low36.2Very low139 Ų139138.4 Ų138.485%0.85379%0.789SS**SBendtrans-129.836.7177.151.60000113.6
39L37.1Very low36.3Very low169 Ų169142 Ų14289%0.88579%0.786SS**  trans-13621.6175.8-140.6102.1000116.1
40L37.9Very low36.6Very low186 Ų186146.6 Ų146.697%0.97480%0.796SS**  trans-104.780.7171.7-82.9166.7000110.7
41G33.9Very low36.4Very low71 Ų71141.2 Ų141.273%0.73279%0.789SS**  trans-153.814.8-177.700000115.2
42L32.5Very low36.8Very low150 Ų150144 Ų14479%0.78579%0.79SS**  trans-119.771.4-178.6-150.584.8000111.3I44L42-I44 VanDerWaalsContact C-N 3.28Å; L42-I44 HydrophobicContact CD2-CD1 4.19Å; L42-I44 HydrophobicContact CD2-CG1 4.04Å; L42-I44 HydrophobicContact CG-CG1 4.33Å; L42-I44 PolarHBondContact O-N 3.2Å
43T36Very low36.7Very low124 Ų124145.7 Ų145.776%0.76179%0.794SS**  trans-66.887.816624.90000109.6F45T43-F45 PolarHBondContact O-N 2.86Å
44I35.2Very low36.9Very low127 Ų127147.6 Ų147.665%0.65180%0.801SS**  trans-65.7101.1168.5-59.5178000107.4L42 V46L42-I44 VanDerWaalsContact C-N 3.28Å; L42-I44 HydrophobicContact CD2-CD1 4.19Å; L42-I44 HydrophobicContact CD2-CG1 4.04Å; L42-I44 HydrophobicContact CG-CG1 4.33Å; L42-I44 PolarHBondContact O-N 3.2Å; I44-V46 VanDerWaalsContact C-N 3.32Å; I44-V46 HydrophobicContact CG2-CG2 4.15Å; I44-V46 PolarHBondContact O-N 3.01Å
45F32.3Very low36.1Very low177 Ų177143 Ų14378%0.77680%0.797SS**  trans-64.396.6163.4-85.4-95.1000108.3T43 V47T43-F45 PolarHBondContact O-N 2.86Å; F45-V47 HydrophobicContact CB-CG2 4.28Å; F45-V47 PolarHBondContact O-N 2.81Å
46V32.2Very low36.2Very low124 Ų124139.8 Ų139.875%0.75279%0.794SS**  trans-70.583.9163.1-178.10000106.8I44 S48I44-V46 VanDerWaalsContact C-N 3.32Å; I44-V46 HydrophobicContact CG2-CG2 4.15Å; I44-V46 PolarHBondContact O-N 3.01Å; V46-S48 PolarHBondContact O-N 3.41Å; V46-S48 VanDerWaalsContact O-N 3.15Å
47V34.2Very low36.4Very low116 Ų116141.1 Ų141.170%0.70380%0.795SS**  trans-69.3106.3168.8178.20000106.7F45 R49F45-V47 HydrophobicContact CB-CG2 4.28Å; F45-V47 PolarHBondContact O-N 2.81Å; V47-R49 PolarHBondContact O-N 3.45Å; V47-R49 VanDerWaalsContact O-N 3.08Å
48S36.5Very low36.8Very low99 Ų99141.8 Ų141.869%0.69279%0.794SS**  trans-53.3115.6168.6-59.90000108.7V46V46-S48 PolarHBondContact O-N 3.41Å; V46-S48 VanDerWaalsContact O-N 3.15Å
49R37.8Very low37.1Very low230 Ų230141.2 Ų141.287%0.86880%0.795SS**  trans-108.481.4-179.2-169176.6-169.3163.23108.1V47 A51V47-R49 PolarHBondContact O-N 3.45Å; V47-R49 VanDerWaalsContact O-N 3.08Å; R49-A51 PolarHBondContact O-N 3.32Å
50D37.3Very low37.6Very low157 Ų157141.9 Ų141.984%0.8479%0.794SS**  trans-58122.3172.1-68.6-45.3000109.1
51A35.6Very low38Very low89 Ų89138.3 Ų138.374%0.73678%0.782SS**  trans-154.895.2-179.200000107.8R49R49-A51 PolarHBondContact O-N 3.32Å
52T39.6Very low38.4Very low138 Ų138139.9 Ų139.985%0.84779%0.788SS**  trans-128138172.6-210000108
53E36.4Very low39Very low171 Ų171137.6 Ų137.680%0.79979%0.791SS**  trans-76.8152.7-168-62.1148.8103.600113.2
54T41.1Very low39.6Very low149 Ų149137.4 Ų137.491%0.91480%0.795SS**  -158.7151.5129.61.40000110.2
55T35.9Very low40.2Very low123 Ų123138 Ų13876%0.75580%0.799SS**  trans-112.9-169.9-158.9-27.20000111.3
56P39.9Very low41.1Very low109 Ų109137.1 Ų137.171%0.70880%0.803SS**  -105.3170.4-111.240.4-28.4000115.1
57Q38.3Very low41.9Very low184 Ų184134.7 Ų134.786%0.8680%0.802SS**  trans-159.4135.6138.2-116.2169.520.200115.8
58N42.3Very low42.6Very low146 Ų146136.8 Ų136.878%0.78181%0.809SS**  trans-7.7132.2162.2-49.4-15.3000120.7
59S47.7Very low43.1Very low127 Ų127136.8 Ų136.889%0.88882%0.815SS**  -169.1153110.222.30000111.3
60E45.9Very low43.5Very low183 Ų183131.6 Ų131.686%0.85581%0.814SS**  trans-120.3-167.8-173.2-143.2-157.2134.700111
61P46.7Very low43.9Very low110 Ų110128.6 Ų128.671%0.71481%0.806SS**  -111.9177.2-114.141.4-28.1000114.7
62A42.5Very low44.7Very low105 Ų105129.7 Ų129.787%0.86881%0.806SS**  trans-135.6143.5160.200000109.7
63A44.7Very low44.7Very low102 Ų102133.2 Ų133.284%0.84381%0.805SS**  trans-123.6141.2-171.900000112.8
64S48.4Very low45.2Very low120 Ų120131.2 Ų131.284%0.83980%0.804SS**  trans-172.415914650.70000108.7
65D48.6Very low45.4Very low140 Ų140130.4 Ų130.475%0.74980%0.799SS**  cis171.8153.3-36.6-146.7-18.6000104
66N52.2Low45.8Very low158 Ų158136 Ų13685%0.84581%0.807SS**  trans81.2145.3174.8-51-72.9000119.1
67G47.7Very low46.1Very low72 Ų72140.4 Ų140.474%0.74282%0.815SS**  trans146.8-1.4166.600000119.3
68N48.4Very low46.4Very low160 Ų160136.3 Ų136.386%0.85681%0.812SS**  trans7.9108164.4-173.816.1000119.4
69A47.1Very low46.6Very low99 Ų99137.4 Ų137.482%0.81881%0.81SS**  trans-151.3112.7158.900000111.9
70S46.3Very low46.6Very low121 Ų121136.2 Ų136.285%0.84680%0.802SS**  trans-84.6138.8-175.7-1770000113.7
71S46Very low46.7Very low94 Ų94136.7 Ų136.766%0.65780%0.797SS**  trans-152.6129165.3-174.50000111Y73S71-Y73 PolarHBondContact O-N 3.18Å
72P52.6Low46.6Very low113 Ų113138.4 Ų138.473%0.73480%0.8SS**  trans-8398-167.731.8-35.4000113.5T74P72-T74 PolarHBondContact O-N 3.15Å; P72-T74 VanDerWaalsContact O-N 3.15Å
73Y40.5Very low46.7Very low212 Ų212140.6 Ų140.683%0.83180%0.795SS**  trans-70.6104.3164.6-93.8-89.1000111.1S71 T75S71-Y73 PolarHBondContact O-N 3.18Å; Y73-T75 PolarHBondContact O-N 3.06Å
74T46.3Very low46.7Very low128 Ų128142.7 Ų142.779%0.78579%0.791SS**  trans-74.48717249.20000110.9P72 R76P72-T74 PolarHBondContact O-N 3.15Å; P72-T74 VanDerWaalsContact O-N 3.15Å; T74-R76 PolarHBondContact O-N 3.13Å
75T46Very low46.5Very low132 Ų132142.9 Ų142.981%0.8179%0.787SS**  trans-64.491.3173.128.80000111.1Y73 K77Y73-T75 PolarHBondContact O-N 3.06Å; T75-K77 PolarHBondContact O-N 3.3Å
76R42.7Very low46.3Very low241 Ų241142.7 Ų142.791%0.90979%0.791SS**  trans-60.8105.5166.9-81.2-172.3170.2-168.4-2.9109.1T74 A78T74-R76 PolarHBondContact O-N 3.13Å; R76-A78 PolarHBondContact O-N 3.31Å; R76-A78 VanDerWaalsContact O-N 3.16Å
77K46.2Very low45.7Very low202 Ų202138.4 Ų138.488%0.87878%0.784SS**  trans-52120.3170.5-67.2-171176.7-172.80109.3T75 K79T75-K77 PolarHBondContact O-N 3.3Å; K77-K79 PolarHBondContact O-N 3.37Å
78A44.9Very low45.3Very low97 Ų97144.4 Ų144.480%0.80279%0.79SS**  trans-66.6127168.700000108.3R76 S80R76-A78 PolarHBondContact O-N 3.31Å; R76-A78 VanDerWaalsContact O-N 3.16Å; A78-S80 PolarHBondContact O-N 3.13Å
79K47.6Very low45.4Very low170 Ų170146.1 Ų146.174%0.73979%0.792SS**  trans-75.7108.1164.1-73.1-170.5174.4-170.40107.5K77 Y81K77-K79 PolarHBondContact O-N 3.37Å; K79-Y81 HydrophobicContact CB-CE2 4.22Å
80S48.1Very low45.4Very low102 Ų102150.5 Ų150.571%0.71379%0.788SS**  trans-58.3134.2153.943.60000107.9A78A78-S80 PolarHBondContact O-N 3.13Å
81Y46.9Very low45.3Very low193 Ų193151.2 Ų151.276%0.75778%0.778SS**  trans-106.1118.4163.7-78.1-93.1000106K79 I83K79-Y81 HydrophobicContact CB-CE2 4.22Å; Y81-I83 PolarHBondContact O-N 2.87Å; Y81-I83 VanDerWaalsContact O-N 3.1Å
82D44.3Very low45.1Very low146 Ų146156.9 Ų156.978%0.78179%0.791SS**  trans-68.1110.1175.9-59.1-50.4000108.6I84D82-I84 PolarHBondContact O-N 2.98Å; D82-I84 VanDerWaalsContact O-N 3.16Å
83I45.4Very low44.8Very low150 Ų150161.8 Ų161.877%0.76980%0.801SS**  trans-76104171.5-61.5177.8000106.2Y81 T85Y81-I83 PolarHBondContact O-N 2.87Å; Y81-I83 VanDerWaalsContact O-N 3.1Å; I83-T85 VanDerWaalsContact C-N 3.29Å; I83-T85 PolarHBondContact O-N 3.27Å
84I45Very low44.7Very low147 Ų147155 Ų15575%0.75480%0.796SS**  trans-65.392.7170.8-57.4175.1000107.9D82 V86D82-I84 PolarHBondContact O-N 2.98Å; D82-I84 VanDerWaalsContact O-N 3.16Å; I84-V86 PolarHBondContact O-N 3.18Å; I84-V86 VanDerWaalsContact O-N 3.12Å
85T44.2Very low44.2Very low124 Ų124157.7 Ų157.776%0.76180%0.799SS**  trans-68103.3163.644.20000108I83 G87I83-T85 VanDerWaalsContact C-N 3.29Å; I83-T85 PolarHBondContact O-N 3.27Å; T85-G87 PolarHBondContact O-N 3.08Å
86V44Very low44.1Very low136 Ų136156 Ų15682%0.82480%0.799SS**  trans-55.3127169.9176.90000108.5I84I84-V86 PolarHBondContact O-N 3.18Å; I84-V86 VanDerWaalsContact O-N 3.12Å
87G38.9Very low44.2Very low67 Ų67153.2 Ų153.269%0.69180%0.796SS**  trans-69.5174-174.200000113.9T85T85-G87 PolarHBondContact O-N 3.08Å
88K40.2Very low43.9Very low199 Ų199148.5 Ų148.587%0.86580%0.795SS**  trans-94.6117.9179.3-60170.9-177.7172.50110.7
89E50.4Low44Very low195 Ų195151.6 Ų151.691%0.91180%0.798SS**  trans-126.496.5159.1-66.9176.7-172.500105
90R46.6Very low44.2Very low191 Ų191152 Ų15272%0.72180%0.802SS**  69.7113.773.8-71.9-163.5110.9160.7-0113.9
91E44.6Very low44.3Very low136 Ų136155 Ų15564%0.63681%0.807SS**  trans59.275.5131-64.6151.3-15000117.5
92F42.1Very low45Very low214 Ų214151.2 Ų151.294%0.93981%0.806SS**  trans-142.677.7145.5-100.1-73.5000111
93F45.1Very low46Very low216 Ų216153.4 Ų153.495%0.94781%0.809SS**  trans-91102.6158.8-90.7-81.6000107.9E95F93-E95 PolarHBondContact O-N 3.33Å
94G40.1Very low46Very low70 Ų70151.8 Ų151.872%0.72281%0.808SS**  trans-71.2112.7171.300000110A96G94-A96 PolarHBondContact O-N 2.83Å; G94-A96 VanDerWaalsContact O-N 3.15Å
95E35.8Very low46.3Very low183 Ų183151.8 Ų151.886%0.85581%0.808SS**  trans-71101.3176.8-175.2169.5-156.100110F93F93-E95 PolarHBondContact O-N 3.33Å
96A43.8Very low46.2Very low97 Ų97155.4 Ų155.480%0.80281%0.813SS**  trans-93.6106.9172.500000108.9G94G94-A96 PolarHBondContact O-N 2.83Å; G94-A96 VanDerWaalsContact O-N 3.15Å
97Q44.4Very low46.2Very low183 Ų183157.4 Ų157.486%0.85581%0.814SS**  trans-62.1144.8178.1-71-178.9-37.200111.3
98A39.9Very low46.6Very low102 Ų102160.4 Ų160.484%0.84382%0.818SS**  trans-94.6113.8169.600000109.1
99D47Very low46.6Very low163 Ų163155.8 Ų155.887%0.87281%0.809SS**  trans-153.1166.9161.4-135.5-33.3000112.3
100E50.5Low45.9Very low178 Ų178153.6 Ų153.683%0.83280%0.804SS**  trans59.888.1171.6-152.7162.1-138.800118.6
101M50.2Low46Very low165 Ų165152.6 Ų152.681%0.81381%0.811SS**PPolyproline II helixtrans-79.4129.7161.2-94.2-169.165.600112.1
102P63.2Low45.7Very low113 Ų113153.2 Ų153.273%0.73482%0.818SS**PPolyproline II helixtrans-71.2141.5161.130.3-32.8000110.8
103K63.8Low45.7Very low192 Ų192151.6 Ų151.684%0.83582%0.818SS**PPolyproline II helixtrans-79.9145-176.5-65167.5-175.3166.20111.4I105K103-I105 PolarHBondContact O-N 3.1Å
104P45.6Very low45.6Very low117 Ų117150 Ų15076%0.7681%0.814SS**PPolyproline II helixtrans-69125.817229.1-33.6000110.4
105I52.9Low45.2Very low147 Ų147152.6 Ų152.675%0.75482%0.816SS**PPolyproline II helixtrans-73.4132.3170.2-63.2176.6000108.1K103 E107K103-I105 PolarHBondContact O-N 3.1Å; I105-E107 HydrophobicContact CG2-CG 4.14Å
106K40.9Very low45.3Very low199 Ų199151.1 Ų151.187%0.86581%0.813SS**PPolyproline II helixtrans-88.9122.9168.6-65.2178.7179.2-179.50108.3
107E45Very low45.2Very low179 Ų179153.4 Ų153.484%0.83682%0.817SS**  trans-123.2140.9161.1-73.5-177.7-177.100109.4I105I105-E107 HydrophobicContact CG2-CG 4.14Å
108T47.4Very low44.8Very low129 Ų129149.6 Ų149.679%0.79181%0.811SS**  trans-96.1149.9-170.745.10000111.4
109P39.7Very low44.8Very low103 Ų103150.5 Ų150.567%0.66981%0.808SS**  trans-70.8-172.5161.835.4-36.5000111
110D36.5Very low44.5Very low149 Ų149153.8 Ų153.880%0.79781%0.808SS**  trans76.174.6166.3-51-21.4000117.8
111I47.6Very low44.2Very low170 Ų170155.9 Ų155.987%0.87281%0.809SS**  trans-129.4135140.2-58.7-176.8000108.7
112N37.8Very low44Very low148 Ų148156.1 Ų156.179%0.79181%0.812SS**  trans-69147.4-174.2-59.9-71.4000113.1
113L41.9Very low42.8Very low180 Ų180154 Ų15494%0.94281%0.811SS**  trans-93.3107.2164.6-140.180.5000109.1
114E43.2Very low42Very low183 Ų183150.3 Ų150.386%0.85581%0.806SS**  trans-74.6139.7177.2-73.8-165.1127.200112.9
115T33.1Very low42.2Very low124 Ų124150.5 Ų150.576%0.76181%0.808SS**  trans-35.3134.2162.6-42.30000114.1
116L37.1Very low41.9Very low153 Ų153152 Ų15280%0.80181%0.814SS**  156.2119.2128.5-84.2164.6000112.6
117T41.4Very low41.6Very low144 Ų144148.2 Ų148.288%0.88381%0.812SS**  -174.310412918.30000114
118S35.6Very low41.3Very low103 Ų103143.9 Ų143.972%0.7281%0.808SS**  trans34.9113.2140.1-160.30000121.7
119P39.6Very low40.9Very low121 Ų121148.6 Ų148.679%0.78681%0.811SS**  trans-94.1151.6164.636.6-32.7000113.2
120R41.4Very low40.8Very low233 Ų233151.4 Ų151.488%0.87982%0.819SS**  trans-160.5144.5168.4-116.8169.2-171.6-175.32.7115.4
121R43.4Very low40.9Very low221 Ų221152.6 Ų152.683%0.83483%0.825SS**  trans75.7114.4176.5-55.5-179.4-177.7-99.8-0.2113.9
122L47.9Very low40.5Very low171 Ų171148.3 Ų148.390%0.89582%0.816SS**  74.9125.159.2-64.9165.6000112.2
123G38Very low40.8Very low68 Ų68149.9 Ų149.970%0.70182%0.823SS**  cis-163.1-170.1500000114.5
124P45.4Very low40.5Very low114 Ų114146.7 Ų146.774%0.7482%0.816SS**  trans-97.9169.1-165.839.3-37.4000115.2
125P51.1Low40.5Very low122 Ų122146.3 Ų146.379%0.79282%0.818SS**  -133.3139.7105.535.6-25.5000112.5
126M45.9Very low40.9Very low177 Ų177145.5 Ų145.587%0.87282%0.817SS**  67.2102.468.1-73.2-73.2-85.300114.4
127S35.5Very low41.4Very low120 Ų120144.1 Ų144.184%0.83982%0.821SS**  trans-88.3149.5169.3-51.80000111.6
128A38Very low41.6Very low89 Ų89148.5 Ų148.574%0.73682%0.821SS**  166.7144.7126.300000113.5
129R39.9Very low42.1Very low228 Ų228153.6 Ų153.686%0.8683%0.83SS**  trans61120.2156.2-67.9171.6177.9-176.2-2.9116.8
130L36.2Very low42.4Very low161 Ų161157.9 Ų157.984%0.84384%0.836SS**  57.9103.271.6-73.3169.5000112.8
131D39.1Very low42.9Very low174 Ų174151.7 Ų151.793%0.9383%0.829SS**  -146.3157.6125.1-122.1-35.5000110.5
132A39.3Very low43.2Very low81 Ų81146.6 Ų146.667%0.66983%0.827SS**  trans-120.7128.1-168.500000113
133L44Very low42.8Very low180 Ų180142.3 Ų142.394%0.94282%0.824SS**  trans-125.6107167.2-74.8176.8000110.9
134S35.8Very low43.2Very low113 Ų113147.3 Ų147.379%0.7983%0.834SS**  trans-85.6141.8164.2-66.80000110.1
135I43Very low43.3Very low176 Ų176151.8 Ų151.890%0.90384%0.842SS**  trans-145.7136.7146.8-97138.4000107.9
136S42Very low43.2Very low107 Ų107151.7 Ų151.775%0.74884%0.844SS**  trans-90.4154-17266.90000113.4
137S47.6Very low43.3Very low124 Ų124152.7 Ų152.787%0.86784%0.843SS**  trans-137.1156.7141.771.60000111
138R45Very low43.7Very low236 Ų236151.5 Ų151.589%0.89184%0.841SS**  trans-103.1143-165.5-59.7172.2176.5176.1-1.7112.2
139K46.3Very low44Very low209 Ų209153.6 Ų153.691%0.90984%0.835SS**  trans-152.9140.5139.5-116.9166.8-175.5174.70111.5
140K45.1Very low44.3Very low211 Ų211149.5 Ų149.592%0.91783%0.83SS**  trans-112.6126.7177.4-71.9-175.8176.9-177.30109.6
141S53.5Low44.9Very low103 Ų103150.3 Ų150.372%0.7282%0.822SS**  trans-162.592.1163.150.70000107.9
142S49.3Very low45.5Very low114 Ų114150.3 Ų150.380%0.79781%0.814SS**  76.896.685.868.40000112.6
143G38.4Very low46Very low81 Ų81154.6 Ų154.684%0.83582%0.82SS**  trans-36.6143-170.800000120
144L46.1Very low46.2Very low174 Ų174150.8 Ų150.891%0.91181%0.808SS**  trans-114.8131.6156.8-77173.1000109.6S146L144-S146 PolarHBondContact O-N 2.98Å
145K48.1Very low47.2Very low208 Ų208151.2 Ų151.290%0.90481%0.808SS**  trans-85.9103.4170.9-67.2178.1179.7177.90108.6K147K145-K147 PolarHBondContact O-N 3.03Å; K145-K147 VanDerWaalsContact O-N 3.1Å
146S48.9Very low47.2Very low119 Ų119147.9 Ų147.983%0.83281%0.807SS**  trans-71.399.9172.437.90000110.8L144 A148L144-S146 PolarHBondContact O-N 2.98Å; S146-A148 PolarHBondContact O-N 3.38Å
147K48.4Very low47.7Very low198 Ų198149 Ų14986%0.86181%0.809SS**  trans-67.6119.1157.3-85.2-174.3172.8-177.30108K145 E149K145-K147 PolarHBondContact O-N 3.03Å; K145-K147 VanDerWaalsContact O-N 3.1Å; K147-E149 VanDerWaalsContact C-N 3.32Å; K147-E149 PolarHBondContact O-N 3Å
148A43.8Very low47.3Very low96 Ų96147.1 Ų147.179%0.79381%0.81SS**  trans-72.786.1169.600000110S146 L150S146-A148 PolarHBondContact O-N 3.38Å; A148-L150 PolarHBondContact O-N 3.03Å
149E44Very low47.6Very low132 Ų132143.4 Ų143.462%0.61781%0.807SS**  trans-81.888.9174.8-163.4-178144.900109.9K147 R151K147-E149 VanDerWaalsContact C-N 3.32Å; K147-E149 PolarHBondContact O-N 3Å; E149-R151 VanDerWaalsContact C-N 3.31Å; E149-R151 HydrophobicContact CG-CG 4.28Å; E149-R151 PolarHBondContact O-N 2.97Å; E149-R151 IonicContact OE1-CZ 3.3Å; E149-R151 IonicContact OE1-NE 2.73Å; E149-R151 PolarHBondContact OE1-NE 3.07Å; E149-R151 IonicContact OE1-NH2 3.39Å; E149-R151 PolarHBondContact OE1-NH2 3.21Å; E149-R151 IonicContact OE2-NH2 2.67Å
150L45.8Very low48Very low142 Ų142144.8 Ų144.874%0.74381%0.806SS**  trans-67.580.9-179.1-103.5163.7000112.2A148 F152A148-L150 PolarHBondContact O-N 3.03Å; L150-F152 HydrophobicContact CD2-CE2 4.11Å; L150-F152 PolarHBondContact O-N 2.95Å
151R49.2Very low48.4Very low178 Ų178142 Ų14267%0.67280%0.8SS**  trans-80.491.4174.8-68.9-170.1177.3-176.23.7111.5E149 H153E149-R151 VanDerWaalsContact C-N 3.31Å; E149-R151 HydrophobicContact CG-CG 4.28Å; E149-R151 PolarHBondContact O-N 2.97Å; E149-R151 IonicContact OE1-CZ 3.3Å; E149-R151 IonicContact OE1-NE 2.73Å; E149-R151 PolarHBondContact OE1-NE 3.07Å; E149-R151 IonicContact OE1-NH2 3.39Å; E149-R151 PolarHBondContact OE1-NH2 3.21Å; E149-R151 IonicContact OE2-NH2 2.67Å; R151-H153 PolarHBondContact O-N 3.15Å; R151-H153 VanDerWaalsContact O-N 3.11Å
152F52.8Low48.7Very low175 Ų175142.6 Ų142.677%0.76880%0.799SS**  trans-66.1105.2166.7-83.2-87.7000111L150 S154L150-F152 HydrophobicContact CD2-CE2 4.11Å; L150-F152 PolarHBondContact O-N 2.95Å; F152-S154 PolarHBondContact O-N 2.89Å; F152-S154 VanDerWaalsContact O-N 3.15Å
153H49.6Very low48.8Very low171 Ų171142.1 Ų142.179%0.79280%0.796SS**  trans-80.282.3167.5-79.5-82.7000110.5R151R151-H153 PolarHBondContact O-N 3.15Å; R151-H153 VanDerWaalsContact O-N 3.11Å
154S47.5Very low49.3Very low100 Ų100145 Ų14570%0.69980%0.797SS**PPolyproline II helixtrans-65.8135170.7-58.90000111F152F152-S154 PolarHBondContact O-N 2.89Å; F152-S154 VanDerWaalsContact O-N 3.15Å
155P56.9Low49.7Very low121 Ų121145.7 Ų145.779%0.78679%0.793SS**PPolyproline II helixtrans-68.5150.6-18028-34.7000112.3T157P155-T157 PolarHBondContact O-N 2.97Å
156A43.2Very low49.9Very low106 Ų106140.1 Ų140.188%0.87679%0.785SS**PPolyproline II helixtrans-71.2119.9-167.100000113.9
157T52Low50.1Low130 Ų130140.9 Ų140.980%0.79879%0.785SS**  trans-128.7116.2158.740.90000109.5P155 L159P155-T157 PolarHBondContact O-N 2.97Å; T157-L159 VanDerWaalsContact C-N 3.34Å; T157-L159 PolarHBondContact O-N 2.94Å
158G39Very low50.8Low86 Ų86137.4 Ų137.489%0.88778%0.78SS**  trans-81.250.4-160.100000117.2R160G158-R160 PolarHBondContact O-N 2.9Å
159L52.1Low51.5Low158 Ų158137.9 Ų137.983%0.82778%0.778SS**  trans-91.689.5177.2-82.5167.7000112.7T157 I161T157-L159 VanDerWaalsContact C-N 3.34Å; T157-L159 PolarHBondContact O-N 2.94Å; L159-I161 PolarHBondContact O-N 3.03Å
160R55.4Low52.6Low237 Ų237137.3 Ų137.389%0.89479%0.786SS**  trans-71.392.4170-70-177.5177178.2-0.7110.9G158 T162G158-R160 PolarHBondContact O-N 2.9Å; R160-T162 PolarHBondContact O-N 3.12Å; R160-T162 VanDerWaalsContact O-N 3.16Å
161I53.5Low53.7Low153 Ų153140 Ų14079%0.78579%0.791SS**  trans-74.7101169.1-57.6178.9000108.7L159L159-I161 PolarHBondContact O-N 3.03Å
162T57.8Low54.5Low116 Ų116137 Ų13771%0.71280%0.795SS**  trans-77.9122.5177.3430000111.4R160R160-T162 PolarHBondContact O-N 3.12Å; R160-T162 VanDerWaalsContact O-N 3.16Å
163S52Low55Low103 Ų103136.7 Ų136.772%0.7279%0.794SS**  trans36.8107.9163.761.50000117.5K165S163-K165 PolarHBondContact O-N 3.41Å
164V49.1Very low55Low142 Ų142135.2 Ų135.286%0.86179%0.792SS**  trans-62.796169.3-177.50000110
165K54.7Low55.1Low189 Ų189139.1 Ų139.182%0.82280%0.796SS**  trans-74126.8172.6-151.5168.6-171.1173.70108S163 V167S163-K165 PolarHBondContact O-N 3.41Å; K165-V167 PolarHBondContact O-N 3.16Å; K165-V167 VanDerWaalsContact O-N 3.08Å
166A53.2Low54.7Low91 Ų91137.3 Ų137.375%0.75279%0.787SS**  trans-56.7114.1-16800000112.4T168A166-T168 PolarHBondContact O-N 2.98Å; A166-T168 VanDerWaalsContact O-N 3.13Å
167V51.4Low54.6Low134 Ų134142 Ų14281%0.81279%0.787SS**  trans-79.395173.7-179.10000108.1K165 S169K165-V167 PolarHBondContact O-N 3.16Å; K165-V167 VanDerWaalsContact O-N 3.08Å; V167-S169 PolarHBondContact O-N 3.22Å
168T62.7Low54.1Low125 Ų125147.1 Ų147.177%0.76779%0.792SS**PPolyproline II helixtrans-57.3125.6166.750.10000109.1A166A166-T168 PolarHBondContact O-N 2.98Å; A166-T168 VanDerWaalsContact O-N 3.13Å
169S58.6Low54.2Low107 Ų107151.2 Ų151.275%0.74879%0.793SS**PPolyproline II helixtrans-60.7138.5-179.644.50000111.4V167 K171V167-S169 PolarHBondContact O-N 3.22Å; S169-K171 PolarHBondContact O-N 3.09Å
170P68.3Low53.7Low120 Ų120149 Ų14978%0.77979%0.79SS**PPolyproline II helixtrans-64131.5175.626.7-33.3000109.7
171K69.2Low53Low199 Ų199148.8 Ų148.887%0.86579%0.79SS**PPolyproline II helixtrans-58.8127.4-179.6-151.8169.7-171.1172.90109S169 F173S169-K171 PolarHBondContact O-N 3.09Å; K171-F173 PolarHBondContact O-N 2.84Å
172P65.5Low52.3Low115 Ų115150.3 Ų150.375%0.74779%0.793SS**PPolyproline II helixtrans-61.7128.5-172.222.9-33.2000111.2N174P172-N174 PolarHBondContact O-N 3.08Å
173F63.8Low51.5Low168 Ų168152.7 Ų152.774%0.73780%0.796SS**  trans-74.3109.6-179.9-164.6-86.7000109.6K171 F175K171-F173 PolarHBondContact O-N 2.84Å; F173-F175 HydrophobicContact CB-CE2 4.47Å; F173-F175 HydrophobicContact CD1-CD1 4.4Å; F173-F175 AromaticContact CD1-CD2 3.87Å; F173-F175 HydrophobicContact CD1-CD2 3.87Å; F173-F175 HydrophobicContact CD1-CE1 4.15Å; F173-F175 AromaticContact CD1-CE2 3.59Å; F173-F175 HydrophobicContact CD1-CE2 3.59Å; F173-F175 HydrophobicContact CD1-CG 4.27Å; F173-F175 AromaticContact CD1-CZ 3.74Å; F173-F175 HydrophobicContact CD1-CZ 3.74Å; F173-F175 HydrophobicContact CE1-CD1 4.41Å; F173-F175 HydrophobicContact CE1-CE1 4.07Å; F173-F175 HydrophobicContact CE1-CE2 4.31Å; F173-F175 HydrophobicContact CE1-CZ 4.02Å; F173-F175 HydrophobicContact CG-CE2 4.42Å; F173-F175 WeakPolarHBondContact O-CD2 3.47Å; F173-F175 PolarHBondContact O-N 3.4Å
174N49.8Very low51.1Low140 Ų140151.5 Ų151.575%0.74979%0.788SS**  trans-83.187.6-166.5-151.7-1.8000111.1P172 S176P172-N174 PolarHBondContact O-N 3.08Å; N174-S176 PolarHBondContact O-N 3.06Å
175F49.4Very low50.8Low181 Ų181152.7 Ų152.779%0.79478%0.782SS**  trans-68.273.9173.1-75.1-80.6000110.9F173F173-F175 HydrophobicContact CB-CE2 4.47Å; F173-F175 HydrophobicContact CD1-CD1 4.4Å; F173-F175 AromaticContact CD1-CD2 3.87Å; F173-F175 HydrophobicContact CD1-CD2 3.87Å; F173-F175 HydrophobicContact CD1-CE1 4.15Å; F173-F175 AromaticContact CD1-CE2 3.59Å; F173-F175 HydrophobicContact CD1-CE2 3.59Å; F173-F175 HydrophobicContact CD1-CG 4.27Å; F173-F175 AromaticContact CD1-CZ 3.74Å; F173-F175 HydrophobicContact CD1-CZ 3.74Å; F173-F175 HydrophobicContact CE1-CD1 4.41Å; F173-F175 HydrophobicContact CE1-CE1 4.07Å; F173-F175 HydrophobicContact CE1-CE2 4.31Å; F173-F175 HydrophobicContact CE1-CZ 4.02Å; F173-F175 HydrophobicContact CG-CE2 4.42Å; F173-F175 WeakPolarHBondContact O-CD2 3.47Å; F173-F175 PolarHBondContact O-N 3.4Å
176S47.9Very low50.3Low84 Ų84152.1 Ų152.159%0.58778%0.782SS**  trans-150.666.9-176.8-77.40000111.6N174N174-S176 PolarHBondContact O-N 3.06Å
177K41.8Very low49.9Very low205 Ų205154.5 Ų154.589%0.89178%0.778SS**SBendtrans-170.4147.2157.3-100.5142.3-171.4179.30109.4
178R40.9Very low49.5Very low237 Ų237153.7 Ų153.789%0.89477%0.768SS**SBendtrans73.956.2177.9-56.2-176.5169.9-168.3-2.8118.6
179L40.8Very low48.7Very low172 Ų172153.2 Ų153.290%0.90176%0.764SS**  trans-137.836.9145.8-83.8-172.1000112.6R181L179-R181 PolarHBondContact O-N 3.16Å
180S41.7Very low47.8Very low112 Ų112153.2 Ų153.278%0.78376%0.76SS**  trans-79.670.2168.656.30000110.8
181R40.3Very low46.6Very low232 Ų232155 Ų15588%0.87576%0.758SS**  trans-147.352.4167.9-78.6-160.4172.2-161.2-3.6110.1L179L179-R181 PolarHBondContact O-N 3.16Å
182Q38.7Very low45.3Very low184 Ų184154.6 Ų154.686%0.8676%0.756SS**  trans-109.439.9171-162.1170.4-13.700110.4
183E41.7Very low44.3Very low166 Ų166157.8 Ų157.878%0.77676%0.758SS**  trans-109.9158.8167.4-65.3168.9146.600107.2
184S43Very low43.3Very low79 Ų79153.6 Ų153.655%0.55275%0.75SS**SBendtrans71.99.4178.496.50000119.8
185F43.2Very low42.8Very low166 Ų166155.2 Ų155.273%0.72875%0.753SS**SBendtrans-83.6-22.2171.7-106.2-77.3000115
186E45.1Very low42.3Very low177 Ų177152.5 Ų152.583%0.82775%0.751SS**SBendtrans-81.1-15.9173.4-64-163.6135.500113.4
187Q45Very low42.1Very low141 Ų141155.8 Ų155.866%0.65976%0.761SS**THydrogen-bonded Turntrans-82.5-12-176.1-160.2166.88.300113.8T190Q187-T190 PolarHBondContact O-OG1 3.01Å
188I43.2Very low42Very low118 Ų118156.8 Ų156.861%0.60576%0.759SS**THydrogen-bonded Turntrans-96.4-13.6-178.5-62.2175000111.8
189V45.1Very low41.8Very low114 Ų114150.8 Ų150.869%0.69175%0.754SS**THydrogen-bonded Turntrans-88.6-19.8-179.7-178.20000112.3
190T39.9Very low41.6Very low107 Ų107149 Ų14966%0.65675%0.75SS**SBendtrans-89.4-17.5-17941.90000114.3Q187 K192Q187-T190 PolarHBondContact O-OG1 3.01Å; T190-K192 PolarHBondContact O-N 2.99Å
191E43Very low41.2Very low158 Ų158148 Ų14874%0.73875%0.749SS**THydrogen-bonded Turntrans-91.813.4-174.5-152.4169-142.200114.6
192K41.5Very low41Very low190 Ų190149.2 Ų149.283%0.82675%0.753SS**THydrogen-bonded Turntrans-127.532.5176.7-72.4-161.2171.9-169.50115.2T190T190-K192 PolarHBondContact O-N 2.99Å
193K44.3Very low40.9Very low183 Ų183145.7 Ų145.780%0.79675%0.749SS**SBendtrans-129.38.1172.7-73.3-172.2174.9178.80115.1
194S42.3Very low40.6Very low79 Ų79146 Ų14655%0.55276%0.756SS**SBendtrans-96.5-13.1-17944.20000114.6
195E39.7Very low40.6Very low175 Ų175147.4 Ų147.482%0.81877%0.765SS**SBendtrans-103.218.2-168.9-155.7166.2-157.600114.4
196V40.3Very low40.5Very low123 Ų123145.6 Ų145.675%0.74577%0.769SS**SBendtrans-118.51.1179.5-173.50000112.4
197L43Very low40.1Very low154 Ų154141.3 Ų141.381%0.80677%0.772SS**SBendtrans-120.221.2-171.4-86.9165.9000115.1
198R38.9Very low39.9Very low226 Ų226139.8 Ų139.885%0.85377%0.772SS**SBendtrans-130.70.4179.3-69.8-175177.9152.80.5116.1
199S36.8Very low39.7Very low111 Ų111142.5 Ų142.578%0.77679%0.787SS**SBendtrans-108.15.4-171.5-50.50000114.9
200T37.2Very low39.3Very low135 Ų135140.6 Ų140.683%0.82879%0.79SS**SBendtrans-133.432.8-168.7-24.70000113.2
201A33.9Very low39.3Very low91 Ų91142.6 Ų142.675%0.75280%0.802SS**SBendtrans-146.441-173.400000114
202R35.9Very low39.2Very low256 Ų256146.4 Ų146.497%0.96681%0.81SS**  trans-155.149.1-179.3-122.4172.2-168.5-173.61.6116
203S35.7Very low39.3Very low111 Ų111146.6 Ų146.678%0.77681%0.814SS**  trans-155.185.2164.1-173.80000110.3
204N35.5Very low39.2Very low172 Ų172144.3 Ų144.392%0.9282%0.815SS**  trans-177.592.3165.2-98.2-26.1000108.7
205S44.1Very low39Very low108 Ų108149.5 Ų149.576%0.75583%0.83SS**  trans-146.181.3177.358.90000111.3G207S205-G207 PolarHBondContact O-N 3.05Å
206T39.5Very low39.2Very low129 Ų129148 Ų14879%0.79183%0.833SS**  trans28.688.7144.354.20000117.4
207G36.7Very low39.3Very low87 Ų87145.6 Ų145.690%0.89783%0.833SS**  trans-91120.4146.900000108.4S205S205-G207 PolarHBondContact O-N 3.05Å
208T40.7Very low39.5Very low109 Ų109146 Ų14667%0.66984%0.836SS**  trans-119154.6-167.6-41.10000111.6
209L39.6Very low40.1Very low174 Ų174139.8 Ų139.891%0.91183%0.825SS**  trans80.3124.9170.1-49.8174.9000117.4
210G35.9Very low40.4Very low74 Ų74143.5 Ų143.576%0.76383%0.827SS**  trans126.828.8131.900000121.9
211V40.9Very low40.5Very low150 Ų150148.7 Ų148.791%0.90983%0.832SS**  trans-107.994.4171.2-173.60000112.9
212R40.3Very low41Very low238 Ų238148 Ų14890%0.89883%0.826SS**  trans21.6118.7152-67.5-177.6169.9-175.7-5.3119.8
213Q43.8Very low41.5Very low194 Ų194143.1 Ų143.191%0.90782%0.819SS**PPolyproline II helixtrans-70.5167.8161.1-163168.43.300112
214V43.2Very low42Very low134 Ų134146.6 Ų146.681%0.81282%0.823SS**PPolyproline II helixtrans-69152-167.9175.90000114.3
215Q37.1Very low42.5Very low188 Ų188142.9 Ų142.988%0.87981%0.808SS**PPolyproline II helixtrans-79136.4174.1-64.1173.5-43.300112.8
216T43.4Very low42.4Very low144 Ų144142.5 Ų142.588%0.88381%0.806SS**  trans-151.9126.2156.2-18.10000112.2
217G43.1Very low42.8Very low72 Ų72143.7 Ų143.774%0.74280%0.802SS**  trans78.368.1137.200000122.1
218D47.8Very low43.1Very low163 Ų163144 Ų14487%0.87279%0.787SS**  66.9172.7123.2-116.114000120.7
219P50.8Low43.2Very low96 Ų96146 Ų14662%0.62379%0.788SS**  -139.1176.4-11742-22000117.2
220K44.1Very low43.3Very low189 Ų189144 Ų14482%0.82277%0.774SS**  trans178.4136.9135.7-100.7151.5-172.4168.50114.9
221R39Very low43.6Very low243 Ų243147.4 Ų147.492%0.91778%0.775SS**  trans61147.2149.8-69.1-175.7171.8-172.5-3.3119.1
222A42.8Very low43.7Very low76 Ų76143.4 Ų143.463%0.62876%0.764SS**  cis-165.6171.3-17.700000110.9
223N48.1Very low43.9Very low154 Ų154141.5 Ų141.582%0.82477%0.765SS**  trans70.180.3158.1-57.2-6000119.9
224Q44.6Very low43.8Very low185 Ų185136 Ų13686%0.86475%0.753SS**  8.9168.3105.5-92.9-1608.100121.1
225P46.6Very low43.9Very low93 Ų93140.2 Ų140.260%0.60475%0.754SS**  cis-144.9-176.8-17.237.1-17.4000117
226S42.6Very low44.2Very low101 Ų101140.7 Ų140.771%0.70675%0.754SS**  trans76.9164.6148.482.80000118.5
227H48.7Very low44.2Very low153 Ų153136.5 Ų136.571%0.70874%0.739SS**  cis-151.1170.34.6-140-84.1000106.1
228T42.7Very low44.1Very low94 Ų94139.3 Ų139.358%0.57774%0.742SS**  cis-161.5132.916.5-44.20000110.7
229Q42.3Very low43.5Very low150 Ų150140.4 Ų140.470%0.70174%0.739SS**  trans46.1166.6142.2-70.2170.2-11.400122.8
230H40.9Very low43Very low132 Ų132142.2 Ų142.261%0.61174%0.743SS**  cis-152.7153.7-8.4-118.7-42.5000111.6
231N43.4Very low42.5Very low146 Ų146139.3 Ų139.378%0.78173%0.732SS**  trans34.9143.9145.5-56.3-0.4000122.9
232G41.5Very low42.3Very low66 Ų66135 Ų13568%0.6872%0.72SS**  cis160.2171.8-4.800000114.4
233E45Very low41.8Very low198 Ų198138 Ų13893%0.92572%0.721SS**  trans61151.7166.7-56.2-152.1125.700117.5
234A42.1Very low41.1Very low80 Ų80137.4 Ų137.466%0.66171%0.713SS**  cis-160.8170-8.800000106.8
235R44.4Very low40.4Very low221 Ų221135.9 Ų135.983%0.83471%0.711SS**  cis-159.4157.43.9-123.8166.4-170.3-165.55.1108.7
236K45.3Very low39.6Very low198 Ų198135.1 Ų135.186%0.86172%0.72SS**  trans14.9140.6151-57.1176.6-178.6-175.10120.1
237G41.8Very low39Very low57 Ų57137.3 Ų137.359%0.58872%0.724SS**  cis-170.5156.77.300000113.2
238T42.1Very low38.1Very low130 Ų130135.2 Ų135.280%0.79873%0.726SS**  78.1112103.853.10000114.8
239K35.7Very low37.7Very low187 Ų187136.8 Ų136.881%0.81374%0.741SS**  67.6131.577.8-85-169.5176.2-172.60111.7
240L39.6Very low37Very low133 Ų133134.6 Ų134.670%0.69674%0.743SS**  cis-14515017.9-83.7121.5000109.3
241E34.3Very low36.4Very low129 Ų129134.5 Ų134.560%0.60376%0.755SS**  81.1127.268.1-149.2-157178.400115.3
242K34Very low35.8Very low152 Ų152136.7 Ų136.766%0.66176%0.758SS**  trans67.4159166.1-73.9154.6174.6151.50116.9
243Q33.1Very low35.3Very low140 Ų140140.1 Ų140.165%0.65477%0.765SS**  cis-151.6155-6-132.3159.3-76.500113.3
244Q32.4Very low34.8Very low140 Ų140136.9 Ų136.965%0.65476%0.758SS**  trans32.9133.9144.3-77.6169.1-38.900123.9
245N30.7Very low34.6Very low154 Ų154141.8 Ų141.882%0.82477%0.765SS**  trans50128130.9-52.32.3000121.1
246G28.5Very low34.1Very low76 Ų76137.4 Ų137.478%0.78477%0.765SS**  trans170.685.9164.100000115.6
247D31.6Very low33.5Very low148 Ų148139.3 Ų139.379%0.79177%0.767SS**  trans27.8120.2154-82.5-72.4000124.4
248S28.6Very low32.9Very low108 Ų108144.3 Ų144.376%0.75578%0.779SS**  56.691.5114.8-53.10000120
249S34.2Very low32.5Very low128 Ų128143.9 Ų143.990%0.89578%0.776SS**  trans-130.8136.2146.263.80000110.9
250S28.3Very low32.3Very low104 Ų104140.3 Ų140.373%0.72777%0.77SS**  trans-105.9132-168.468.20000112.8
251C28.8Very low31.8Very low129 Ų129145.1 Ų145.187%0.87278%0.779SS**  trans-121.7132.1162.1-91.50000110.8V253C251-V253 PolarHBondContact O-N 3.47Å
252K30.7Very low31.6Very low193 Ų193143.9 Ų143.984%0.83979%0.785SS**  trans-90.2103.1-166-65.1169.9-177.81690111.3V254K252-V254 PolarHBondContact O-N 2.88Å
253V31.1Very low31.4Very low138 Ų138141.8 Ų141.884%0.83680%0.795SS**  trans-82.7112.7168.1-177.90000109.5C251 K255C251-V253 PolarHBondContact O-N 3.47Å; V253-K255 PolarHBondContact O-N 2.72Å
254V33.2Very low31.2Very low129 Ų129142.3 Ų142.378%0.78280%0.802SS**  trans-77.3112.8-176.7179.50000110.5K252K252-V254 PolarHBondContact O-N 2.88Å
255K38.6Very low31.3Very low184 Ų184139.6 Ų139.680%0.880%0.804SS**PPolyproline II helixtrans-75.3132.5171.7-69.3-177.4177.7179.30110.6V253 R257V253-K255 PolarHBondContact O-N 2.72Å; K255-R257 PolarHBondContact O-N 3.4Å
256P33.9Very low31.2Very low129 Ų129138.9 Ų138.984%0.83880%0.8SS**PPolyproline II helixtrans-66.7119.8173.427.3-33.2000110.3
257R32.3Very low31.5Very low237 Ų237145.9 Ų145.989%0.89480%0.804SS**PPolyproline II helixtrans-77121.1172.3-85.4-178.2164.6175.5-5109.9K255 V259K255-R257 PolarHBondContact O-N 3.4Å; R257-V259 PolarHBondContact O-N 3.22Å; R257-V259 VanDerWaalsContact O-N 3.13Å
258L29.2Very low31.6Very low163 Ų163148.6 Ų148.685%0.85380%0.803SS**  trans-70.9102.7171.4-161.685.3000109.4V260L258-V260 HydrophobicContact CD2-CG2 4.1Å; L258-V260 PolarHBondContact O-N 2.92Å
259V32.9Very low31.8Very low120 Ų120152.4 Ų152.473%0.72781%0.809SS**  trans-8086.8-180-176.60000110R257 R261R257-V259 PolarHBondContact O-N 3.22Å; R257-V259 VanDerWaalsContact O-N 3.13Å; V259-R261 HydrophobicContact CG1-CG 4.29Å; V259-R261 PolarHBondContact O-N 2.81Å
260V32.3Very low32Very low112 Ų112155 Ų15568%0.67981%0.805SS**  trans-72107.7167.1-178.90000108.2L258 S262L258-V260 HydrophobicContact CD2-CG2 4.1Å; L258-V260 PolarHBondContact O-N 2.92Å; V260-S262 VanDerWaalsContact C-N 3.3Å; V260-S262 PolarHBondContact O-N 2.99Å
261R28.4Very low32.2Very low234 Ų234161.6 Ų161.688%0.88381%0.814SS**  trans-77.280.9172.5-64.1179.778.4173.45.2109.5V259V259-R261 HydrophobicContact CG1-CG 4.29Å; V259-R261 PolarHBondContact O-N 2.81Å
262S30.4Very low32.4Very low104 Ų104164.4 Ų164.473%0.72781%0.811SS**  trans-61.4135.5160.641.60000109.1V260 L264V260-S262 VanDerWaalsContact C-N 3.3Å; V260-S262 PolarHBondContact O-N 2.99Å; S262-L264 PolarHBondContact O-N 3.29Å
263A29.4Very low32.5Very low107 Ų107162.1 Ų162.188%0.88481%0.808SS**  trans-72110.7176.100000109.1
264L30.6Very low32.5Very low151 Ų151161.7 Ų161.779%0.79181%0.81SS**  trans-78.2123.4174.6-166.271.8000108.7S262 D266S262-L264 PolarHBondContact O-N 3.29Å; L264-D266 PolarHBondContact O-N 2.94Å
265A33.1Very low32.4Very low84 Ų84164.7 Ų164.769%0.69482%0.815SS**  trans-83.5109.7173.700000109.5Y267A265-Y267 PolarHBondContact O-N 3.38Å
266D29Very low32.4Very low138 Ų138161.7 Ų161.774%0.73881%0.814SS**  trans-70.387.8178.3-82.9-52.6000112L264L264-D266 PolarHBondContact O-N 2.94Å
267Y34.8Very low32.4Very low223 Ų223164.3 Ų164.388%0.87581%0.812SS**  trans-101.685.9162.7-101.4-90.6000110.2A265 Q269A265-Y267 PolarHBondContact O-N 3.38Å; Y267-Q269 PolarHBondContact O-N 3.29Å
268R34.8Very low32.6Very low206 Ų206159.3 Ų159.378%0.77781%0.811SS**  trans-68113.6172.9-80-169.1172.1-149.7-1.1110.6F270R268-F270 PolarHBondContact O-N 3.03Å
269Q31.5Very low32.9Very low187 Ų187157.5 Ų157.587%0.87481%0.807SS**  trans-68.7123.7168-66.3179-11.800110.5Y267Y267-Q269 PolarHBondContact O-N 3.29Å
270F39.1Very low32.9Very low184 Ų184156.2 Ų156.281%0.80781%0.808SS**  trans-121.490.6157.8-86.6-80.1000109R268R268-F270 PolarHBondContact O-N 3.03Å
271R31.7Very low33.5Very low242 Ų242157.2 Ų157.291%0.91381%0.814SS**  trans-85.8125.8157.4-88.4-168.7172-153.2-1.7108.3
272K32.7Very low34Very low188 Ų188154.6 Ų154.682%0.81781%0.812SS**  trans-164.4131148.8-109.8165.9-175.4-178.80110.4
273N33.3Very low34.2Very low144 Ų144155.2 Ų155.277%0.7782%0.816SS**  trans59.8100154.8-49-3.4000118
274C31.6Very low34.8Very low130 Ų130155.1 Ų155.188%0.87881%0.809SS**  172.7106.6127-95.80000110.8
275E30.5Very low35.2Very low192 Ų192155.9 Ų155.990%0.89781%0.814SS**PPolyproline II helixtrans-93.7132.5164-67.6-176.9143.800109.9
276P38.1Very low35.3Very low120 Ų120155.6 Ų155.678%0.77982%0.819SS**PPolyproline II helixtrans-101.2126.8158.56.114.3000110.3
277K34.3Very low35.8Very low184 Ų184155 Ų15580%0.883%0.826SS**PPolyproline II helixtrans-71.6142.6174.4-66.1175.7179.5175.50111T279K277-T279 PolarHBondContact O-N 2.7Å
278P36Very low35.8Very low132 Ų132147.4 Ų147.486%0.85782%0.815SS**  trans-77.2109.8168.330.8-32000110.5
279T37.3Very low36.1Very low126 Ų126145.9 Ų145.977%0.77382%0.823SS**  trans-86.9114169.5-56.90000109.3K277K277-T279 PolarHBondContact O-N 2.7Å
280A33Very low36.2Very low92 Ų92142.7 Ų142.776%0.7682%0.816SS**  trans-74.1141.8174.500000111.1
281V45Very low36.4Very low133 Ų133142.4 Ų142.481%0.80682%0.822SS**  trans-125.3117.4173.5-174.50000110.4
282H37.7Very low36.6Very low180 Ų180140.3 Ų140.383%0.83382%0.819SS**  trans-21.4135.9177.3-68.4-91.5000120
283S35.4Very low36.6Very low117 Ų117134.6 Ų134.682%0.81881%0.814SS**  trans-76.8149.8158.7420000112.5
284S40.7Very low36.7Very low104 Ų104134.9 Ų134.973%0.72782%0.821SS**  trans-157.2135.8149.654.40000113.1
285N39.3Very low36.6Very low167 Ų167136 Ų13689%0.89382%0.817SS**  trans50.6124.8146.2-53.6-13.5000121.4
286G36.7Very low36.9Very low79 Ų79136.1 Ų136.181%0.81481%0.809SS**  trans166.496.6160.700000114.1
287S38.2Very low36.7Very low125 Ų125137.9 Ų137.987%0.87481%0.807SS**  trans-60.5150.3167.643.70000111.5
288G35.9Very low36.6Very low63 Ų63133.3 Ų133.365%0.64980%0.804SS**  cis114.5121.4600000111.8
289N40.1Very low36.5Very low175 Ų175133.9 Ų133.994%0.93680%0.795SS**  trans-168148.2151.6-104-30.4000111.6
290V33.4Very low36.4Very low119 Ų119135.1 Ų135.172%0.72179%0.792SS**  trans-122.7128.2-176.9173.10000109.6
291L43.2Very low36.7Very low179 Ų179135.5 Ų135.594%0.93779%0.789SS**  trans-135.1148.5157.1-80.5180000110.9
292K37.1Very low36.5Very low198 Ų198139 Ų13986%0.86179%0.793SS**  trans-114.3153.4-175.3-63.2174.9179174.60110.1
293G31.9Very low36.4Very low68 Ų68134.2 Ų134.270%0.70179%0.793SS**  trans112.4152.3168.400000113.8
294T35.7Very low36.5Very low149 Ų149141 Ų14191%0.91480%0.801SS**  cis-152.7156.8-4.7-31.80000110.9
295L30.1Very low36.1Very low155 Ų155141.1 Ų141.181%0.81280%0.802SS**  trans-75.4125.1-179.4177.885.5000112.8
296R36.3Very low36Very low193 Ų193144.5 Ų144.573%0.72880%0.802SS**  174.1152.6125.1-99.9179.1-173.9-116.25.9115.2
297Q33.2Very low35.7Very low157 Ų157144.4 Ų144.473%0.73480%0.802SS**  trans21.1133.8140.7-65.3171.7-4800119.2
298A32.1Very low35.7Very low88 Ų88144.8 Ų144.873%0.72780%0.798SS**  cis-151-134.3-2.800000110.5
299E34.8Very low35.6Very low145 Ų145147 Ų14768%0.67880%0.803SS**  cis-152.2179.120.9-126.5-57.182.800112.4
300Q34.9Very low35.2Very low151 Ų151144 Ų14471%0.70680%0.797SS**  trans-44.1145.6178.8-69.9168.67100117.4
301S40Very low35.3Very low100 Ų100147 Ų14770%0.69980%0.803SS**  -173.5141.878.246.20000118.1
302K39.3Very low34.9Very low206 Ų206143.3 Ų143.390%0.89680%0.798SS**  trans5782.6142.4-62.4169.5-174.91690119.8
303G36.3Very low35.1Very low81 Ų81141.5 Ų141.584%0.83580%0.797SS**  trans-123.1120.3148.700000110.1
304R38Very low35.3Very low258 Ų258143.6 Ų143.697%0.97480%0.798SS**  trans-92.3141.4-168.4-138.3-179-170.2-162.63.6112.9
305S31.9Very low35.3Very low108 Ų108148.1 Ų148.176%0.75580%0.798SS**  trans-83.3153.4-170.752.90000115.1
306R37.3Very low35.6Very low237 Ų237146.9 Ų146.989%0.89480%0.797SS**  trans-165.686.1142-112176.2-172.4-168.32.1112.2
307G29.7Very low35.6Very low78 Ų78144.1 Ų144.180%0.80480%0.802SS**  trans-79145150.900000109.3
308V38.5Very low35.8Very low133 Ų133148 Ų14881%0.80681%0.81SS**  trans-132.2125.2170.3-176.90000107.4
309S33.5Very low36.2Very low108 Ų108148.1 Ų148.176%0.75581%0.811SS**  trans-79.9164.2-174.747.30000113
310S32.1Very low36.2Very low113 Ų113150 Ų15079%0.7982%0.819SS**  trans-58.2134.717351.20000113.3
311Q35.9Very low36.2Very low183 Ų183150.1 Ų150.186%0.85583%0.825SS**  trans-130.6130.1148.3-74-164-1200109.6
312A34.7Very low36.2Very low101 Ų101151.8 Ų151.884%0.83583%0.825SS**PPolyproline II helixtrans-90.1131.9170.300000109.1
313L39.9Very low36.3Very low160 Ų160152.3 Ų152.384%0.83882%0.822SS**PPolyproline II helixtrans-88.7142.3175.8-70.7173.4000111.1
314P37.6Very low36.5Very low111 Ų111156.6 Ų156.672%0.72183%0.825SS**PPolyproline II helixtrans-73.9155.5-173.829.9-35.9000113.2V316P314-V316 PolarHBondContact O-N 2.8Å
315R34.4Very low36.8Very low244 Ų244150.8 Ų150.892%0.92182%0.818SS**PPolyproline II helixtrans-70.8119171.3-73.7178.3171.6168.9-2.7110.4T317R315-T317 PolarHBondContact O-N 3.19Å
316V36.8Very low37.4Very low130 Ų130150.9 Ų150.979%0.78882%0.819SS**  trans-86.698.7169.9-179.20000109.8P314 R318P314-V316 PolarHBondContact O-N 2.8Å; V316-R318 PolarHBondContact O-N 3.2Å
317T37.3Very low38.2Very low134 Ų134149 Ų14982%0.82282%0.817SS**  trans-75.9101162.538.60000109.3R315 A319R315-T317 PolarHBondContact O-N 3.19Å; T317-A319 PolarHBondContact O-N 2.77Å
318R37.7Very low39.6Very low239 Ų239150.9 Ų150.990%0.90282%0.815SS**  trans-85.5110.2176.4-158.8173.6-165.2167.35109.7V316V316-R318 PolarHBondContact O-N 3.2Å
319A39.5Very low40.7Very low91 Ų91150.4 Ų150.475%0.75282%0.815SS**  trans-66.5163.6179.500000112.8T317T317-A319 PolarHBondContact O-N 2.77Å
320E35.9Very low41.6Very low183 Ų183153.3 Ų153.386%0.85582%0.821SS**  trans-63.8134.1178-56.9169.3120.700111.7
321N33.7Very low43.1Very low154 Ų154153.7 Ų153.782%0.82482%0.821SS**  trans-171.3171.5137.2-118.9-78.6000113.6
322L39.6Very low43.4Very low135 Ų135153.3 Ų153.371%0.70783%0.825SS**  trans77.2109.9167.5-63.3170.6000119.8
323R42.6Very low44.1Very low218 Ų218152.4 Ų152.482%0.82383%0.825SS**  trans80.699.5134.9-66.3179.6176.6-174.5-1.8119.2
324N40Very low44.1Very low170 Ų170150.4 Ų150.491%0.90982%0.824SS**  trans-40.5131.9143.6-55.1-29.7000111.5
325V44.5Very low44.3Very low137 Ų137149.3 Ų149.383%0.8383%0.825SS**  trans-133.3140.4163.2-174.50000107.8
326S44.4Very low44.9Very low110 Ų110149 Ų14977%0.76982%0.824SS**PPolyproline II helixtrans-76.1161.7-169.139.40000114.4
327K54.7Low45.4Very low196 Ų196150.2 Ų150.285%0.85282%0.821SS**PPolyproline II helixtrans-67.6142.3171.1-60.5173.6-178.2173.60110.5
328P58.7Low46Very low118 Ų118151.1 Ų151.177%0.76681%0.814SS**PPolyproline II helixtrans-75150.2162.632.6-33.8000111.2
329P62.1Low46.5Very low124 Ų124148 Ų14881%0.80581%0.809SS**PPolyproline II helixtrans-80.7168.1173.834.1-35.3000112.8
330L51.4Low46.8Very low168 Ų168147.2 Ų147.288%0.8880%0.803SS**PPolyproline II helixtrans-88.6152.8171.6-71.1167.2000111.1
331P64.2Low47.6Very low122 Ų122144.4 Ų144.479%0.79280%0.799SS**PPolyproline II helixtrans-91.7126.417534.1-30.9000112.5
332D41.7Very low48.5Very low175 Ų175146.4 Ų146.494%0.93680%0.8SS**PPolyproline II helixtrans-83.9143.9162.2-77.2-49.6000110.8
333G48.2Very low48.6Very low81 Ų81148.9 Ų148.984%0.83581%0.808SS**  trans-152.4130.4177.800000111.1
334S41.3Very low48.8Very low118 Ų118143.5 Ų143.583%0.82581%0.81SS**  trans-118.2166.9-159.869.90000115.7
335A42.1Very low49.2Very low89 Ų89142.4 Ų142.474%0.73681%0.809SS**  trans67111.3151.100000121
336R46.4Very low49.5Very low237 Ų237139.4 Ų139.489%0.89481%0.806SS**  -172.4112.8122.7-97156.8-172.7-143.60.8108
337Q46.8Very low49.3Very low156 Ų156139.8 Ų139.873%0.72981%0.807SS**  83106.758.5-164.9-145.833.100113.3
338K49.4Very low49Very low153 Ų153142.2 Ų142.267%0.66581%0.811SS**  153126.2128.3-84.1-178.6179.4-170.40114.7
339Q49.5Very low48.7Very low172 Ų172142 Ų14280%0.80481%0.81SS**  trans58.5150.3139.2-62.6169.8-74.800121
340A46.5Very low48.5Very low76 Ų76141.7 Ų141.763%0.62881%0.808SS**  cis-171.1154.6-23.900000109.9
341T52Low48.5Very low124 Ų124142.6 Ų142.676%0.76181%0.81SS**  trans36.5139.4148.455.40000120.8
342K52.1Low47.7Very low195 Ų195140.3 Ų140.385%0.84880%0.801SS**  cis-168.817729.6-129.8166.7-176.4-177.50110.5
343E42.7Very low48Very low188 Ų188141.8 Ų141.888%0.87980%0.799SS**  trans-93.9156.7-173-56.9151.9120.100114.6
344A45.8Very low47.9Very low104 Ų104143.6 Ų143.686%0.8680%0.799SS**  trans-158139.6151.200000110.1
345V47.8Very low47.9Very low147 Ų147144.5 Ų144.589%0.89180%0.8SS**  trans-108.7138.5-178.7177.10000110.3
346G50.9Low48.4Very low74 Ų74145.9 Ų145.976%0.76380%0.804SS**  trans-168.5122.7174.300000112.9
347C40.4Very low48.5Very low119 Ų119140.3 Ų140.380%0.80480%0.801SS**  trans-100127.7-169.2-57.40000113.2
348R48.4Very low48.5Very low246 Ų246144 Ų14493%0.92881%0.809SS**  trans-171.1120.5147-115.1174.9-178.9-174.80.5114.2
349P53.8Low48.9Very low115 Ų115142.3 Ų142.375%0.74781%0.813SS**  trans-114.3-174.2162.142.7-32.3000110.6
350P57.6Low49Very low117 Ų117140.8 Ų140.876%0.7682%0.816SS**  -131.6159.9-6938.5-24.2000113.1
351M51Low49.4Very low186 Ų186146.3 Ų146.392%0.91683%0.826SS**  trans-137.7109.9167.8-89.1-172.866.100114.9
352A48.4Very low49.5Very low74 Ų74145.9 Ų145.961%0.61283%0.825SS**  48.7125.113000000122.6
353K47.4Very low49.2Very low206 Ų206148 Ų14890%0.89683%0.827SS**  trans69.2126.4149.2-55.7160.3-174.5177.10115.7
354S44.6Very low49.3Very low120 Ų120144.8 Ų144.884%0.83982%0.824SS**  -156.1169.358.2-162.40000114
355T43Very low49.3Very low137 Ų137145.9 Ų145.984%0.8482%0.82SS**  trans-86.6134.9-176.748.20000113.2
356S52.5Low49.2Very low117 Ų117144 Ų14482%0.81881%0.813SS**  trans-124.3115.4165.4-174.70000110.3R358S356-R358 PolarHBondContact O-N 3.42Å
357S47.8Very low49.2Very low120 Ų120146.2 Ų146.284%0.83981%0.812SS**  trans-81.5100-178.939.10000111.1
358R47.6Very low49.8Very low235 Ų235146 Ų14689%0.88781%0.807SS**  trans-72129.5167.8-89-172.7167.6-170.5-2.8110.4S356S356-R358 PolarHBondContact O-N 3.42Å
359P57.4Low49.9Very low117 Ų117143.1 Ų143.176%0.7680%0.804SS**  trans-68.4136.9179.927.4-34.4000111.4K361P359-K361 PolarHBondContact O-N 2.96Å; P359-K361 VanDerWaalsContact O-N 3.13Å
360T52.2Low50.2Low139 Ų139143.8 Ų143.885%0.85381%0.806SS**  trans-63.5110.6170.741.80000110.2
361K53.7Low50.8Low193 Ų193146.9 Ų146.984%0.83981%0.807SS**  trans-55.8134.3169.4-69.4-174.6176.5-175.80109.5P359 R363P359-K361 PolarHBondContact O-N 2.96Å; P359-K361 VanDerWaalsContact O-N 3.13Å; K361-R363 PolarHBondContact O-N 3.49Å
362P54.5Low51.2Low114 Ų114143.3 Ų143.374%0.7480%0.798SS**  trans-61.2133.6171.726.7-33.5000109.2C364P362-C364 PolarHBondContact O-N 2.92Å
363R45.9Very low51.6Low239 Ų239146.8 Ų146.890%0.90280%0.8SS**  trans-68.5105.5171.1-81.3-179.5168.7166.2-3.8108.4K361 V365K361-R363 PolarHBondContact O-N 3.49Å; R363-V365 PolarHBondContact O-N 3.1Å
364C44.7Very low51.9Low121 Ų121143.2 Ų143.282%0.81880%0.795SS**  trans-59.6106.6168.3-590000108.9P362 S366P362-C364 PolarHBondContact O-N 2.92Å; C364-S366 PolarHBondContact O-N 2.67Å
365V46.6Very low52.4Low128 Ų128143.5 Ų143.578%0.77678%0.781SS**  trans-74.496.6174.4179.90000107.7R363 V367R363-V365 PolarHBondContact O-N 3.1Å; V365-V367 PolarHBondContact O-N 2.95Å
366S45.8Very low53.3Low106 Ų106142.7 Ų142.774%0.74177%0.768SS**  trans-67.797173.655.90000109.5C364 T368C364-S366 PolarHBondContact O-N 2.67Å; S366-T368 PolarHBondContact O-N 3.3Å
367V48.9Very low54.2Low121 Ų121140.3 Ų140.373%0.73375%0.749SS**  trans-68.697.5172-179.20000108.2V365 Q369V365-V367 PolarHBondContact O-N 2.95Å; V367-Q369 PolarHBondContact O-N 3.2Å; V367-Q369 VanDerWaalsContact O-N 3.09Å
368T53.7Low55.5Low115 Ų115140.4 Ų140.471%0.70674%0.74SS**  trans-61.3111.4165.932.90000108.3S366 V370S366-T368 PolarHBondContact O-N 3.3Å; T368-V370 VanDerWaalsContact C-N 3.3Å; T368-V370 PolarHBondContact O-N 2.84Å
369Q51.7Low57.3Low186 Ų186135.7 Ų135.787%0.86973%0.726SS**  trans-64.894171.1-70.1-175.5-4.600108.7V367 K371V367-Q369 PolarHBondContact O-N 3.2Å; V367-Q369 VanDerWaalsContact O-N 3.09Å; Q369-K371 PolarHBondContact O-N 2.77Å
370V59.1Low58.5Low128 Ų128139 Ų13978%0.77672%0.723SS**  trans-62.7111.1168.2179.60000106.4T368T368-V370 VanDerWaalsContact C-N 3.3Å; T368-V370 PolarHBondContact O-N 2.84Å
371K69.5Low60.2Low182 Ų182137.8 Ų137.879%0.79171%0.708SS**  trans-49.7126.5176.1-176.1178.4-177.2179.30108Q369 F373Q369-K371 PolarHBondContact O-N 2.77Å; K371-F373 PolarHBondContact O-N 3.07Å
372P61.2Low61.9Low111 Ų111134.7 Ų134.772%0.72170%0.696SS**  trans-57119.1-177.622.3-32.8000108.5T374P372-T374 PolarHBondContact O-N 3.48Å
373F55.5Low63.6Low148 Ų148136.1 Ų136.165%0.64969%0.687SS**  trans-64.8104.3171.3147.6-121.5000106.5K371 F375K371-F373 PolarHBondContact O-N 3.07Å; F373-F375 HydrophobicContact CD1-CD2 4.21Å; F373-F375 HydrophobicContact CE1-CB 4.08Å; F373-F375 HydrophobicContact CE1-CD1 4.27Å; F373-F375 AromaticContact CE1-CD2 3.23Å; F373-F375 HydrophobicContact CE1-CD2 3.23Å; F373-F375 AromaticContact CE1-CE2 3.57Å; F373-F375 HydrophobicContact CE1-CE2 3.57Å; F373-F375 AromaticContact CE1-CG 3.61Å; F373-F375 HydrophobicContact CE1-CG 3.61Å; F373-F375 HydrophobicContact CE1-CZ 4.2Å; F373-F375 HydrophobicContact CE2-CB 4.36Å; F373-F375 HydrophobicContact CE2-CD1 4.47Å; F373-F375 HydrophobicContact CE2-CG 4.27Å; F373-F375 HydrophobicContact CZ-CB 3.92Å; F373-F375 AromaticContact CZ-CD1 3.67Å; F373-F375 HydrophobicContact CZ-CD1 3.67Å; F373-F375 AromaticContact CZ-CD2 3.54Å; F373-F375 HydrophobicContact CZ-CD2 3.54Å; F373-F375 AromaticContact CZ-CE1 3.96Å; F373-F375 HydrophobicContact CZ-CE1 3.96Å; F373-F375 AromaticContact CZ-CE2 3.85Å; F373-F375 HydrophobicContact CZ-CE2 3.85Å; F373-F375 AromaticContact CZ-CG 3.42Å; F373-F375 HydrophobicContact CZ-CG 3.42Å; F373-F375 VanDerWaalsContact CZ-CG 3.42Å; F373-F375 HydrophobicContact CZ-CZ 4.04Å; F373-F375 PolarHBondContact O-N 3.46Å
374T54.1Low65.6Low130 Ų130131.4 Ų131.480%0.79867%0.67SS**  trans-64.892.2166.950.10000106.7P372 E376P372-T374 PolarHBondContact O-N 3.48Å; T374-E376 PolarHBondContact O-N 3.48Å
375F54.9Low67.8Low126 Ų126129.8 Ų129.855%0.55365%0.653SS**  trans-53.7139.3170.8-140.8-49.4000107.2F373 T377F373-F375 HydrophobicContact CD1-CD2 4.21Å; F373-F375 HydrophobicContact CE1-CB 4.08Å; F373-F375 HydrophobicContact CE1-CD1 4.27Å; F373-F375 AromaticContact CE1-CD2 3.23Å; F373-F375 HydrophobicContact CE1-CD2 3.23Å; F373-F375 AromaticContact CE1-CE2 3.57Å; F373-F375 HydrophobicContact CE1-CE2 3.57Å; F373-F375 AromaticContact CE1-CG 3.61Å; F373-F375 HydrophobicContact CE1-CG 3.61Å; F373-F375 HydrophobicContact CE1-CZ 4.2Å; F373-F375 HydrophobicContact CE2-CB 4.36Å; F373-F375 HydrophobicContact CE2-CD1 4.47Å; F373-F375 HydrophobicContact CE2-CG 4.27Å; F373-F375 HydrophobicContact CZ-CB 3.92Å; F373-F375 AromaticContact CZ-CD1 3.67Å; F373-F375 HydrophobicContact CZ-CD1 3.67Å; F373-F375 AromaticContact CZ-CD2 3.54Å; F373-F375 HydrophobicContact CZ-CD2 3.54Å; F373-F375 AromaticContact CZ-CE1 3.96Å; F373-F375 HydrophobicContact CZ-CE1 3.96Å; F373-F375 AromaticContact CZ-CE2 3.85Å; F373-F375 HydrophobicContact CZ-CE2 3.85Å; F373-F375 AromaticContact CZ-CG 3.42Å; F373-F375 HydrophobicContact CZ-CG 3.42Å; F373-F375 VanDerWaalsContact CZ-CG 3.42Å; F373-F375 HydrophobicContact CZ-CZ 4.04Å; F373-F375 PolarHBondContact O-N 3.46Å; F375-T377 HydrophobicContact CB-CG2 3.84Å; F375-T377 HydrophobicContact CD1-CG2 4.02Å; F375-T377 HydrophobicContact CG-CG2 3.87Å; F375-T377 PolarHBondContact O-N 2.73Å; F375-T377 PolarHBondContact O-OG1 3.35Å
376E62.5Low70Confident120 Ų120130.3 Ų130.356%0.56165%0.645SS**THydrogen-bonded Turntrans-72.431.4173.2-153.1-177.9134.300111.7T374 D378 K379 R380 R383T374-E376 PolarHBondContact O-N 3.48Å; E376-D378 VanDerWaalsContact C-N 3.35Å; E376-K379 HydrophobicContact CG-CB 4.26Å; E376-R380 WeakPolarHBondContact O-CB 3.49Å; E376-R380 PolarHBondContact O-N 2.72Å; E376-R383 IonicContact OE1-CZ 3.76Å; E376-R383 IonicContact OE1-NH2 2.72Å; E376-R383 PolarHBondContact OE1-NH2 2.99Å
377T70.6Confident72Confident68 Ų68127.5 Ų127.542%0.41763%0.628SS.*Hα-helixtrans-59.3-45.617836.50000110.9F375 R380 H381F375-T377 HydrophobicContact CB-CG2 3.84Å; F375-T377 HydrophobicContact CD1-CG2 4.02Å; F375-T377 HydrophobicContact CG-CG2 3.87Å; F375-T377 PolarHBondContact O-N 2.73Å; F375-T377 PolarHBondContact O-OG1 3.35Å; T377-R380 CarbonylContact O-C 3.48Å; T377-R380 WeakPolarHBondContact O-CA 3.26Å; T377-R380 PolarHBondContact O-N 3.06Å; T377-H381 VanDerWaalsContact O-CB 3.26Å; T377-H381 WeakPolarHBondContact O-CB 3.47Å; T377-H381 PolarHBondContact O-N 3.38Å
378D75.1Confident73.9Confident122 Ų122126.5 Ų126.565%0.65261%0.614SS**Hα-helixtrans-71.6-50.6-164.1-52.51.5000109.2E376 R380 H381 E382E376-D378 VanDerWaalsContact C-N 3.35Å; D378-R380 PolarHBondContact O-N 3.41Å; D378-H381 PolarHBondContact O-N 2.95Å; D378-E382 VanDerWaalsContact O-CB 3.24Å; D378-E382 WeakPolarHBondContact O-CB 3.45Å; D378-E382 PolarHBondContact O-N 3.16Å
379K84.7Confident75.6Confident135 Ų135127.5 Ų127.559%0.58761%0.61SS**Hα-helixtrans-63.4-19.1170.1-69.8-170.9175.1-173.50114.1E376 R383E376-K379 HydrophobicContact CG-CB 4.26Å; K379-R383 WeakPolarHBondContact O-CB 3.14Å; K379-R383 WeakPolarHBondContact O-CG 3.37Å; K379-R383 PolarHBondContact O-N 2.97Å; K379-R383 PolarHBondContact O-NE 3.01Å; K379-R383 PolarHBondContact O-NH2 2.78Å
380R84Confident77.2Confident186 Ų186124.8 Ų124.870%0.70260%0.598SS**Hα-helixtrans-88.2-32.7175.5-169.1176.6-171.3-166.22.4111.8E376 T377 D378 Y384E376-R380 WeakPolarHBondContact O-CB 3.49Å; E376-R380 PolarHBondContact O-N 2.72Å; T377-R380 CarbonylContact O-C 3.48Å; T377-R380 WeakPolarHBondContact O-CA 3.26Å; T377-R380 PolarHBondContact O-N 3.06Å; D378-R380 PolarHBondContact O-N 3.41Å; R380-Y384 WeakPolarHBondContact O-CB 3.45Å; R380-Y384 PolarHBondContact O-N 2.86Å
381H88.4Confident78.1Confident114 Ų114125.2 Ų125.253%0.52859%0.591SS.*Hα-helixtrans-72.2-44.5174.1-176.253.8000110.5T377 D378 R383 Y384 L385T377-H381 VanDerWaalsContact O-CB 3.26Å; T377-H381 WeakPolarHBondContact O-CB 3.47Å; T377-H381 PolarHBondContact O-N 3.38Å; D378-H381 PolarHBondContact O-N 2.95Å; H381-R383 PolarHBondContact O-N 2.85Å; H381-Y384 CarbonylContact O-C 3.57Å; H381-Y384 WeakPolarHBondContact O-CA 3.37Å; H381-Y384 WeakPolarHBondContact O-CB 3.49Å; H381-Y384 PolarHBondContact O-N 3.16Å; H381-L385 WeakPolarHBondContact O-CB 3.35Å; H381-L385 WeakPolarHBondContact O-CG 3.24Å; H381-L385 PolarHBondContact O-N 3.44Å
382E87.7Confident78.5Confident128 Ų128120.7 Ų120.760%0.59859%0.588SS**Hα-helixtrans-57.1-46.3171.2-174.5179.5-122.700111.7D378 Y384 L385 K386D378-E382 VanDerWaalsContact O-CB 3.24Å; D378-E382 WeakPolarHBondContact O-CB 3.45Å; D378-E382 PolarHBondContact O-N 3.16Å; E382-Y384 PolarHBondContact O-N 3.48Å; E382-L385 PolarHBondContact O-N 3.19Å; E382-K386 WeakPolarHBondContact O-CB 3.37Å; E382-K386 PolarHBondContact O-N 3.47Å
383R90.1Very high79Confident144 Ų144118.4 Ų118.454%0.54357%0.574SS.*Hα-helixtrans-62.5-36.5171.5-82.8179.2-75.8-168.9-4.4113.2E376 K379 H381 A387E376-R383 IonicContact OE1-CZ 3.76Å; E376-R383 IonicContact OE1-NH2 2.72Å; E376-R383 PolarHBondContact OE1-NH2 2.99Å; K379-R383 WeakPolarHBondContact O-CB 3.14Å; K379-R383 WeakPolarHBondContact O-CG 3.37Å; K379-R383 PolarHBondContact O-N 2.97Å; K379-R383 PolarHBondContact O-NE 3.01Å; K379-R383 PolarHBondContact O-NH2 2.78Å; H381-R383 PolarHBondContact O-N 2.85Å; R383-A387 WeakPolarHBondContact O-CB 3.49Å; R383-A387 PolarHBondContact O-N 3Å
384Y88Confident78.9Confident140 Ų140114.1 Ų114.155%0.54957%0.572SS.*Hα-helixtrans-71.2-43.4177.4172.4-94.2000112.4R380 H381 E382 A387 K388R380-Y384 WeakPolarHBondContact O-CB 3.45Å; R380-Y384 PolarHBondContact O-N 2.86Å; H381-Y384 CarbonylContact O-C 3.57Å; H381-Y384 WeakPolarHBondContact O-CA 3.37Å; H381-Y384 WeakPolarHBondContact O-CB 3.49Å; H381-Y384 PolarHBondContact O-N 3.16Å; E382-Y384 PolarHBondContact O-N 3.48Å; Y384-A387 PolarHBondContact O-N 2.94Å; Y384-K388 HydrophobicContact CE1-CG 4.16Å; Y384-K388 HydrophobicContact CE2-CG 4.34Å; Y384-K388 PolarHBondContact O-N 3.26Å
385L92.4Very high78.7Confident88 Ų88117.4 Ų117.446%0.46157%0.57SS.*Hα-helixtrans-61.2-48.5175-71.9175.9000110.1H381 E382 A387 K388 E389H381-L385 WeakPolarHBondContact O-CB 3.35Å; H381-L385 WeakPolarHBondContact O-CG 3.24Å; H381-L385 PolarHBondContact O-N 3.44Å; E382-L385 PolarHBondContact O-N 3.19Å; L385-A387 VanDerWaalsContact C-N 3.34Å; L385-A387 PolarHBondContact O-N 3.23Å; L385-K388 CarbonylContact O-C 3.56Å; L385-K388 WeakPolarHBondContact O-CA 3.39Å; L385-K388 PolarHBondContact O-N 3.36Å; L385-E389 WeakPolarHBondContact O-CB 3.33Å; L385-E389 PolarHBondContact O-N 3.23Å
386K92.3Very high78.3Confident138 Ų138117 Ų11760%0.658%0.578SS**Hα-helixtrans-59.3-41.6176-175.4167.1-177.8168.90112.7E382 K388 E389 E390E382-K386 WeakPolarHBondContact O-CB 3.37Å; E382-K386 PolarHBondContact O-N 3.47Å; K386-K388 VanDerWaalsContact C-N 3.28Å; K386-K388 PolarHBondContact O-N 2.78Å; K386-E389 PolarHBondContact O-N 3.34Å; K386-E390 VanDerWaalsContact O-CB 3.27Å; K386-E390 WeakPolarHBondContact O-CB 3.27Å; K386-E390 PolarHBondContact O-N 2.85Å
387A87.3Confident77.8Confident47 Ų47118.3 Ų118.339%0.38859%0.589SS.*Hα-helixtrans-66.9-28.2175.200000113.1R383 Y384 L385 Q391R383-A387 WeakPolarHBondContact O-CB 3.49Å; R383-A387 PolarHBondContact O-N 3Å; Y384-A387 PolarHBondContact O-N 2.94Å; L385-A387 VanDerWaalsContact C-N 3.34Å; L385-A387 PolarHBondContact O-N 3.23Å; A387-Q391 WeakPolarHBondContact O-CG 3.35Å; A387-Q391 PolarHBondContact O-N 3.13Å; A387-Q391 VanDerWaalsContact O-N 3.16Å
388K88.2Confident76.8Confident101 Ų101120 Ų12044%0.43960%0.598SS.*Hα-helixtrans-78.8-37.2174-87.4-72.8167.4-157.70113Y384 L385 K386 Q391 A392Y384-K388 HydrophobicContact CE1-CG 4.16Å; Y384-K388 HydrophobicContact CE2-CG 4.34Å; Y384-K388 PolarHBondContact O-N 3.26Å; L385-K388 CarbonylContact O-C 3.56Å; L385-K388 WeakPolarHBondContact O-CA 3.39Å; L385-K388 PolarHBondContact O-N 3.36Å; K386-K388 VanDerWaalsContact C-N 3.28Å; K386-K388 PolarHBondContact O-N 2.78Å; K388-Q391 PolarHBondContact O-N 3.01Å; K388-A392 WeakPolarHBondContact O-CB 3.45Å; K388-A392 PolarHBondContact O-N 3.03Å
389E90.8Very high75.4Confident136 Ų136122.3 Ų122.364%0.63661%0.605SS**Hα-helixtrans-62.3-45.6170.5-177.5-179.3-15900110.8L385 K386 Q391 A392 S393L385-E389 WeakPolarHBondContact O-CB 3.33Å; L385-E389 PolarHBondContact O-N 3.23Å; K386-E389 PolarHBondContact O-N 3.34Å; E389-Q391 PolarHBondContact O-N 3.11Å; E389-A392 CarbonylContact O-C 3.59Å; E389-A392 PolarHBondContact O-N 3.21Å; E389-A392 VanDerWaalsContact O-N 3.12Å; E389-S393 VanDerWaalsContact O-CB 3.31Å; E389-S393 WeakPolarHBondContact O-CB 3.43Å; E389-S393 PolarHBondContact O-N 3.4Å
390E84.5Confident73.5Confident129 Ų129122.1 Ų122.160%0.60362%0.616SS**Hα-helixtrans-60.7-43.9175.4-169.2164.8-153.800111.5K386 A392 S393K386-E390 VanDerWaalsContact O-CB 3.27Å; K386-E390 WeakPolarHBondContact O-CB 3.27Å; K386-E390 PolarHBondContact O-N 2.85Å; E390-A392 PolarHBondContact O-N 2.83Å; E390-S393 PolarHBondContact O-N 2.9Å; E390-S393 PolarHBondContact O-OG 3.15Å
391Q78.5Confident71.7Confident137 Ų137117.9 Ų117.964%0.6462%0.615SS**Hα-helixtrans-61.8-39171-78.9-176.9-9.800113.7A387 K388 E389A387-Q391 WeakPolarHBondContact O-CG 3.35Å; A387-Q391 PolarHBondContact O-N 3.13Å; A387-Q391 VanDerWaalsContact O-N 3.16Å; K388-Q391 PolarHBondContact O-N 3.01Å; E389-Q391 PolarHBondContact O-N 3.11Å
392A77.8Confident69.3Low87 Ų87115.6 Ų115.672%0.71962%0.622SS**Hα-helixtrans-76-27.918000000113K388 E389 E390 G394K388-A392 WeakPolarHBondContact O-CB 3.45Å; K388-A392 PolarHBondContact O-N 3.03Å; E389-A392 CarbonylContact O-C 3.59Å; E389-A392 PolarHBondContact O-N 3.21Å; E389-A392 VanDerWaalsContact O-N 3.12Å; E390-A392 PolarHBondContact O-N 2.83Å; A392-G394 PolarHBondContact O-N 2.8Å
393S71.6Confident67.2Low63 Ų63119.1 Ų119.144%0.44164%0.635SS.*THydrogen-bonded Turntrans-68.9-10.4-175.974.70000114.9E389 E390 R395E389-S393 VanDerWaalsContact O-CB 3.31Å; E389-S393 WeakPolarHBondContact O-CB 3.43Å; E389-S393 PolarHBondContact O-N 3.4Å; E390-S393 PolarHBondContact O-N 2.9Å; E390-S393 PolarHBondContact O-OG 3.15Å; S393-R395 PolarHBondContact O-N 3.45Å; S393-R395 PolarHBondContact OG-N 2.97Å
394G53.6Low65.1Low58 Ų58121.1 Ų121.160%0.59865%0.651SS**  trans65.1-1.2-176.600000115.1A392 T396A392-G394 PolarHBondContact O-N 2.8Å; G394-T396 PolarHBondContact O-N 3.42Å
395R49.7Very low63.1Low199 Ų199124.7 Ų124.775%0.75166%0.664SS**  trans-79.657.1-178-72.7-172.4169.6-173.8-2.2112.5S393 N397S393-R395 PolarHBondContact O-N 3.45Å; S393-R395 PolarHBondContact OG-N 2.97Å; R395-N397 PolarHBondContact O-N 3.18Å
396T47.6Very low60.7Low117 Ų117129 Ų12972%0.71868%0.681SS**  trans-7079.1162.7560000109.1G394 V398G394-T396 PolarHBondContact O-N 3.42Å; T396-V398 PolarHBondContact O-N 3.5Å
397N52Low58.1Low148 Ų148128.5 Ų128.579%0.79169%0.69SS**  trans-67.669.5164.2-80.61.3000108.9R395 E399R395-N397 PolarHBondContact O-N 3.18Å; N397-E399 VanDerWaalsContact C-N 3.26Å; N397-E399 PolarHBondContact O-N 2.8Å
398V48.4Very low56Low102 Ų102131.4 Ų131.462%0.61871%0.707SS**  trans-74.888169-1740000106.7T396 T400T396-V398 PolarHBondContact O-N 3.5Å; V398-T400 VanDerWaalsContact C-N 3.31Å; V398-T400 HydrophobicContact CG1-CG2 3.82Å; V398-T400 PolarHBondContact O-N 3.12Å
399E45.8Very low54.1Low171 Ų171130.9 Ų130.980%0.79972%0.722SS**  trans-59.6100.5159.3-69.4-169.813700107.3N397 S401N397-E399 VanDerWaalsContact C-N 3.26Å; N397-E399 PolarHBondContact O-N 2.8Å; E399-S401 PolarHBondContact O-N 3.46Å
400T44.2Very low52.3Low131 Ų131129.8 Ų129.880%0.80473%0.727SS**  trans-74.749.6178.737.60000111.4V398 G402V398-T400 VanDerWaalsContact C-N 3.31Å; V398-T400 HydrophobicContact CG1-CG2 3.82Å; V398-T400 PolarHBondContact O-N 3.12Å; T400-G402 PolarHBondContact O-N 2.76Å
401S46Very low50.3Low98 Ų98130.2 Ų130.269%0.68573%0.733SS**  trans-77.185.4-178.558.80000111.6E399E399-S401 PolarHBondContact O-N 3.46Å
402G38.5Very low48.8Very low66 Ų66131.7 Ų131.768%0.6875%0.745SS**  trans7166.7147.200000118.1T400T400-G402 PolarHBondContact O-N 2.76Å
403F43Very low47.2Very low201 Ų201135.6 Ų135.688%0.88275%0.745SS**  trans-120.686.8154.6-98.6-80.1000111.6R405F403-R405 VanDerWaalsContact C-N 3.33Å; F403-R405 PolarHBondContact O-N 3.1Å
404Q46.4Very low46Very low186 Ų186142 Ų14287%0.86977%0.765SS**  trans-70.484174.6-173.8177.74.500110.3Q406Q404-Q406 PolarHBondContact O-N 3.36Å; Q404-Q406 VanDerWaalsContact O-N 3.12Å
405R45.9Very low45.7Very low216 Ų216145.5 Ų145.582%0.81578%0.775SS**  trans-66109.6173.9-73.9-170.4174.1-160.1-0.4110.2F403 T407F403-R405 VanDerWaalsContact C-N 3.33Å; F403-R405 PolarHBondContact O-N 3.1Å; R405-T407 HydrophobicContact CB-CG2 4.28Å; R405-T407 PolarHBondContact O-N 2.86Å
406Q42.3Very low44.9Very low178 Ų178140.9 Ų140.983%0.83278%0.779SS**  trans-68.695.9167.5-71.4-179.7-21.900110Q404Q404-Q406 PolarHBondContact O-N 3.36Å; Q404-Q406 VanDerWaalsContact O-N 3.12Å
407T37.9Very low44.8Very low128 Ų128144.4 Ų144.479%0.78579%0.785SS**  trans-102.464.6175550000111.4R405R405-T407 HydrophobicContact CB-CG2 4.28Å; R405-T407 PolarHBondContact O-N 2.86Å
408S43.7Very low44Very low107 Ų107144.6 Ų144.675%0.74878%0.784SS**  trans-101.988.6173.855.10000110.9
409A48Very low43.4Very low90 Ų90145.6 Ų145.674%0.74479%0.794SS**  trans-78.6130.6174.100000110.9N411A409-N411 PolarHBondContact O-N 3.4Å
410P53.3Low43.2Very low114 Ų114142.7 Ų142.774%0.7479%0.789SS**  trans-71.8119.8179.528-33.4000111.5L412P410-L412 PolarHBondContact O-N 2.97Å; P410-L412 VanDerWaalsContact O-N 3.1Å
411N41.9Very low42.7Very low137 Ų137143 Ų14373%0.73379%0.79SS**  trans-87.373.6-171-169.2-0.6000112.4A409 K413A409-N411 PolarHBondContact O-N 3.4Å; N411-K413 PolarHBondContact O-N 3.48Å
412L47.7Very low42.3Very low169 Ų169144.1 Ų144.189%0.88580%0.795SS**  trans-79.281.1-179.7-71.9173.6000112.6P410P410-L412 PolarHBondContact O-N 2.97Å; P410-L412 VanDerWaalsContact O-N 3.1Å
413K44.1Very low42.2Very low168 Ų168151 Ų15173%0.7381%0.806SS**  trans-111.9134166.7-83.2-176.7174.7177.10111.3N411N411-K413 PolarHBondContact O-N 3.48Å
414K46Very low41.9Very low199 Ų199146.1 Ų146.187%0.86580%0.803SS**  trans66.7118.3175.5-47.1169.4-177.41790112.3
415T46.3Very low41.8Very low130 Ų130141.6 Ų141.680%0.79880%0.797SS**  -158.81316331.70000111.7
416A33.9Very low41.6Very low102 Ų102136.2 Ų136.284%0.84379%0.793SS**  trans-84125.1162.500000108.9
417K44.6Very low41.5Very low191 Ų191138 Ų13883%0.8380%0.798SS**  trans-122.7116.7162.2-83.2-167.8172.5-174.90108.9
418I35.8Very low41.8Very low153 Ų153138.6 Ų138.679%0.78580%0.796SS**  trans-80.7122174.2-62.9166.9000107.2T420I418-T420 HydrophobicContact CG2-CG2 3.94Å
419C36.5Very low41.7Very low123 Ų123145.3 Ų145.383%0.83181%0.805SS**  trans-129.2121.3164.7-67.80000108.1
420T41Very low41.5Very low110 Ų110149 Ų14968%0.67581%0.812SS**  trans-111.9130-171.744.40000111.7I418I418-T420 HydrophobicContact CG2-CG2 3.94Å
421V34.7Very low41.1Very low138 Ų138149.9 Ų149.984%0.83681%0.81SS**  trans71.5151148.3170.90000114.2
422P37.7Very low41.4Very low121 Ų121153 Ų15379%0.78682%0.817SS**  cis-120.4178.613.317.18.3000117.3
423K35.7Very low41.3Very low210 Ų210156.5 Ų156.591%0.91382%0.819SS**  trans-63.3138.4168.3-56.6166.3176.2174.30111.9
424A37.4Very low41.6Very low99 Ų99155.8 Ų155.882%0.81882%0.821SS**  trans-173.9163.3137.200000112
425A42.6Very low41.8Very low91 Ų91155 Ų15575%0.75282%0.821SS**  trans72.1129.8160.600000121.5
426S42.8Very low42Very low102 Ų102157.9 Ų157.971%0.71383%0.825SS**  trans48.890.4150.159.60000120.1D428S426-D428 PolarHBondContact O-N 3.12Å
427F40.3Very low42.8Very low215 Ų215161.4 Ų161.494%0.94383%0.829SS**  trans-79.686.9145.3-114.5-92.5000108.3
428D44.4Very low42.4Very low141 Ų141156.1 Ų156.175%0.75483%0.829SS**  trans-150.460.6-172.3-128.4-26.8000113.1S426S426-D428 PolarHBondContact O-N 3.12Å
429R41.6Very low42.5Very low249 Ų249152.4 Ų152.494%0.9483%0.828SS**  trans-171.854174.4-112.2162.6-165.5-1604.3114.9
430L42.5Very low42.7Very low168 Ų168156 Ų15688%0.8883%0.832SS**  trans-148.328.4176-122.6168000116.6
431D45.1Very low42.8Very low131 Ų131160.2 Ų160.270%0.70184%0.841SS**  trans-136.773.6175.3-161.47.6000112.8
432K48.2Very low43.2Very low204 Ų204161.3 Ų161.389%0.88784%0.842SS**SBendtrans-147.625.8178.5-108.2-168.6-177.9-170.60115.1
433R46.4Very low43.2Very low242 Ų242163.5 Ų163.591%0.91385%0.846SS**SBendtrans-141.915.5178.9-77.4-163172.4-169-2.5115.9
434I50.4Low43.3Very low152 Ų152160.8 Ų160.878%0.77985%0.847SS**SBendtrans-128.644.8-179.6-39.1-177.3000111.2
435Q49.7Very low43.3Very low184 Ų184160.4 Ų160.486%0.8684%0.844SS**SBendtrans-145.37.9-176-124.1174.848.500117.2
436E51.3Low43.1Very low189 Ų189160.6 Ų160.688%0.88385%0.845SS**SBendtrans-117.49.4-172.1-68.5-172133.900116.1
437L49.4Very low42.7Very low177 Ų177162.7 Ų162.793%0.92785%0.853SS**SBendtrans-129.3112.2179.5-74.3177000114.6
438G37.5Very low42.8Very low80 Ų80161.5 Ų161.583%0.82585%0.848SS**  trans7289.7145.800000117.2
439G37.1Very low42.3Very low74 Ų74161.3 Ų161.376%0.76385%0.852SS**  trans-82.4137.8175.200000114.4
440H41.1Very low42.4Very low199 Ų199155.9 Ų155.992%0.92185%0.847SS**  trans-127.795.3154.6-89.5-74.2000109.7
441K41.9Very low42.2Very low198 Ų198155.9 Ų155.986%0.86185%0.848SS**  trans-100.1107.4166.2-68.5-179.2-179.8178.30108
442N44.6Very low42Very low162 Ų162158 Ų15887%0.86686%0.858SS**  trans-179.482.1156.1-96.3-17.4000111.6
443L37.5Very low41.6Very low167 Ų167157.8 Ų157.887%0.87486%0.857SS**  trans-166.6106131.6-131.473.6000109.5
444V37.2Very low41.1Very low152 Ų152150.9 Ų150.992%0.92185%0.852SS**  trans-110.6104.8165.21760000106.8
445A38.7Very low40.6Very low92 Ų92148.7 Ų148.776%0.7686%0.856SS**  trans-130.1107.3171.700000107.6
446A36.8Very low40Very low94 Ų94146.4 Ų146.478%0.77786%0.855SS**  trans-88.5133.4-175.200000111.5
447V35.6Very low39.8Very low146 Ų146145.8 Ų145.889%0.88586%0.857SS**  trans-130.9134156.4-177.30000107.6
448K41.1Very low39.2Very low190 Ų190140.8 Ų140.883%0.82685%0.848SS**  trans-83.4162.5-175.8-71.5179.8178.1176.50112.2
449T35.8Very low39.7Very low138 Ų138142.6 Ų142.685%0.84785%0.848SS**  trans-54.3130.9170.249.60000113.9
450T43.2Very low40.4Very low135 Ų135148.7 Ų148.783%0.82885%0.854SS**  trans-142.1127.5153.549.40000110.1
451N37.2Very low41.2Very low168 Ų168145.1 Ų145.190%0.89885%0.848SS**  trans-76.4135.5170-67.6-62000110.1
452L42.1Very low41.6Very low175 Ų175144.9 Ų144.992%0.91685%0.847SS**  trans-142.7152.7158.1-99.9176000111
453K39.1Very low42.2Very low199 Ų199142.5 Ų142.587%0.86584%0.84SS**  trans-91.1150.1-172.2-71178.9177.9175.90112.7
454A36.2Very low42.8Very low98 Ų98141.1 Ų141.181%0.8184%0.839SS**  trans23.9119.3145.400000119.9
455A39.2Very low43.1Very low105 Ų105141.5 Ų141.587%0.86883%0.83SS**  trans-136.1129.3147.800000109.1
456T38.5Very low43.7Very low137 Ų137142.9 Ų142.984%0.8483%0.832SS**  trans-99.8108.8-173.6-57.70000111.1
457L45.3Very low43.8Very low176 Ų176144.8 Ų144.892%0.92184%0.837SS**  trans-159.5147.3163.5-93.2132.8000108.2
458G36.7Very low44Very low72 Ų72140.7 Ų140.774%0.74283%0.825SS**  cis15927.1-0.600000115
459S48.5Very low44Very low118 Ų118143.3 Ų143.383%0.82583%0.829SS**  trans-135.4124.9-174.853.90000112.8
460K52Low44.2Very low202 Ų202144.2 Ų144.288%0.87883%0.828SS**PPolyproline II helixtrans-91.9135.9170.1-66.3-179.5-179.71780109.6
461P58Low44.3Very low123 Ų123143.4 Ų143.480%0.79982%0.823SS**PPolyproline II helixtrans-68.7140.5170.629.1-33.6000110.8
462K50.9Low44.3Very low194 Ų194141.6 Ų141.684%0.84382%0.817SS**PPolyproline II helixtrans-79.4135.9173.9-69.6-179.9177.9177.60110.3
463P56.4Low44.2Very low111 Ų111139.2 Ų139.272%0.72181%0.81SS**PPolyproline II helixtrans-71.1139.5171.230.1-33.8000110.9
464V50.4Low44.7Very low139 Ų139138.2 Ų138.284%0.84281%0.805SS**PPolyproline II helixtrans-92.5119.1176.1177.60000109.3P466V464-P466 WeakPolarHBondContact O-CD 3.47Å
465H43.6Very low44.9Very low159 Ų159138.4 Ų138.474%0.73680%0.798SS**PPolyproline II helixtrans-80.1124.6174.6-76.4-78.7000111.6C467H465-C467 PolarHBondContact O-N 3.05Å
466P51.7Low45Very low122 Ų122143.3 Ų143.379%0.79280%0.801SS**  trans-80.4101.6172.231.1-32.5000111V464 G468V464-P466 WeakPolarHBondContact O-CD 3.47Å; P466-G468 PolarHBondContact O-N 2.85Å
467C38.4Very low45.2Very low133 Ų133142.8 Ų142.890%0.89979%0.792SS**  trans-73.669174.3-69.80000112.8H465H465-C467 PolarHBondContact O-N 3.05Å
468G40.2Very low45.2Very low60 Ų60141 Ų14162%0.61978%0.777SS**  trans-100.2108.117300000112.5P466 I470P466-G468 PolarHBondContact O-N 2.85Å; G468-I470 PolarHBondContact O-N 3.2Å
469R40.2Very low45.9Very low246 Ų246143 Ų14393%0.92877%0.767SS**  trans-73.594.7172.3-74.9-176.6177.7167.80.3110.7T471R469-T471 PolarHBondContact O-N 3.48Å
470I40.2Very low46.5Very low157 Ų157142.9 Ų142.981%0.80576%0.761SS**  trans-75101.9168.8-58177.5000108.5G468 V472G468-I470 PolarHBondContact O-N 3.2Å; I470-V472 PolarHBondContact O-N 3.44Å
471T44.7Very low47.4Very low118 Ų118136.8 Ų136.872%0.72474%0.736SS**  trans-70.6111.3166.445.40000109.3R469 V473R469-T471 PolarHBondContact O-N 3.48Å; T471-V473 PolarHBondContact O-N 2.92Å
472V37.7Very low48.2Very low130 Ų130138 Ų13879%0.78873%0.729SS**  trans-66.398.8175.2-179.80000109.4I470 K474I470-V472 PolarHBondContact O-N 3.44Å; V472-K474 PolarHBondContact O-N 2.99Å
473V40.7Very low49.3Very low125 Ų125136.4 Ų136.476%0.75872%0.717SS**  trans-70.7109.1169.7-179.90000107.4T471T471-V473 PolarHBondContact O-N 2.92Å
474K48.6Very low50.6Low177 Ų177135.7 Ų135.777%0.7770%0.704SS**  trans-59.9133.1170.9-75.8-173174.7-175.50109V472 F476V472-K474 PolarHBondContact O-N 2.99Å; K474-F476 PolarHBondContact O-N 3.2Å
475P41Very low52Low103 Ų103132.9 Ų132.967%0.66968%0.684SS**  trans-65.8131.617629.3-35.3000109.6L477P475-L477 VanDerWaalsContact C-N 3.26Å; P475-L477 HydrophobicContact CB-CD1 3.71Å; P475-L477 HydrophobicContact CG-CD1 4.06Å; P475-L477 PolarHBondContact O-N 3.17Å
476F41.5Very low53.9Low208 Ų208131.6 Ų131.691%0.91268%0.679SS**  trans-82.469.2-173.1-144.4-82.5000110.6K474K474-F476 PolarHBondContact O-N 3.2Å
477L42.2Very low55.4Low126 Ų126132.5 Ų132.566%0.6667%0.67SS**  trans-79.3131-178.1-98.577.2000112.6P475P475-L477 VanDerWaalsContact C-N 3.26Å; P475-L477 HydrophobicContact CB-CD1 3.71Å; P475-L477 HydrophobicContact CG-CD1 4.06Å; P475-L477 PolarHBondContact O-N 3.17Å
478F45.7Very low57.6Low139 Ų139131.2 Ų131.261%0.6165%0.652SS**  trans64.267.3147.2-74-117.6000118Q481F478-Q481 HydrophobicContact CD1-CB 3.39Å; F478-Q481 HydrophobicContact CD1-CG 3.88Å; F478-Q481 HydrophobicContact CE1-CB 3.74Å; F478-Q481 HydrophobicContact CE1-CG 3.83Å; F478-Q481 HydrophobicContact CG-CB 4.29Å
479E52.6Low59.6Low112 Ų112131 Ų13152%0.52365%0.645SS.*SBendtrans-106.8-23.5148-151.3-172133.200113R483E479-R483 IonicContact OE1-CZ 2.72Å; E479-R483 IonicContact OE1-NE 3.15Å; E479-R483 PolarHBondContact OE1-NE 3.28Å; E479-R483 IonicContact OE1-NH2 3.8Å; E479-R483 PolarHBondContact OE1-NH2 3.46Å
480T60.8Low61.3Low116 Ų116122 Ų12271%0.71262%0.623SS**Hα-helixtrans-64.8-44.3176.544.50000112.7K482 R483 H484T480-K482 PolarHBondContact O-N 3.39Å; T480-R483 PolarHBondContact O-N 3.42Å; T480-H484 PolarHBondContact O-N 2.98Å
481Q70.5Confident62.8Low74 Ų74119 Ų11935%0.34661%0.608SS.*Hα-helixtrans-61-45.6-179.2-16865.542.400112F478 R483 H484 D485F478-Q481 HydrophobicContact CD1-CB 3.39Å; F478-Q481 HydrophobicContact CD1-CG 3.88Å; F478-Q481 HydrophobicContact CE1-CB 3.74Å; F478-Q481 HydrophobicContact CE1-CG 3.83Å; F478-Q481 HydrophobicContact CG-CB 4.29Å; Q481-R483 PolarHBondContact O-N 2.91Å; Q481-H484 WeakPolarHBondContact O-CA 3.35Å; Q481-H484 WeakPolarHBondContact O-CB 3.31Å; Q481-H484 PolarHBondContact O-N 3.02Å; Q481-D485 WeakPolarHBondContact CG-OD2 3.4Å; Q481-D485 PolarHBondContact NE2-OD1 3.33Å; Q481-D485 PolarHBondContact O-N 3.31Å
482K74.6Confident63.9Low148 Ų148117.5 Ų117.564%0.64360%0.602SS**Hα-helixtrans-60.2-33.2179.5-168.9173.8-178.1178.40112.5T480 Q486T480-K482 PolarHBondContact O-N 3.39Å; K482-Q486 WeakPolarHBondContact O-CB 3.4Å; K482-Q486 WeakPolarHBondContact O-CG 3.47Å; K482-Q486 PolarHBondContact O-N 3.5Å
483R74.9Confident65.2Low162 Ų162119.3 Ų119.361%0.61160%0.599SS**Hα-helixtrans-77-34.6173.9-63.1-178.8-173.1-148.84.1112.5E479 T480 Q481 K487E479-R483 IonicContact OE1-CZ 2.72Å; E479-R483 IonicContact OE1-NE 3.15Å; E479-R483 PolarHBondContact OE1-NE 3.28Å; E479-R483 IonicContact OE1-NH2 3.8Å; E479-R483 PolarHBondContact OE1-NH2 3.46Å; T480-R483 PolarHBondContact O-N 3.42Å; Q481-R483 PolarHBondContact O-N 2.91Å; R483-K487 WeakPolarHBondContact O-CB 3.48Å; R483-K487 PolarHBondContact O-N 2.96Å
484H81.9Confident66Low96 Ų96118.6 Ų118.644%0.44460%0.595SS.*Hα-helixtrans-61.1-50.6171.5175.5-86.9000110.9T480 Q481 Q486 K487 M488T480-H484 PolarHBondContact O-N 2.98Å; Q481-H484 WeakPolarHBondContact O-CA 3.35Å; Q481-H484 WeakPolarHBondContact O-CB 3.31Å; Q481-H484 PolarHBondContact O-N 3.02Å; H484-Q486 PolarHBondContact O-N 3.12Å; H484-K487 WeakPolarHBondContact O-CA 3.36Å; H484-K487 WeakPolarHBondContact O-CB 3.44Å; H484-K487 PolarHBondContact O-N 3.06Å; H484-M488 WeakPolarHBondContact O-CG 3.29Å; H484-M488 PolarHBondContact O-N 2.94Å
485D80.7Confident66.1Low79 Ų79115.7 Ų115.742%0.42259%0.592SS.*Hα-helixtrans-68.6-36.9-175.4-55.6-19.7000111.5Q481 K487 M488 A489Q481-D485 WeakPolarHBondContact CG-OD2 3.4Å; Q481-D485 PolarHBondContact NE2-OD1 3.33Å; Q481-D485 PolarHBondContact O-N 3.31Å; D485-K487 VanDerWaalsContact C-N 3.33Å; D485-K487 PolarHBondContact O-N 3.39Å; D485-M488 PolarHBondContact O-N 3.22Å; D485-A489 VanDerWaalsContact O-CB 3.29Å; D485-A489 WeakPolarHBondContact O-CB 3.37Å; D485-A489 PolarHBondContact O-N 3.25Å
486Q83Confident66.7Low132 Ų132119.7 Ų119.762%0.61760%0.599SS**Hα-helixtrans-61.2-38.5167.9-80.6-173.3-42.200112.8K482 H484 A490K482-Q486 WeakPolarHBondContact O-CB 3.4Å; K482-Q486 WeakPolarHBondContact O-CG 3.47Å; K482-Q486 PolarHBondContact O-N 3.5Å; H484-Q486 PolarHBondContact O-N 3.12Å; Q486-A490 WeakPolarHBondContact O-CB 3.4Å; Q486-A490 PolarHBondContact O-N 3.05Å
487K84.5Confident67.3Low142 Ų142118.2 Ų118.262%0.61760%0.595SS**Hα-helixtrans-67.6-41.8177.4-170.3-178.1178.8-171.90111.6R483 H484 D485 A490 L491R483-K487 WeakPolarHBondContact O-CB 3.48Å; R483-K487 PolarHBondContact O-N 2.96Å; H484-K487 WeakPolarHBondContact O-CA 3.36Å; H484-K487 WeakPolarHBondContact O-CB 3.44Å; H484-K487 PolarHBondContact O-N 3.06Å; D485-K487 VanDerWaalsContact C-N 3.33Å; D485-K487 PolarHBondContact O-N 3.39Å; K487-A490 PolarHBondContact O-N 3.24Å; K487-L491 HydrophobicContact CG-CD1 4.35Å; K487-L491 WeakPolarHBondContact O-CG 3.43Å; K487-L491 PolarHBondContact O-N 3.3Å
488M83.5Confident67.8Low105 Ų105119.8 Ų119.852%0.51760%0.604SS.*Hα-helixtrans-66.8-41.4176.1-60.2-58.4-8900111.4H484 D485 A490 L491 S492H484-M488 WeakPolarHBondContact O-CG 3.29Å; H484-M488 PolarHBondContact O-N 2.94Å; D485-M488 PolarHBondContact O-N 3.22Å; M488-A490 VanDerWaalsContact C-N 3.29Å; M488-A490 PolarHBondContact O-N 3.47Å; M488-L491 PolarHBondContact O-N 3.3Å; M488-L491 HydrophobicContact SD-CD1 4.41Å; M488-S492 WeakPolarHBondContact O-CB 3.42Å; M488-S492 PolarHBondContact O-N 3.31Å
489A81.7Confident68Low57 Ų57122.6 Ų122.647%0.47162%0.619SS.*Hα-helixtrans-65.5-28.3174.900000113.6D485D485-A489 VanDerWaalsContact O-CB 3.29Å; D485-A489 WeakPolarHBondContact O-CB 3.37Å; D485-A489 PolarHBondContact O-N 3.25Å
490A77.3Confident67.5Low56 Ų56120.9 Ų120.946%0.46363%0.631SS.*Hα-helixtrans-73.5-46.7171.700000111.8Q486 K487 M488 S492 K493 V494Q486-A490 WeakPolarHBondContact O-CB 3.4Å; Q486-A490 PolarHBondContact O-N 3.05Å; K487-A490 PolarHBondContact O-N 3.24Å; M488-A490 VanDerWaalsContact C-N 3.29Å; M488-A490 PolarHBondContact O-N 3.47Å; A490-S492 VanDerWaalsContact C-N 3.31Å; A490-S492 PolarHBondContact O-N 3.02Å; A490-K493 PolarHBondContact O-N 3.43Å; A490-V494 PolarHBondContact O-N 3.15Å
491L71.6Confident66.9Low95 Ų95124.1 Ų124.150%0.49764%0.639SS.*Hα-helixtrans-60.3-41.1178-71.1167.4000111.7K487 M488 K493 V494K487-L491 HydrophobicContact CG-CD1 4.35Å; K487-L491 WeakPolarHBondContact O-CG 3.43Å; K487-L491 PolarHBondContact O-N 3.3Å; M488-L491 PolarHBondContact O-N 3.3Å; M488-L491 HydrophobicContact SD-CD1 4.41Å; L491-K493 PolarHBondContact O-N 3.31Å; L491-V494 PolarHBondContact O-N 3.43Å; L491-V494 VanDerWaalsContact O-N 3.12Å
492S68.1Low66.1Low85 Ų85126.4 Ų126.459%0.59466%0.66SS**Hα-helixtrans-62.2-11175.4-178.70000114.9M488 A490M488-S492 WeakPolarHBondContact O-CB 3.42Å; M488-S492 PolarHBondContact O-N 3.31Å; A490-S492 VanDerWaalsContact C-N 3.31Å; A490-S492 PolarHBondContact O-N 3.02Å
493K63.5Low64.5Low168 Ų168129 Ų12973%0.7367%0.671SS**Hα-helixtrans-100.1-18.4175.5-72.9-173.4175-166.70114A490 L491A490-K493 PolarHBondContact O-N 3.43Å; L491-K493 PolarHBondContact O-N 3.31Å
494V57.1Low63.4Low110 Ų110128 Ų12867%0.66768%0.683SS**Hα-helixtrans-83.1-27.4179.8178.20000111.2A490 L491 K496A490-V494 PolarHBondContact O-N 3.15Å; L491-V494 PolarHBondContact O-N 3.43Å; L491-V494 VanDerWaalsContact O-N 3.12Å; V494-K496 PolarHBondContact O-N 3.33Å
495T51.8Low61.6Low116 Ų116129.6 Ų129.671%0.71270%0.704SS**THydrogen-bonded Turntrans-83.440.9-178.5620000113.8
496K53.6Low59.5Low187 Ų187129.1 Ų129.181%0.81372%0.717SS**THydrogen-bonded Turntrans-143.86.9177.6-80.1-152.4171.4-161.20115.5V494V494-K496 PolarHBondContact O-N 3.33Å
497E53.6Low57.6Low177 Ų177130.4 Ų130.483%0.82773%0.728SS**SBendtrans-126.552.6-178.3-64.4-173.6152.500111.6
498D52Low55.8Low159 Ų159129.3 Ų129.385%0.8574%0.739SS**  trans-14827.4178.6-131.8-11.1000114.9
499E50Low54Low199 Ų199128.4 Ų128.493%0.9375%0.748SS**  trans-97.693.9163.3-75-167.6158.800109.6Q501E499-Q501 PolarHBondContact O-N 3.42Å
500G43Very low52.4Low75 Ų75130.8 Ų130.877%0.77376%0.761SS**  trans-77.3115.8-173.100000114.2
501Q48.8Very low51Low185 Ų185137.9 Ų137.986%0.86478%0.781SS**PPolyproline II helixtrans-71.7137165.5-74.5-168-19.600111.7E499E499-Q501 PolarHBondContact O-N 3.42Å
502P52.5Low50.1Low121 Ų121139.4 Ų139.479%0.78680%0.8SS**PPolyproline II helixtrans-72.7138177.429.8-34.4000111.8T504P502-T504 PolarHBondContact O-N 3.39Å
503K41.3Very low49.1Very low203 Ų203146.7 Ų146.788%0.88381%0.814SS**PPolyproline II helixtrans-76.1117.2-179.9-62.5172.4-176.7171.50111.2
504T51.7Low48.4Very low142 Ų142146.4 Ų146.487%0.87182%0.821SS**PPolyproline II helixtrans-87.6120.3162.441.20000110.2P502P502-T504 PolarHBondContact O-N 3.39Å
505C44.2Very low47.9Very low129 Ų129146.7 Ų146.787%0.87282%0.823SS**PPolyproline II helixtrans-75.7131169.9-660000109.1
506G37.7Very low47.7Very low68 Ų68152.8 Ų152.870%0.70183%0.833SS**  trans-84.9176.5-179.200000114
507N42.7Very low47.2Very low159 Ų159148.1 Ų148.185%0.8583%0.83SS**  trans-161.9139.4162.9-103-36.8000110.5
508S46.6Very low46.9Very low120 Ų120146.3 Ų146.384%0.83983%0.83SS**  trans60.2155.9164.265.20000118.4
509A46.1Very low46.8Very low86 Ų86144.9 Ų144.971%0.71183%0.83SS**  cis-166-176.3-26.100000109.4
510S48.1Very low46.6Very low106 Ų106138.8 Ų138.874%0.74182%0.82SS**  trans75.196.3153.2-60.30000120.3
511K47.3Very low46.8Very low206 Ų206143.6 Ų143.690%0.89683%0.826SS**  40.5117.8122.7-58.9170.8-178.31730119
512S53.1Low46.7Very low127 Ų127138.6 Ų138.689%0.88882%0.816SS**  -157.4168.1111.560.40000110.9
513R46.1Very low46.4Very low238 Ų238139.9 Ų139.990%0.89882%0.816SS**  trans-113145.2178.5-62.3171.6176.2158.5-4.8109.4
514N49.7Very low46.8Very low161 Ų161139.3 Ų139.386%0.86181%0.814SS**  trans-153.2164.7133.4-138.6-27.3000112
515T46.3Very low46.3Very low117 Ų117137.5 Ų137.572%0.71881%0.807SS**  trans-139.4133.2-157.351.10000115.6
516R47.7Very low46.5Very low243 Ų243138.2 Ų138.292%0.91781%0.807SS**  trans-160.4122.1148.8-100169.6-177.9-174-0.7106
517A42.9Very low46.9Very low90 Ų90144 Ų14474%0.74482%0.816SS**  57.4123.173.300000110.9
518V47.6Very low46.9Very low139 Ų139141.6 Ų141.684%0.84281%0.812SS**  cis-145.6160.742.4161.30000110.3
519P49.4Very low47Very low129 Ų129147.5 Ų147.584%0.83882%0.816SS**  trans-104.4170.1-153.839.8-35.2000117
520G45.7Very low47.1Very low70 Ų70150.7 Ų150.772%0.72282%0.82SS**  trans-153.7104.9171.200000115
521I46.9Very low47.5Very low177 Ų177153.1 Ų153.191%0.90882%0.824SS**  trans60.9108.6151.6-53.9177.5000118.4
522A47.2Very low47.8Very low79 Ų79148.7 Ų148.765%0.65382%0.816SS**  trans-78.1171.6157.700000110.1
523N46.5Very low47.9Very low148 Ų148151.1 Ų151.179%0.79182%0.818SS**  cis-173.9163.438.7-134.9-28.5000106.1
524K49.2Very low48.4Very low192 Ų192149.4 Ų149.484%0.83582%0.817SS**  cis-142.5-177.418.6-55.5178-178.9179.60110.8
525S41.8Very low47.9Very low104 Ų104146.5 Ų146.573%0.72782%0.815SS**  trans-129.6155.5167.5176.20000110.5
526T48.9Very low48.3Very low143 Ų143150.8 Ų150.888%0.87782%0.824SS**  trans-136.9122.2166.227.90000109.7
527Q45.9Very low48.1Very low189 Ų189148 Ų14888%0.88382%0.821SS**PPolyproline II helixtrans-79.9161.7-174.4-70174.6-50.900113.4
528S41.6Very low48.1Very low110 Ų110151 Ų15177%0.76982%0.823SS**PPolyproline II helixtrans-69.4149.8170.744.80000112.6
529R49.6Very low47.7Very low244 Ų244151.6 Ų151.692%0.92182%0.819SS**PPolyproline II helixtrans-103.8125.1163.6-86.3-175.6169.1178.2-3.2109.8
530I48.6Very low47.5Very low153 Ų153152.3 Ų152.379%0.78581%0.811SS**PPolyproline II helixtrans-92.8139.1166.5-62.9172.2000108
531L55.6Low47.3Very low157 Ų157156 Ų15682%0.82281%0.809SS**  trans-126.8118.4168.6-77.1175.5000109.7
532P53.7Low46.9Very low113 Ų113153.3 Ų153.373%0.73480%0.803SS**PPolyproline II helixtrans-86.7123.1171.532.4-30.3000110.6
533L54.3Low46.9Very low177 Ų177161.4 Ų161.493%0.92782%0.817SS**PPolyproline II helixtrans-83.6129.2169.7-74.5171.8000110.2
534K57.5Low46.5Very low202 Ų202159 Ų15988%0.87882%0.818SS**PPolyproline II helixtrans-81.2143-180-65.5-175.6177.7-176.30111.3
535A39.8Very low46.1Very low101 Ų101156.4 Ų156.484%0.83582%0.817SS**PPolyproline II helixtrans-71.8148.4162.700000111.1
536K53.5Low46Very low207 Ų207159.7 Ų159.790%0.982%0.821SS**  trans-132.6117.5159.5-82.8-169.3172.7-171.90108.6
537Q43.2Very low45.6Very low183 Ų183159.3 Ų159.386%0.85582%0.818SS**  trans-76.7161151.6-65.2168.1-54.800108.5
538I44Very low45.3Very low153 Ų153154.8 Ų154.879%0.78581%0.814SS**  trans166.4109.3135-87.3162.6000110.2
539M39.7Very low45.2Very low153 Ų153157.1 Ų157.175%0.75482%0.817SS**  trans77.8151.2136.5-122156.160.300123.3
540E43.6Very low45.1Very low143 Ų143151.6 Ų151.667%0.66881%0.813SS**  trans67.7144161-55.8-166.3-170.300119
541H42Very low44.9Very low149 Ų149147.6 Ų147.669%0.6981%0.809SS**  cis-158.5149-10.8-122.3-34.7000110
542P39.8Very low44.3Very low119 Ų119148.7 Ų148.777%0.77382%0.815SS**  trans-123.5122.8165.835.4-22.8000113.7
543R46.9Very low43.8Very low250 Ų250149.5 Ų149.594%0.94382%0.818SS**  trans-146.4156.2163.5-74.8-163.7175.2-164.5-0.7110.8
544A37.2Very low43.4Very low98 Ų98150.5 Ų150.581%0.8182%0.815SS**  trans-122.8146.1-176.200000112.5
545V41.5Very low42.9Very low137 Ų137150 Ų15083%0.8381%0.812SS**  trans-145.4106.6170.3-1760000105
546Q40.3Very low43.1Very low173 Ų173154.3 Ų154.381%0.80882%0.815SS**  67118.681.5-83.1-156.92.900116.9
547V39.8Very low42.7Very low134 Ų134148.6 Ų148.681%0.81281%0.806SS**  trans63.1112.6140-175.50000120
548A39.2Very low42.7Very low95 Ų95148.3 Ų148.379%0.78581%0.805SS**  -171143.9120.700000113.2
549N38.5Very low42.6Very low158 Ų158146.4 Ų146.485%0.84581%0.806SS**  trans-92.1179.3163.9-105.1-30.5000109.1
550P49.1Very low42.8Very low128 Ų128145.9 Ų145.983%0.83181%0.805SS**  cis-142-162.824.542.7-21.5000115.4
551G44Very low42.7Very low69 Ų69148.2 Ų148.271%0.71181%0.813SS**  trans-171.54.9178.200000125.7
552L43.3Very low43.1Very low181 Ų181146.2 Ų146.295%0.94881%0.813SS**  trans65.3170.6165.7-71.4167.1000120.8
553V42.8Very low43.4Very low129 Ų129150.1 Ų150.178%0.78282%0.818SS**  trans-147.1141-163.1171.50000112.3
554K46.7Very low43Very low199 Ų199144.5 Ų144.587%0.86581%0.811SS**  trans-178.9136.8150.3-94.7146.6-174.4-176.30107.7
555K46.2Very low43.3Very low191 Ų191147.1 Ų147.183%0.8381%0.811SS**  cis98.9109.341.4-102.7-159.5172.7-167.20112.6
556E44.4Very low43.2Very low192 Ų192144.8 Ų144.890%0.89780%0.801SS**  trans175129.1147.1-96.9157-150.900106.7
557A44.3Very low43.3Very low86 Ų86141.8 Ų141.871%0.71180%0.795SS**  86140.661.800000112.6
558E43.3Very low43.4Very low178 Ų178143.9 Ų143.983%0.83279%0.793SS**  cis-165.3156.4-13.8-123.6-179162.900111.3
559S41.8Very low43.5Very low113 Ų113145.1 Ų145.179%0.7979%0.786SS**  trans62.2-178.5160.480.10000120.1
560L43.7Very low43.6Very low142 Ų142143.4 Ų143.474%0.74378%0.777SS**  -172.6116.3-83-102.5168000111.6
561K42.3Very low43.1Very low192 Ų192148 Ų14884%0.83578%0.778SS**  trans60.8-170.8157.5-59.3177.2176.81760116.1
562P50.4Low42.6Very low106 Ų106149.3 Ų149.369%0.68878%0.781SS**  cis-125.9174.7-30.3210.8000113.7
563K46.5Very low42.6Very low201 Ų201147.3 Ų147.387%0.87478%0.777SS**  170.2159115.8-93.2171.4179.8176.70114
564V38.2Very low42.6Very low132 Ų132145.2 Ų145.280%0.877%0.773SS**  trans-135.4141173173.80000107.3
565N42.3Very low42.5Very low153 Ų153143.2 Ų143.282%0.81877%0.77SS**  trans156.1157157.8-87.1-8.1000111.5
566S40.2Very low42.1Very low89 Ų89145.6 Ų145.662%0.62277%0.774SS**  cis-175.2153.6-2456.90000113.1
567V42.3Very low42Very low110 Ų110144.4 Ų144.467%0.66777%0.768SS**  trans66.8158.1157-146.20000121.2
568F41.5Very low42Very low178 Ų178147.9 Ų147.978%0.78177%0.77SS**  trans80.5137.3162.4-62.1-78.2000119.5
569N41.6Very low42Very low120 Ų120146 Ų14664%0.64276%0.764SS**  cis-164.6155.5-28.4-136.94000114
570L40.7Very low42.3Very low123 Ų123145.9 Ų145.964%0.64476%0.758SS**  trans55.8144.6149.8-107.174000124.2
571R37.6Very low42.5Very low225 Ų225147.3 Ų147.385%0.84976%0.761SS**  trans64.5122.1157.3-65.9173.8178.3170.2-0.7117.4
572A35.5Very low42.8Very low95 Ų95147.5 Ų147.579%0.78576%0.763SS**  cis84.186.525.200000116.8
573T42.5Very low42.8Very low139 Ų139149 Ų14985%0.85377%0.77SS**  trans-155.5121.1145.125.60000106
574A43.6Very low43.3Very low85 Ų85142.8 Ų142.870%0.70276%0.755SS**  cis93.9127.640.500000113.5
575I43.7Very low44.4Very low157 Ų157142.9 Ų142.981%0.80576%0.756SS**  trans64.1105.4157.9-56.6161.7000117.3
576R37.2Very low44.9Very low242 Ų242146.5 Ų146.591%0.91378%0.776SS**  trans-96.1115.7141.4-76.5178.4173.5171.3-2.5107.9
577Q42.7Very low45.1Very low166 Ų166149.4 Ų149.478%0.77678%0.783SS**  trans176.2169.8151.1-103.6161.2-6.800109.4
578H43.3Very low45.3Very low160 Ų160151.5 Ų151.574%0.74179%0.789SS**  trans69145.2-178.4-64-91.9000116.8
579L43.3Very low45.5Very low137 Ų137150 Ų15072%0.71779%0.79SS**  cis-164.4169.6-34.9-145.169.1000108.7
580V49.4Very low45.7Very low111 Ų111151.8 Ų151.867%0.67380%0.799SS**  trans63.8123.1155.6166.90000117.9
581E47.3Very low46Very low172 Ų172153.6 Ų153.680%0.80481%0.808SS**  trans-60.7146.4165.8-62.2129.5123.700112.3
582F48.3Very low46.6Very low197 Ų197148.8 Ų148.886%0.86481%0.805SS**  trans-112.1107.4153-112.7-86.6000108.4
583V50.5Low47.4Very low138 Ų138152.6 Ų152.684%0.83681%0.807SS**  trans-122.6119.9155.5177.70000105.5
584A57.1Low47.8Very low69 Ų69153.7 Ų153.757%0.5780%0.803SS**  trans-105.9-173.5174.200000109.5
585V61Low48.1Very low134 Ų134159.4 Ų159.481%0.81281%0.812SS**  trans80.9118.2-169-168.40000110.9
586D53.6Low48.5Very low230 Ų230159.6 Ų159.6100%1.2381%0.812SS**  cis-6002-61.9-57.8000115.7

Retrieved 586 of 586 residues in 172.3 ms (Link to these results)