A0A077Z7P5_TRITR Loading...

Collagen domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z7P5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 640 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M46.2Very low52.7Low249 Ų249134.3 Ų134.3100%1.22787%0.873SS**  0106.40-71.5-174.7167.400107.6
2L40.4Very low52.6Low184 Ų184133.5 Ų133.596%0.96387%0.868SS**  trans-99.2134.3-172.6-78.2148.8000108.9
3A55Low51.8Low105 Ų105129 Ų12987%0.86886%0.861SS**  trans-146.5107.7162.800000109.2
4G53Low51.6Low70 Ų70128.4 Ų128.472%0.72286%0.859SS**PPolyproline II helixtrans-82.9171.4174.200000112.7
5P67.2Low51.6Low128 Ų128128.2 Ų128.283%0.83186%0.856SS**PPolyproline II helixtrans-84.9151.5-175.633.1-31.7000112.9
6P60.4Low51Low131 Ų131125.1 Ų125.185%0.85185%0.853SS**PPolyproline II helixtrans-83.7153.2179.535-33.6000112.7
7G51.8Low50.8Low77 Ų77128 Ų12879%0.79486%0.857SS**  trans-82.9176.9-167.500000117.9
8S49Very low50.5Low121 Ų121127.3 Ų127.385%0.84685%0.851SS**PPolyproline II helixtrans-69.6140.7-174-390000114.1
9P59.4Low49.9Very low129 Ų129124.7 Ų124.784%0.83885%0.848SS**PPolyproline II helixtrans-89.6131168.226.8-18.7000112
10G45.7Very low49.6Very low73 Ų73129 Ų12975%0.75385%0.852SS**PPolyproline II helixtrans-67.6154.4174.900000113.7
11K52.1Low49.4Very low210 Ų210130.8 Ų130.891%0.91385%0.854SS**PPolyproline II helixtrans-80.3135.6176.8-75.3-175.4174.9-1760111.4
12P50.8Low49Very low125 Ų125122.7 Ų122.781%0.81283%0.834SS**PPolyproline II helixtrans-80.9148.51660.417.3000111.8
13G42.9Very low49.2Very low75 Ų75121.9 Ų121.977%0.77383%0.829SS**PPolyproline II helixtrans-67.7159179.700000114.9
14S49.3Very low48.7Very low120 Ų120126.1 Ų126.184%0.83983%0.831SS**PPolyproline II helixtrans-91.7133.1176.6-50.20000110.7
15P51.3Low47.9Very low126 Ų126126 Ų12682%0.81883%0.83SS**PPolyproline II helixtrans-77144174-7.724.3000112.1
16G42.3Very low47.1Very low78 Ų78125.5 Ų125.580%0.80483%0.826SS**PPolyproline II helixtrans-70.4151175.500000113.9
17L47.8Very low46.2Very low175 Ų175130.4 Ų130.492%0.91683%0.828SS**PPolyproline II helixtrans-89.9139.6172.9-81.1162.7000110.9
18P43.8Very low45.5Very low115 Ų115129.8 Ų129.875%0.74782%0.822SS**PPolyproline II helixtrans-84.4156.5174.733.5-30.6000112.5
19G39.5Very low45.4Very low78 Ų78134.6 Ų134.680%0.80482%0.823SS**PPolyproline II helixtrans-73.4165.5-16500000117.9
20F44.7Very low45Very low210 Ų210134.4 Ų134.492%0.92182%0.822SS**  trans-114109.9168.2-96.5-91.2000109.8
21N44.6Very low44.9Very low168 Ų168133.8 Ų133.890%0.89882%0.816SS**  trans-87.7143.2152.8-86.3-27.1000107.8
22G39.1Very low44.6Very low78 Ų78133 Ų13380%0.80481%0.812SS**  trans155.467.9167.900000114.9
23I43Very low44.3Very low168 Ų168134 Ų13486%0.86281%0.811SS**  trans-70.7121.6164.1-64.5170000108.1
24Q44.3Very low44.2Very low194 Ų194134.5 Ų134.591%0.90782%0.816SS**  trans-157.1106.1156.2-103.9176.368.600108.3
25G38.1Very low43.8Very low67 Ų67131.8 Ų131.869%0.69181%0.807SS**  trans-89.7-159.1150.900000109
26P48.6Very low43.6Very low118 Ų118135.2 Ų135.277%0.76681%0.812SS**  cis-124178.1-30.837.3-22.4000110.1
27R42.1Very low43.8Very low233 Ų233136.4 Ų136.488%0.87981%0.805SS**  trans171.1115.4142.2-96.7165.8-143.9-1535110.5
28G37.6Very low43.5Very low65 Ų65134.6 Ų134.667%0.6780%0.801SS**  trans-84.3162.3158.600000111
29Y45.8Very low43.3Very low222 Ų222139.9 Ų139.987%0.87181%0.806SS**  trans-164.9160.3158.2-94.1-57.4000109.1
30P52Low43.3Very low124 Ų124147.7 Ų147.781%0.80581%0.811SS**  trans-130.9-172.4-131.430.6-5.8000112.3
31G44.4Very low43.3Very low61 Ų61144.2 Ų144.263%0.62981%0.807SS**  trans138.5116.2154.900000113.3
32K45.1Very low43.2Very low192 Ų192142.2 Ų142.284%0.83580%0.804SS**  79.5130.975.2-82.8-170.4-177.3-170.40110.1
33D44.3Very low43.2Very low148 Ų148141.8 Ų141.879%0.79180%0.799SS**  cis-157.4148.324.2-73.3-53000108.7
34G41.3Very low42.8Very low85 Ų85139.7 Ų139.788%0.87680%0.798SS**  124.4142.297.700000108
35G41.4Very low42.5Very low63 Ų63135.3 Ų135.365%0.64979%0.789SS**  cis152.4122.59.700000105.5
36H45.1Very low42.6Very low198 Ų198142.6 Ų142.692%0.91780%0.797SS**  175.2147.3122.8-95.5-71.8000113.2
37P47.3Very low42Very low103 Ų103141.4 Ų141.467%0.66979%0.791SS**  trans-118.8154.6-159.339.4-25.7000113.6
38V42.1Very low41.8Very low137 Ų137138.7 Ų138.783%0.8379%0.786SS**  trans-149.4108.8150-172.60000112
39R40.2Very low41.8Very low225 Ų225143.1 Ų143.185%0.84979%0.789SS**  trans27.4124.2138.7-52.6-179.9174.2-156.3-2118.2
40R39.5Very low41.4Very low243 Ų243140.6 Ų140.692%0.91779%0.785SS**  -174.4150.480.8-86.5-175.8-170.6-168.22.3109.9
41T43.5Very low40.8Very low136 Ų136138.8 Ų138.883%0.83478%0.776SS**  trans-95.4-169-162.7510000111.8
42P43Very low40.4Very low127 Ų127145.6 Ų145.683%0.82578%0.784SS**  -121.5170.6-104.727.7-3.8000112.6
43G39.5Very low40.1Very low69 Ų69144 Ų14471%0.71178%0.784SS**  trans174.1112.4169.400000114.3
44C34.4Very low39.5Very low123 Ų123141.7 Ų141.783%0.83178%0.778SS**  trans64.4104.1145-66.60000119.9
45S38.2Very low39.5Very low102 Ų102143.2 Ų143.271%0.71377%0.771SS**  58.9118119.862.70000120.8
46Y38.5Very low39.4Very low221 Ų221149.2 Ų149.287%0.86778%0.782SS**  trans59.8101.5133.2-93.1-96.8000119.6
47S36.4Very low39.1Very low93 Ų93143.1 Ų143.165%0.6577%0.773SS**  trans19.3108.1135.162.80000119.3
48F39.1Very low38.7Very low176 Ų176148.1 Ų148.177%0.77278%0.784SS**  171.6144.4119.4-120.6-109.5000109.3
49Q36.9Very low38.5Very low157 Ų157153.6 Ų153.673%0.73479%0.79SS**  trans67.2115.3163.7-75.7159.6-2900118.1
50Q38Very low38.4Very low169 Ų169148.6 Ų148.679%0.7979%0.79SS**  78.7127.384.6-114.6179.713.700115
51S38Very low38.5Very low87 Ų87142.5 Ų142.561%0.60878%0.779SS**  trans71125.7152.957.80000119.4
52Y36.7Very low38.4Very low203 Ų203146.2 Ų146.280%0.79678%0.778SS**  168.2154.799.7-103.7-79.8000112.5
53L38.7Very low38.2Very low159 Ų159151.4 Ų151.483%0.83278%0.781SS**  trans83.1136161.8-59.5146.5000115
54C32.3Very low38Very low100 Ų100152.8 Ų152.868%0.67679%0.786SS**  cis-163.1136.212.1-148.10000103.8
55T40.9Very low38.3Very low116 Ų116158.1 Ų158.171%0.71279%0.789SS**  170.514983.845.70000109.7
56Q39.1Very low38.5Very low189 Ų189157.8 Ų157.888%0.88379%0.786SS**  trans89.998.3153.6-55.3-109.6-1.300119
57G38.5Very low38.9Very low71 Ų71154.6 Ų154.673%0.73278%0.784SS**  105.5109.3116.600000118.3
58K39.5Very low39.1Very low207 Ų207157.9 Ų157.990%0.979%0.794SS**  trans9091.6152-57.8-177.2180177.90118.7
59R36.7Very low39.5Very low252 Ų252156.8 Ų156.895%0.95180%0.796SS**  21115.6127.3-66.3179.7-178.6-178-0.1117.1
60S38.5Very low39.9Very low121 Ų121159.7 Ų159.785%0.84680%0.801SS**  -173.1138.3107.9-168.20000110.7
61T42.9Very low39.9Very low114 Ų114154.9 Ų154.970%0.69980%0.797SS**  trans-69.7142.4-173.451.40000114
62R39.8Very low40.2Very low214 Ų214158.8 Ų158.881%0.80881%0.81SS**  166.2125.1106.2-89-176.5-168.9-152.62.1113
63R39.9Very low41.1Very low236 Ų236154.2 Ų154.289%0.89181%0.805SS**  trans64.4112.1142-67.1-172.8-176.9-164.8-0.1120.1
64A36.2Very low42.1Very low98 Ų98152.6 Ų152.681%0.8180%0.804SS**  trans-76.1149.6167.500000113.9
65R39Very low42.9Very low236 Ų236158 Ų15889%0.89181%0.812SS**  trans-152.298139.2-87.6-171.1176.1170.3-2.4104.5
66S43.1Very low43Very low94 Ų94159.4 Ų159.466%0.65781%0.81SS**  54.493.1103.563.30000112.2
67D45.9Very low43.3Very low155 Ų155157.9 Ų157.983%0.82981%0.808SS**  trans156.868.1147.3-74.4-20.7000109.4
68D41.9Very low43.9Very low162 Ų162164.3 Ų164.387%0.86681%0.81SS**  trans-12584.4173.7-83.1-41.8000109.8
69L46.6Very low44.3Very low152 Ų152162.3 Ų162.380%0.79680%0.803SS**SBendtrans-122.4108.2160.4-101.2145.2000106.3
70Y46.5Very low44.6Very low219 Ų219158.1 Ų158.186%0.85980%0.799SS**  trans67.367171.5-58.2-80000117.3
71G38Very low45.1Very low67 Ų67163.8 Ų163.869%0.69180%0.802SS**  trans-95.499.2160.200000112.2
72L43.2Very low45.8Very low169 Ų169160.7 Ų160.789%0.88579%0.793SS**  trans-115.4116.5149.1-78.8175.7000107.2
73P55.9Low46.8Very low108 Ų108156.4 Ų156.470%0.70179%0.792SS**PPolyproline II helixtrans-73.3151.5-176.229.4-33.3000111.4Y75P73-Y75 PolarHBondContact O-N 3.33Å
74P60.8Low48.1Very low124 Ų124151.2 Ų151.281%0.80579%0.79SS**PPolyproline II helixtrans-67.9128.4176.228.5-31.1000109.6E76P74-E76 PolarHBondContact O-N 2.74Å
75Y48.5Very low49.7Very low213 Ų213149.5 Ų149.584%0.83578%0.781SS**PPolyproline II helixtrans-51.9118.6174.8-93.6-97000111P73 L77P73-Y75 PolarHBondContact O-N 3.33Å; Y75-L77 PolarHBondContact O-N 3.2Å; Y75-L77 VanDerWaalsContact O-N 3.12Å
76E43.5Very low51.1Low146 Ų146144 Ų14468%0.68278%0.776SS**  trans-63.5110.9161.4-91.8-152.9137.100109.5P74 R78P74-E76 PolarHBondContact O-N 2.74Å; E76-R78 PolarHBondContact O-N 3.04Å
77L45.2Very low52.3Low158 Ų158145.6 Ų145.683%0.82778%0.784SS**THydrogen-bonded Turntrans-73.841.2176.6-13686.8000112.5Y75Y75-L77 PolarHBondContact O-N 3.2Å; Y75-L77 VanDerWaalsContact O-N 3.12Å
78R49.8Very low53.2Low205 Ų205141.1 Ų141.177%0.77478%0.775SS**THydrogen-bonded Turntrans-128.41.2-172.5-73.6-171.8175-176.80117E76E76-R78 PolarHBondContact O-N 3.04Å
79H47.8Very low54.3Low166 Ų166139.6 Ų139.677%0.76977%0.774SS**SBendtrans-127.316.4177.9-68.6-62.8000116.2R81H79-R81 VanDerWaalsContact C-N 3.28Å; H79-R81 PolarHBondContact O-N 3.28Å
80L44.1Very low54.9Low163 Ų163137.1 Ų137.185%0.85378%0.775SS**  trans-89.829.4172.9-82.1162.9000114G82L80-G82 PolarHBondContact O-N 3.24Å
81R48.6Very low55.2Low240 Ų240129.2 Ų129.291%0.90676%0.76SS**  trans-86.695.1164-152.4175.5-161176.24.7106.8H79H79-R81 VanDerWaalsContact C-N 3.28Å; H79-R81 PolarHBondContact O-N 3.28Å
82G58Low56.1Low50 Ų50132.3 Ų132.352%0.51577%0.768SS.*PPolyproline II helixtrans-50.7155.8169.100000110.5L80L80-G82 PolarHBondContact O-N 3.24Å
83P61.5Low56.5Low123 Ų123134.1 Ų134.180%0.79977%0.769SS**PPolyproline II helixtrans-50.2140.2177.522.3-32.8000109.5G85P83-G85 PolarHBondContact O-N 3.21Å
84P66.7Low56.2Low128 Ų128132.2 Ų132.283%0.83177%0.769SS**PPolyproline II helixtrans-48.5128.9174.6-24.832.6000109.4
85G69Low55.7Low61 Ų61131.9 Ų131.963%0.62977%0.77SS**PPolyproline II helixtrans-54.8151.4176.800000110.6P83P83-G85 PolarHBondContact O-N 3.21Å
86P68.1Low55.9Low120 Ų120133.1 Ų133.178%0.77977%0.773SS**PPolyproline II helixtrans-53.6144.1176.923.6-33.3000109.9G88P86-G88 PolarHBondContact O-N 3.38Å
87P69.2Low56Low129 Ų129129.2 Ų129.284%0.83877%0.772SS**PPolyproline II helixtrans-48.5129.9174.5-26.433.7000110.1
88G64.7Low56.1Low61 Ų61131.9 Ų131.963%0.62977%0.773SS**PPolyproline II helixtrans-54.5153.4176.500000110.8P86 A90P86-G88 PolarHBondContact O-N 3.38Å; G88-A90 PolarHBondContact O-N 3.42Å
89P64.1Low56.5Low130 Ų130127.5 Ų127.584%0.84477%0.771SS**PPolyproline II helixtrans-52.8129.5178.723.2-32.9000109.2G91P89-G91 PolarHBondContact O-N 3.15Å
90A59.9Low56.4Low99 Ų99123.1 Ų123.182%0.81877%0.771SS**PPolyproline II helixtrans-52.9120.8175.800000108.3G88G88-A90 PolarHBondContact O-N 3.42Å
91G52.8Low56.7Low54 Ų54124.4 Ų124.456%0.55777%0.769SS**PPolyproline II helixtrans-52.3149.5174.300000109.7P89 K93P89-G91 PolarHBondContact O-N 3.15Å; G91-K93 PolarHBondContact O-N 3.49Å
92P57.4Low57.3Low131 Ų131118.7 Ų118.785%0.85176%0.764SS**PPolyproline II helixtrans-52119.6-179.622.4-32.2000108.4G94P92-G94 PolarHBondContact O-N 3.19Å
93K50.9Low56.8Low207 Ų207119 Ų11990%0.977%0.767SS**  trans-52.9114.3173.3-81.9-178.7176.6176.60106.4G91 S95G91-K93 PolarHBondContact O-N 3.49Å; K93-S95 PolarHBondContact O-N 3.42Å; K93-S95 VanDerWaalsContact O-N 3.14Å
94G48.8Very low56.6Low69 Ų69119.7 Ų119.771%0.71177%0.771SS**  trans-49.8124.3172.900000107.8P92 R96P92-G94 PolarHBondContact O-N 3.19Å; G94-R96 PolarHBondContact O-N 3.42Å
95S50.5Low55.9Low117 Ų117121.6 Ų121.682%0.81877%0.773SS**  trans-57.3106.2177.148.10000107.5K93 G97K93-S95 PolarHBondContact O-N 3.42Å; K93-S95 VanDerWaalsContact O-N 3.14Å; S95-G97 PolarHBondContact O-N 3.19Å; S95-G97 VanDerWaalsContact O-N 3.12Å
96R52.6Low54.8Low238 Ų238121.7 Ų121.790%0.89877%0.773SS**PPolyproline II helixtrans-55.5117.9172.1-162.9178.8-75.1177.8-6.2106G94 Y98G94-R96 PolarHBondContact O-N 3.42Å; R96-Y98 PolarHBondContact O-N 3.33Å
97G46.4Very low53.6Low65 Ų65124.4 Ų124.467%0.6778%0.78SS**PPolyproline II helixtrans-51.9135.2-176.900000110.5S95S95-G97 PolarHBondContact O-N 3.19Å; S95-G97 VanDerWaalsContact O-N 3.12Å
98Y48.4Very low52.8Low214 Ų214126 Ų12684%0.83978%0.782SS**PPolyproline II helixtrans-60.9131175.3-79.2-85.9000109.1R96 G100R96-Y98 PolarHBondContact O-N 3.33Å; Y98-G100 PolarHBondContact O-N 3.41Å
99P57.6Low52Low113 Ų113126.9 Ų126.973%0.73479%0.791SS**PPolyproline II helixtrans-56.3132.1164.6-18.931000108.8F101P99-F101 PolarHBondContact O-N 3.43Å
100G44.7Very low51.1Low74 Ų74126.4 Ų126.476%0.76379%0.791SS**PPolyproline II helixtrans-55.8132179.100000111Y98Y98-G100 PolarHBondContact O-N 3.41Å
101F50.3Low50.4Low189 Ų189130.7 Ų130.783%0.82979%0.791SS**PPolyproline II helixtrans-66.2133.7176.6-87.3-88.7000110.3P99P99-F101 PolarHBondContact O-N 3.43Å
102P62.2Low50.3Low121 Ų121131.6 Ų131.679%0.78680%0.8SS**PPolyproline II helixtrans-58.7137.1168-20.632.1000110.7
103G48Very low50.1Low57 Ų57132.1 Ų132.159%0.58880%0.796SS**PPolyproline II helixtrans-61.8159.5-179.400000113.4I105G103-I105 PolarHBondContact O-N 3.29Å
104P56.7Low50Low137 Ų137131.2 Ų131.289%0.8980%0.795SS**PPolyproline II helixtrans-65.9122.6-173.827-32.7000111.1
105I52.1Low49.9Very low168 Ų168131.3 Ų131.386%0.86280%0.796SS**PPolyproline II helixtrans-74.1136.3169.7-66.6169.1000108.3G103G103-I105 PolarHBondContact O-N 3.29Å
106G46.5Very low49.7Very low62 Ų62134.1 Ų134.164%0.63980%0.801SS**PPolyproline II helixtrans-61.8157.2-168.500000115.9
107L41.9Very low49.8Very low177 Ų177129 Ų12993%0.92780%0.799SS**  trans-83.3110.2179.6-70.8160000110.7
108D53Low49.9Very low163 Ų163129.6 Ų129.687%0.87280%0.804SS**  trans-122.5115.3162.3-53.1-24.1000105.2
109G46.4Very low50Low80 Ų80126.8 Ų126.883%0.82581%0.809SS**  126.5126.363.400000106
110S45.2Very low49.3Very low119 Ų119131.2 Ų131.283%0.83282%0.817SS**  trans-87.1145.4-163.243.40000115.2
111K46.4Very low49.4Very low190 Ų190131.1 Ų131.183%0.82682%0.815SS**  trans87.5129.1144.5-144.6178.7-174.9-172.50119.5
112G50.8Low49.5Very low72 Ų72131.8 Ų131.874%0.74282%0.821SS**  trans-166.9121.916200000109.6
113D52.4Low48.5Very low142 Ų142135.4 Ų135.476%0.75982%0.824SS**PPolyproline II helixtrans-73.7156.6-159.6-57.1-55.4000115.8
114Q48.7Very low48.6Very low188 Ų188136 Ų13688%0.87983%0.831SS**PPolyproline II helixtrans-79.2141.3-174.7-68.3-178.6-3.200114.2
115G48Very low48.1Very low71 Ų71137.1 Ų137.173%0.73283%0.83SS**PPolyproline II helixtrans-91.2151.4166.800000113.6
116L45.1Very low47.7Very low177 Ų177141.4 Ų141.493%0.92784%0.835SS**PPolyproline II helixtrans-62.6134.7-167.4-68.3150.3000115.5
117P55.6Low47.5Very low131 Ų131142.2 Ų142.285%0.85184%0.843SS**PPolyproline II helixtrans-84.6129.6172.5-11.528.5000114
118G48.2Very low47.4Very low76 Ų76143 Ų14378%0.78484%0.842SS**PPolyproline II helixtrans-76.4171.3176.400000116
119V50.9Low46.7Very low156 Ų156140.4 Ų140.495%0.94584%0.837SS**PPolyproline II helixtrans-74.5154.4-156.4-122.70000116.4
120K41.7Very low46.4Very low206 Ų206141.1 Ų141.190%0.89684%0.835SS**PPolyproline II helixtrans-67.7135.2-175.8-176.7-177.3-179-174.10114.3
121G47.8Very low46Very low71 Ų71140.2 Ų140.273%0.73284%0.835SS**  trans-107.3151.716900000113.4
122E51.4Low46Very low204 Ų204137.8 Ų137.895%0.95384%0.836SS**PPolyproline II helixtrans-84.4164-161.7-63.3175.2130.600115.8
123K42.7Very low45.6Very low196 Ų196143.6 Ų143.685%0.85284%0.843SS**PPolyproline II helixtrans-92.6130.3-174.6-179.6-175.4-178.5-172.90110.7
124G49.3Very low45.1Very low71 Ų71140.2 Ų140.273%0.73284%0.842SS**PPolyproline II helixtrans-101151.8173.200000113.9
125D46.6Very low44.8Very low160 Ų160142.3 Ų142.386%0.85684%0.842SS**PPolyproline II helixtrans-88.7172.9-163.2-69.2-53.9000116.7
126R43Very low44.4Very low257 Ų257145.8 Ų145.897%0.9784%0.844SS**PPolyproline II helixtrans-59.9151.4-177.3-64.6175.3-166.2145.54.6114.2
127G42.4Very low44.1Very low79 Ų79147.7 Ų147.781%0.81485%0.845SS**  trans-130138163.800000112.2
128E39.8Very low43.2Very low193 Ų193151.9 Ų151.990%0.90284%0.844SS**  trans-76.9170.1-172.5-100.8164.8121.300116.5
129S37.9Very low42.7Very low109 Ų109156.5 Ų156.576%0.76285%0.85SS**  trans-25.5145.3168.953.80000120.7
130A40.2Very low42.2Very low96 Ų96155 Ų15579%0.79384%0.835SS**  trans-161.4126.6139.600000112
131A37.8Very low42.1Very low100 Ų100155 Ų15583%0.82684%0.835SS**  trans-76137.8166.900000110.4
132T44.5Very low41.6Very low138 Ų138162.9 Ų162.985%0.84784%0.843SS**  trans-145.4124163.8-18.60000110.9
133H43.1Very low41Very low194 Ų194164.2 Ų164.290%0.89884%0.839SS**  trans-68.1145173.1-81.559.5000111.7
134G41.5Very low40.9Very low71 Ų71163.3 Ų163.373%0.73284%0.838SS**  trans-158.978.7176.600000114.7
135R42.3Very low40.3Very low233 Ų233164.1 Ų164.188%0.87985%0.846SS**  trans47.8114.2140.4-56.1-178.3-162170.25.3121.6
136D39.4Very low39.8Very low143 Ų143160.4 Ų160.477%0.76585%0.845SS**  38.9120126.3-61-43.8000121.7
137F39.5Very low39.5Very low218 Ų218157 Ų15796%0.95684%0.84SS**  -154.3106.8123.9-90.9-73.5000110
138R36.9Very low39.3Very low218 Ų218159.3 Ų159.382%0.82384%0.841SS**  trans-82.2131.1167.2-91.7-179.2176.6169.50.3109.7
139L38.4Very low39.4Very low174 Ų174158 Ų15891%0.91184%0.84SS**  trans-132.5105.6154.3-115.7141.2000108.1
140I38.8Very low39.5Very low123 Ų123157.7 Ų157.763%0.63184%0.837SS**  trans-96.1126173.7-63168.6000106.8
141K40.2Very low39.8Very low208 Ų208159.6 Ų159.690%0.90483%0.834SS**  trans-132110.7154.3-110.6-174.5178.7175.50108.9
142R37.3Very low40.3Very low236 Ų236162 Ų16289%0.89183%0.833SS**  trans-80.3142.4162.7-79.2-175.9172.3-158.4-0.6109.4
143R39.5Very low40.2Very low231 Ų231159.1 Ų159.187%0.87283%0.831SS**  trans-162.496.6148.2-151174.5-170.4-173.72106.2
144E40.4Very low40.4Very low178 Ų178159.3 Ų159.383%0.83283%0.829SS**  56.6113.399.9-74.7-174.5171.200114.9
145G37.3Very low40.7Very low88 Ų88163.5 Ų163.591%0.90784%0.835SS**  trans62.4105.5135.300000119.3
146G36.3Very low41Very low81 Ų81159.5 Ų159.584%0.83583%0.831SS**  trans-174.3110.6161.700000110.8
147Q35.6Very low41.4Very low185 Ų185158.4 Ų158.486%0.86483%0.829SS**PPolyproline II helixtrans-63.8157178-65.9-178.9-79.200112L149Q147-L149 PolarHBondContact O-N 3.27Å
148P38.2Very low41.7Very low129 Ų129154.1 Ų154.184%0.83882%0.815SS**PPolyproline II helixtrans-79.1119.3176.731.9-29.1000109.9
149L42.6Very low41.7Very low166 Ų166153.3 Ų153.387%0.86981%0.813SS**PPolyproline II helixtrans-85.5116.4162.3-92.3125.6000108.5Q147Q147-L149 PolarHBondContact O-N 3.27Å
150S40.5Very low42Very low101 Ų101153.5 Ų153.571%0.70680%0.803SS**PPolyproline II helixtrans-64.5125.1153.747.30000108.8
151D46.6Very low42.3Very low137 Ų137154.8 Ų154.873%0.73381%0.811SS**  trans-166.9137.4139.4-97.8-24.7000110.3
152D46.4Very low42.6Very low150 Ų150152.8 Ų152.880%0.80280%0.803SS**  trans70.9111.1153.3-56.1-31.2000120.4
153G42.9Very low43.1Very low77 Ų77147.1 Ų147.179%0.79480%0.797SS**  trans-61.1138.3175.800000114.2
154K47.6Very low43.3Very low198 Ų198144.7 Ų144.786%0.86180%0.798SS**  trans-162.2137.3140.4-104.4156.5-172.5171.80107.9D156K154-D156 PolarHBondContact O-N 3.4Å; K154-D156 VanDerWaalsContact O-N 3.14Å
155D48.6Very low43.5Very low160 Ų160145.1 Ų145.186%0.85680%0.797SS**  trans-56105.7-173.5-62.6-60.4000113.6
156D47.4Very low44.1Very low149 Ų149147.7 Ų147.780%0.79779%0.794SS**  trans-10698.4162.3-80.5-23.9000109.5K154 I158K154-D156 PolarHBondContact O-N 3.4Å; K154-D156 VanDerWaalsContact O-N 3.14Å; D156-I158 PolarHBondContact O-N 3.15Å
157T47.3Very low44.4Very low120 Ų120151.6 Ų151.674%0.73680%0.795SS**  trans-71.697.2172.3-51.20000108.7Y159T157-Y159 PolarHBondContact O-N 3.08Å
158I46Very low44.9Very low127 Ų127152.3 Ų152.365%0.65180%0.795SS**  trans-73.7105.3175-59.6174.9000109.1D156 Y160D156-I158 PolarHBondContact O-N 3.15Å; I158-Y160 HydrophobicContact CG2-CD2 4.3Å; I158-Y160 HydrophobicContact CG2-CE2 4.09Å; I158-Y160 PolarHBondContact O-N 3.13Å
159Y37.9Very low45.4Very low202 Ų202149.4 Ų149.479%0.79279%0.789SS**  trans-75.4107.8167.8-107.2-94.2000109.7T157 N161T157-Y159 PolarHBondContact O-N 3.08Å; Y159-N161 PolarHBondContact O-N 3.12Å; Y159-N161 VanDerWaalsContact O-N 3.17Å
160Y44.7Very low45.9Very low178 Ų178150.5 Ų150.570%0.69879%0.789SS**  trans-73.299.7165.5-76.8-88000109.7I158 F162I158-Y160 HydrophobicContact CG2-CD2 4.3Å; I158-Y160 HydrophobicContact CG2-CE2 4.09Å; I158-Y160 PolarHBondContact O-N 3.13Å; Y160-F162 AromaticContact CD1-CE2 3.94Å; Y160-F162 HydrophobicContact CD1-CE2 3.94Å; Y160-F162 HydrophobicContact CD1-CZ 4.4Å; Y160-F162 HydrophobicContact CG-CE2 4.32Å; Y160-F162 PolarHBondContact O-N 3.16Å
161N44.9Very low46.9Very low150 Ų150151.7 Ų151.780%0.80280%0.795SS**  trans-82.391.5165.9-96.3-28.1000109.4Y159Y159-N161 PolarHBondContact O-N 3.12Å; Y159-N161 VanDerWaalsContact O-N 3.17Å
162F45.8Very low47.8Very low165 Ų165148.3 Ų148.372%0.72479%0.792SS**  trans-86121.2160.8-74.9-80000109.1Y160 M164Y160-F162 AromaticContact CD1-CE2 3.94Å; Y160-F162 HydrophobicContact CD1-CE2 3.94Å; Y160-F162 HydrophobicContact CD1-CZ 4.4Å; Y160-F162 HydrophobicContact CG-CE2 4.32Å; Y160-F162 PolarHBondContact O-N 3.16Å; F162-M164 PolarHBondContact O-N 3.28Å; F162-M164 VanDerWaalsContact O-N 3.08Å
163P49.4Very low48.8Very low117 Ų117146.6 Ų146.676%0.7679%0.789SS**  trans-71.2103.617227.5-30.8000109.4K165P163-K165 PolarHBondContact O-N 2.87Å; P163-K165 VanDerWaalsContact O-N 3.14Å
164M42.6Very low50Low181 Ų181149 Ų14989%0.89279%0.791SS**  trans-68.7107.1169.6-80.7-142.9-78.600109.7F162 V166F162-M164 PolarHBondContact O-N 3.28Å; F162-M164 VanDerWaalsContact O-N 3.08Å; M164-V166 PolarHBondContact O-N 3.4Å
165K44.8Very low51Low187 Ų187142.5 Ų142.581%0.81378%0.781SS**  trans-72.1112.3162.7-70.1-178.5179.5179.40107.9P163 L167P163-K165 PolarHBondContact O-N 2.87Å; P163-K165 VanDerWaalsContact O-N 3.14Å; K165-L167 PolarHBondContact O-N 3.46Å
166V49Very low52Low142 Ų142140.4 Ų140.486%0.86178%0.775SS**  trans-68.199.4170.9-178.30000107.8M164 K168M164-V166 PolarHBondContact O-N 3.4Å; V166-K168 PolarHBondContact O-N 3.39Å
167L44.6Very low52.7Low163 Ų163137.9 Ų137.985%0.85378%0.776SS**  trans-73.3107172.3-76.3162.5000108.6K165 G169K165-L167 PolarHBondContact O-N 3.46Å; L167-G169 PolarHBondContact O-N 2.95Å
168K44.5Very low53Low199 Ų199135.6 Ų135.687%0.86578%0.775SS**PPolyproline II helixtrans-60.4118.9167.3-172.8176.5-178.8-179.50107.7V166V166-K168 PolarHBondContact O-N 3.39Å
169G49.6Very low53.6Low68 Ų68137.6 Ų137.670%0.70179%0.787SS**PPolyproline II helixtrans-59.8138.9-179.200000112.1L167L167-G169 PolarHBondContact O-N 2.95Å
170E51.8Low54.9Low189 Ų189133.7 Ų133.788%0.88379%0.786SS**PPolyproline II helixtrans-66.1142.2177.5-63.7-173.5150.900111.3G172E170-G172 PolarHBondContact O-N 3.07Å
171P61.6Low55.4Low127 Ų127128.8 Ų128.883%0.82579%0.79SS**PPolyproline II helixtrans-55.7135.6171.8-23.333.5000111.4
172G66.7Low56.5Low65 Ų65128.4 Ų128.467%0.6779%0.793SS**PPolyproline II helixtrans-62.8154.8177.400000112.7E170E170-G172 PolarHBondContact O-N 3.07Å
173P67.4Low57.3Low114 Ų114130.1 Ų130.174%0.7480%0.8SS**PPolyproline II helixtrans-62148.5178.825.8-34.1000111.5
174P68.1Low57.7Low127 Ų127127.6 Ų127.683%0.82580%0.796SS**PPolyproline II helixtrans-52.9141.8172.3-24.833.8000111.7
175G68.2Low58.7Low63 Ų63126.7 Ų126.765%0.64979%0.794SS**PPolyproline II helixtrans-61.7158.2175.400000112.4
176P70.2Confident59.5Low115 Ų115127.4 Ų127.475%0.74780%0.797SS**PPolyproline II helixtrans-61.4151.8175.327.5-34000111.2
177A61.4Low59.8Low97 Ų97123.9 Ų123.980%0.80279%0.79SS**PPolyproline II helixtrans-60.1142.6172.600000110.4
178G54.4Low60.7Low71 Ų71123.9 Ų123.973%0.73279%0.791SS**PPolyproline II helixtrans-60.7145.2172.800000110.9
179L58.5Low61.3Low170 Ų170126.2 Ų126.289%0.8979%0.794SS**PPolyproline II helixtrans-61.8134.1175-69.7167.6000109.6G181L179-G181 PolarHBondContact O-N 3.05Å
180P65.1Low61.2Low120 Ų120126 Ų12678%0.77979%0.793SS**PPolyproline II helixtrans-55.7133.8172.1-24.233.8000110.8
181G55.8Low61.3Low75 Ų75125 Ų12577%0.77379%0.793SS**PPolyproline II helixtrans-60.3138.8174.800000110.7L179 K183L179-G181 PolarHBondContact O-N 3.05Å; G181-K183 PolarHBondContact O-N 3.47Å
182T66.8Low61.1Low141 Ų141124.7 Ų124.787%0.86579%0.79SS**PPolyproline II helixtrans-64.3132.1172.549.40000109G184T182-G184 PolarHBondContact O-N 3Å
183K63.8Low60.1Low201 Ų201124.7 Ų124.787%0.87479%0.791SS**PPolyproline II helixtrans-64.2122.5172.4-176.4177.6-178.9178.10107.4G181G181-K183 PolarHBondContact O-N 3.47Å
184G56.3Low59.5Low65 Ų65129.4 Ų129.467%0.6780%0.8SS**PPolyproline II helixtrans-57.3139.8178.200000111.3T182 K186T182-G184 PolarHBondContact O-N 3Å; G184-K186 PolarHBondContact O-N 2.93Å
185D63.5Low58.6Low162 Ų162130.1 Ų130.187%0.86680%0.797SS**PPolyproline II helixtrans-56.8139.1178.4-64.8-46.1000110.3G187D185-G187 PolarHBondContact O-N 3.1Å
186K63.4Low57.5Low201 Ų201130.7 Ų130.787%0.87480%0.803SS**PPolyproline II helixtrans-65.4118.8177-160.1178-166.5178.40107G184 D188G184-K186 PolarHBondContact O-N 2.93Å; K186-D188 PolarHBondContact O-N 2.89Å
187G55.3Low56.5Low69 Ų69135.9 Ų135.971%0.71181%0.808SS**PPolyproline II helixtrans-51.7136-177.900000111.9D185 R189D185-G187 PolarHBondContact O-N 3.1Å; G187-R189 PolarHBondContact O-N 3.44Å
188D62.1Low55.4Low162 Ų162136.7 Ų136.787%0.86681%0.807SS**PPolyproline II helixtrans-55135.1-178.5-67.8-41000110.7K186 G190K186-D188 PolarHBondContact O-N 2.89Å; D188-G190 PolarHBondContact O-N 3.33Å
189R56.9Low55.1Low248 Ų248141.3 Ų141.394%0.93681%0.813SS**PPolyproline II helixtrans-62.4119.7176.4-165.2-178.2-88.3175.7-8.2107.3G187G187-R189 PolarHBondContact O-N 3.44Å
190G47.6Very low54.7Low65 Ų65139.4 Ų139.467%0.6781%0.809SS**PPolyproline II helixtrans-50.9140.3-177.200000112.3D188D188-G190 PolarHBondContact O-N 3.33Å
191L54.5Low53.6Low168 Ų168136.6 Ų136.688%0.8880%0.801SS**PPolyproline II helixtrans-53132.9179-74.5159.7000110.3G193L191-G193 PolarHBondContact O-N 3.17Å
192P56.7Low53.3Low119 Ų119139.1 Ų139.177%0.77380%0.804SS**PPolyproline II helixtrans-52.6126.4170.8-24.133.4000110F194P192-F194 PolarHBondContact O-N 3.14Å
193G47Very low52.2Low66 Ų66142.4 Ų142.468%0.6881%0.806SS**PPolyproline II helixtrans-58.8133.5178.300000110.4L191 D195L191-G193 PolarHBondContact O-N 3.17Å; G193-D195 PolarHBondContact O-N 2.79Å
194F55Low51.3Low212 Ų212137.5 Ų137.593%0.9380%0.803SS**PPolyproline II helixtrans-57.6123.3179.6-86-98.3000111.1P192 G196P192-F194 PolarHBondContact O-N 3.14Å; F194-G196 PolarHBondContact O-N 3.24Å
195D49.1Very low50.9Low142 Ų142139 Ų13976%0.75980%0.804SS**PPolyproline II helixtrans-56.1121.5168.7-51.8-31.3000108.8G193 R197G193-D195 PolarHBondContact O-N 2.79Å; D195-R197 PolarHBondContact O-N 3.02Å
196G43.5Very low50.2Low76 Ų76139.9 Ų139.978%0.78480%0.802SS**  trans-65.179.7176.900000111.2F194 S198F194-G196 PolarHBondContact O-N 3.24Å; G196-S198 PolarHBondContact O-N 3.24Å
197R49.2Very low49.2Very low224 Ų224140.8 Ų140.885%0.84580%0.8SS**  trans-63.8107.7168.7-79-177.3177.5179.1-0.5108.1D195 I199D195-R197 PolarHBondContact O-N 3.02Å; R197-I199 PolarHBondContact O-N 3.03Å; R197-I199 VanDerWaalsContact O-N 3.15Å
198S39.5Very low48.8Very low114 Ų114144.8 Ų144.880%0.79781%0.806SS**  trans-52.9110.8174.5-44.50000110.1G196G196-S198 PolarHBondContact O-N 3.24Å
199I47.4Very low47.8Very low167 Ų167146.8 Ų146.886%0.85681%0.807SS**  trans-100.5109.8165.8-52.1179.3000106.9R197R197-I199 PolarHBondContact O-N 3.03Å; R197-I199 VanDerWaalsContact O-N 3.15Å
200V50.3Low47.6Very low131 Ų131143.5 Ų143.579%0.79480%0.801SS**  trans-55124.6-177.1175.60000111.1
201G42.9Very low47.2Very low60 Ų60145.3 Ų145.362%0.61981%0.81SS**  trans-82.3153.7170.800000112.2
202P47.5Very low46.7Very low128 Ų128143.9 Ų143.983%0.83181%0.809SS**  trans-88109.316332.4-24.5000108.3
203K44.7Very low46.4Very low210 Ų210144.5 Ų144.591%0.91381%0.81SS**  trans-133.7134.6157.8-81.7-166.7177.8178.80110.6
204A44.9Very low46.3Very low99 Ų99150.6 Ų150.682%0.81882%0.823SS**  trans-62.7137.7-165.800000114.2
205S47.2Very low46Very low96 Ų96143.8 Ų143.867%0.67181%0.813SS**  trans51.9110.9131.2-135.40000120.5
206Q50.4Low46.2Very low180 Ų180146 Ų14684%0.84182%0.819SS**  trans72.1143.3145.2-62176.56.800119.1
207R40.8Very low47.1Very low221 Ų221148.4 Ų148.483%0.83482%0.821SS**  cis18099.1-21.6176.1-168.2-99.8-159.4-2.5103.3
208N47.3Very low47.1Very low153 Ų153141.2 Ų141.282%0.81882%0.816SS**  trans-179130.8143.4-103.6-19000111.7
209K41.7Very low48.1Very low204 Ų204147.1 Ų147.189%0.88782%0.821SS**  trans-93.9104-162.2-61.9174-179.9179.30109.1
210H51.8Low48.7Very low178 Ų178145 Ų14582%0.82482%0.819SS**  trans-123.1139.8169.7-80.617.4000109.9
211A39.4Very low48.8Very low103 Ų103142.1 Ų142.185%0.85182%0.815SS**  trans-27.4122.5-175.200000116.3
212T44.5Very low49.9Very low139 Ų139145.8 Ų145.885%0.85383%0.825SS**  trans-90.3112.1168.4-460000109
213T50.7Low50.6Low132 Ų132145.2 Ų145.281%0.8182%0.821SS**PPolyproline II helixtrans-59.9128.516426.30000109.8G215T213-G215 PolarHBondContact O-N 3.27Å
214M45.1Very low51.3Low193 Ų193138.4 Ų138.495%0.95181%0.811SS**PPolyproline II helixtrans-56.2118.9169.7-97.3178.3-75.100109.3
215G48.1Very low52.1Low70 Ų70143.2 Ų143.272%0.72281%0.813SS**PPolyproline II helixtrans-68.6142.1171.800000111T213T213-G215 PolarHBondContact O-N 3.27Å
216E54.2Low52.9Low188 Ų188144.6 Ų144.688%0.87982%0.82SS**PPolyproline II helixtrans-56.4139.3-178.9-68.2-166.1141.200112.1G218E216-G218 PolarHBondContact O-N 3.11Å
217P62.1Low53.5Low126 Ų126138.8 Ų138.882%0.81881%0.808SS**PPolyproline II helixtrans-53.2130.6170.2-24.433.5000111.2
218G49.1Very low54.6Low73 Ų73134.4 Ų134.475%0.75381%0.809SS**PPolyproline II helixtrans-56.5139177.600000111.7E216E216-G218 PolarHBondContact O-N 3.11Å
219R60.8Low55.4Low238 Ų238134 Ų13490%0.89881%0.811SS**PPolyproline II helixtrans-56139179.8-71.6-178.1177.6-133.9-1.4110.8G221R219-G221 PolarHBondContact O-N 3.36Å
220P59.1Low56.1Low124 Ų124127.2 Ų127.281%0.80580%0.799SS**PPolyproline II helixtrans-51.2134.7172.3-25.833.7000111.2
221G53.3Low56.6Low69 Ų69123.5 Ų123.571%0.71180%0.799SS**PPolyproline II helixtrans-57.8140.3177.600000111.3R219R219-G221 PolarHBondContact O-N 3.36Å
222V64.6Low57.5Low137 Ų137123 Ų12383%0.8380%0.795SS**PPolyproline II helixtrans-60.5126.1178.6-166.10000108.6G224V222-G224 PolarHBondContact O-N 3.41Å
223P62.2Low57.9Low116 Ų116119.6 Ų119.675%0.75379%0.788SS**PPolyproline II helixtrans-51134.1174.6-27.534.8000110.7K225P223-K225 PolarHBondContact O-N 3.35Å
224G59.3Low58.3Low68 Ų68120.8 Ų120.870%0.70179%0.788SS**PPolyproline II helixtrans-54.3136.1178.200000110.4V222V222-G224 PolarHBondContact O-N 3.41Å
225K61.9Low59.1Low200 Ų200116.8 Ų116.887%0.8778%0.776SS**PPolyproline II helixtrans-52.6127.9176.7-66.4-178.3-179.5-179.80108.2P223 G227P223-K225 PolarHBondContact O-N 3.35Å; K225-G227 PolarHBondContact O-N 3.4Å
226P65Low59.4Low124 Ų124117 Ų11781%0.80578%0.778SS**PPolyproline II helixtrans-47.9132.7171.4-27.534.5000109.2
227G62.8Low59.6Low58 Ų58116.2 Ų116.260%0.59877%0.774SS**PPolyproline II helixtrans-53.8151177.100000110.1K225 V229K225-G227 PolarHBondContact O-N 3.4Å; G227-V229 PolarHBondContact O-N 3.29Å; G227-V229 VanDerWaalsContact O-N 3.13Å
228P64.6Low59.4Low130 Ų130119.1 Ų119.184%0.84477%0.774SS**PPolyproline II helixtrans-51.7127.9175.523.5-32.6000108.3G230P228-G230 PolarHBondContact O-N 3.14Å; P228-G230 VanDerWaalsContact O-N 3.08Å
229V64.3Low59.6Low143 Ų143117.6 Ų117.687%0.86776%0.759SS**PPolyproline II helixtrans-51.2123.3171.3177.70000106G227 A231G227-V229 PolarHBondContact O-N 3.29Å; G227-V229 VanDerWaalsContact O-N 3.13Å; V229-A231 PolarHBondContact O-N 3.08Å
230G56Low59.4Low62 Ų62110.2 Ų110.264%0.63975%0.748SS**PPolyproline II helixtrans-49.2134.2-179.700000109P228 A232P228-G230 PolarHBondContact O-N 3.14Å; P228-G230 VanDerWaalsContact O-N 3.08Å; G230-A232 PolarHBondContact O-N 3.33Å; G230-A232 VanDerWaalsContact O-N 3.15Å
231A60.8Low59.5Low100 Ų100111.4 Ų111.483%0.82674%0.743SS**PPolyproline II helixtrans-47.2128.4178.700000108.5V229 G233V229-A231 PolarHBondContact O-N 3.08Å; A231-G233 PolarHBondContact O-N 3.07Å; A231-G233 VanDerWaalsContact O-N 3.12Å
232A59.7Low59.7Low93 Ų93109.7 Ų109.777%0.76973%0.726SS**PPolyproline II helixtrans-49.3127.1177.500000108.1G230 I234G230-A232 PolarHBondContact O-N 3.33Å; G230-A232 VanDerWaalsContact O-N 3.15Å; A232-I234 PolarHBondContact O-N 3.28Å; A232-I234 VanDerWaalsContact O-N 3.16Å
233G52.8Low59.5Low68 Ų68109.4 Ų109.470%0.70172%0.719SS**PPolyproline II helixtrans-49.3128.2178.300000108.5A231 P235A231-G233 PolarHBondContact O-N 3.07Å; A231-G233 VanDerWaalsContact O-N 3.12Å; G233-P235 VanDerWaalsContact O-CD 3.27Å; G233-P235 WeakPolarHBondContact O-CD 3.27Å
234I59.3Low59.6Low156 Ų156112 Ų11280%0.872%0.721SS**PPolyproline II helixtrans-52.1117.9-178.4-50172.1000106A232 G236A232-I234 PolarHBondContact O-N 3.28Å; A232-I234 VanDerWaalsContact O-N 3.16Å; I234-G236 PolarHBondContact O-N 3.27Å
235P61.6Low59.5Low109 Ų109110.3 Ų110.371%0.70871%0.705SS**PPolyproline II helixtrans-50.7124.1178.2-27.634.7000107.8G233 Q237G233-P235 VanDerWaalsContact O-CD 3.27Å; G233-P235 WeakPolarHBondContact O-CD 3.27Å; P235-Q237 PolarHBondContact O-N 3.19Å
236G53.2Low59.7Low74 Ų74106.4 Ų106.476%0.76369%0.693SS**PPolyproline II helixtrans-48.9124.4-178.500000108.1I234 K238I234-G236 PolarHBondContact O-N 3.27Å; G236-K238 PolarHBondContact O-N 3.42Å
237Q59Low59.9Low172 Ų172106.8 Ų106.880%0.80469%0.693SS**PPolyproline II helixtrans-54.3121.5177.5-68.9-173.411.800106.4P235 G239P235-Q237 PolarHBondContact O-N 3.19Å; Q237-G239 PolarHBondContact O-N 3.31Å
238K57.1Low59.9Low187 Ų187105.6 Ų105.681%0.81368%0.681SS**PPolyproline II helixtrans-52117.5170.9179.5-176.6176.4-170.30105.1G236 A240G236-K238 PolarHBondContact O-N 3.42Å; K238-A240 PolarHBondContact O-N 3.48Å
239G55.1Low60.3Low42 Ų42107 Ų10743%0.43367%0.673SS.*PPolyproline II helixtrans-46.9133179.900000108.4Q237 Q241Q237-G239 PolarHBondContact O-N 3.31Å; G239-Q241 PolarHBondContact O-N 3.17Å; G239-Q241 VanDerWaalsContact O-N 3.11Å
240A56.6Low60.8Low82 Ų82105.8 Ų105.868%0.67867%0.669SS**PPolyproline II helixtrans-48.2127179.300000107.6K238 G242K238-A240 PolarHBondContact O-N 3.48Å; A240-G242 PolarHBondContact O-N 3.48Å
241Q61Low61.5Low149 Ų149104.3 Ų104.370%0.69665%0.654SS**PPolyproline II helixtrans-54.6120173.7176176.5-4100105.9G239 D243G239-Q241 PolarHBondContact O-N 3.17Å; G239-Q241 VanDerWaalsContact O-N 3.11Å; Q241-D243 PolarHBondContact O-N 3.16Å
242G57Low62.5Low33 Ų33109.1 Ų109.134%0.3465%0.651SS.*PPolyproline II helixtrans-50.3133.2-178.200000109.2A240 Q244A240-G242 PolarHBondContact O-N 3.48Å; G242-Q244 PolarHBondContact O-N 3.19Å
243D59.2Low63.2Low131 Ų131110.4 Ų110.470%0.70165%0.651SS**PPolyproline II helixtrans-53.3132.6-176.1-68-34.5000109Q241 G245Q241-D243 PolarHBondContact O-N 3.16Å; D243-G245 PolarHBondContact O-N 3.32Å
244Q64.5Low64.3Low170 Ų170109.2 Ų109.279%0.79464%0.639SS**PPolyproline II helixtrans-55.4122.9173.4-76.8-175.1-25.500107.3G242 L246G242-Q244 PolarHBondContact O-N 3.19Å; Q244-L246 PolarHBondContact O-N 3.45Å
245G58.4Low65.4Low34 Ų34106.8 Ų106.835%0.35163%0.631SS.*PPolyproline II helixtrans-51134.7179.300000110D243 T247 E334D243-G245 PolarHBondContact O-N 3.32Å; G245-T247 PolarHBondContact O-N 3.27Å; G245-T247 VanDerWaalsContact O-N 3.16Å; G245-E334 WeakPolarHBondContact CA-O 3.4Å
246L65.1Low66.3Low118 Ų118111.5 Ų111.562%0.61864%0.635SS**PPolyproline II helixtrans-57.7124.2-177.6-68.5171.2000109Q244 G248 G333Q244-L246 PolarHBondContact O-N 3.45Å; L246-G248 PolarHBondContact O-N 3.3Å; L246-G333 WeakPolarHBondContact O-CA 3.28Å
247T70.4Confident67.4Low132 Ų132108.6 Ų108.681%0.8161%0.605SS**PPolyproline II helixtrans-53.6127172.450.80000108.4G245 F249G245-T247 PolarHBondContact O-N 3.27Å; G245-T247 VanDerWaalsContact O-N 3.16Å; T247-F249 PolarHBondContact O-N 3.36Å
248G61.8Low68.4Low33 Ų33104.2 Ų104.234%0.3459%0.591SS.*PPolyproline II helixtrans-53.9140-178.500000111.5L246 P250 K331L246-G248 PolarHBondContact O-N 3.3Å; G248-P250 WeakPolarHBondContact O-CD 3.46Å; G248-K331 WeakPolarHBondContact CA-O 3.28Å
249F74.1Confident69.3Low158 Ų15899.8 Ų99.869%0.69358%0.581SS**PPolyproline II helixtrans-63126.5178.5-71.4-83.8000109.7T247 G251 G330 K331T247-F249 PolarHBondContact O-N 3.36Å; F249-G251 PolarHBondContact O-N 3.2Å; F249-G330 WeakPolarHBondContact O-CA 3.46Å; F249-K331 PolarHBondContact O-N 3.13Å
250P73.6Confident70.4Confident118 Ų11899.3 Ų99.377%0.76658%0.577SS**PPolyproline II helixtrans-52.1139172.3-26.234.3000110.8G248G248-P250 WeakPolarHBondContact O-CD 3.46Å
251G72.1Confident71.5Confident32 Ų32103.4 Ų103.433%0.3358%0.576SS.*PPolyproline II helixtrans-57.7146176.900000111.4F249 P253 T328F249-G251 PolarHBondContact O-N 3.2Å; G251-P253 WeakPolarHBondContact O-CD 3.33Å; G251-T328 CarbonylContact C-O 3.48Å; G251-T328 WeakPolarHBondContact CA-O 3.21Å
252R80.8Confident72.3Confident200 Ų200102.1 Ų102.176%0.75558%0.581SS**PPolyproline II helixtrans-69.3129.2176.5-67.3-175.3176.7-140-0108.8G327 T328R252-G327 WeakPolarHBondContact O-CA 3.23Å; R252-T328 PolarHBondContact N-O 3.39Å; R252-T328 PolarHBondContact O-N 3.43Å
253P75.5Confident73.2Confident121 Ų121102.4 Ų102.479%0.78658%0.584SS**PPolyproline II helixtrans-53.2144.1173.5-25.834.3000111.4G251G251-P253 WeakPolarHBondContact O-CD 3.33Å
254G75.6Confident74.2Confident42 Ų42103 Ų10343%0.43358%0.582SS.*PPolyproline II helixtrans-60.3148.2176.500000111.7K325G254-K325 CarbonylContact C-O 3.43Å; G254-K325 WeakPolarHBondContact CA-O 3.17Å
255V81.7Confident74.8Confident106 Ų106104.5 Ų104.564%0.64259%0.586SS**BIsolated β-bridgetrans-87.3119.7176.4-176.20000107.6G257 G324 K325V255-G257 PolarHBondContact O-N 3.48Å; V255-G324 CarbonylContact O-C 3.58Å; V255-G324 WeakPolarHBondContact O-CA 3.21Å; V255-K325 PolarHBondContact N-O 3.39Å; V255-K325 VanDerWaalsContact N-O 3.12Å; V255-K325 PolarHBondContact O-N 3.12Å
256R81Confident75.7Confident207 Ų207104.4 Ų104.478%0.78159%0.585SS**PPolyproline II helixtrans-57.5131.6172.3176.5-179.6149-169.7-4.5109.1
257G75.5Confident76.4Confident13 Ų13103.1 Ų103.113%0.13458%0.582CS.*PPolyproline II helixtrans-65.5157.917900000112.3V255 M322V255-G257 PolarHBondContact O-N 3.48Å; G257-M322 WeakPolarHBondContact CA-O 3.23Å
258P79.8Confident76.8Confident81 Ų81103.7 Ų103.753%0.52659%0.585SS.*PPolyproline II helixtrans-56.9139.1176.124.3-32.6000110.3G321 M322P258-G321 WeakPolarHBondContact O-CA 3.03Å; P258-M322 HydrophobicContact CG-CB 4.43Å
259P76.7Confident77.5Confident93 Ų93103.2 Ų103.260%0.60458%0.58SS**PPolyproline II helixtrans-54.7149.2171.8-2232.4000111.2
260G77.8Confident77.8Confident33 Ų3398.6 Ų98.634%0.3457%0.571SS.*PPolyproline II helixtrans-62.2156.8172.700000111.9I319 G321G260-I319 CarbonylContact C-O 3.57Å; G260-I319 WeakPolarHBondContact CA-O 3.4Å; G260-G321 VanDerWaalsContact CA-CA 3.42Å; G260-G321 VanDerWaalsContact CA-N 3.26Å
261Y79.3Confident78Confident168 Ų16899 Ų9966%0.65957%0.574SS**BIsolated β-bridgetrans-83.2132.8175.2-64.5-105.8000108.9G318 I319Y261-G318 CarbonylContact O-C 3.57Å; Y261-G318 WeakPolarHBondContact O-CA 3.42Å; Y261-I319 HydrophobicContact CD2-CD1 3.45Å; Y261-I319 VanDerWaalsContact CD2-CD1 3.45Å; Y261-I319 HydrophobicContact CD2-CG1 3.65Å; Y261-I319 HydrophobicContact CE2-CD1 4.07Å; Y261-I319 HydrophobicContact CG-CD1 4.2Å; Y261-I319 HydrophobicContact CG-CG1 4.16Å; Y261-I319 PolarHBondContact N-O 3.42Å; Y261-I319 VanDerWaalsContact N-O 3.12Å; Y261-I319 PolarHBondContact O-N 3.25Å
262P77.5Confident78.3Confident122 Ų12298.9 Ų98.979%0.79257%0.572SS**PPolyproline II helixtrans-55.4143.5171.7-2333.5000110.8
263G77.3Confident78.2Confident39 Ų3993.5 Ų93.540%0.40256%0.563SS.*PPolyproline II helixtrans-64.4153.8175.500000111.9E316 G318G263-E316 CarbonylContact C-O 3.43Å; G263-E316 VanDerWaalsContact CA-O 3.23Å; G263-E316 WeakPolarHBondContact CA-O 3.06Å; G263-G318 VanDerWaalsContact CA-N 3.28Å; G263-G318 VanDerWaalsContact N-CA 3.31Å
264E80.2Confident78.3Confident144 Ų14499.3 Ų99.367%0.67357%0.57SS**PPolyproline II helixtrans-68.2141.4173.1-63.2-160.6150.700109.6G315 E316E264-G315 CarbonylContact O-C 3.58Å; E264-G315 VanDerWaalsContact O-CA 3.25Å; E264-G315 WeakPolarHBondContact O-CA 3.28Å; E264-E316 PolarHBondContact N-O 3.27Å
265K77.6Confident78.1Confident201 Ų20198.4 Ų98.487%0.87456%0.561SS**PPolyproline II helixtrans-75134173.9-171-179.8176.5-174.70108.1
266G76.8Confident77.6Confident32 Ų32102.8 Ų102.833%0.3357%0.567SS.*PPolyproline II helixtrans-56.4147.4174.200000111.8P313G266-P313 VanDerWaalsContact CA-O 3.28Å; G266-P313 WeakPolarHBondContact CA-O 3.12Å
267T79.3Confident77Confident91 Ų9198.6 Ų98.656%0.55857%0.566SS**PPolyproline II helixtrans-77.9157.117860.10000110.3G312 P313T267-G312 WeakPolarHBondContact O-CA 3.45Å; T267-P313 PolarHBondContact N-O 3.42Å; T267-P313 VanDerWaalsContact OG1-CD 3.23Å; T267-P313 WeakPolarHBondContact OG1-CD 3.22Å; T267-P313 WeakPolarHBondContact OG1-CG 3.22Å
268V78.9Confident76.5Confident143 Ų14399 Ų9987%0.86757%0.571SS**PPolyproline II helixtrans-70.2138.5172.5-175.80000108
269G76.7Confident75.8Confident23 Ų23104.6 Ų104.624%0.23759%0.587CS.*PPolyproline II helixtrans-58149.8176.800000112.2P310 G312G269-P310 VanDerWaalsContact CA-O 3.28Å; G269-P310 WeakPolarHBondContact CA-O 3.45Å; G269-G312 VanDerWaalsContact CA-CA 3.43Å
270A79.8Confident74.9Confident62 Ų62106.4 Ų106.451%0.51259%0.59SS.*PPolyproline II helixtrans-57.9140.2174.600000109.7G272 G309A270-G272 PolarHBondContact O-N 3.47Å; A270-G309 WeakPolarHBondContact O-CA 3.44Å
271P78.1Confident73.9Confident127 Ų127107.9 Ų107.983%0.82560%0.599SS**PPolyproline II helixtrans-53.6140.7173.3-25.434.3000111.1
272G78.2Confident72.9Confident28 Ų28102.4 Ų102.429%0.28959%0.594SS.*PPolyproline II helixtrans-63.8158.8176.900000112.3A270 R274 S307 G309A270-G272 PolarHBondContact O-N 3.47Å; G272-R274 PolarHBondContact O-N 2.82Å; G272-S307 WeakPolarHBondContact CA-O 3.36Å; G272-G309 VanDerWaalsContact CA-CA 3.42Å
273P79.6Confident71.9Confident87 Ų87102.3 Ų102.357%0.56559%0.593SS**PPolyproline II helixtrans-57.1136.3175.225.7-33.8000110G275 G306 S307P273-G275 PolarHBondContact O-N 3.11Å; P273-G306 WeakPolarHBondContact O-CA 3.43Å; P273-S307 WeakPolarHBondContact CG-OG 3.13Å
274R76.8Confident70.6Confident243 Ų243108.9 Ų108.992%0.91762%0.618SS**PPolyproline II helixtrans-58.6134.2174.2-174177.3178.8175.90.3108.8G272G272-R274 PolarHBondContact O-N 2.82Å
275G71.2Confident69Low24 Ų24108 Ų10825%0.24762%0.623CS.*PPolyproline II helixtrans-55.4145.2176.100000111.5P273P273-G275 PolarHBondContact O-N 3.11Å
276Y72Confident67.6Low197 Ų197103 Ų10377%0.77361%0.613SS**PPolyproline II helixtrans-60.4139.4178.7-67.7-80.9000110.5G278 G303Y276-G278 PolarHBondContact O-N 3.45Å; Y276-G303 WeakPolarHBondContact O-CA 3.49Å
277P68.7Low65.9Low119 Ų119107.5 Ų107.577%0.77364%0.639SS**PPolyproline II helixtrans-54.6136.5170.9-23.133000110.5
278G64.5Low64.4Low22 Ų22107.2 Ų107.223%0.22765%0.646CS.*PPolyproline II helixtrans-62.4141.3178.200000111.1Y276 I280 L301Y276-G278 PolarHBondContact O-N 3.45Å; G278-I280 PolarHBondContact O-N 3.25Å; G278-L301 VanDerWaalsContact CA-O 3.32Å; G278-L301 WeakPolarHBondContact CA-O 3.07Å
279K64Low63.2Low199 Ų199107.2 Ų107.287%0.86564%0.64SS**PPolyproline II helixtrans-60.7124.4179.2-64.8-177.2179.8-177.10108.8A281K279-A281 PolarHBondContact O-N 3.35Å
280I58.8Low61.4Low130 Ų130111.2 Ų111.267%0.66767%0.671SS**PPolyproline II helixtrans-60.7128165.1-55.3174.4000105.6G278 G282 P300G278-I280 PolarHBondContact O-N 3.25Å; I280-G282 PolarHBondContact O-N 3.2Å; I280-P300 HydrophobicContact CG1-CG 4.33Å
281A57Low60.1Low65 Ų65116.1 Ų116.154%0.53768%0.683SS.*  trans-55114.5173.100000107K279K279-A281 PolarHBondContact O-N 3.35Å
282G58Low58.6Low53 Ų53119.5 Ų119.555%0.54669%0.688SS.*  trans-54.7154.2178.700000110.1I280 L284I280-G282 PolarHBondContact O-N 3.2Å; G282-L284 PolarHBondContact O-N 3.35Å
283P56.6Low56.8Low119 Ų119121.8 Ų121.877%0.77371%0.712SS**  trans-53.4134.2173.724.5-32.4000108.4V285P283-V285 PolarHBondContact O-N 2.92Å
284L50.2Low55.2Low177 Ų177122.5 Ų122.593%0.92772%0.719SS**  trans-6289.2176.2-69.7171.9000108.6G282 S286G282-L284 PolarHBondContact O-N 3.35Å; L284-S286 VanDerWaalsContact C-N 3.34Å; L284-S286 PolarHBondContact O-N 2.89Å
285V45.9Very low54Low127 Ų127119.2 Ų119.277%0.7772%0.719SS**  trans-8389.3163.8-175.70000106.2P283P283-V285 PolarHBondContact O-N 2.92Å
286S48.1Very low53Low96 Ų96127.5 Ų127.567%0.67175%0.745SS**SBendtrans160.299.7144.9-74.70000109.8L284L284-S286 VanDerWaalsContact C-N 3.34Å; L284-S286 PolarHBondContact O-N 2.89Å
287S41.1Very low52.3Low125 Ų125124 Ų12487%0.87475%0.746SS**  40.586.8128.5-45.30000117.3
288A48.7Very low51.7Low86 Ų86128 Ų12871%0.71175%0.746SS**  trans176124.3138.100000111
289I52.7Low51.4Low143 Ų143130.6 Ų130.673%0.73377%0.765SS**  trans79.189154.4-53.5158.7000115.1Q291I289-Q291 HydrophobicContact CG2-CB 4.4Å; I289-Q291 HydrophobicContact CG2-CG 3.95Å; I289-Q291 PolarHBondContact O-N 3.09Å
290A39.6Very low51.3Low107 Ų107124.8 Ų124.888%0.88475%0.748SS**  trans-62.8102.5153.200000109.6
291Q52.5Low51.5Low165 Ų165124.6 Ų124.677%0.77175%0.747SS**  trans-138.1102.7156.2-73.1-168.8-1.500109.3I289I289-Q291 HydrophobicContact CG2-CB 4.4Å; I289-Q291 HydrophobicContact CG2-CG 3.95Å; I289-Q291 PolarHBondContact O-N 3.09Å
292Q45.6Very low52Low197 Ų197127.4 Ų127.492%0.92176%0.76SS**  trans34.3115.1145.8-65.6177.8-21.300118.7
293G41.4Very low52.5Low77 Ų77126.1 Ų126.179%0.79475%0.747SS**  trans91.376.2138.400000117
294S46.7Very low53.4Low102 Ų102125 Ų12571%0.71374%0.74SS**  trans-179.781.9141.338.20000110.3Y296S294-Y296 PolarHBondContact O-N 3.22Å
295N50.4Low54.6Low174 Ų174122.7 Ų122.793%0.9374%0.735SS**  trans-82.170.1168.3-122.3-9.9000108.7
296Y51.2Low56.1Low198 Ų198118.3 Ų118.378%0.77672%0.716SS**  trans-105.9125.7162.6-69.6-76.6000107.7S294 R298S294-Y296 PolarHBondContact O-N 3.22Å; Y296-R298 PolarHBondContact O-N 3.07Å
297P55.8Low57.6Low123 Ų123117.1 Ų117.180%0.79971%0.707SS**  trans-58.6114.6172.923.9-30.6000107.6A299P297-A299 PolarHBondContact O-N 3.14Å
298R57.6Low59.4Low203 Ų203117.1 Ų117.177%0.76670%0.704SS**  trans-61111.1177.5-157.7176.9-169.5-147.63106.9Y296Y296-R298 PolarHBondContact O-N 3.07Å
299A57.2Low61Low77 Ų77114.3 Ų114.364%0.63668%0.684SS**PPolyproline II helixtrans-53.3135.117900000109P297 L301P297-A299 PolarHBondContact O-N 3.14Å; A299-L301 PolarHBondContact O-N 3.3Å
300P61.3Low62.4Low77 Ų77111.6 Ų111.650%0.568%0.675SS.*PPolyproline II helixtrans-55.3129.1175.9-19.729.8000108.7I280I280-P300 HydrophobicContact CG1-CG 4.33Å
301L64.7Low64.4Low126 Ų126112.5 Ų112.566%0.6667%0.672SS**PPolyproline II helixtrans-57.8132.3173.9-69.9171.9000108.1G278 A299 G303G278-L301 VanDerWaalsContact CA-O 3.32Å; G278-L301 WeakPolarHBondContact CA-O 3.07Å; A299-L301 PolarHBondContact O-N 3.3Å; L301-G303 PolarHBondContact O-N 3.35Å
302P66.6Low65.7Low124 Ų124105.8 Ų105.881%0.80565%0.647SS**PPolyproline II helixtrans-52.7128.6172.2-26.134.6000109.6
303G68.9Low67.5Low26 Ų26100.9 Ų100.927%0.26863%0.633SS.*PPolyproline II helixtrans-63.9162.1176.400000111.5Y276 L301Y276-G303 WeakPolarHBondContact O-CA 3.49Å; L301-G303 PolarHBondContact O-N 3.35Å
304P76.1Confident69.3Low96 Ų96106.6 Ų106.662%0.62364%0.635SS**PPolyproline II helixtrans-57.7144.8177.225.2-33.3000110.7
305P73.8Confident70.7Confident128 Ų128102.6 Ų102.683%0.83161%0.611SS**PPolyproline II helixtrans-51.4142.8173-2634.3000111.5
306G77.1Confident72.2Confident35 Ų35100.9 Ų100.936%0.36160%0.597SS.*PPolyproline II helixtrans-60.6150.8175.700000111.8P273P273-G306 WeakPolarHBondContact O-CA 3.43Å
307S80.9Confident73.5Confident71 Ų7197.1 Ų97.150%0.49760%0.597SS.*PPolyproline II helixtrans-62.3143.2174.154.30000110.5G272 P273G272-S307 WeakPolarHBondContact CA-O 3.36Å; P273-S307 WeakPolarHBondContact CG-OG 3.13Å
308P78.9Confident74.6Confident125 Ų12593 Ų9381%0.81258%0.576SS**PPolyproline II helixtrans-51.7142.4172.5-25.934.6000111.6
309G81.1Confident75.7Confident27 Ų2788.4 Ų88.428%0.27857%0.566SS.*PPolyproline II helixtrans-68.7161.8176.900000112.5A270 G272A270-G309 WeakPolarHBondContact O-CA 3.44Å; G272-G309 VanDerWaalsContact CA-CA 3.42Å
310P83.5Confident76.8Confident85 Ų8591.4 Ų91.455%0.55258%0.576SS**PPolyproline II helixtrans-60.4139.6175.526.6-33.4000110.2G269 G312G269-P310 VanDerWaalsContact CA-O 3.28Å; G269-P310 WeakPolarHBondContact CA-O 3.45Å; P310-G312 PolarHBondContact O-N 2.69Å
311P80.4Confident77.4Confident127 Ų12789 Ų8983%0.82557%0.566SS**PPolyproline II helixtrans-53.2141.6172.4-25.334.2000111.2
312G80.1Confident78.1Confident24 Ų2489.7 Ų89.725%0.24757%0.567CS.*PPolyproline II helixtrans-66.6154.217700000111.5T267 G269 P310 K314T267-G312 WeakPolarHBondContact O-CA 3.45Å; G269-G312 VanDerWaalsContact CA-CA 3.43Å; P310-G312 PolarHBondContact O-N 2.69Å; G312-K314 PolarHBondContact O-N 3.17Å
313P83.6Confident78.6Confident94 Ų9489.6 Ų89.661%0.6157%0.567SS**PPolyproline II helixtrans-55.9133.3174.724.6-34.4000110.3G266 T267 G315G266-P313 VanDerWaalsContact CA-O 3.28Å; G266-P313 WeakPolarHBondContact CA-O 3.12Å; T267-P313 PolarHBondContact N-O 3.42Å; T267-P313 VanDerWaalsContact OG1-CD 3.23Å; T267-P313 WeakPolarHBondContact OG1-CD 3.22Å; T267-P313 WeakPolarHBondContact OG1-CG 3.22Å; P313-G315 PolarHBondContact O-N 3.23Å
314K79.3Confident78.9Confident196 Ų19690.1 Ų90.185%0.85257%0.571SS**PPolyproline II helixtrans-61.5136.4172.2-173.5-180177-176.90108G312G312-K314 PolarHBondContact O-N 3.17Å
315G76.1Confident79.2Confident19 Ų1993.5 Ų93.520%0.19658%0.576CS.*PPolyproline II helixtrans-65.2154.3177.900000112E264 P313E264-G315 CarbonylContact O-C 3.58Å; E264-G315 VanDerWaalsContact O-CA 3.25Å; E264-G315 WeakPolarHBondContact O-CA 3.28Å; P313-G315 PolarHBondContact O-N 3.23Å
316E81.6Confident79.3Confident138 Ų13893.1 Ų93.165%0.64557%0.574SS**PPolyproline II helixtrans-66.9137.4-179.1-64.7-169.615800111G263 E264G263-E316 CarbonylContact C-O 3.43Å; G263-E316 VanDerWaalsContact CA-O 3.23Å; G263-E316 WeakPolarHBondContact CA-O 3.06Å; E264-E316 PolarHBondContact N-O 3.27Å
317P78.7Confident79.2Confident119 Ų11993.1 Ų93.177%0.77357%0.574SS**PPolyproline II helixtrans-55.8141.2172.3-22.733.2000111.2
318G78.1Confident79.2Confident35 Ų3593.9 Ų93.936%0.36158%0.576SS.*PPolyproline II helixtrans-64.6149.4174.300000111.5Y261 G263Y261-G318 CarbonylContact O-C 3.57Å; Y261-G318 WeakPolarHBondContact O-CA 3.42Å; G263-G318 VanDerWaalsContact CA-N 3.28Å; G263-G318 VanDerWaalsContact N-CA 3.31Å
319I81.7Confident79Confident108 Ų10893.6 Ų93.655%0.55457%0.574SS**BIsolated β-bridgetrans-79.7130.3174.362.6177.3000109.8G260 Y261G260-I319 CarbonylContact C-O 3.57Å; G260-I319 WeakPolarHBondContact CA-O 3.4Å; Y261-I319 HydrophobicContact CD2-CD1 3.45Å; Y261-I319 VanDerWaalsContact CD2-CD1 3.45Å; Y261-I319 HydrophobicContact CD2-CG1 3.65Å; Y261-I319 HydrophobicContact CE2-CD1 4.07Å; Y261-I319 HydrophobicContact CG-CD1 4.2Å; Y261-I319 HydrophobicContact CG-CG1 4.16Å; Y261-I319 PolarHBondContact N-O 3.42Å; Y261-I319 VanDerWaalsContact N-O 3.12Å; Y261-I319 PolarHBondContact O-N 3.25Å
320V79.6Confident78.6Confident139 Ų13994 Ų9484%0.84258%0.578SS**PPolyproline II helixtrans-63.1141.1175.6-175.90000108.8
321G74.9Confident78.3Confident28 Ų2897.7 Ų97.729%0.28959%0.586SS.*PPolyproline II helixtrans-61.1146178.500000111.4P258 G260P258-G321 WeakPolarHBondContact O-CA 3.03Å; G260-G321 VanDerWaalsContact CA-CA 3.42Å; G260-G321 VanDerWaalsContact CA-N 3.26Å
322M80Confident77.9Confident140 Ų14097.5 Ų97.569%0.6958%0.584SS**PPolyproline II helixtrans-65.2142.5177.4-63.4-174.279.100110.2G257 P258G257-M322 WeakPolarHBondContact CA-O 3.23Å; P258-M322 HydrophobicContact CG-CB 4.43Å
323P76.1Confident77.3Confident122 Ų12298.3 Ų98.379%0.79259%0.593SS**PPolyproline II helixtrans-53.4145.1169.9-25.634.7000111.6
324G76.2Confident76.8Confident36 Ų36100.8 Ų100.837%0.37160%0.596SS.*PPolyproline II helixtrans-65.5152.5174.600000111.9V255 P326V255-G324 CarbonylContact O-C 3.58Å; V255-G324 WeakPolarHBondContact O-CA 3.21Å; G324-P326 WeakPolarHBondContact O-CD 3.25Å
325K80.6Confident76.2Confident167 Ų167101 Ų10173%0.72660%0.597SS**BIsolated β-bridgetrans-72125.9171.6-67.9-173.9179.3-176.50108.3G254 V255G254-K325 CarbonylContact C-O 3.43Å; G254-K325 WeakPolarHBondContact CA-O 3.17Å; V255-K325 PolarHBondContact N-O 3.39Å; V255-K325 VanDerWaalsContact N-O 3.12Å; V255-K325 PolarHBondContact O-N 3.12Å
326P76.9Confident75.3Confident120 Ų120101.8 Ų101.878%0.77961%0.605SS**PPolyproline II helixtrans-53.2148.9174.9-26.434.9000111.6G324G324-P326 WeakPolarHBondContact O-CD 3.25Å
327G76Confident74.5Confident36 Ų36102.9 Ų102.937%0.37161%0.61SS.*PPolyproline II helixtrans-61.5153.5174.200000111.1R252R252-G327 WeakPolarHBondContact O-CA 3.23Å
328T79.4Confident73.7Confident86 Ų86106.1 Ų106.153%0.52861%0.612SS.*PPolyproline II helixtrans-79.7131.9171.3460000108.3G251 R252G251-T328 CarbonylContact C-O 3.48Å; G251-T328 WeakPolarHBondContact CA-O 3.21Å; R252-T328 PolarHBondContact N-O 3.39Å; R252-T328 PolarHBondContact O-N 3.43Å
329P75.4Confident72.5Confident119 Ų119106.2 Ų106.277%0.77361%0.613SS**PPolyproline II helixtrans-54.7145.4172.5-25.634.8000111
330G73.1Confident71.2Confident36 Ų36106 Ų10637%0.37162%0.621SS.*PPolyproline II helixtrans-60.6144.6174.400000110.5F249F249-G330 WeakPolarHBondContact O-CA 3.46Å
331K76.6Confident69.8Low163 Ų163107.4 Ų107.471%0.70962%0.616SS**PPolyproline II helixtrans-67.4131.4170.9-69.9-173.4176.6-175.10107.9G248 F249 G333G248-K331 WeakPolarHBondContact CA-O 3.28Å; F249-K331 PolarHBondContact O-N 3.13Å; K331-G333 PolarHBondContact O-N 2.89Å
332P72.3Confident68.5Low122 Ų122110.3 Ų110.379%0.79264%0.637SS**PPolyproline II helixtrans-51.8141.4170.4-25.234.5000110.2
333G67.2Low67Low41 Ų41112.1 Ų112.142%0.42364%0.644SS.*PPolyproline II helixtrans-60143.5175.800000110.5L246 K331 K335L246-G333 WeakPolarHBondContact O-CA 3.28Å; K331-G333 PolarHBondContact O-N 2.89Å; G333-K335 PolarHBondContact O-N 3.07Å
334E72.6Confident65.6Low147 Ų147111 Ų11169%0.68765%0.645SS**PPolyproline II helixtrans-66.9134.9173-71.2-174.3145.400109G245 G336G245-E334 WeakPolarHBondContact CA-O 3.4Å; E334-G336 PolarHBondContact O-N 3.36Å
335K66.8Low64Low201 Ų201118.2 Ų118.287%0.87467%0.671SS**PPolyproline II helixtrans-64.5125.2174-175.2177.5-179.4178.70107.4G333 E337G333-K335 PolarHBondContact O-N 3.07Å; K335-E337 PolarHBondContact O-N 3.19Å
336G58.2Low62.2Low34 Ų34114.3 Ų114.335%0.35167%0.67SS.*PPolyproline II helixtrans-51.6135.617900000111.1E334 K338E334-G336 PolarHBondContact O-N 3.36Å; G336-K338 PolarHBondContact O-N 3.11Å
337E64.4Low60.5Low161 Ų161113.3 Ų113.375%0.75267%0.672SS**PPolyproline II helixtrans-59.3137.1177.8-67.1-168.7142.600109.5K335 G339K335-E337 PolarHBondContact O-N 3.19Å; E337-G339 PolarHBondContact O-N 2.92Å; E337-G339 VanDerWaalsContact O-N 3.14Å
338K61Low59.1Low187 Ų187118 Ų11881%0.81369%0.694SS**PPolyproline II helixtrans-67.3116.9174.7-171.8176.5-176.7177.40106.7G336 S340G336-K338 PolarHBondContact O-N 3.11Å; K338-S340 PolarHBondContact O-N 3.32Å
339G53.7Low57.5Low38 Ų38119.3 Ų119.339%0.39271%0.706SS.*  trans-44.9124.2-179.800000110.8E337 K341E337-G339 PolarHBondContact O-N 2.92Å; E337-G339 VanDerWaalsContact O-N 3.14Å; G339-K341 PolarHBondContact O-N 3.29Å
340S54.7Low56.3Low103 Ų103119.9 Ų119.972%0.7271%0.707SS**  trans-54.9132.2179.448.30000108.7K338 A342K338-S340 PolarHBondContact O-N 3.32Å; S340-A342 PolarHBondContact O-N 3.37Å
341K50.5Low54.6Low169 Ų169121.8 Ų121.874%0.73573%0.727SS**  trans-61.6134.2164.7-69.5179178.5178.10105.8G339 E343G339-K341 PolarHBondContact O-N 3.29Å; K341-E343 VanDerWaalsContact C-N 3.3Å; K341-E343 PolarHBondContact O-N 3.27Å
342A46.8Very low53.3Low88 Ų88120.3 Ų120.373%0.72773%0.732SS**  trans-59.796.4173.500000108.5S340 A344S340-A342 PolarHBondContact O-N 3.37Å; A342-A344 PolarHBondContact O-N 3.22Å
343E47.8Very low52.1Low178 Ų178119.8 Ų119.883%0.83273%0.731SS**  trans-66.9123.2165.1-105.9165.2131.600106.8K341 M345K341-E343 VanDerWaalsContact C-N 3.3Å; K341-E343 PolarHBondContact O-N 3.27Å; E343-M345 PolarHBondContact O-N 3.23Å
344A46.7Very low50.7Low100 Ų100121.4 Ų121.483%0.82675%0.747SS**  trans-59.6102.7172.700000107.7A342 A346A342-A344 PolarHBondContact O-N 3.22Å; A344-A346 VanDerWaalsContact C-N 3.33Å; A344-A346 PolarHBondContact O-N 3.28Å
345M43.2Very low49.3Very low186 Ų186126 Ų12692%0.91676%0.759SS**  trans-62.499.6170.6-76.8-176.2164.500107.8E343 A347E343-M345 PolarHBondContact O-N 3.23Å; M345-A347 PolarHBondContact O-N 3.35Å; M345-A347 VanDerWaalsContact O-N 3.1Å
346A42.8Very low48.1Very low85 Ų85121 Ų12170%0.70276%0.755SS**  trans-58.5111.4162.500000107.2A344 T348A344-A346 VanDerWaalsContact C-N 3.33Å; A344-A346 PolarHBondContact O-N 3.28Å; A346-T348 PolarHBondContact O-N 3.3Å; A346-T348 PolarHBondContact O-OG1 3.34Å
347A40.6Very low47.5Very low100 Ų100123.1 Ų123.183%0.82677%0.769SS**  trans-57.2102.8175.900000109.6M345M345-A347 PolarHBondContact O-N 3.35Å; M345-A347 VanDerWaalsContact O-N 3.1Å
348T47.7Very low46.6Very low135 Ų135125 Ų12583%0.82878%0.775SS**  trans-12088.8159.58.70000107.6A346 V350A346-T348 PolarHBondContact O-N 3.3Å; A346-T348 PolarHBondContact O-OG1 3.34Å; T348-V350 PolarHBondContact O-N 3.28Å
349S46.4Very low46.3Very low112 Ų112123.2 Ų123.278%0.78377%0.773SS**  trans-69.210416749.50000109.8
350V48.4Very low46.1Very low131 Ų131130.2 Ų130.279%0.79480%0.795SS**  trans-146.9113.3147.8-174.40000107.7T348T348-V350 PolarHBondContact O-N 3.28Å
351G37.2Very low46.1Very low77 Ų77128.1 Ų128.179%0.79479%0.789SS**  trans-71.2134.517200000110.7
352V49.8Very low46.5Very low131 Ų131125.9 Ų125.979%0.79479%0.792SS**  trans-135.7112.8157.1-169.30000108
353S48.1Very low47.3Very low111 Ų111127.8 Ų127.878%0.77680%0.797SS**  trans-51.7136.9170.147.50000113
354G37.4Very low47.8Very low75 Ų75122.2 Ų122.277%0.77379%0.788SS**  trans5387.7137.600000117.7
355R43.6Very low48.5Very low245 Ų245123.2 Ų123.293%0.92579%0.786SS**  trans-147.2109145.2-112.1172.4175.5167.8-1.7109A357R355-A357 VanDerWaalsContact C-N 3.25Å; R355-A357 PolarHBondContact O-N 3.3Å
356A41.4Very low49.6Very low96 Ų96120.4 Ų120.479%0.79378%0.782SS**  trans-63.991.1166.200000107.8F358A356-F358 PolarHBondContact O-N 3.17Å
357A45.9Very low49.9Very low78 Ų78119.3 Ų119.365%0.64578%0.778SS**  trans-73.5109.1166.900000107.1R355 I359R355-A357 VanDerWaalsContact C-N 3.25Å; R355-A357 PolarHBondContact O-N 3.3Å; A357-I359 HydrophobicContact CB-CG1 4.35Å; A357-I359 PolarHBondContact O-N 3.25Å
358F45.4Very low50.9Low201 Ų201120.8 Ų120.888%0.88278%0.779SS**  trans-62.692162-84-100.1000107.5A356 E360A356-F358 PolarHBondContact O-N 3.17Å; F358-E360 PolarHBondContact O-N 3.07Å
359I53.3Low51.1Low149 Ų149122.5 Ų122.576%0.76478%0.78SS**  trans-82.3100.9167.4-57.4175.5000105.2A357 G361A357-I359 HydrophobicContact CB-CG1 4.35Å; A357-I359 PolarHBondContact O-N 3.25Å; I359-G361 PolarHBondContact O-N 3.23Å
360E51.4Low51.1Low185 Ų185119.8 Ų119.886%0.86477%0.769SS**PPolyproline II helixtrans-55.9121.3165.7-70.4-173.5158.200107.9F358F358-E360 PolarHBondContact O-N 3.07Å
361G53.7Low51.2Low58 Ų58119.4 Ų119.460%0.59877%0.77SS**PPolyproline II helixtrans-61150.9178.700000110.9I359I359-G361 PolarHBondContact O-N 3.23Å
362P59.9Low51.7Low122 Ų122124.8 Ų124.879%0.79277%0.772SS**PPolyproline II helixtrans-54.8144.1177.123.7-33.4000110.6G364P362-G364 PolarHBondContact O-N 2.91Å
363P62Low51.4Low128 Ų128122.1 Ų122.183%0.83177%0.771SS**PPolyproline II helixtrans-49.9134.7175.4-26.733.8000111
364G58.1Low51.4Low62 Ų62127.8 Ų127.864%0.63978%0.776SS**PPolyproline II helixtrans-56.7151178.100000111.5P362P362-G364 PolarHBondContact O-N 2.91Å
365P62.6Low51.9Low120 Ų120135.9 Ų135.978%0.77978%0.784SS**PPolyproline II helixtrans-56144.817724.5-33.5000110.4G367P365-G367 PolarHBondContact O-N 3.19Å
366P66.8Low51.9Low128 Ų128126.7 Ų126.783%0.83177%0.765SS**PPolyproline II helixtrans-49.6136.1174.3-26.533.9000110.7
367G49.2Very low52.1Low61 Ų61127.9 Ų127.963%0.62977%0.765SS**PPolyproline II helixtrans-54.8151.7177.400000111.3P365 M369P365-G367 PolarHBondContact O-N 3.19Å; G367-M369 PolarHBondContact O-N 2.93Å
368P60.5Low52.2Low131 Ų131130 Ų13085%0.85177%0.772SS**PPolyproline II helixtrans-55.4131.117824.2-33.2000109.6G370P368-G370 PolarHBondContact O-N 3.24Å
369M51.5Low52Low172 Ų172123.5 Ų123.585%0.84776%0.762SS**PPolyproline II helixtrans-54.2127.3174.4-174.2173.762.200108.6G367G367-M369 PolarHBondContact O-N 2.93Å
370G46.8Very low51.7Low54 Ų54125.5 Ų125.556%0.55777%0.768SS**PPolyproline II helixtrans-54.8153.7179.900000111.8P368 K372P368-G370 PolarHBondContact O-N 3.24Å; G370-K372 PolarHBondContact O-N 3.05Å
371P50.9Low51.5Low124 Ų124121.8 Ų121.881%0.80576%0.758SS**PPolyproline II helixtrans-54.9132.1179.523.6-32.8000109.9G373P371-G373 PolarHBondContact O-N 3.22Å
372K48.4Very low51.3Low190 Ų190127 Ų12783%0.82676%0.76SS**PPolyproline II helixtrans-53.4126.3172.1-109.3178.7177176.20108.1G370 Y374G370-K372 PolarHBondContact O-N 3.05Å; K372-Y374 PolarHBondContact O-N 3.19Å
373G42.8Very low50.8Low75 Ų75128 Ų12877%0.77376%0.757SS**PPolyproline II helixtrans-54.5133.8174.300000110.4P371 R375P371-G373 PolarHBondContact O-N 3.22Å; G373-R375 PolarHBondContact O-N 3.07Å
374Y47.8Very low50.2Low229 Ų229126.4 Ų126.490%0.89874%0.74SS**PPolyproline II helixtrans-60.9124.9177.5-64.8-84000109.1K372 G376K372-Y374 PolarHBondContact O-N 3.19Å; Y374-G376 PolarHBondContact O-N 3Å
375R48Very low50Low245 Ų245127.9 Ų127.993%0.92573%0.734SS**PPolyproline II helixtrans-63.2123.7167.6-156.9-179.3-146.6-158.94.6106.4G373G373-R375 PolarHBondContact O-N 3.07Å
376G43.3Very low49.8Very low52 Ų52129 Ų12954%0.53673%0.733SS.*PPolyproline II helixtrans-54150.6177.100000111.1Y374Y374-G376 PolarHBondContact O-N 3Å
377P46.2Very low49.7Very low121 Ų121128 Ų12879%0.78673%0.729SS**PPolyproline II helixtrans-53.3139.1178.123.2-32.5000109.5G379P377-G379 PolarHBondContact O-N 2.97Å
378P47.3Very low50.3Low123 Ų123129.4 Ų129.480%0.79972%0.722SS**PPolyproline II helixtrans-51.5132.6170-21.631.4000108.9E380P378-E380 PolarHBondContact O-N 2.95Å
379G42.4Very low50.6Low65 Ų65128.2 Ų128.267%0.6771%0.712SS**PPolyproline II helixtrans-52.2128173.700000109.2P377 T381P377-G379 PolarHBondContact O-N 2.97Å; G379-T381 PolarHBondContact O-N 3.14Å
380E46.8Very low51.2Low190 Ų190125.2 Ų125.289%0.88870%0.699SS**  trans-54.7106.7-174.4-161.3152.6-159.700109.5P378 R382P378-E380 PolarHBondContact O-N 2.95Å; E380-R382 PolarHBondContact O-N 2.87Å
381T45.9Very low51.8Low107 Ų107124.3 Ų124.366%0.65668%0.681SS**  trans-81.1107.5172.630.70000105.5G379 I383G379-T381 PolarHBondContact O-N 3.14Å; T381-I383 PolarHBondContact O-N 3.3Å; T381-I383 VanDerWaalsContact O-N 3.11Å
382R49.4Very low52.3Low169 Ų169124.2 Ų124.264%0.63867%0.67SS**  trans-59.1117.2168.5-74.7-173.4174.4-176.9-2.6107.6E380 I384E380-R382 PolarHBondContact O-N 2.87Å; R382-I384 PolarHBondContact O-N 3.25Å
383I49.6Very low53.1Low142 Ų142120.5 Ų120.573%0.72866%0.658SS**  trans-65.1111.3164.8-56.6174.7000104.5T381 D385T381-I383 PolarHBondContact O-N 3.3Å; T381-I383 VanDerWaalsContact O-N 3.11Å; I383-D385 PolarHBondContact O-N 2.82Å
384I50.4Low54Low94 Ų94121.2 Ų121.248%0.48264%0.64SS.*  trans-81.6103.8174.1-53.3174000104R382 D386 D391R382-I384 PolarHBondContact O-N 3.25Å; I384-D386 PolarHBondContact O-N 3.48Å; I384-D391 HydrophobicContact CG2-CB 4.03Å
385D52.5Low54.6Low94 Ų94113.4 Ų113.450%0.50362%0.623SS.*  trans-80.9110.1166.8-89.7-28.3000106.7I383 S387 N388I383-D385 PolarHBondContact O-N 2.82Å; D385-S387 PolarHBondContact O-N 3.39Å; D385-N388 PolarHBondContact O-N 3.02Å
386D58.7Low55.4Low143 Ų143110.6 Ų110.677%0.76562%0.617SS**THydrogen-bonded Turntrans-57.4-8.8-177.6-70.5-35.3000114I384I384-D386 PolarHBondContact O-N 3.48Å
387S65.2Low56Low106 Ų106113.4 Ų113.474%0.74162%0.619SS**THydrogen-bonded Turntrans-83.1-12.1176.927.80000115.6D385D385-S387 PolarHBondContact O-N 3.39Å
388N61.5Low56.5Low92 Ų92113.3 Ų113.349%0.49262%0.619SS.*  trans-103119.4-179.8-106.8-33.1000112.2D385 L390 D391 Q392D385-N388 PolarHBondContact O-N 3.02Å; N388-L390 PolarHBondContact O-N 3.46Å; N388-L390 VanDerWaalsContact O-N 3.13Å; N388-D391 HydrophobicContact CB-CB 4.24Å; N388-D391 WeakPolarHBondContact CB-OD2 3.39Å; N388-D391 WeakPolarHBondContact O-CB 3.41Å; N388-D391 PolarHBondContact O-N 3.16Å; N388-Q392 PolarHBondContact O-N 3.34Å
389V66.7Low56.7Low105 Ų105118.5 Ų118.564%0.63662%0.622SS**Hα-helixtrans-57.6-28.2174.2178.50000111.6Q392 I393V389-Q392 PolarHBondContact O-N 3.46Å; V389-I393 PolarHBondContact O-N 3.34Å
390L65.2Low57.2Low109 Ų109118.1 Ų118.157%0.57162%0.619SS**Hα-helixtrans-65-37.1172.5-97.3132000112.6N388 Q392 I393 F394N388-L390 PolarHBondContact O-N 3.46Å; N388-L390 VanDerWaalsContact O-N 3.13Å; L390-Q392 VanDerWaalsContact C-N 3.3Å; L390-Q392 PolarHBondContact O-N 3.36Å; L390-I393 PolarHBondContact O-N 3.24Å; L390-I393 VanDerWaalsContact O-N 3.16Å; L390-F394 HydrophobicContact CD2-CE2 3.98Å; L390-F394 VanDerWaalsContact O-CD2 3.28Å; L390-F394 WeakPolarHBondContact O-CD2 3.13Å; L390-F394 PolarHBondContact O-N 3.27Å
391D59.5Low57.8Low36 Ų36114.8 Ų114.819%0.19361%0.614CS.*Hα-helixtrans-69.8-29.8177.3-73.8-33.2000111.7I384 N388 I393 F394 A395I384-D391 HydrophobicContact CG2-CB 4.03Å; N388-D391 HydrophobicContact CB-CB 4.24Å; N388-D391 WeakPolarHBondContact CB-OD2 3.39Å; N388-D391 WeakPolarHBondContact O-CB 3.41Å; N388-D391 PolarHBondContact O-N 3.16Å; D391-I393 VanDerWaalsContact C-N 3.33Å; D391-I393 PolarHBondContact O-N 3.19Å; D391-F394 PolarHBondContact O-N 3.21Å; D391-A395 VanDerWaalsContact O-CB 3.22Å; D391-A395 WeakPolarHBondContact O-CB 3.17Å; D391-A395 PolarHBondContact O-N 3.29Å
392Q61.6Low58.5Low121 Ų121115.8 Ų115.857%0.56562%0.622SS**Hα-helixtrans-67-31.6171-63.6-174.418.200113.1N388 V389 L390N388-Q392 PolarHBondContact O-N 3.34Å; V389-Q392 PolarHBondContact O-N 3.46Å; L390-Q392 VanDerWaalsContact C-N 3.3Å; L390-Q392 PolarHBondContact O-N 3.36Å
393I64.8Low58.5Low112 Ų112111.2 Ų111.257%0.57463%0.628SS**Hα-helixtrans-74.3-42175.3-63170.7000110V389 L390 D391 A395 K396V389-I393 PolarHBondContact O-N 3.34Å; L390-I393 PolarHBondContact O-N 3.24Å; L390-I393 VanDerWaalsContact O-N 3.16Å; D391-I393 VanDerWaalsContact C-N 3.33Å; D391-I393 PolarHBondContact O-N 3.19Å; I393-A395 VanDerWaalsContact C-N 3.32Å; I393-A395 PolarHBondContact O-N 3.26Å; I393-K396 PolarHBondContact O-N 3.18Å
394F61Low58.7Low91 Ų91112.4 Ų112.440%0.39964%0.635SS.*Hα-helixtrans-70.6-26.7176.6-80.3-74.2000113.2L390 D391 K396 L397L390-F394 HydrophobicContact CD2-CE2 3.98Å; L390-F394 VanDerWaalsContact O-CD2 3.28Å; L390-F394 WeakPolarHBondContact O-CD2 3.13Å; L390-F394 PolarHBondContact O-N 3.27Å; D391-F394 PolarHBondContact O-N 3.21Å; F394-K396 PolarHBondContact O-N 3.45Å; F394-L397 HydrophobicContact CD1-CD1 3.71Å; F394-L397 HydrophobicContact CE1-CD1 4.08Å; F394-L397 PolarHBondContact O-N 3.21Å
395A60.8Low59.1Low64 Ų64113.6 Ų113.653%0.52965%0.648SS.*THydrogen-bonded Turntrans-65.5-17173.900000113.8D391 I393D391-A395 VanDerWaalsContact O-CB 3.22Å; D391-A395 WeakPolarHBondContact O-CB 3.17Å; D391-A395 PolarHBondContact O-N 3.29Å; I393-A395 VanDerWaalsContact C-N 3.32Å; I393-A395 PolarHBondContact O-N 3.26Å
396K64.2Low58.7Low187 Ų187112.6 Ų112.681%0.81366%0.66SS**THydrogen-bonded Turntrans-91.4-3.2176.1-71.5-164.9178.5-171.80114.6I393 F394I393-K396 PolarHBondContact O-N 3.18Å; F394-K396 PolarHBondContact O-N 3.45Å
397L56.4Low58.4Low110 Ų110114.2 Ų114.258%0.57667%0.668SS**SBendtrans-82.5133176.1-74.4164.2000110.5F394 R399F394-L397 HydrophobicContact CD1-CD1 3.71Å; F394-L397 HydrophobicContact CE1-CD1 4.08Å; F394-L397 PolarHBondContact O-N 3.21Å; L397-R399 PolarHBondContact O-N 3.36Å
398P56.2Low57.9Low120 Ų120120.5 Ų120.578%0.77968%0.676SS**PPolyproline II helixtrans-58.9126.8179.221.7-29.9000110.2G400P398-G400 PolarHBondContact O-N 3.01Å
399R53Low57.1Low231 Ų231119.1 Ų119.187%0.87268%0.683SS**PPolyproline II helixtrans-55.3123177.3-153.3176.3-163.9175.15.2108.4L397L397-R399 PolarHBondContact O-N 3.36Å
400G52.8Low56.3Low58 Ų58122.5 Ų122.560%0.59869%0.692SS**PPolyproline II helixtrans-55.2147.7179.500000111.6P398P398-G400 PolarHBondContact O-N 3.01Å
401P57.5Low56.3Low120 Ų120123.1 Ų123.178%0.77970%0.702SS**PPolyproline II helixtrans-56144.2-178.522.8-32.5000110.8G403P401-G403 PolarHBondContact O-N 3.12Å
402P61.2Low55.7Low128 Ų128124.8 Ų124.883%0.83173%0.728SS**PPolyproline II helixtrans-50134.2174.4-25.233.1000111L404P402-L404 PolarHBondContact O-N 3.36Å
403G49.9Very low55.2Low73 Ų73127.6 Ų127.675%0.75374%0.741SS**PPolyproline II helixtrans-56.3139.1176.800000111.1P401P401-G403 PolarHBondContact O-N 3.12Å
404L53.1Low54.9Low167 Ų167130.3 Ų130.387%0.87476%0.755SS**PPolyproline II helixtrans-51.3135178.1-73.3163.1000110.3P402 G406P402-L404 PolarHBondContact O-N 3.36Å; L404-G406 PolarHBondContact O-N 3.14Å
405P59.4Low54.4Low118 Ų118128.5 Ų128.577%0.76676%0.762SS**PPolyproline II helixtrans-51.1130.4172.9-25.433.5000110.3L407P405-L407 PolarHBondContact O-N 3.04Å
406G44Very low54.2Low74 Ų74131.2 Ų131.276%0.76377%0.774SS**PPolyproline II helixtrans-57.2131.6178.400000110.6L404 R408L404-G406 PolarHBondContact O-N 3.14Å; G406-R408 PolarHBondContact O-N 3.18Å
407L51.7Low54.6Low177 Ų177128.2 Ų128.293%0.92777%0.774SS**PPolyproline II helixtrans-53.5124.1175-67.8170.8000108.8P405 G409P405-L407 PolarHBondContact O-N 3.04Å; L407-G409 PolarHBondContact O-N 3.35Å
408R54.4Low54.7Low238 Ų238126.5 Ų126.590%0.89878%0.782SS**PPolyproline II helixtrans-55.6123.7173.7-179.4177.8180173.3-0.2107.7G406 E410G406-R408 PolarHBondContact O-N 3.18Å; R408-E410 PolarHBondContact O-N 2.89Å
409G45.3Very low54.8Low63 Ų63128.6 Ų128.665%0.64979%0.786SS**PPolyproline II helixtrans-54.4138.1179.300000111.1L407L407-G409 PolarHBondContact O-N 3.35Å
410E51Low55.9Low176 Ų176123.3 Ų123.382%0.82278%0.782SS**PPolyproline II helixtrans-53.6136.7179.9-66.2-163.2142.200110.5R408 G412R408-E410 PolarHBondContact O-N 2.89Å; E410-G412 PolarHBondContact O-N 3.31Å
411P63.9Low56.6Low121 Ų121123.5 Ų123.579%0.78678%0.784SS**PPolyproline II helixtrans-51.5129.1173.1-24.833.7000110.2H413P411-H413 PolarHBondContact O-N 3.2Å
412G47.1Very low56.9Low71 Ų71124 Ų12473%0.73279%0.787SS**PPolyproline II helixtrans-57.6136.5-18000000111E410 I414E410-G412 PolarHBondContact O-N 3.31Å; G412-I414 PolarHBondContact O-N 3.04Å
413H52Low57.4Low181 Ų181122.5 Ų122.584%0.83879%0.785SS**PPolyproline II helixtrans-53.6127.2174-65.6-89.5000109.8P411 G415P411-H413 PolarHBondContact O-N 3.2Å; H413-G415 PolarHBondContact O-N 3.04Å
414I58Low58.2Low169 Ų169121.8 Ų121.887%0.86778%0.778SS**PPolyproline II helixtrans-53.9124.2172.3-60171.8000107G412G412-I414 PolarHBondContact O-N 3.04Å
415G51.6Low58.8Low53 Ų53120 Ų12055%0.54678%0.776SS.*PPolyproline II helixtrans-56.9149.6-179.400000111.1H413H413-G415 PolarHBondContact O-N 3.04Å
416P56.3Low59.2Low120 Ų120122 Ų12278%0.77978%0.779SS**PPolyproline II helixtrans-55.6146.3176.224.6-33.3000110.1G418P416-G418 PolarHBondContact O-N 3.44Å
417P72.3Confident60Low125 Ų125121 Ų12181%0.81277%0.768SS**PPolyproline II helixtrans-48140.4173.5-2734.2000111.1L419P417-L419 PolarHBondContact O-N 3.24Å
418G57.9Low60.4Low73 Ų73118.3 Ų118.375%0.75376%0.761SS**PPolyproline II helixtrans-54.1135178.400000110.4P416P416-G418 PolarHBondContact O-N 3.44Å
419L59.6Low61.1Low164 Ų164112.2 Ų112.286%0.85975%0.753SS**PPolyproline II helixtrans-54.1136.1172.8-70167.4000108.7P417 G421P417-L419 PolarHBondContact O-N 3.24Å; L419-G421 PolarHBondContact O-N 3.25Å
420P75.4Confident61.4Low121 Ų121112.3 Ų112.379%0.78675%0.754SS**PPolyproline II helixtrans-48.5136.1173.3-27.434.5000110.2
421G66.6Low61.4Low62 Ų62112.3 Ų112.364%0.63976%0.757SS**PPolyproline II helixtrans-53146.1178.300000110.4L419 A423L419-G421 PolarHBondContact O-N 3.25Å; G421-A423 PolarHBondContact O-N 3.36Å
422P64.4Low60.3Low130 Ų130113.2 Ų113.284%0.84475%0.754SS**PPolyproline II helixtrans-52.7135.1174.124.1-32.9000108.6G424P422-G424 PolarHBondContact O-N 3.48Å
423A71.9Confident60.2Low97 Ų97113 Ų11380%0.80275%0.752SS**PPolyproline II helixtrans-50.6134.8174.500000108.7G421G421-A423 PolarHBondContact O-N 3.36Å
424G67.4Low59.9Low58 Ų58112.4 Ų112.460%0.59875%0.754SS**PPolyproline II helixtrans-51.8148.5176.500000110.2P422 I426P422-G424 PolarHBondContact O-N 3.48Å; G424-I426 PolarHBondContact O-N 3.32Å
425P65.4Low59.9Low129 Ų129109.4 Ų109.484%0.83875%0.745SS**PPolyproline II helixtrans-52.1130.4177.823.6-32.9000108.6G427P425-G427 PolarHBondContact O-N 3.45Å; P425-G427 VanDerWaalsContact O-N 3.09Å
426I68.4Low59.7Low161 Ų161109.7 Ų109.783%0.82675%0.749SS**PPolyproline II helixtrans-51.9123.8171.5-63.4172000105.8G424G424-I426 PolarHBondContact O-N 3.32Å
427G60.6Low59.5Low51 Ų51110.2 Ų110.253%0.52675%0.752SS.*PPolyproline II helixtrans-49.4142.8179.300000109.4P425 P429P425-G427 PolarHBondContact O-N 3.45Å; P425-G427 VanDerWaalsContact O-N 3.09Å; G427-P429 VanDerWaalsContact O-N 3.09Å
428P59.8Low58.3Low122 Ų122112.6 Ų112.679%0.79275%0.752SS**PPolyproline II helixtrans-49.2125.5-174.820.5-32000108.7G430P428-G430 PolarHBondContact O-N 3.25Å
429P67.6Low57.9Low110 Ų110112 Ų11271%0.71475%0.747SS**PPolyproline II helixtrans-47.6131.7174.4-27.834.2000108.6G427 I431G427-P429 VanDerWaalsContact O-N 3.09Å; P429-I431 PolarHBondContact O-N 3.43Å
430G51.9Low57.4Low65 Ų65112.2 Ų112.267%0.6775%0.747SS**PPolyproline II helixtrans-49.8138.6174.800000108.7P428 I432P428-G430 PolarHBondContact O-N 3.25Å; G430-I432 VanDerWaalsContact C-N 3.29Å; G430-I432 PolarHBondContact O-N 3.41Å
431I51Low56Low175 Ų175114.9 Ų114.990%0.89775%0.749SS**  trans-53.291.7-17743.8164.5000110.5P429 G433P429-I431 PolarHBondContact O-N 3.43Å; I431-G433 PolarHBondContact O-N 3.4Å
432I40.4Very low55Low140 Ų140114.3 Ų114.372%0.71874%0.743SS**  trans-64.7120.3167.8-61.5172.7000104.2G430 L434G430-I432 VanDerWaalsContact C-N 3.29Å; G430-I432 PolarHBondContact O-N 3.41Å; I432-L434 PolarHBondContact O-N 3.26Å; I432-L434 VanDerWaalsContact O-N 3.17Å
433G45.2Very low54.2Low66 Ų66114.2 Ų114.268%0.6874%0.742SS**  trans-46.1125.3-175.500000110.1I431 P435I431-G433 PolarHBondContact O-N 3.4Å; G433-P435 WeakPolarHBondContact O-CD 3.09Å
434L47Very low53.2Low170 Ų170118.3 Ų118.389%0.8975%0.745SS**  trans-38.7106.3-171.1-79.1154.5000110.3I432 G436I432-L434 PolarHBondContact O-N 3.26Å; I432-L434 VanDerWaalsContact O-N 3.17Å; L434-G436 PolarHBondContact O-N 3.12Å
435P57.9Low51.9Low105 Ų105118.5 Ų118.568%0.68275%0.747SS**  trans-52.8132.1167.8-24.835.4000107.3G433G433-P435 WeakPolarHBondContact O-CD 3.09Å
436G47.7Very low50.9Low60 Ų60119.8 Ų119.862%0.61975%0.746SS**  trans-48.4146.4-176.100000110.7L434 Q438L434-G436 PolarHBondContact O-N 3.12Å; G436-Q438 PolarHBondContact O-N 3.05Å
437P51.5Low49.9Very low130 Ų130117.4 Ų117.484%0.84474%0.741SS**  trans-48.6113.9-170.320.4-32.5000109.4G439P437-G439 PolarHBondContact O-N 3.25Å
438Q47.6Very low49Very low175 Ų175118.3 Ų118.382%0.81875%0.75SS**  trans-57.3118.7176.6-175.2175.1-15.300106.2G436 I440G436-Q438 PolarHBondContact O-N 3.05Å; Q438-I440 PolarHBondContact O-N 3.1Å
439G48Very low48.3Very low62 Ų62121 Ų12164%0.63975%0.752SS**  trans-48.4131.4-179.100000108.8P437 Q441P437-G439 PolarHBondContact O-N 3.25Å; G439-Q441 PolarHBondContact O-N 3.12Å
440I49.6Very low47.2Very low168 Ų168121.3 Ų121.386%0.86276%0.757SS**  trans-43.1113.6-178.544.8169.2000108.8Q438 G442Q438-I440 PolarHBondContact O-N 3.1Å; I440-G442 PolarHBondContact O-N 3.47Å
441Q45.5Very low46.7Very low176 Ų176121.5 Ų121.582%0.82276%0.759SS**PPolyproline II helixtrans-55.8119.2174-174174.43100105.5G439G439-Q441 PolarHBondContact O-N 3.12Å
442G46.4Very low46.5Very low50 Ų50118.1 Ų118.152%0.51576%0.757SS.*PPolyproline II helixtrans-48.6144.1178.900000109.1I440 Q444I440-G442 PolarHBondContact O-N 3.47Å; G442-Q444 PolarHBondContact O-N 3.18Å
443P48.2Very low46.6Very low129 Ų129120.9 Ų120.984%0.83876%0.764SS**PPolyproline II helixtrans-48122.8-173.619.9-32000108.9G445P443-G445 PolarHBondContact O-N 3.07Å
444Q49.8Very low46.6Very low182 Ų182120.9 Ų120.985%0.8576%0.764SS**PPolyproline II helixtrans-51.4120.9178.6-170.6176.818.200107.1G442 L446G442-Q444 PolarHBondContact O-N 3.18Å; Q444-L446 PolarHBondContact O-N 3.06Å
445G39.8Very low46.5Very low62 Ų62120.3 Ų120.364%0.63976%0.762SS**PPolyproline II helixtrans-48.7129.2-177.600000109.3P443P443-G445 PolarHBondContact O-N 3.07Å
446L44.4Very low46Very low156 Ų156127.1 Ų127.182%0.81777%0.774SS**  trans-45.2126.4-177.8-80156.5000109.2Q444 G448Q444-L446 PolarHBondContact O-N 3.06Å; L446-G448 PolarHBondContact O-N 3.28Å; L446-G448 VanDerWaalsContact O-N 3.1Å
447P48.7Very low45.9Very low111 Ų111127.4 Ų127.472%0.72178%0.776SS**PPolyproline II helixtrans-49.2123.9176.6-28.234.3000109.5H449P447-H449 PolarHBondContact O-N 3.42Å
448G40.1Very low45.6Very low71 Ų71130 Ų13073%0.73278%0.78SS**PPolyproline II helixtrans-50.4130.4-17800000110L446 S450L446-G448 PolarHBondContact O-N 3.28Å; L446-G448 VanDerWaalsContact O-N 3.1Å; G448-S450 PolarHBondContact O-N 3.18Å
449H46.5Very low45.6Very low179 Ų179129.7 Ų129.783%0.82978%0.782SS**PPolyproline II helixtrans-51.1119.3-179.6-46.8-58.6000108.6P447 G451P447-H449 PolarHBondContact O-N 3.42Å; H449-G451 PolarHBondContact O-N 3.1Å
450S43.6Very low45.2Very low115 Ų115129.3 Ų129.380%0.80478%0.778SS**PPolyproline II helixtrans-52.3120.2177.350.90000108.6G448 A452G448-S450 PolarHBondContact O-N 3.18Å; S450-A452 PolarHBondContact O-N 3.25Å
451G41.2Very low45.2Very low70 Ų70127 Ų12772%0.72277%0.774SS**PPolyproline II helixtrans-50137.9-17600000111.3H449 K453H449-G451 PolarHBondContact O-N 3.1Å; G451-K453 PolarHBondContact O-N 3.47Å
452A48.2Very low45.6Very low103 Ų103124.6 Ų124.685%0.85177%0.773SS**PPolyproline II helixtrans-49.1126.7178.200000109.2S450 G454S450-A452 PolarHBondContact O-N 3.25Å; A452-G454 PolarHBondContact O-N 2.99Å
453K42.2Very low45.5Very low199 Ų199125.7 Ų125.787%0.86579%0.785SS**  trans-54.9113.5178.1177.7-176.1175.8-171.80107.7G451 D455G451-K453 PolarHBondContact O-N 3.47Å; K453-D455 PolarHBondContact O-N 3.44Å
454G44.6Very low45.6Very low66 Ų66127.4 Ų127.468%0.6879%0.786SS**PPolyproline II helixtrans-50131.6-178.500000111.3A452A452-G454 PolarHBondContact O-N 2.99Å
455D45.4Very low45.9Very low158 Ų158124.5 Ų124.585%0.84578%0.783SS**PPolyproline II helixtrans-56140.9-176.2-67.8-46.7000110.8K453 G457K453-D455 PolarHBondContact O-N 3.44Å; D455-G457 PolarHBondContact O-N 3.46Å; D455-G457 VanDerWaalsContact O-N 3.08Å
456R47.5Very low46Very low247 Ų247124.4 Ų124.493%0.93278%0.783SS**PPolyproline II helixtrans-57.8118.7177-175177.4-174.5169.9-0.2107.4M458R456-M458 PolarHBondContact O-N 3.48Å
457G44.3Very low46.5Very low66 Ų66122.7 Ų122.768%0.6878%0.781SS**PPolyproline II helixtrans-46.8134.7-178.600000111.7D455 I459D455-G457 PolarHBondContact O-N 3.46Å; D455-G457 VanDerWaalsContact O-N 3.08Å; G457-I459 PolarHBondContact O-N 3.08Å
458M46.9Very low47Very low185 Ų185123.4 Ų123.491%0.91179%0.785SS**PPolyproline II helixtrans-54.5135.2-177.5-67.117665.700109.9R456 G460R456-M458 PolarHBondContact O-N 3.48Å; M458-G460 PolarHBondContact O-N 3.38Å
459I47Very low47.2Very low168 Ų168123.4 Ų123.486%0.86279%0.785SS**PPolyproline II helixtrans-58124.5169.7-61.4170.3000106.1G457G457-I459 PolarHBondContact O-N 3.08Å
460G40.4Very low47.5Very low54 Ų54126.4 Ų126.456%0.55779%0.789SS**PPolyproline II helixtrans-54.4145.9-17900000111.1M458M458-G460 PolarHBondContact O-N 3.38Å
461P49Very low48.1Very low121 Ų121126.9 Ų126.979%0.78679%0.789SS**PPolyproline II helixtrans-56.3143.6-178.623.4-32.3000110.3G463P461-G463 PolarHBondContact O-N 3.34Å
462P53.4Low48.4Very low124 Ų124126.8 Ų126.881%0.80579%0.789SS**PPolyproline II helixtrans-49.7137172.6-25.133.4000110.5L464P462-L464 PolarHBondContact O-N 3.34Å
463G44.9Very low48.6Very low74 Ų74126.9 Ų126.976%0.76378%0.783SS**PPolyproline II helixtrans-52.6134.8-179.300000111.2P461P461-G463 PolarHBondContact O-N 3.34Å
464L50.6Low49Very low165 Ų165125.3 Ų125.386%0.86478%0.783SS**PPolyproline II helixtrans-55.2134.6179.8-75.8161.5000110P462 G466P462-L464 PolarHBondContact O-N 3.34Å; L464-G466 PolarHBondContact O-N 3.03Å
465P54.5Low48.9Very low120 Ų120128.7 Ų128.778%0.77979%0.786SS**PPolyproline II helixtrans-51.5134.6171.7-25.634.1000110.4
466G43.2Very low49Very low61 Ų61125.8 Ų125.863%0.62978%0.783SS**PPolyproline II helixtrans-56.3145.5-179.600000111.2L464L464-G466 PolarHBondContact O-N 3.03Å
467P54.4Low48.9Very low120 Ų120121.4 Ų121.478%0.77978%0.779SS**PPolyproline II helixtrans-56.1137.8179.523.3-32.5000109.9G469P467-G469 PolarHBondContact O-N 3.25Å
468P58.1Low49.1Very low126 Ų126125.1 Ų125.182%0.81878%0.781SS**PPolyproline II helixtrans-50.2133.7172.3-26.234000110.1R470P468-R470 PolarHBondContact O-N 3.3Å
469G45.1Very low49.1Very low70 Ų70124.4 Ų124.472%0.72278%0.776SS**PPolyproline II helixtrans-52.3132.2-179.300000110.2P467 P471P467-G469 PolarHBondContact O-N 3.25Å; G469-P471 WeakPolarHBondContact O-CD 3.39Å; G469-P471 VanDerWaalsContact O-N 3.16Å
470R53.8Low49.3Very low243 Ų243124.2 Ų124.292%0.91778%0.776SS**PPolyproline II helixtrans-50.9125.6177-83.6-175.4178-137.9-0.3108.3P468 G472P468-R470 PolarHBondContact O-N 3.3Å; R470-G472 PolarHBondContact O-N 3.47Å
471P55.7Low49.7Very low124 Ų124130.2 Ų130.281%0.80579%0.79SS**PPolyproline II helixtrans-51.1128.8166.3-23.232.8000107.8G469 S473G469-P471 WeakPolarHBondContact O-CD 3.39Å; G469-P471 VanDerWaalsContact O-N 3.16Å; P471-S473 PolarHBondContact O-N 3.47Å; P471-S473 VanDerWaalsContact O-N 3.14Å
472G47.4Very low49.6Very low69 Ų69130.7 Ų130.771%0.71179%0.79SS**PPolyproline II helixtrans-51.3124.4178.700000108.6R470 L474R470-G472 PolarHBondContact O-N 3.47Å; G472-L474 VanDerWaalsContact C-N 3.32Å; G472-L474 PolarHBondContact O-N 3.35Å
473S52.4Low49.3Very low105 Ų105130.6 Ų130.673%0.73479%0.787SS**  trans-58.9101.8170.950.40000106.9P471 D475P471-S473 PolarHBondContact O-N 3.47Å; P471-S473 VanDerWaalsContact O-N 3.14Å; S473-D475 PolarHBondContact O-N 3.43Å
474L49.6Very low49.6Very low166 Ų166138.8 Ų138.887%0.86980%0.795SS**  trans-59.9110.1160.2-76.3159.2000104.9G472 A476G472-L474 VanDerWaalsContact C-N 3.32Å; G472-L474 PolarHBondContact O-N 3.35Å; L474-A476 PolarHBondContact O-N 3.22Å
475D44.2Very low49.5Very low136 Ų136138.9 Ų138.973%0.72779%0.793SS**  trans-53.2111.6168.8-73.8-45.5000107.6S473 N477S473-D475 PolarHBondContact O-N 3.43Å; D475-N477 PolarHBondContact O-N 3.19Å
476A46.1Very low49.1Very low97 Ų97141.3 Ų141.380%0.80280%0.799SS**THydrogen-bonded Turntrans-71.844.5-175.100000112.9L474L474-A476 PolarHBondContact O-N 3.22Å
477N46.6Very low49.5Very low155 Ų155143.7 Ų143.783%0.82980%0.803SS**THydrogen-bonded Turntrans-142.713.4-176.9-91.7-54.4000116.2D475D475-N477 PolarHBondContact O-N 3.19Å
478I47.9Very low49.3Very low144 Ų144144 Ų14474%0.73881%0.806SS**SBendtrans-128.640.5177.4-37.5179.8000112.1
479E46.5Very low48.6Very low170 Ų170149 Ų14979%0.79481%0.808SS**SBendtrans-119.94.7172.2-113.7-179.6170.600114.5
480N51.8Low48.7Very low164 Ų164153.2 Ų153.288%0.87781%0.813SS**SBendtrans-112.715.6-180-84.5-24.3000115.6
481H49.7Very low48.2Very low181 Ų181147.2 Ų147.284%0.83881%0.808SS**SBendtrans-125.7-1.1-179.3-126.359000116.7
482V46.8Very low47.7Very low130 Ų130146.1 Ų146.179%0.78881%0.809SS**SBendtrans-127.313-174.9-162.20000112.9
483T46.5Very low47.9Very low122 Ų122149.8 Ų149.875%0.74881%0.811SS**SBendtrans-111.814.9-176.2-33.10000113.7
484R51.2Low47.7Very low246 Ų246150.6 Ų150.693%0.92881%0.814SS**SBendtrans-115.85.7-178.6-80.4-167.5177.6-118.91.1116.2
485M48.9Very low47.7Very low167 Ų167154.3 Ų154.382%0.82382%0.817SS**SBendtrans-132.33.6-163.4-79.6-68.4-145.600118.9
486L45.9Very low47.7Very low172 Ų172154.1 Ų154.190%0.90182%0.82SS**  trans-149144.4173.4-84.6110.4000116.3
487P51.7Low47.8Very low111 Ų111155.6 Ų155.672%0.72182%0.819SS**  trans-84.6166.8-165.534.9-36.8000115.3R489P487-R489 PolarHBondContact O-N 3.5Å
488P49.7Very low47.9Very low127 Ų127155 Ų15583%0.82582%0.822SS**SBendtrans-89.875.2-163.936.5-33.5000111.8
489R43.9Very low47.9Very low231 Ų231151.4 Ų151.487%0.87282%0.82SS**  trans-150.990.8164.9-71.2-162.6174.3-177.6-1.3109.7P487P487-R489 PolarHBondContact O-N 3.5Å
490L46.8Very low48.1Very low158 Ų158151.3 Ų151.383%0.82782%0.824SS**  trans-167.889144.9-120.374000107.6
491S43.3Very low48.1Very low117 Ų117149.3 Ų149.382%0.81882%0.82SS**  trans-60.7145.115739.40000109.1
492A44.3Very low48.2Very low100 Ų100143.6 Ų143.683%0.82681%0.809SS**  trans82.277.3175.900000116.9
493I52.8Low48.6Very low146 Ų146143.1 Ų143.175%0.74981%0.809SS**  trans-130.2120.7147.7-24.4176.2000107.1R495I493-R495 PolarHBondContact O-N 3.37Å
494P47.8Very low49.1Very low123 Ų123143.4 Ų143.480%0.79981%0.813SS**  trans-67.2136.4178.628.2-31.3000109.2V496P494-V496 PolarHBondContact O-N 3.41Å
495R50.2Low49.1Very low244 Ų244134.6 Ų134.692%0.92180%0.799SS**  trans-51.7125.2-175.4-71.6179.1179-151.4-1.3111.7I493 T497I493-R495 PolarHBondContact O-N 3.37Å; R495-T497 PolarHBondContact O-N 3.04Å
496V43.9Very low49.5Very low132 Ų132133 Ų13380%0.880%0.801SS**  trans-2111151.2-1740000114.4P494 T498P494-V496 PolarHBondContact O-N 3.41Å; V496-T498 PolarHBondContact O-N 3.15Å
497T47.8Very low49.6Very low127 Ų127134.6 Ų134.678%0.77980%0.8SS**  trans-8110.5156.155.60000115.4R495 G499R495-T497 PolarHBondContact O-N 3.04Å; T497-G499 PolarHBondContact O-N 3.45Å; T497-G499 VanDerWaalsContact O-N 3.16Å
498T47.8Very low49.3Very low144 Ų144132.2 Ų132.288%0.88380%0.797SS**  trans-58.4112.7160-4.80000107.9V496V496-T498 PolarHBondContact O-N 3.15Å
499G49.5Very low49.5Very low68 Ų68135 Ų13570%0.70180%0.798SS**PPolyproline II helixtrans-57.5140.2174.900000110.9T497T497-G499 PolarHBondContact O-N 3.45Å; T497-G499 VanDerWaalsContact O-N 3.16Å
500L49.9Very low50Low168 Ų168130 Ų13088%0.8880%0.796SS**PPolyproline II helixtrans-50.9134.7177.3-71.8165.9000110.3G502L500-G502 PolarHBondContact O-N 3.39Å
501P50.9Low50Low122 Ų122125.9 Ų125.979%0.79279%0.792SS**PPolyproline II helixtrans-51.5129.2173.2-25.333.5000110.2
502G53.4Low50.7Low60 Ų60129.5 Ų129.562%0.61980%0.796SS**PPolyproline II helixtrans-55.2149.917600000111L500L500-G502 PolarHBondContact O-N 3.39Å
503P54.2Low50.8Low120 Ų120134.5 Ų134.578%0.77980%0.799SS**PPolyproline II helixtrans-54.6142.7-179.923.1-33000110.5G505P503-G505 PolarHBondContact O-N 3.13Å
504P57.1Low50.5Low129 Ų129130.8 Ų130.884%0.83880%0.797SS**PPolyproline II helixtrans-51130.4176.1-26.334000110.5
505G50.2Low50.5Low61 Ų61131.5 Ų131.563%0.62980%0.799SS**PPolyproline II helixtrans-55.9154.3179.300000111.8P503 K507P503-G505 PolarHBondContact O-N 3.13Å; G505-K507 PolarHBondContact O-N 3.24Å
506P57.2Low50.6Low132 Ų132131.1 Ų131.186%0.85780%0.798SS**PPolyproline II helixtrans-54.8136.5178.824.4-33.4000110G508P506-G508 PolarHBondContact O-N 3.09Å
507K49.2Very low50.6Low206 Ų206127.9 Ų127.990%0.89679%0.791SS**PPolyproline II helixtrans-54.8122.7176.6-177175.4-178.81740108.6G505G505-K507 PolarHBondContact O-N 3.24Å
508G45.6Very low50.6Low62 Ų62128.6 Ų128.664%0.63980%0.796SS**PPolyproline II helixtrans-51.5142-178.700000112P506P506-G508 PolarHBondContact O-N 3.09Å
509E53.9Low50.4Low184 Ų184130.2 Ų130.286%0.8680%0.795SS**PPolyproline II helixtrans-56.4141.1-179-65.6-169.9139.300110.8G511E509-G511 PolarHBondContact O-N 3.28Å; E509-G511 VanDerWaalsContact O-N 3.16Å
510P54.1Low50Low126 Ų126130.4 Ų130.482%0.81880%0.797SS**PPolyproline II helixtrans-54.1123.6173.3-22.833000109.8E512P510-E512 PolarHBondContact O-N 3.34Å
511G46.5Very low49.8Very low72 Ų72130.4 Ų130.474%0.74280%0.797SS**PPolyproline II helixtrans-53.5140.7-178.200000111.7E509 K513E509-G511 PolarHBondContact O-N 3.28Å; E509-G511 VanDerWaalsContact O-N 3.16Å; G511-K513 PolarHBondContact O-N 3.17Å
512E57.3Low50.1Low193 Ų193130.3 Ų130.390%0.90280%0.797SS**PPolyproline II helixtrans-53.8133.6-179.7-67.7-165.7140.300110.6P510 G514P510-E512 PolarHBondContact O-N 3.34Å; E512-G514 PolarHBondContact O-N 3.48Å
513K48Very low49.6Very low205 Ų205130.5 Ų130.589%0.89180%0.798SS**  trans-60.8114.2177.7-172.3179.2-166.1174.90108.2G511 T515G511-K513 PolarHBondContact O-N 3.17Å; K513-T515 PolarHBondContact O-N 3.16Å
514G45.2Very low49.9Very low69 Ų69130.6 Ų130.671%0.71180%0.799SS**PPolyproline II helixtrans-47.4136-17900000112.1E512E512-G514 PolarHBondContact O-N 3.48Å
515T47.7Very low50.3Low138 Ų138130.6 Ų130.685%0.84780%0.799SS**PPolyproline II helixtrans-59.1141179.851.80000109.9K513 G517K513-T515 PolarHBondContact O-N 3.16Å; T515-G517 PolarHBondContact O-N 3.3Å; T515-G517 VanDerWaalsContact O-N 3.15Å
516R52.5Low50.3Low235 Ų235130.7 Ų130.789%0.88780%0.8SS**PPolyproline II helixtrans-62119.4175.1-176.5178-171164.32.4107.6T518R516-T518 PolarHBondContact O-N 3.37Å
517G44.6Very low50.5Low65 Ų65130.7 Ų130.767%0.6780%0.8SS**PPolyproline II helixtrans-50.3138176.400000111.2T515T515-G517 PolarHBondContact O-N 3.3Å; T515-G517 VanDerWaalsContact O-N 3.15Å
518T47.7Very low51.2Low141 Ų141127.7 Ų127.787%0.86580%0.798SS**PPolyproline II helixtrans-59.3138178.547.60000109.5R516 G520R516-T518 PolarHBondContact O-N 3.37Å; T518-G520 PolarHBondContact O-N 2.95Å
519M43.5Very low51.5Low179 Ų179127.9 Ų127.988%0.88280%0.8SS**PPolyproline II helixtrans-60.9130.2170.4-88.1169.637.500108.4L521M519-L521 PolarHBondContact O-N 2.94Å
520G41.2Very low51.5Low71 Ų71128.4 Ų128.473%0.73280%0.803SS**PPolyproline II helixtrans-56.1137.8173.100000110.6T518T518-G520 PolarHBondContact O-N 2.95Å
521L46.3Very low51.9Low168 Ų168127.2 Ų127.288%0.8880%0.803SS**PPolyproline II helixtrans-58.3137.3176.6-74.1162.8000109.7M519 G523M519-L521 PolarHBondContact O-N 2.94Å; L521-G523 PolarHBondContact O-N 3.21Å
522P56.7Low52.1Low121 Ų121127.3 Ų127.379%0.78680%0.804SS**PPolyproline II helixtrans-52.9137171.2-2433.6000110.7
523G43Very low51.8Low63 Ų63126.3 Ų126.365%0.64980%0.804SS**PPolyproline II helixtrans-60.7150.6177.600000111.7L521L521-G523 PolarHBondContact O-N 3.21Å
524P60.1Low52.9Low122 Ų122122.1 Ų122.179%0.79280%0.798SS**PPolyproline II helixtrans-57.9143.9177.324.7-33.1000110.7G526P524-G526 PolarHBondContact O-N 3.47Å
525P64.8Low53.4Low130 Ų130122.3 Ų122.384%0.84480%0.8SS**PPolyproline II helixtrans-53.3137.9172.5-24.633.8000111
526G50.4Low53.5Low63 Ų63124.8 Ų124.865%0.64980%0.801SS**PPolyproline II helixtrans-61.7155.717800000112.2P524 V528P524-G526 PolarHBondContact O-N 3.47Å; G526-V528 PolarHBondContact O-N 3.11Å
527P62.5Low53.5Low131 Ų131120.7 Ų120.785%0.85180%0.803SS**PPolyproline II helixtrans-58.3138.717825.4-33.3000110.6G529P527-G529 PolarHBondContact O-N 3.1Å
528V62.6Low53.9Low143 Ų143121 Ų12187%0.86781%0.805SS**PPolyproline II helixtrans-61.2124175.6179.60000108.4G526G526-V528 PolarHBondContact O-N 3.11Å
529G52.1Low54Low66 Ų66124.4 Ų124.468%0.6881%0.808SS**PPolyproline II helixtrans-60.5137.4178.700000111.4P527P527-G529 PolarHBondContact O-N 3.1Å
530Q54.8Low54.3Low196 Ų196125.4 Ų125.492%0.91681%0.811SS**PPolyproline II helixtrans-58.6138.1175.8-73.5180-2.900110.7G532Q530-G532 PolarHBondContact O-N 3.18Å
531A61.5Low54.7Low100 Ų100125.4 Ų125.483%0.82681%0.811SS**PPolyproline II helixtrans-61.9133.2177.600000110.9
532G50.8Low54.8Low74 Ų74126 Ų12676%0.76381%0.814SS**PPolyproline II helixtrans-68.3142.3176.600000112.2Q530Q530-G532 PolarHBondContact O-N 3.18Å
533L51.2Low54.5Low173 Ų173126.3 Ų126.391%0.90682%0.819SS**PPolyproline II helixtrans-63.8139.6174.9-74156.4000111G535L533-G535 PolarHBondContact O-N 3.47Å
534P70.7Confident55Low116 Ų116126.5 Ų126.575%0.75382%0.821SS**PPolyproline II helixtrans-58.9130178.2-24.533.8000113.3
535G55.8Low54.4Low73 Ų73127 Ų12775%0.75382%0.824SS**PPolyproline II helixtrans-79.8139.7179.500000113.8L533L533-G535 PolarHBondContact O-N 3.47Å
536H49.8Very low53.5Low190 Ų190130.8 Ų130.888%0.8883%0.827SS**PPolyproline II helixtrans-75.4134.2-177.2-40.6-65.7000112.7G538H536-G538 PolarHBondContact O-N 3.36Å
537T53.7Low53.6Low150 Ų150131.2 Ų131.292%0.9283%0.832SS**PPolyproline II helixtrans-70.4118.9-178.6-44.30000112.5
538G52.8Low52.9Low70 Ų70132.7 Ų132.772%0.72283%0.833SS**PPolyproline II helixtrans-102.1142178.100000114.1H536H536-G538 PolarHBondContact O-N 3.36Å
539K48.7Very low52.1Low213 Ų213135.9 Ų135.993%0.92684%0.835SS**PPolyproline II helixtrans-69.9143-166.9-57177.4-178.7-179.30114.3
540Q51.1Low52.3Low201 Ų201136.1 Ų136.194%0.93984%0.837SS**PPolyproline II helixtrans-64.5134.7179.3-173.3176.6-1700112.8
541G48.7Very low52Low71 Ų71135.7 Ų135.773%0.73284%0.836SS**PPolyproline II helixtrans-98.4160.5-167.800000116.9
542L48.2Very low51.5Low180 Ų180140.1 Ų140.194%0.94284%0.839SS**PPolyproline II helixtrans-73.1139.2174.6-67.7159.8000111.5
543S52.3Low51.5Low127 Ų127139.7 Ų139.789%0.88883%0.834SS**PPolyproline II helixtrans-73.2129.1-18049.30000113.2
544G52.1Low51.4Low67 Ų67139.2 Ų139.269%0.69183%0.832SS**PPolyproline II helixtrans-99.2173.3179.500000115.4
545P48.3Very low51.1Low133 Ų133139.5 Ų139.586%0.86483%0.834SS**PPolyproline II helixtrans-75.4158.5-167.831.5-35000114.3
546K44.8Very low51.1Low209 Ų209139 Ų13991%0.90983%0.829SS**PPolyproline II helixtrans-68.9129.9-174.4-174.4177.9-179.2179.10112.4
547G52.7Low51.7Low72 Ų72136 Ų13674%0.74283%0.826SS**PPolyproline II helixtrans-88.5161.6-167.700000117.9
548D48.1Very low52.2Low163 Ų163137 Ų13787%0.87282%0.824SS**PPolyproline II helixtrans-69.7160.1-179-66.2-49.6000114.7G550D548-G550 PolarHBondContact O-N 3.26Å
549K46.5Very low52.2Low209 Ų209136.2 Ų136.291%0.90982%0.816SS**PPolyproline II helixtrans-65.1118.4-175.9-175.1-179.6-178.9-177.50111.5
550G54.7Low52.7Low71 Ų71132.1 Ų132.173%0.73281%0.811SS**PPolyproline II helixtrans-60139.1-175.500000115.2D548D548-G550 PolarHBondContact O-N 3.26Å
551E50.4Low53.1Low188 Ų188131.7 Ų131.788%0.87981%0.809SS**PPolyproline II helixtrans-58.8149.8171-61.6179.715400111.3G553E551-G553 PolarHBondContact O-N 2.07Å
552Q49.2Very low52.9Low193 Ų193131.4 Ų131.490%0.90281%0.806SS**PPolyproline II helixtrans-59.1121177.1-177.5178.5-39.100109.6L554Q552-L554 PolarHBondContact O-N 3.37Å
553G51Low53Low64 Ų64131.1 Ų131.166%0.6681%0.805SS**PPolyproline II helixtrans-54.1134.5-175.400000112.7E551E551-G553 PolarHBondContact O-N 2.07Å
554L50.9Low53.3Low163 Ų163134.8 Ų134.885%0.85381%0.805SS**PPolyproline II helixtrans-53.3144170.8-69.6165000109.9Q552 G556Q552-L554 PolarHBondContact O-N 3.37Å; L554-G556 PolarHBondContact O-N 3.09Å
555P63.7Low53Low122 Ų122134.7 Ų134.779%0.79280%0.804SS**PPolyproline II helixtrans-49.4133173.2-25.633.7000110.6
556G55.3Low53.2Low63 Ų63133.1 Ų133.165%0.64980%0.802SS**PPolyproline II helixtrans-55.6147.9-177.500000111.8L554 I558L554-G556 PolarHBondContact O-N 3.09Å; G556-I558 PolarHBondContact O-N 3.2Å
557P61.9Low53.6Low128 Ų128132.7 Ų132.783%0.83180%0.8SS**PPolyproline II helixtrans-57.2140.7177.925.5-33.4000109.7G559P557-G559 PolarHBondContact O-N 2.7Å; P557-G559 VanDerWaalsContact O-N 3.11Å
558I64.1Low53.2Low171 Ų171132.3 Ų132.388%0.87780%0.797SS**PPolyproline II helixtrans-53.3122.6172.2-66.8170.7000107.3G556G556-I558 PolarHBondContact O-N 3.2Å
559G53.8Low53.7Low53 Ų53131.8 Ų131.855%0.54679%0.793SS.*PPolyproline II helixtrans-53.1147.4-177.600000111.4P557 Q561P557-G559 PolarHBondContact O-N 2.7Å; P557-G559 VanDerWaalsContact O-N 3.11Å; G559-Q561 PolarHBondContact O-N 3.23Å
560P57.9Low54.6Low127 Ų127127.7 Ų127.783%0.82579%0.789SS**PPolyproline II helixtrans-54.8131.9-176.823.6-33.1000109.6G562P560-G562 PolarHBondContact O-N 3.05Å
561Q59.6Low54.1Low191 Ų191127.8 Ų127.889%0.89379%0.789SS**PPolyproline II helixtrans-51.8120.5175.7-175.7176.119.600108.3G559 L563G559-Q561 PolarHBondContact O-N 3.23Å; Q561-L563 PolarHBondContact O-N 3.12Å
562G46.2Very low54.4Low66 Ų66128 Ų12868%0.6879%0.79SS**PPolyproline II helixtrans-49.9128.6-174.600000110.9P560 K564P560-G562 PolarHBondContact O-N 3.05Å; G562-K564 PolarHBondContact O-N 3.22Å; G562-K564 VanDerWaalsContact O-N 3.14Å
563L50Low55Low173 Ų173128.4 Ų128.491%0.90679%0.789SS**PPolyproline II helixtrans-51.1123.3-179-68.4171.7000109.1Q561 G565Q561-L563 PolarHBondContact O-N 3.12Å; L563-G565 PolarHBondContact O-N 3.17Å
564K58.3Low54.7Low204 Ų204128.6 Ų128.689%0.88779%0.791SS**PPolyproline II helixtrans-51.6117.9174.3-173.4176.5-170.8173.70107.7G562 A566G562-K564 PolarHBondContact O-N 3.22Å; G562-K564 VanDerWaalsContact O-N 3.14Å; K564-A566 PolarHBondContact O-N 3.39Å
565G45.7Very low54.9Low65 Ų65128.2 Ų128.267%0.6779%0.788SS**PPolyproline II helixtrans-48.6138.2-173.600000111.6L563 K567L563-G565 PolarHBondContact O-N 3.17Å; G565-K567 PolarHBondContact O-N 3.39Å
566A52.9Low55.1Low101 Ų101134 Ų13484%0.83579%0.794SS**PPolyproline II helixtrans-47.8130.5178.400000109.5K564 G568K564-A566 PolarHBondContact O-N 3.39Å; A566-G568 PolarHBondContact O-N 3.26Å
567K53Low54.6Low200 Ų200134 Ų13487%0.8779%0.794SS**PPolyproline II helixtrans-57117.7175.9-179-178.4178.4-173.40107.2G565 D569G565-K567 PolarHBondContact O-N 3.39Å; K567-D569 PolarHBondContact O-N 3.33Å
568G43.9Very low54.4Low64 Ų64137.3 Ų137.366%0.6680%0.796SS**PPolyproline II helixtrans-52139.7-178.500000111.1A566A566-G568 PolarHBondContact O-N 3.26Å
569D58.4Low54.7Low151 Ų151138.3 Ų138.381%0.80780%0.796SS**PPolyproline II helixtrans-49.9141.5-178-64.6-51.3000110.8K567 G571K567-D569 PolarHBondContact O-N 3.33Å; D569-G571 PolarHBondContact O-N 3.31Å; D569-G571 VanDerWaalsContact O-N 3.1Å
570P64.5Low54.7Low124 Ų124138.3 Ų138.381%0.80580%0.797SS**PPolyproline II helixtrans-50.1123.6173.6-24.533.2000109.6Q572P570-Q572 PolarHBondContact O-N 3.02Å
571G44.5Very low54.8Low72 Ų72138.4 Ų138.474%0.74280%0.797SS**PPolyproline II helixtrans-51.2133.3-179.100000110.3D569 K573D569-G571 PolarHBondContact O-N 3.31Å; D569-G571 VanDerWaalsContact O-N 3.1Å; G571-K573 PolarHBondContact O-N 3.41Å
572Q56.5Low55.2Low193 Ų193140.6 Ų140.690%0.90280%0.797SS**PPolyproline II helixtrans-49.4131.1179.6-68.7-177.2600109.3P570 G574P570-Q572 PolarHBondContact O-N 3.02Å; Q572-G574 PolarHBondContact O-N 2.84Å
573K63Low55.6Low202 Ų202140.6 Ų140.688%0.87880%0.797SS**PPolyproline II helixtrans-50.2118177.8-171.5177.5-172.9178.50107.8G571 I575G571-K573 PolarHBondContact O-N 3.41Å; K573-I575 PolarHBondContact O-N 2.85Å
574G43.6Very low55.8Low68 Ų68140.6 Ų140.670%0.70180%0.797SS**PPolyproline II helixtrans-50.4126.1-175.100000110.3Q572 R576Q572-G574 PolarHBondContact O-N 2.84Å; G574-R576 PolarHBondContact O-N 3.09Å
575I55.8Low56.1Low155 Ų155139.8 Ų139.880%0.79580%0.797SS**PPolyproline II helixtrans-52.1130.3174.649.4171.1000108.5K573 G577K573-I575 PolarHBondContact O-N 2.85Å; I575-G577 PolarHBondContact O-N 3.1Å; I575-G577 VanDerWaalsContact O-N 3.09Å
576R67.5Low56.4Low243 Ų243139.8 Ų139.892%0.91780%0.797SS**PPolyproline II helixtrans-50.8122.8173.8179.6176.5-179.5173.1-0.3107G574 K578G574-R576 PolarHBondContact O-N 3.09Å; R576-K578 PolarHBondContact O-N 3.03Å
577G45.9Very low56.7Low63 Ų63144 Ų14465%0.64980%0.799SS**PPolyproline II helixtrans-48.8130.3-179.100000109.5I575 Q579I575-G577 PolarHBondContact O-N 3.1Å; I575-G577 VanDerWaalsContact O-N 3.09Å; G577-Q579 PolarHBondContact O-N 3.43Å
578K57.9Low56.8Low198 Ų198143.1 Ų143.186%0.86180%0.798SS**PPolyproline II helixtrans-50.7128.2175.9-63.5-174.7-179.3-175.50106.8R576 G580R576-K578 PolarHBondContact O-N 3.03Å; K578-G580 PolarHBondContact O-N 3.01Å; K578-G580 VanDerWaalsContact O-N 3.13Å
579Q69Low57Low191 Ų191143 Ų14389%0.89380%0.797SS**PPolyproline II helixtrans-49126.1174.3-178.6172.99.100107.3G577G577-Q579 PolarHBondContact O-N 3.43Å
580G53.8Low56.9Low54 Ų54142.9 Ų142.956%0.55780%0.795SS**PPolyproline II helixtrans-52.1147-177.200000110.1K578 R582K578-G580 PolarHBondContact O-N 3.01Å; K578-G580 VanDerWaalsContact O-N 3.13Å; G580-R582 PolarHBondContact O-N 3.16Å
581P61.1Low56.1Low128 Ų128142 Ų14283%0.83179%0.789SS**PPolyproline II helixtrans-51.4133.4177.123.4-32.4000108.2G583P581-G583 PolarHBondContact O-N 3.22Å; P581-G583 VanDerWaalsContact O-N 3.1Å
582R66.7Low56.3Low237 Ų237141.6 Ų141.689%0.89479%0.785SS**PPolyproline II helixtrans-50.1124.2170.6-176.1176.1-176.6170-0.2106.1G580 L584G580-R582 PolarHBondContact O-N 3.16Å; R582-L584 PolarHBondContact O-N 3.21Å
583G54.7Low55.7Low66 Ų66139.5 Ų139.568%0.6878%0.779SS**PPolyproline II helixtrans-47128-176.900000109P581 Q585P581-G583 PolarHBondContact O-N 3.22Å; P581-G583 VanDerWaalsContact O-N 3.1Å; G583-Q585 PolarHBondContact O-N 3.28Å
584L56Low55Low174 Ų174136.3 Ų136.391%0.91177%0.772SS**PPolyproline II helixtrans-50.9121.2178.2-68.2171.8000106.6R582 G586R582-L584 PolarHBondContact O-N 3.21Å; L584-G586 PolarHBondContact O-N 3.47Å; L584-G586 VanDerWaalsContact O-N 3.12Å
585Q62.9Low55.4Low187 Ų187136.4 Ų136.487%0.87477%0.766SS**PPolyproline II helixtrans-50.7123.7170.2177.1172.8-10.700106.1G583 E587G583-Q585 PolarHBondContact O-N 3.28Å; Q585-E587 PolarHBondContact O-N 3.5Å
586G53.5Low55.6Low65 Ų65134.8 Ų134.867%0.6777%0.766SS**PPolyproline II helixtrans-48.3130.5-174.500000109.4L584 Q588L584-G586 PolarHBondContact O-N 3.47Å; L584-G586 VanDerWaalsContact O-N 3.12Å; G586-Q588 PolarHBondContact O-N 3.33Å
587E58.4Low54.8Low190 Ų190125.7 Ų125.789%0.88874%0.739SS**PPolyproline II helixtrans-48.2119.7179.1-69-173.3145.200107.6Q585 G589Q585-E587 PolarHBondContact O-N 3.5Å; E587-G589 PolarHBondContact O-N 3.24Å
588Q55.2Low55.5Low180 Ų180127.6 Ų127.684%0.84174%0.739SS**PPolyproline II helixtrans-53.3119.7173.7-167.1173.2-1.800105.7G586 I590G586-Q588 PolarHBondContact O-N 3.33Å; Q588-I590 PolarHBondContact O-N 3.23Å; Q588-I590 VanDerWaalsContact O-N 3.1Å
589G49.1Very low55.4Low63 Ų63124 Ų12465%0.64973%0.729SS**PPolyproline II helixtrans-47.2124.4-171.800000109.2E587 P591E587-G589 PolarHBondContact O-N 3.24Å; G589-P591 VanDerWaalsContact O-CD 3.22Å; G589-P591 WeakPolarHBondContact O-CD 3.35Å
590I54.7Low55.3Low148 Ų148115.7 Ų115.776%0.75970%0.695SS**  trans-42.3112.9-177.9-26171000106.9Q588 G592Q588-I590 PolarHBondContact O-N 3.23Å; Q588-I590 VanDerWaalsContact O-N 3.1Å; I590-G592 PolarHBondContact O-N 3.14Å; I590-G592 VanDerWaalsContact O-N 3.09Å
591P48.1Very low55.9Low104 Ų104119.6 Ų119.668%0.67571%0.71SS**  trans-51.4125167.3-24.134.2000105.8G589 L593G589-P591 VanDerWaalsContact O-CD 3.22Å; G589-P591 WeakPolarHBondContact O-CD 3.35Å; P591-L593 PolarHBondContact O-N 2.86Å
592G48.1Very low56.4Low64 Ų64120.1 Ų120.166%0.6671%0.706SS**  trans-45.4110.5-173.100000108.5I590 D594I590-G592 PolarHBondContact O-N 3.14Å; I590-G592 VanDerWaalsContact O-N 3.09Å; G592-D594 PolarHBondContact O-N 3.49Å
593L45.5Very low56.3Low150 Ų150111 Ų11179%0.78569%0.687SS**  trans-68.399.8177-146.387.5000103.6P591 A595P591-L593 PolarHBondContact O-N 2.86Å; L593-A595 PolarHBondContact O-N 3.27Å
594D47.9Very low56.7Low135 Ų135113.8 Ų113.872%0.72269%0.685SS**  trans-60.679.3164.5-63.4-40.9000105.7G592 P596G592-D594 PolarHBondContact O-N 3.49Å; D594-P596 WeakPolarHBondContact O-CD 3.22Å
595A51.9Low56.8Low70 Ų70109.8 Ų109.858%0.57967%0.669SS**PPolyproline II helixtrans-62.1123.4177.300000106.2L593 C597L593-A595 PolarHBondContact O-N 3.27Å; A595-C597 PolarHBondContact O-N 3.29Å
596P58.9Low56.7Low121 Ų121105.8 Ų105.879%0.78665%0.654SS**PPolyproline II helixtrans-53.3128.1171.6-20.330.1000108.1D594D594-P596 WeakPolarHBondContact O-CD 3.22Å
597C51.7Low57Low52 Ų52109.1 Ų109.135%0.35166%0.663SS.*PPolyproline II helixtrans-50.5129.8179.5-66.20000108.9A595 L599 C609A595-C597 PolarHBondContact O-N 3.29Å; C597-L599 PolarHBondContact O-N 3.14Å; C597-L599 VanDerWaalsContact O-N 3.11Å; C597-C609 HydrophobicContact CB-CB 4.42Å; C597-C609 WeakPolarHBondContact CB-SG 3.32Å; C597-C609 WeakPolarHBondContact SG-CB 3.46Å; C597-C609 CovalentContact SG-SG 2.07Å; C597-C609 PolarHBondContact SG-SG 3.05Å
598P59.9Low57.3Low102 Ų102103.8 Ų103.866%0.66266%0.659SS**PPolyproline II helixtrans-59122.1177.522.7-31.1000108.7G600P598-G600 PolarHBondContact O-N 2.96Å
599L57.5Low57.4Low123 Ų12398 Ų9864%0.64464%0.638SS**BIsolated β-bridgetrans-59.7131.4173.1-75.2148.8000108.4C597 G603C597-L599 PolarHBondContact O-N 3.14Å; C597-L599 VanDerWaalsContact O-N 3.11Å; L599-G603 WeakPolarHBondContact CD2-O 3.45Å
600G66Low57.4Low17 Ų1798.5 Ų98.518%0.17564%0.643CS.*PPolyproline II helixtrans-62.5169.7170.400000111.5P598 D602 G603 L604P598-G600 PolarHBondContact O-N 2.96Å; G600-D602 PolarHBondContact O-N 3.05Å; G600-G603 PolarHBondContact O-N 2.96Å; G600-L604 PolarHBondContact N-O 2.98Å
601P66.1Low57.1Low135 Ų135103.1 Ų103.188%0.87765%0.651SS**THydrogen-bonded Turntrans-55.7-18176.623.8-33.5000113.5
602D72.1Confident57.3Low139 Ų139107.3 Ų107.374%0.74366%0.659SS**THydrogen-bonded Turntrans-963.5-179.9-45-34.8000113.7G600 L604G600-D602 PolarHBondContact O-N 3.05Å; D602-L604 PolarHBondContact O-N 3.07Å
603G63.9Low57.6Low47 Ų47110.3 Ų110.349%0.48567%0.667SS.*SBendtrans72.111.2-177.800000114.9L599 G600L599-G603 WeakPolarHBondContact CD2-O 3.45Å; G600-G603 PolarHBondContact O-N 2.96Å
604L63.9Low57.3Low123 Ų123110.2 Ų110.264%0.64467%0.666SS**  trans-104.3140.9176.7-65.7173.9000111.3G600 D602G600-L604 PolarHBondContact N-O 2.98Å; D602-L604 PolarHBondContact O-N 3.07Å
605P57.9Low57.3Low90 Ų90113.2 Ų113.258%0.58467%0.673SS**BIsolated β-bridgetrans-66.3135.1175.926-31.9000110.8
606L60.5Low57Low104 Ų104116.2 Ų116.255%0.54568%0.684SS.*  trans-62.4135.3179.9-67.7170.3000111.2G608L606-G608 PolarHBondContact O-N 3.45Å; L606-G608 VanDerWaalsContact O-N 3.09Å
607P60.6Low56.1Low134 Ų134118.7 Ų118.787%0.8769%0.685SS**THydrogen-bonded Turntrans-64.1112.5175.724.6-30.9000109.7
608G64.1Low55.7Low78 Ų78124.6 Ų124.680%0.80471%0.707SS**THydrogen-bonded Turntrans147.9-16.1-17700000114.9L606 G610L606-G608 PolarHBondContact O-N 3.45Å; L606-G608 VanDerWaalsContact O-N 3.09Å; G608-G610 PolarHBondContact O-N 3.33Å
609C57.3Low55Low59 Ų59125.5 Ų125.540%0.39971%0.711SS.*  trans-76.385.8172.1-69.90000110.6C597C597-C609 HydrophobicContact CB-CB 4.42Å; C597-C609 WeakPolarHBondContact CB-SG 3.32Å; C597-C609 WeakPolarHBondContact SG-CB 3.46Å; C597-C609 CovalentContact SG-SG 2.07Å; C597-C609 PolarHBondContact SG-SG 3.05Å
610G49.4Very low54.2Low74 Ų74125.9 Ų125.976%0.76372%0.718SS**  trans-82116.117400000112G608G608-G610 PolarHBondContact O-N 3.33Å
611W48.6Very low53.1Low244 Ų244131 Ų13192%0.92475%0.746SS**  trans-75.3128.6178-66.635.2000109.6
612K51.7Low51.8Low193 Ų193132.1 Ų132.184%0.83974%0.739SS**  trans-117.1134.7164-77.3177.2-177.2-102.50108.5L614K612-L614 PolarHBondContact O-N 3.23Å
613P54.3Low50.3Low127 Ų127131.4 Ų131.483%0.82574%0.742SS**  trans-70.5130.5-172.727.7-32.3000111.1K615P613-K615 PolarHBondContact O-N 3.08Å
614L39.7Very low49.5Very low147 Ų147133.5 Ų133.577%0.7775%0.749SS**  trans-66.9116.5175.3-13489.8000109.4K612 V616K612-L614 PolarHBondContact O-N 3.23Å; L614-V616 PolarHBondContact O-N 2.75Å
615K46.6Very low48.5Very low199 Ų199133 Ų13387%0.86576%0.756SS**  trans-70113166.4-98.7176.3174.5176.80108.6P613 Q617P613-K615 PolarHBondContact O-N 3.08Å; K615-Q617 PolarHBondContact O-N 3.27Å; K615-Q617 VanDerWaalsContact O-N 3.14Å
616V45.5Very low47.8Very low132 Ų132137.3 Ų137.380%0.877%0.773SS**  trans-59.7110.7166.7-175.40000108.3L614 H618L614-V616 PolarHBondContact O-N 2.75Å; V616-H618 PolarHBondContact O-N 2.98Å
617Q41.6Very low47Very low174 Ų174144.6 Ų144.681%0.81379%0.794SS**  trans-81.7112.2167.1-74.1-165.4-11.100108.6K615 T619K615-Q617 PolarHBondContact O-N 3.27Å; K615-Q617 VanDerWaalsContact O-N 3.14Å; Q617-T619 PolarHBondContact O-N 2.8Å
618H43.1Very low46.2Very low175 Ų175141.4 Ų141.481%0.8178%0.784SS**  trans-53.5105.6162.4-101.2-134.1000109.6V616 T620V616-H618 PolarHBondContact O-N 2.98Å; H618-T620 PolarHBondContact O-N 3.42Å
619T43.8Very low45.2Very low122 Ų122146 Ų14675%0.74879%0.79SS**  trans-80.2102.316044.40000108.4Q617 V621Q617-T619 PolarHBondContact O-N 2.8Å; T619-V621 PolarHBondContact O-N 3.46Å; T619-V621 VanDerWaalsContact O-N 3.08Å
620T42.5Very low44.8Very low131 Ų131148.6 Ų148.680%0.80481%0.806SS**  trans-60.1102.1167-49.50000109.3H618H618-T620 PolarHBondContact O-N 3.42Å
621V41.7Very low44.3Very low125 Ų125154 Ų15476%0.75881%0.813SS**  trans-89.9119.5168.3-172.20000107.8T619T619-V621 PolarHBondContact O-N 3.46Å; T619-V621 VanDerWaalsContact O-N 3.08Å
622H39.6Very low44Very low157 Ų157147.6 Ų147.673%0.72781%0.806SS**  trans-65.2124178.1-134.5-91.9000110.4S624H622-S624 PolarHBondContact ND1-OG 3.19Å; H622-S624 PolarHBondContact O-N 3.06Å
623P40.1Very low43.7Very low125 Ų125144.5 Ų144.581%0.81280%0.803SS**  trans-92.699.8177.633.6-26.7000108.9
624S46Very low43.3Very low91 Ų91144.5 Ų144.564%0.63680%0.801SS**  trans-146.116177-49.70000115H622H622-S624 PolarHBondContact ND1-OG 3.19Å; H622-S624 PolarHBondContact O-N 3.06Å
625S43.8Very low43.7Very low111 Ų111142.7 Ų142.778%0.77680%0.798SS**SBendtrans-158.499.4169.1-93.90000109.2
626L43.8Very low43.4Very low181 Ų181138.6 Ų138.695%0.94879%0.793SS**  trans164.588149.1-87.2154000107
627R44.1Very low43.7Very low258 Ų258141.3 Ų141.397%0.97480%0.799SS**  trans-79.8122.6158.6-65.3-177.7-152.3-1583.7106.2
628G43.4Very low44.1Very low66 Ų66140.5 Ų140.568%0.6880%0.799SS**  trans14696.3163.600000114.6
629L43.3Very low44.5Very low176 Ų176139.6 Ų139.692%0.92180%0.8SS**  trans93.3145.7149.3-58.1164.4000118.4
630P47.9Very low44.5Very low113 Ų113144.9 Ų144.973%0.73482%0.823SS**  trans-106.5145.6-140.336.7-28.2000115.5
631M38.7Very low44.6Very low186 Ų186145.6 Ų145.692%0.91682%0.824SS**  trans-7.4122.9149.2-61-88.5-101.800116.8
632S43.7Very low44.8Very low110 Ų110146.6 Ų146.677%0.76983%0.828SS**  trans-160.6132.1134.663.40000112.6
633V44.8Very low45Very low129 Ų129146.1 Ų146.178%0.78283%0.833SS**  trans81103.3154.4-152.20000120
634V44.7Very low45.3Very low127 Ų127147.3 Ų147.377%0.7784%0.835SS**  trans-104.6146.1148.7178.80000107.1
635P49.1Very low45.3Very low109 Ų109150.8 Ų150.871%0.70885%0.847SS**  -138.4129.3119.629.2-12.1000111
636C41.2Very low45.4Very low113 Ų113153.5 Ų153.576%0.76485%0.852SS**  54.797.583.2-78.60000115.2
637M50.9Low45.5Very low189 Ų189151.5 Ų151.593%0.93185%0.845SS**  trans-154.6113.3145.9-71.8-156.1163.600104.5
638L50.6Low45.6Very low157 Ų157143.3 Ų143.382%0.82284%0.835SS**  cis66.2122.343-130.588000114.9
639L50.3Low45.8Very low156 Ų156149.8 Ų149.882%0.81785%0.848SS**  trans91.9122.9170.8-53.8155.2000113.9
640D44.6Very low46Very low232 Ų232147.4 Ų147.4100%1.24184%0.841SS**  cis-132016.5-102.5-49.9000112.1

Retrieved 640 of 640 residues in 117.9 ms (Link to these results)