A0A087XFJ3_POEFO Loading...

Thymocyte selection-associated high mobility group box

AlphaFold DB , UniProt , Accession A0A087XFJ3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 472 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1S38.3Very low39.6Very low166 Ų166155.7 Ų155.7100%1.16186%0.855SS**  0135.60-50.80000108.8
2Y31.2Very low40.5Very low239 Ų239158.8 Ų158.894%0.93785%0.854SS**  trans57.3118.1-177.3-79.4-82.6000117.3
3S35.4Very low40.7Very low107 Ų107158.2 Ų158.275%0.74885%0.85SS**PPolyproline II helixtrans-93.3156.9172.9-52.30000110.2
4M39.2Very low41.4Very low187 Ų187156.4 Ų156.492%0.92184%0.838SS**PPolyproline II helixtrans-74.8135.3163-75.2-67.6-173.600109.8G6M4-G6 PolarHBondContact O-N 2.8Å
5N38.7Very low42Very low146 Ų146152.4 Ų152.478%0.78182%0.824SS**PPolyproline II helixtrans-74.2117.5171.6-74.29.9000109.4
6G35.5Very low42.5Very low74 Ų74150.2 Ų150.276%0.76382%0.82SS**PPolyproline II helixtrans-73126.7163.300000109.7M4M4-G6 PolarHBondContact O-N 2.8Å
7F39.2Very low42.7Very low208 Ų208151.1 Ų151.191%0.91282%0.822SS**PPolyproline II helixtrans-78.2122.7162.9-91.3-99.3000108.3
8S36.2Very low43.2Very low97 Ų97149.4 Ų149.468%0.67882%0.817SS**PPolyproline II helixtrans-83.8146.9179.746.10000112E10S8-E10 PolarHBondContact O-N 3.06Å
9D43.7Very low43.6Very low170 Ų170146.9 Ų146.991%0.90981%0.809SS**SBendtrans-79.146.8-174.4-152.3-130.6000112.7
10E51.6Low43.8Very low171 Ų171145.8 Ų145.880%0.79981%0.809SS**  trans-123.336.2-159.4-77.2-99.790.300113.9S8S8-E10 PolarHBondContact O-N 3.06Å
11D47Very low43.7Very low148 Ų148145.5 Ų145.579%0.79181%0.811SS**  trans-139.645.1174-161.8-143.9000114.4
12F50.1Low44.2Very low192 Ų192145.5 Ų145.584%0.84280%0.798SS**  trans-122.436.2168.1-88.7-72.3000113I14F12-I14 PolarHBondContact O-N 3.13Å
13N43.1Very low44.9Very low151 Ų151139 Ų13981%0.80779%0.785SS**  trans-81.683175.2-159.8-22.9000111P15N13-P15 WeakPolarHBondContact O-CD 3.38Å
14I50.2Low45Very low134 Ų134140.1 Ų140.169%0.68778%0.782SS**  trans-71.4115.4177.1-56.9174.7000108.8F12F12-I14 PolarHBondContact O-N 3.13Å
15P50.3Low44.9Very low96 Ų96139.1 Ų139.162%0.62378%0.775SS**  trans-67.5144.417928.1-34.6000111.1N13N13-P15 WeakPolarHBondContact O-CD 3.38Å
16P51Low44.7Very low117 Ų117137.6 Ų137.676%0.7677%0.771SS**  trans-63.6137.7-178.325.9-34.2000111.7T18P16-T18 PolarHBondContact O-N 2.7Å
17I46Very low44.6Very low166 Ų166140 Ų14085%0.85178%0.776SS**  trans-76.294.6-175.8-53.9173.8000109.9
18T50Low44.5Very low121 Ų121134.8 Ų134.874%0.74277%0.772SS**PPolyproline II helixtrans-69.1124.4171.2-54.40000110.3P16P16-T18 PolarHBondContact O-N 2.7Å
19P52Low44.2Very low101 Ų101137.1 Ų137.166%0.65678%0.782SS**PPolyproline II helixtrans-70.6145.9176.329.5-34.5000111.2T21P19-T21 PolarHBondContact O-N 3.34Å
20P47.7Very low43.6Very low125 Ų125137 Ų13781%0.81278%0.775SS**PPolyproline II helixtrans-68.7127.9179.728.1-34.2000111.2
21T41.8Very low42.6Very low140 Ų140133.8 Ų133.886%0.85977%0.767SS**PPolyproline II helixtrans-70.1127.1175.428.70000111.5P19P19-T21 PolarHBondContact O-N 3.34Å
22L47.3Very low41.7Very low166 Ų166134.4 Ų134.487%0.86977%0.765SS**PPolyproline II helixtrans-75.4135.2168.6-72.2165.3000109.7D24L22-D24 PolarHBondContact O-N 3.34Å; L22-D24 VanDerWaalsContact O-N 3.16Å
23P46.7Very low41Very low103 Ų103132.2 Ų132.267%0.66976%0.762SS**  trans-80.392.817331.7-32.6000110.4H25P23-H25 PolarHBondContact O-N 3.03Å; P23-H25 PolarHBondContact O-ND1 3.02Å
24D37.5Very low40.5Very low130 Ų130132 Ų13270%0.69576%0.759SS**  trans-62.9133.1162.8-160.2-56.5000109.3L22 T26L22-D24 PolarHBondContact O-N 3.34Å; L22-D24 VanDerWaalsContact O-N 3.16Å; D24-T26 PolarHBondContact OD1-N 3.14Å; D24-T26 PolarHBondContact OD1-OG1 3.32Å
25H36.8Very low39.7Very low165 Ų165130.7 Ų130.776%0.76476%0.758SS**  trans-142.652.2175.551.5-78.2000110.9P23P23-H25 PolarHBondContact O-N 3.03Å; P23-H25 PolarHBondContact O-ND1 3.02Å
26T35.9Very low38.7Very low114 Ų114132.1 Ų132.170%0.69977%0.765SS**  trans-97.378.6172.253.30000113D24D24-T26 PolarHBondContact OD1-N 3.14Å; D24-T26 PolarHBondContact OD1-OG1 3.32Å
27S32.7Very low37.7Very low125 Ų125134.4 Ų134.487%0.87477%0.765SS**  trans-164.8128.9157.1-85.90000111
28A36.1Very low36.9Very low99 Ų99135.8 Ų135.882%0.81876%0.76SS**  trans-133.2115.9-176.900000112
29V30.8Very low36Very low146 Ų146139.4 Ų139.489%0.88577%0.766SS**  trans-155.9139.3170.1-179.20000105.5
30H31Very low35.1Very low166 Ų166142.5 Ų142.577%0.76977%0.771SS**  cis-178.6165.6-20.2175.7-141.8000104.9
31V30.5Very low34.1Very low104 Ų104140 Ų14063%0.6377%0.768SS**  trans69.6131.2170.9-170.10000115.3
32E28.8Very low33.5Very low162 Ų162138.8 Ų138.876%0.75776%0.764SS**  cis-149.4168.3-14.3-125174.2165.200109.9
33N34.5Very low33.1Very low146 Ų146138.5 Ų138.578%0.78176%0.763SS**  trans-120.6108.9173.6-179.48.8000109.7
34I33.5Very low33.6Very low145 Ų145138.6 Ų138.674%0.74476%0.763SS**  trans-123.2140.8176.1-63.6-177.1000109.7
35V32.4Very low33.3Very low108 Ų108140.3 Ų140.366%0.65577%0.772SS**  trans-101.2167.1-162.8171.10000111.8
36T30.5Very low33.5Very low125 Ų125136.3 Ų136.377%0.76776%0.762SS**  trans74145.8170.716.40000116
37Q30.1Very low33.6Very low165 Ų165139.6 Ų139.677%0.77177%0.769SS**  cis-125.5146.14.1-54.5-176.54500109.3
38R29.2Very low33.7Very low196 Ų196138.7 Ų138.774%0.7477%0.769SS**  54109.368.3-130.3-116.9-77-1460.8114.9
39F29.7Very low33.7Very low197 Ų197137 Ų13786%0.86476%0.762SS**  -152.6156.7129.8-124.7-83.2000110.5
40E32.6Very low34Very low165 Ų165137 Ų13777%0.77176%0.762SS**  trans-116.5160.7-170.8-76.1-175.488.700114.2
41G27.8Very low34.2Very low73 Ų73136.5 Ų136.575%0.75376%0.764SS**  trans177.1128.5157.300000111.4
42C28.9Very low35Very low115 Ų115136.9 Ų136.978%0.77777%0.768SS**  cis-160.4121.5-3.1-159.50000113.1
43L38.8Very low35.2Very low160 Ų160134.9 Ų134.984%0.83877%0.772SS**  trans67.1160.2148.4-67.3177.6000122
44P57.4Low36Very low105 Ų105133.7 Ų133.768%0.68277%0.773SS**  trans-138.8-168.4-144.646.4-29.3000115.9
45L31.2Very low36.7Very low166 Ų166132.5 Ų132.587%0.86977%0.774SS**  trans-147.6125.8138.6-152.563.3000115.2
46S41.2Very low36.9Very low80 Ų80135.5 Ų135.556%0.55978%0.781SS**  trans-24.5157.6166.3-43.10000119.7
47H37.6Very low37.6Very low183 Ų183134.4 Ų134.485%0.84778%0.776SS**  cis-148.8169.336.8-76.586.6000115.9
48A35.4Very low37.9Very low106 Ų106132.5 Ų132.588%0.87678%0.781SS**  trans-26156.5174.600000121.1
49G35Very low38Very low65 Ų65127.1 Ų127.167%0.6779%0.787SS**  cis146.2143.9-10.300000116.2
50V37.1Very low38.3Very low145 Ų145125.3 Ų125.388%0.87979%0.785SS**  trans71.4128.2155.3-176.20000116
51L36.8Very low38.6Very low156 Ų156124 Ų12482%0.81778%0.783SS**  cis-135.9157.216.2-106.5179.6000112.2
52P46.8Very low38.9Very low111 Ų111129 Ų12972%0.72178%0.784SS**  trans-113.3171.3167.140.3-31.2000114.5
53S33.6Very low39.6Very low120 Ų120127.5 Ų127.584%0.83979%0.787SS**  trans-146.6156167.7-82.90000111.8
54P49.3Very low39.5Very low122 Ų122125.5 Ų125.579%0.79278%0.782SS**  trans-91.3165.5-160.635.4-37.5000116.7
55P49.6Very low39Very low119 Ų119127.8 Ų127.877%0.77379%0.794SS**  trans-101-176.4-175.241.1-37.6000114.8
56Q35.5Very low39.9Very low172 Ų172126.4 Ų126.480%0.80479%0.786SS**  trans120.4153.6165.6-69.9-68.814.200113.6
57P46.4Very low39.8Very low102 Ų102127.3 Ų127.366%0.66278%0.784SS**  cis-134.9-179.4-1837.8-20.1000115.2
58S35.5Very low40.5Very low124 Ų124124.1 Ų124.187%0.86778%0.778SS**  trans56.1116.3147.2-64.40000122
59G31.9Very low41.1Very low84 Ų84125.1 Ų125.187%0.86676%0.764SS**  trans-155.280.5166.700000113.1
60L36.7Very low41.6Very low158 Ų158127 Ų12783%0.82776%0.758SS**  trans-100.6119.8-174-165.1-175.2000110.6
61L38Very low42.2Very low137 Ų137126 Ų12672%0.71775%0.747SS**  trans-161129.6150.2-84.4-160.1000114.6
62K33.2Very low42.7Very low180 Ų180124.7 Ų124.778%0.78374%0.737SS**  trans57.891.8139.9-61.9171.6-174.91710120.5
63G43.9Very low42.8Very low82 Ų82121.3 Ų121.385%0.84572%0.715SS**  72.397.1110.600000120.1
64T37.4Very low43.5Very low119 Ų119118.9 Ų118.973%0.7370%0.695SS**  trans-124.2109.2161.9-570000110.2I66T64-I66 VanDerWaalsContact C-N 3.35Å; T64-I66 HydrophobicContact CG2-CG1 4.11Å; T64-I66 PolarHBondContact O-N 3.44Å
65V47.5Very low43.6Very low152 Ų152115.3 Ų115.392%0.92168%0.676SS**  trans-75.491.3165.6178.70000107.6
66I48.9Very low43.7Very low137 Ų137114.8 Ų114.870%0.70367%0.665SS**  trans-69.2135.1-176.4-24.2179.3000109.7T64 T68T64-I66 VanDerWaalsContact C-N 3.35Å; T64-I66 HydrophobicContact CG2-CG1 4.11Å; T64-I66 PolarHBondContact O-N 3.44Å; I66-T68 PolarHBondContact O-N 3.31Å
67N40Very low44.3Very low100 Ų100113.5 Ų113.554%0.53566%0.657SS.*  trans-80.294.2-160.6-162.3-32.3000112.8H69 L70N67-H69 PolarHBondContact O-N 3.49Å; N67-H69 VanDerWaalsContact O-N 3.08Å; N67-H69 WeakPolarHBondContact OD1-CB 3.31Å; N67-H69 PolarHBondContact OD1-N 2.97Å; N67-L70 HydrophobicContact CB-CB 4.41Å; N67-L70 WeakPolarHBondContact O-CB 3.12Å; N67-L70 PolarHBondContact O-N 2.9Å
68T52.7Low44.4Very low115 Ų115112.3 Ų112.371%0.70665%0.648SS**Hα-helixtrans-52.7-31.8-178.6-41.70000113.5I66 L70 L71 Q72I66-T68 PolarHBondContact O-N 3.31Å; T68-L70 VanDerWaalsContact C-N 3.3Å; T68-L70 PolarHBondContact O-N 3.47Å; T68-L71 PolarHBondContact O-N 2.59Å; T68-Q72 PolarHBondContact O-N 3.33Å
69H47.2Very low45.3Very low128 Ų128110.5 Ų110.559%0.59363%0.628SS**Hα-helixtrans-65.5-30.4177.1-176.2-115.6000112.9N67 T73N67-H69 PolarHBondContact O-N 3.49Å; N67-H69 VanDerWaalsContact O-N 3.08Å; N67-H69 WeakPolarHBondContact OD1-CB 3.31Å; N67-H69 PolarHBondContact OD1-N 2.97Å; H69-T73 WeakPolarHBondContact O-CB 3.36Å; H69-T73 WeakPolarHBondContact O-CG2 3.43Å; H69-T73 PolarHBondContact O-N 3.11Å; H69-T73 PolarHBondContact O-OG1 3.48Å
70L46.7Very low46.1Very low104 Ų104111.6 Ų111.655%0.54561%0.609SS.*Hα-helixtrans-73.9-37.9178.4-17259.1000112.1N67 T68 T73 T74N67-L70 HydrophobicContact CB-CB 4.41Å; N67-L70 WeakPolarHBondContact O-CB 3.12Å; N67-L70 PolarHBondContact O-N 2.9Å; T68-L70 VanDerWaalsContact C-N 3.3Å; T68-L70 PolarHBondContact O-N 3.47Å; L70-T73 WeakPolarHBondContact CA-OG1 3.38Å; L70-T73 PolarHBondContact O-OG1 2.72Å; L70-T74 VanDerWaalsContact O-CB 3.3Å; L70-T74 WeakPolarHBondContact O-CB 3.3Å; L70-T74 PolarHBondContact O-N 3.11Å; L70-T74 PolarHBondContact O-OG1 3.01Å
71L47.8Very low46.6Very low124 Ų124111.8 Ų111.865%0.64960%0.599SS**Hα-helixtrans-65-44173.3-88.866000110.9T68 T74 A75T68-L71 PolarHBondContact O-N 2.59Å; L71-T74 PolarHBondContact O-N 3.45Å; L71-A75 WeakPolarHBondContact O-CB 3.42Å; L71-A75 PolarHBondContact O-N 2.76Å
72Q47.3Very low47.2Very low128 Ų128109.5 Ų109.560%0.59859%0.587SS**Hα-helixtrans-69-40.3-179.2-165.816650.500112.8T68 T74 A75 I76T68-Q72 PolarHBondContact O-N 3.33Å; Q72-T74 VanDerWaalsContact C-N 3.29Å; Q72-T74 PolarHBondContact O-N 2.95Å; Q72-A75 PolarHBondContact O-N 3.19Å; Q72-I76 HydrophobicContact CG-CD1 4.27Å; Q72-I76 VanDerWaalsContact O-CG1 3.3Å; Q72-I76 WeakPolarHBondContact O-CG1 3.47Å; Q72-I76 PolarHBondContact O-N 3.45Å
73T48.9Very low48.5Very low41 Ų41103.6 Ų103.625%0.25256%0.563SS.*Hα-helixtrans-67-30.7173.3510000112.6H69 L70 K77H69-T73 WeakPolarHBondContact O-CB 3.36Å; H69-T73 WeakPolarHBondContact O-CG2 3.43Å; H69-T73 PolarHBondContact O-N 3.11Å; H69-T73 PolarHBondContact O-OG1 3.48Å; L70-T73 WeakPolarHBondContact CA-OG1 3.38Å; L70-T73 PolarHBondContact O-OG1 2.72Å; T73-K77 VanDerWaalsContact O-CG 3.32Å; T73-K77 WeakPolarHBondContact O-CG 3.45Å; T73-K77 PolarHBondContact O-N 2.72Å; T73-K77 VanDerWaalsContact O-N 3.14Å
74T49.3Very low49.3Very low69 Ų69103.7 Ų103.742%0.42354%0.541SS..Hα-helixtrans-68-47.8171.6-58.70000110.9L70 L71 Q72 I76 K77 T78L70-T74 VanDerWaalsContact O-CB 3.3Å; L70-T74 WeakPolarHBondContact O-CB 3.3Å; L70-T74 PolarHBondContact O-N 3.11Å; L70-T74 PolarHBondContact O-OG1 3.01Å; L71-T74 PolarHBondContact O-N 3.45Å; Q72-T74 VanDerWaalsContact C-N 3.29Å; Q72-T74 PolarHBondContact O-N 2.95Å; T74-I76 VanDerWaalsContact C-N 3.3Å; T74-I76 PolarHBondContact O-N 3.49Å; T74-K77 WeakPolarHBondContact O-CB 3.2Å; T74-K77 PolarHBondContact O-N 3.18Å; T74-K77 VanDerWaalsContact O-N 3.1Å; T74-T78 PolarHBondContact O-N 3.3Å; T74-T78 PolarHBondContact O-OG1 3.26Å; T74-T78 VanDerWaalsContact O-OG1 3.11Å
75A50.9Low49.8Very low47 Ų47101.9 Ų101.939%0.38853%0.525SS..Hα-helixtrans-57.5-40.6175.200000112.5L71 Q72 T78 N79L71-A75 WeakPolarHBondContact O-CB 3.42Å; L71-A75 PolarHBondContact O-N 2.76Å; Q72-A75 PolarHBondContact O-N 3.19Å; A75-T78 PolarHBondContact O-N 3.11Å; A75-N79 WeakPolarHBondContact O-CB 3.45Å; A75-N79 PolarHBondContact O-N 3.22Å; A75-N79 PolarHBondContact O-ND2 3.09Å
76I52.2Low49.9Very low107 Ų107100.1 Ų100.155%0.54951%0.508SS..Hα-helixtrans-65.2-39.4176.4-69.4164.7000111.6Q72 T74 N79 K80Q72-I76 HydrophobicContact CG-CD1 4.27Å; Q72-I76 VanDerWaalsContact O-CG1 3.3Å; Q72-I76 WeakPolarHBondContact O-CG1 3.47Å; Q72-I76 PolarHBondContact O-N 3.45Å; T74-I76 VanDerWaalsContact C-N 3.3Å; T74-I76 PolarHBondContact O-N 3.49Å; I76-N79 PolarHBondContact O-N 3.49Å; I76-K80 PolarHBondContact O-N 3.11Å
77K47.3Very low50.1Low146 Ų14698.4 Ų98.464%0.63550%0.503SS*.Hα-helixtrans-64.9-46174-72.2168.8-177.6175.60111.7T73 T74 N79 K80 W81T73-K77 VanDerWaalsContact O-CG 3.32Å; T73-K77 WeakPolarHBondContact O-CG 3.45Å; T73-K77 PolarHBondContact O-N 2.72Å; T73-K77 VanDerWaalsContact O-N 3.14Å; T74-K77 WeakPolarHBondContact O-CB 3.2Å; T74-K77 PolarHBondContact O-N 3.18Å; T74-K77 VanDerWaalsContact O-N 3.1Å; K77-N79 VanDerWaalsContact C-N 3.31Å; K77-N79 PolarHBondContact O-N 2.96Å; K77-K80 PolarHBondContact O-N 3.3Å; K77-W81 PolarHBondContact O-N 3.46Å
78T49.4Very low50.4Low77 Ų7797.8 Ų97.847%0.47250%0.5SS..Hα-helixtrans-60-40.2176-54.90000111.5T74 A75 W81 L82T74-T78 PolarHBondContact O-N 3.3Å; T74-T78 PolarHBondContact O-OG1 3.26Å; T74-T78 VanDerWaalsContact O-OG1 3.11Å; A75-T78 PolarHBondContact O-N 3.11Å; T78-W81 PolarHBondContact O-N 3.35Å; T78-L82 WeakPolarHBondContact O-CB 3.44Å; T78-L82 PolarHBondContact O-N 3.43Å
79N53.6Low49.9Very low86 Ų8694.9 Ų94.946%0.4649%0.485SS..Hα-helixtrans-66-36.8175.3-84.4-79.6000113.2A75 I76 K77 M83A75-N79 WeakPolarHBondContact O-CB 3.45Å; A75-N79 PolarHBondContact O-N 3.22Å; A75-N79 PolarHBondContact O-ND2 3.09Å; I76-N79 PolarHBondContact O-N 3.49Å; K77-N79 VanDerWaalsContact C-N 3.31Å; K77-N79 PolarHBondContact O-N 2.96Å; N79-M83 WeakPolarHBondContact O-CG 3.47Å; N79-M83 PolarHBondContact O-N 3.4Å
80K49.8Very low49.7Very low106 Ų10695.7 Ų95.746%0.46149%0.493SS..Hα-helixtrans-63.2-43.4170.2-88.2-117.7-178.7-161.70111.4I76 K77 Q84 D208I76-K80 PolarHBondContact O-N 3.11Å; K77-K80 PolarHBondContact O-N 3.3Å; K80-Q84 PolarHBondContact O-N 3.18Å; K80-Q84 VanDerWaalsContact O-N 3.09Å; K80-D208 IonicContact NZ-OD1 2.74Å; K80-D208 PolarHBondContact NZ-OD1 2.81Å; K80-D208 IonicContact NZ-OD2 2.69Å; K80-D208 PolarHBondContact NZ-OD2 3.34Å
81W45.9Very low49.6Very low162 Ų16295.7 Ų95.761%0.61450%0.502SS*.Hα-helixtrans-67.3-45-179.9-176.482.7000113K77 T78 M83 Q84 Q85K77-W81 PolarHBondContact O-N 3.46Å; T78-W81 PolarHBondContact O-N 3.35Å; W81-M83 PolarHBondContact O-N 2.92Å; W81-Q84 WeakPolarHBondContact O-CB 3.47Å; W81-Q84 PolarHBondContact O-N 3.09Å; W81-Q85 HydrophobicContact CD2-CG 4.21Å; W81-Q85 HydrophobicContact CE3-CG 4.34Å; W81-Q85 HydrophobicContact CH2-CG 4.39Å; W81-Q85 HydrophobicContact CZ2-CG 4.22Å; W81-Q85 VanDerWaalsContact CZ2-NE2 3.31Å; W81-Q85 HydrophobicContact CZ3-CG 4.43Å; W81-Q85 WeakPolarHBondContact O-CG 2.93Å; W81-Q85 PolarHBondContact O-N 3.08Å
82L50.7Low49.2Very low89 Ų8998.8 Ų98.847%0.46651%0.505SS..Hα-helixtrans-62.5-40.9179.1-176.762.2000112T78 Q85 M86T78-L82 WeakPolarHBondContact O-CB 3.44Å; T78-L82 PolarHBondContact O-N 3.43Å; L82-Q85 WeakPolarHBondContact O-CB 3.36Å; L82-Q85 PolarHBondContact O-N 3.32Å; L82-M86 HydrophobicContact CG-CE 4.48Å; L82-M86 PolarHBondContact O-N 3.13Å; L82-M86 VanDerWaalsContact O-N 3.1Å
83M60.3Low48.8Very low56 Ų56102.7 Ų102.728%0.27652%0.52SS..Hα-helixtrans-69.9-34.2174.8-72.1178.363.500112.9N79 W81 Q85 M86 V87 V243 R247N79-M83 WeakPolarHBondContact O-CG 3.47Å; N79-M83 PolarHBondContact O-N 3.4Å; W81-M83 PolarHBondContact O-N 2.92Å; M83-Q85 VanDerWaalsContact C-N 3.31Å; M83-Q85 PolarHBondContact O-N 3.31Å; M83-M86 HydrophobicContact CB-CE 4.39Å; M83-M86 HydrophobicContact CG-CE 3.81Å; M83-M86 PolarHBondContact O-N 3.11Å; M83-V87 WeakPolarHBondContact O-CG2 3.37Å; M83-V87 PolarHBondContact O-N 2.9Å; M83-V87 VanDerWaalsContact O-N 3.11Å; M83-V243 HydrophobicContact CE-CG1 4.11Å; M83-R247 PolarHBondContact SD-NH2 2.89Å
84Q60.6Low48.3Very low84 Ų84105.4 Ų105.439%0.39355%0.547SS..Hα-helixtrans-63.8-38.2172.3-168.467.373.300111.5K80 W81 N88K80-Q84 PolarHBondContact O-N 3.18Å; K80-Q84 VanDerWaalsContact O-N 3.09Å; W81-Q84 WeakPolarHBondContact O-CB 3.47Å; W81-Q84 PolarHBondContact O-N 3.09Å; Q84-N88 PolarHBondContact NE2-OD1 3.32Å; Q84-N88 VanDerWaalsContact O-CB 3.31Å; Q84-N88 WeakPolarHBondContact O-CB 3.44Å; Q84-N88 PolarHBondContact O-N 3.28Å; Q84-N88 PolarHBondContact O-OD1 3.23Å
85Q49Very low47.8Very low81 Ų81108 Ų10838%0.37957%0.567SS.*Hα-helixtrans-64.5-39.5174.9-74.5-110.271.500112.9W81 L82 M83 N88 S89W81-Q85 HydrophobicContact CD2-CG 4.21Å; W81-Q85 HydrophobicContact CE3-CG 4.34Å; W81-Q85 HydrophobicContact CH2-CG 4.39Å; W81-Q85 HydrophobicContact CZ2-CG 4.22Å; W81-Q85 VanDerWaalsContact CZ2-NE2 3.31Å; W81-Q85 HydrophobicContact CZ3-CG 4.43Å; W81-Q85 WeakPolarHBondContact O-CG 2.93Å; W81-Q85 PolarHBondContact O-N 3.08Å; L82-Q85 WeakPolarHBondContact O-CB 3.36Å; L82-Q85 PolarHBondContact O-N 3.32Å; M83-Q85 VanDerWaalsContact C-N 3.31Å; M83-Q85 PolarHBondContact O-N 3.31Å; Q85-N88 PolarHBondContact O-N 3.02Å; Q85-S89 WeakPolarHBondContact O-CB 3.4Å; Q85-S89 PolarHBondContact O-N 2.71Å; Q85-S89 VanDerWaalsContact O-N 3.11Å; Q85-S89 PolarHBondContact O-OG 2.92Å
86M48.3Very low46.8Very low116 Ų116111.2 Ų111.257%0.57159%0.588SS**Hα-helixtrans-64.8-48.9175.8-70.7-173.8-7100111.6L82 M83 N88 S89L82-M86 HydrophobicContact CG-CE 4.48Å; L82-M86 PolarHBondContact O-N 3.13Å; L82-M86 VanDerWaalsContact O-N 3.1Å; M83-M86 HydrophobicContact CB-CE 4.39Å; M83-M86 HydrophobicContact CG-CE 3.81Å; M83-M86 PolarHBondContact O-N 3.11Å; M86-N88 VanDerWaalsContact C-N 3.27Å; M86-N88 PolarHBondContact O-N 3.4Å; M86-S89 PolarHBondContact O-N 3.1Å; M86-S89 VanDerWaalsContact O-N 3.11Å
87V54.9Low45.9Very low100 Ų100114.6 Ų114.661%0.60660%0.601SS**Hα-helixtrans-59.5-37176.6173.70000112M83 S89M83-V87 WeakPolarHBondContact O-CG2 3.37Å; M83-V87 PolarHBondContact O-N 2.9Å; M83-V87 VanDerWaalsContact O-N 3.11Å; V87-S89 VanDerWaalsContact C-N 3.34Å
88N46.5Very low45.6Very low88 Ų88115.5 Ų115.547%0.47161%0.608SS.*Hα-helixtrans-79.9-10.9179.8-66.55.1000114.1Q84 Q85 M86Q84-N88 PolarHBondContact NE2-OD1 3.32Å; Q84-N88 VanDerWaalsContact O-CB 3.31Å; Q84-N88 WeakPolarHBondContact O-CB 3.44Å; Q84-N88 PolarHBondContact O-N 3.28Å; Q84-N88 PolarHBondContact O-OD1 3.23Å; Q85-N88 PolarHBondContact O-N 3.02Å; M86-N88 VanDerWaalsContact C-N 3.27Å; M86-N88 PolarHBondContact O-N 3.4Å
89S41.5Very low45.6Very low54 Ų54117.1 Ų117.138%0.37862%0.619SS.*Hα-helixtrans-89-29.7-175.6-680000113.5Q85 M86 V87 S91 R92Q85-S89 WeakPolarHBondContact O-CB 3.4Å; Q85-S89 PolarHBondContact O-N 2.71Å; Q85-S89 VanDerWaalsContact O-N 3.11Å; Q85-S89 PolarHBondContact O-OG 2.92Å; M86-S89 PolarHBondContact O-N 3.1Å; M86-S89 VanDerWaalsContact O-N 3.11Å; V87-S89 VanDerWaalsContact C-N 3.34Å; S89-S91 VanDerWaalsContact C-N 3.27Å; S89-S91 PolarHBondContact O-N 2.85Å; S89-R92 PolarHBondContact O-N 3.4Å
90D42.4Very low44.8Very low145 Ų145121.1 Ų121.178%0.77564%0.639SS**G310 helixtrans-60.6-35.8-180-156.7-113.4000112.3R92D90-R92 PolarHBondContact O-N 3.45Å
91S44.3Very low44.2Very low104 Ų104125.3 Ų125.373%0.72766%0.657SS**G310 helixtrans-72.87.9-178.9-46.90000115.8S89S89-S91 VanDerWaalsContact C-N 3.27Å; S89-S91 PolarHBondContact O-N 2.85Å
92R40.8Very low43.6Very low189 Ų189122.7 Ų122.771%0.71367%0.67SS**G310 helixtrans-105.83.5-173.5-72.8-163.8-72-175.2-5.3116.4S89 D90S89-R92 PolarHBondContact O-N 3.4Å; D90-R92 PolarHBondContact O-N 3.45Å
93F37.1Very low42.8Very low210 Ų210123.5 Ų123.592%0.92169%0.69SS**SBendtrans-111.67.1-177.1-127.9-90.4000116.1
94A39.4Very low41.7Very low97 Ų97129.6 Ų129.680%0.80272%0.722SS**SBendtrans-128.629.9-168.400000116
95S38.1Very low40.3Very low123 Ų123129.3 Ų129.386%0.8674%0.742SS**  trans-161.1108.5162.7-170.10000113.8
96S30.2Very low40.5Very low116 Ų116131.6 Ų131.681%0.81176%0.763SS**  trans-166.3118.7147.4-167.10000110.6
97Q33.3Very low39.6Very low178 Ų178137.9 Ų137.983%0.83278%0.781SS**  trans-129.8115.6164.4-88.4-163.911.700110.1
98Q41.1Very low38.7Very low165 Ų165138.5 Ų138.577%0.77179%0.79SS**  trans65.6172.7149-55.8-57.9-17.100116.7
99P48.9Very low38.3Very low110 Ų110143.7 Ų143.771%0.71481%0.811SS**  cis-125156.8-5.738.9-24.7000115.6
100I37.8Very low38Very low170 Ų170147.2 Ų147.287%0.87284%0.836SS**  trans-125.9159.1158-61.6-176.9000108.8
101K36.3Very low37.6Very low194 Ų194144.1 Ų144.184%0.84384%0.838SS**  trans-141.2140.4-14543.3-178.5168.6179.60114.4
102A33.3Very low37.2Very low108 Ų108147.6 Ų147.689%0.89385%0.848SS**  trans69.5120.2160.700000120.3
103A33.5Very low37Very low106 Ų106143.3 Ų143.388%0.87685%0.846SS**  trans-152.4132.3147.800000111.5
104L37.3Very low37.2Very low184 Ų184142 Ų14296%0.96384%0.843SS**  trans-45.8150.8-176.3-55.6161.7000118.4
105G31.8Very low37.1Very low77 Ų77145.9 Ų145.979%0.79485%0.845SS**  trans151.9120.4153.800000116.8
106P52.5Low37Very low129 Ų129147 Ų14784%0.83884%0.841SS**  trans-109.1143-175.537.7-31.4000116
107R30.7Very low37.3Very low248 Ų248149.4 Ų149.494%0.93684%0.839SS**  trans-157.7142.4147.7-161.7116.579.1166.45.6111.6
108S36.3Very low37.5Very low113 Ų113148.3 Ų148.379%0.7984%0.839SS**  trans-90.7144178.8-35.10000112.7
109Q37.8Very low37.3Very low197 Ų197146 Ų14692%0.92184%0.841SS**  trans-165.5160.6131.1-115.3-179.52.800112.6
110S35.8Very low36.9Very low128 Ų128147.6 Ų147.690%0.89585%0.849SS**  trans-86.8146.9-177.4-47.20000112.2
111G32.3Very low37.3Very low80 Ų80147.3 Ų147.383%0.82585%0.847SS**  trans-161.3129.117300000112.4
112L37.7Very low37.1Very low178 Ų178144.4 Ų144.493%0.93284%0.841SS**  trans-82.9147.4176.4-61.1160.8000110.4
113S36.6Very low37.5Very low98 Ų98147.9 Ų147.969%0.68584%0.839SS**  172133.9126-167.30000113.7
114Q41.2Very low38Very low182 Ų182147.5 Ų147.585%0.8583%0.829SS**  trans50118.2154.1-68.7179117.400122.1
115Q36.8Very low38Very low180 Ų180147.4 Ų147.484%0.84182%0.824SS**  trans-67155.4151.4-57.7158.3-8100110.4
116N36.2Very low38.4Very low145 Ų145152.3 Ų152.378%0.77583%0.831SS**  trans-144.186.6158.1-163.233.6000110.7
117Q37.2Very low37.6Very low167 Ų167149.5 Ų149.578%0.7883%0.826SS**  trans-104.1118.2177.4-67.7-75.7101.500108.6
118L37.4Very low38Very low156 Ų156146.1 Ų146.182%0.81782%0.823SS**PPolyproline II helixtrans-75.1140.3176.1-96.471.3000111.6
119S36.3Very low37.9Very low117 Ų117148.7 Ų148.782%0.81883%0.828SS**PPolyproline II helixtrans-81.5138.8-170.9-53.80000114.1I121S119-I121 PolarHBondContact O-N 3.24Å
120T39.8Very low37.6Very low143 Ų143143.2 Ų143.288%0.87782%0.824SS**PPolyproline II helixtrans-63.6126.7163.4-53.20000110.3
121I45.8Very low37.6Very low164 Ų164144.8 Ų144.884%0.84182%0.822SS**PPolyproline II helixtrans-77.4135.4174.6-157.869000110.6S119S119-I121 PolarHBondContact O-N 3.24Å
122N33.4Very low38.7Very low132 Ų132145.6 Ų145.671%0.70681%0.813SS**PPolyproline II helixtrans-87.4152.6-175.6178.9-94.8000112.7S124N122-S124 PolarHBondContact OD1-OG 3.33Å; N122-S124 VanDerWaalsContact OD1-OG 3.11Å
123Q40.9Very low38.6Very low182 Ų182143.9 Ų143.985%0.8581%0.81SS**  trans-110.1119.3174.6-173-171.7120.800109.9
124S43.7Very low39.3Very low97 Ų97144.2 Ų144.268%0.67881%0.81SS**  trans-149.7118.2168.4-660000106.4N122N122-S124 PolarHBondContact OD1-OG 3.33Å; N122-S124 VanDerWaalsContact OD1-OG 3.11Å
125Q38.4Very low39.2Very low183 Ų183144.4 Ų144.486%0.85581%0.81SS**  cis78.6117.247.3-168.8175.28.600113.9
126L40.5Very low39Very low179 Ų179141.9 Ų141.994%0.93780%0.803SS**  trans157.5139.1155.6-89.2169.5000106.6
127G35Very low39Very low71 Ų71140 Ų14073%0.73280%0.801SS**  cis-165.7159-8.400000109.6
128M39.2Very low39.6Very low176 Ų176137.7 Ų137.787%0.86780%0.8SS**  trans-91.4143.4-176.2-65-72.3-173.100112.7
129N33.6Very low39.8Very low168 Ų168135.8 Ų135.890%0.89880%0.8SS**  trans153.2137.2130.2-78.3-13.1000112.9
130G32.2Very low40.7Very low82 Ų82135.7 Ų135.785%0.84580%0.797SS**  trans155.7107.1168.900000114
131N35.8Very low41.2Very low160 Ų160134.8 Ų134.886%0.85679%0.793SS**  trans-167.2155.3-178.8-167.161000109.3
132P54.6Low40.5Very low98 Ų98130.5 Ų130.564%0.63679%0.79SS**  cis-120.8168.2-44.636.6-23.4000112.5
133V37Very low40.9Very low141 Ų141129.6 Ų129.686%0.85579%0.793SS**  trans-143.1133161.6-172.10000110.3
134P49.9Very low41Very low106 Ų106130.6 Ų130.669%0.68880%0.795SS**  trans-101.4160.6178.738.9-34.5000113.6
135H40Very low40.8Very low185 Ų185131.8 Ų131.886%0.85680%0.803SS**  trans166.9155150.7-83.4-56.5000107.5
136N33Very low40.8Very low128 Ų128128.5 Ų128.568%0.68480%0.796SS**  cis173.5107.6-32.916823.7000106
137S35.7Very low41.1Very low106 Ų106126 Ų12674%0.74179%0.788SS**  trans65.1170165.4-58.90000117.7
138P49.2Very low41.7Very low117 Ų117128.1 Ų128.176%0.7679%0.789SS**  cis-123.9171.3-6.440.1-26000115.4
139S42.3Very low41.8Very low117 Ų117125.3 Ų125.382%0.81879%0.787SS**  trans-105.3148.4155.7-50.10000109.4
140P54.9Low42.6Very low115 Ų115123 Ų12375%0.74778%0.781SS**  -156.4-161.7108.441.9-23.7000112.5
141P49.9Very low43.3Very low123 Ų123124.6 Ų124.680%0.79978%0.777SS**  cis-115.4169.6-38.517.64.2000111.8
142G32.4Very low43.4Very low75 Ų75122.8 Ų122.877%0.77378%0.776SS**  trans-85.4168.8-179.200000115.8
143S41.4Very low42.5Very low112 Ų112123.7 Ų123.778%0.78379%0.785SS**  trans-131.496.7166-80.50000112.3
144K42Very low42.7Very low203 Ų203120.7 Ų120.788%0.88378%0.775SS**  trans3.2113.7141.442.9168.8178.7-179.80116.7
145S40Very low42Very low122 Ų122124.5 Ų124.585%0.85378%0.783SS**  trans-141.4151146.4-162.60000110.2
146T39.3Very low42.1Very low114 Ų114123.9 Ų123.970%0.69978%0.78SS**  trans-101.3129.4-154.645.60000114.4
147T45.1Very low42.5Very low127 Ų127124.4 Ų124.478%0.77978%0.783SS**  trans60160.6139.560.10000120.6
148P47.9Very low42.6Very low116 Ų116126.3 Ų126.375%0.75379%0.785SS**  cis-133.5164.3-40.137.5-22.7000113.1
149S41.6Very low42.2Very low116 Ų116127.2 Ų127.281%0.81178%0.784SS**  trans-83.9152160.5-44.60000110
150P50.6Low41.9Very low120 Ų120128.2 Ų128.278%0.77978%0.78SS**  -148.8-152.684.736.3-12.8000112.6
151P46.4Very low41.1Very low116 Ų116129.4 Ų129.475%0.75378%0.78SS**  -125.6169.4-79.239.8-25.4000115.3
152S39.1Very low40.6Very low121 Ų121126 Ų12685%0.84677%0.767SS**  trans8.8129.3154.7-163.40000121.1
153S35.9Very low41.2Very low118 Ų118129.6 Ų129.683%0.82577%0.768SS**  trans-154.6159138.5-159.70000113.3
154A39.5Very low41.1Very low77 Ų77134 Ų13464%0.63677%0.773SS**  trans-26.2134.3-175.900000120.3E156A154-E156 HydrophobicContact CB-CG 4.38Å
155H36.8Very low41Very low186 Ų186132 Ų13286%0.86177%0.771SS**  trans-127.6126.9133.6179.451.2000108
156E40.8Very low40.9Very low172 Ų172133.9 Ų133.980%0.80477%0.772SS**  trans-115.7119-176.4-59.6178.1130.500109.9A154A154-E156 HydrophobicContact CB-CG 4.38Å
157D41.8Very low40.8Very low139 Ų139136 Ų13674%0.74378%0.779SS**  trans-154.9129.1139-165.8-126.6000108
158D37.4Very low40.6Very low146 Ų146133.1 Ų133.178%0.78177%0.774SS**  trans-102120.6-177.3-175.1-89.6000110.2
159N41.5Very low40.1Very low136 Ų136134.6 Ų134.673%0.72777%0.771SS**  trans-146.181.6177.3-120-53.8000110.6D161N159-D161 VanDerWaalsContact C-N 3.33Å; N159-D161 PolarHBondContact O-N 3.14Å
160D36.5Very low40.1Very low138 Ų138137.5 Ų137.574%0.73877%0.769SS**  trans-68.681.9174178.7-132000112.3G162D160-G162 VanDerWaalsContact C-N 3.26Å; D160-G162 PolarHBondContact O-N 3.1Å; D160-G162 VanDerWaalsContact O-N 3.14Å; D160-G162 VanDerWaalsContact OD2-CA 3.31Å; D160-G162 WeakPolarHBondContact OD2-CA 3.44Å; D160-G162 PolarHBondContact OD2-N 3.06Å
161D38.3Very low39.7Very low140 Ų140143 Ų14375%0.74977%0.774SS**  trans-77.284.1153.8-113.6-45.4000108.1N159 L163N159-D161 VanDerWaalsContact C-N 3.33Å; N159-D161 PolarHBondContact O-N 3.14Å; D161-L163 VanDerWaalsContact C-N 3.31Å; D161-L163 WeakPolarHBondContact O-CG 3.38Å; D161-L163 PolarHBondContact O-N 3.18Å
162G39.3Very low39.6Very low52 Ų52143 Ų14354%0.53677%0.774SS.*  trans-64.872.7-168.300000116.1D160 K164D160-G162 VanDerWaalsContact C-N 3.26Å; D160-G162 PolarHBondContact O-N 3.1Å; D160-G162 VanDerWaalsContact O-N 3.14Å; D160-G162 VanDerWaalsContact OD2-CA 3.31Å; D160-G162 WeakPolarHBondContact OD2-CA 3.44Å; D160-G162 PolarHBondContact OD2-N 3.06Å; G162-K164 VanDerWaalsContact C-N 3.32Å; G162-K164 PolarHBondContact O-N 2.99Å
163L43.9Very low39.5Very low150 Ų150141.3 Ų141.379%0.78577%0.767SS**  trans-69.479.4176.2-61.2-174.1000111.7D161 L165D161-L163 VanDerWaalsContact C-N 3.31Å; D161-L163 WeakPolarHBondContact O-CG 3.38Å; D161-L163 PolarHBondContact O-N 3.18Å; L163-L165 VanDerWaalsContact C-N 3.28Å; L163-L165 PolarHBondContact O-N 3.23Å
164K39.2Very low39.7Very low205 Ų205140.4 Ų140.489%0.89177%0.767SS**  trans-69.378.4179.4-159.370.8166.6-174.10112.1G162G162-K164 VanDerWaalsContact C-N 3.32Å; G162-K164 PolarHBondContact O-N 2.99Å
165L40.2Very low39.9Very low162 Ų162143.3 Ų143.385%0.84878%0.777SS**  trans-60.7150.2-179.9-77.9173.9000113L163 N167L163-L165 VanDerWaalsContact C-N 3.28Å; L163-L165 PolarHBondContact O-N 3.23Å; L165-N167 PolarHBondContact O-N 2.69Å
166N38.9Very low40.5Very low160 Ų160141 Ų14186%0.85677%0.771SS**  trans-92.6100.1-166.2179.467.9000111.5
167N36.3Very low40.7Very low160 Ų160140 Ų14086%0.85677%0.769SS**  trans-99.7115.6175.8-161.484000110.9L165L165-N167 PolarHBondContact O-N 2.69Å
168G40.2Very low40.8Very low65 Ų65137.9 Ų137.967%0.6777%0.765SS**  trans-146.5111.1-175.300000114.1
169E38.4Very low41.4Very low147 Ų147141.3 Ų141.369%0.68777%0.773SS**  trans-132.4120.3167.3-69.5-150.874.400112.5
170K40.7Very low41.6Very low178 Ų178143.9 Ų143.977%0.77478%0.778SS**  trans6073.4137.7-59.6163.1-175159.70119.9
171R42.1Very low42.1Very low234 Ų234142.8 Ų142.888%0.88378%0.778SS**  16132.9120.2-173.8173.2-175.6-147.7-4.6116.9
172P45Very low42.5Very low117 Ų117146 Ų14676%0.7679%0.786SS**  -155.3152.173.841.5-20.5000123.4
173A35.8Very low42.9Very low85 Ų85149.3 Ų149.370%0.70280%0.796SS**  trans78.7135142.100000122.8
174A42Very low43.3Very low100 Ų100148 Ų14883%0.82680%0.796SS**  trans60.9156.2172.400000116.3
175V43.6Very low43.8Very low137 Ų137147.7 Ų147.783%0.8380%0.795SS**  cis-127.3162.48-172.60000109.8
176D48Very low44.5Very low139 Ų139149.7 Ų149.774%0.74380%0.797SS**  trans-62.9144.4167.9-179-95.5000112.4
177I46.1Very low45.4Very low149 Ų149151.6 Ų151.676%0.76480%0.797SS**  trans-169.3124.5143.4-105.2156.1000113.2
178S43.9Very low46.2Very low95 Ų95153.8 Ų153.866%0.66480%0.799SS**  trans48.695.8149.5-60.10000120.8K180S178-K180 PolarHBondContact O-N 2.74Å
179K49.9Very low46.8Very low219 Ų219161.7 Ų161.795%0.95281%0.809SS**  trans-6794157.7-69.7173.4-179168.60111.5
180K45.8Very low47.8Very low189 Ų189162 Ų16282%0.82281%0.808SS**  trans-92.8120.9173.3-135.5166.6-169.8169.20110.9S178 K182S178-K180 PolarHBondContact O-N 2.74Å; K180-K182 PolarHBondContact O-N 3.22Å
181P46.3Very low48.5Very low115 Ų115158.7 Ų158.775%0.74780%0.799SS**  trans-68.9122.8-17626.7-33.6000111.2T183P181-T183 PolarHBondContact O-N 3.23Å; P181-T183 VanDerWaalsContact O-N 3.08Å
182K46.6Very low49.9Very low208 Ų208153.5 Ų153.590%0.90480%0.795SS**  trans-70.3103.5174.7-71-176.7-176.41790109.2K180K180-K182 PolarHBondContact O-N 3.22Å
183T47.1Very low50.9Low122 Ų122154.1 Ų154.175%0.74879%0.792SS**  trans-59.9133174.447.40000110.1P181 K185P181-T183 PolarHBondContact O-N 3.23Å; P181-T183 VanDerWaalsContact O-N 3.08Å; T183-K185 PolarHBondContact O-N 3.09Å
184P52.4Low52.7Low121 Ų121153.1 Ų153.179%0.78677%0.773SS**  trans-69106-18026.9-32.9000109K186P184-K186 PolarHBondContact O-N 2.85Å
185K50.8Low54.3Low199 Ų199149 Ų14987%0.86574%0.738SS**  trans-53.8107.5171.9-77.7-174.3174.5-1780108.3T183 K187T183-K185 PolarHBondContact O-N 3.09Å; K185-K187 PolarHBondContact O-N 3.21Å
186K53.5Low56.2Low204 Ų204148.6 Ų148.689%0.88774%0.735SS**  trans-55.3103.8170.6-71.6-179.1178.31780107.1P184 K188P184-K186 PolarHBondContact O-N 2.85Å; K186-K188 PolarHBondContact O-N 3.28Å; K186-K188 VanDerWaalsContact O-N 3.1Å
187K57.9Low58Low201 Ų201149.2 Ų149.287%0.87473%0.731SS**PPolyproline II helixtrans-55.8120.4171.2-72.6-175.8176.2-178.50106.3K185 R189K185-K187 PolarHBondContact O-N 3.21Å; K187-R189 PolarHBondContact O-N 3.33Å
188K54.1Low60Low205 Ų205144.2 Ų144.289%0.89171%0.709SS**PPolyproline II helixtrans-46.9129.3164.5-100.5-169.6171.6-1710106K186 K190K186-K188 PolarHBondContact O-N 3.28Å; K186-K188 VanDerWaalsContact O-N 3.1Å; K188-K190 PolarHBondContact O-N 3Å; K188-K190 VanDerWaalsContact O-N 3.14Å
189R52.8Low62.1Low232 Ų232141.9 Ų141.988%0.87569%0.69SS**PPolyproline II helixtrans-55.6124.9169.7-72.9-76179.2156.1-0.6105.5K187K187-R189 PolarHBondContact O-N 3.33Å
190K60.1Low64.2Low153 Ų153134.9 Ų134.967%0.66567%0.669SS**PPolyproline II helixtrans-58138.8166.4-151.776-179.9174.40106.5K188 E194K188-K190 PolarHBondContact O-N 3Å; K188-K190 VanDerWaalsContact O-N 3.14Å; K190-E194 WeakPolarHBondContact CE-OE2 3.48Å; K190-E194 WeakPolarHBondContact CG-OE2 3.3Å; K190-E194 IonicContact NZ-OE2 3.4Å
191D54.2Low66.5Low109 Ų109126.6 Ų126.658%0.58364%0.636SS**PPolyproline II helixtrans-53.7125.2-170.2-61.5-85.5000110.1N193 E194D191-N193 PolarHBondContact O-N 3.42Å; D191-E194 PolarHBondContact O-N 3.45Å
192P71.6Confident68.8Low124 Ų124125 Ų12581%0.80562%0.615SS**THydrogen-bonded Turntrans-59.3-17-166.5-2936.4000116
193N66.6Low71.1Confident131 Ų131116.5 Ų116.570%0.70158%0.584SS**THydrogen-bonded Turntrans-97.1-7.5177.8-70.212000113.9D191 P195 Y262D191-N193 PolarHBondContact O-N 3.42Å; N193-P195 WeakPolarHBondContact O-CD 3.42Å; N193-Y262 HydrophobicContact CB-CE2 4.14Å
194E72.5Confident73.3Confident64 Ų64112.5 Ų112.530%0.29956%0.558SS.*SBendtrans-68.5121.1170-170.3-170.6-168.900108.1K190 D191 V196K190-E194 WeakPolarHBondContact CE-OE2 3.48Å; K190-E194 WeakPolarHBondContact CG-OE2 3.3Å; K190-E194 IonicContact NZ-OE2 3.4Å; D191-E194 PolarHBondContact O-N 3.45Å; E194-V196 PolarHBondContact O-N 2.95Å
195P76.9Confident75.3Confident13 Ų13107.1 Ų107.18%0.08452%0.522CS..PPolyproline II helixtrans-59.2130.8176.723.2-31.6000109.4N193 Y255 Q258 L259N193-P195 WeakPolarHBondContact O-CD 3.42Å; P195-Y255 HydrophobicContact CB-CD2 4.09Å; P195-Y255 HydrophobicContact CB-CE2 4.37Å; P195-Y255 HydrophobicContact CG-CE2 4.43Å; P195-Y255 VanDerWaalsContact O-CE2 3.26Å; P195-Y255 WeakPolarHBondContact O-CE2 3.36Å; P195-Q258 HydrophobicContact CB-CB 3.9Å; P195-Q258 HydrophobicContact CG-CB 4.35Å; P195-L259 HydrophobicContact CG-CB 4.12Å; P195-L259 HydrophobicContact CG-CD1 4.24Å
196V82.8Confident77.5Confident128 Ų12899.2 Ų99.278%0.77649%0.488SS*.PPolyproline II helixtrans-80.2127-173.8-179.10000109.7E194 Y255E194-V196 PolarHBondContact O-N 2.95Å; V196-Y255 WeakPolarHBondContact O-CD2 3.32Å
197K86.2Confident79.4Confident152 Ų15297.1 Ų97.166%0.66148%0.475SS*.PPolyproline II helixtrans-49.4134.1176.8-70.9-175178.2-171.90111.1Y255K197-Y255 HydrophobicContact CB-CE2 4.28Å; K197-Y255 HydrophobicContact CG-CE2 3.75Å
198P87.6Confident81.1Confident45 Ų4590.3 Ų90.329%0.29245%0.447SS..PPolyproline II helixtrans-61.8144-179.530.4-39.4000110.4A251 K252P198-A251 HydrophobicContact CB-CB 4.14Å; P198-K252 HydrophobicContact CB-CB 4.46Å; P198-K252 HydrophobicContact CG-CB 3.96Å; P198-K252 HydrophobicContact CG-CG 4.26Å
199V89.4Confident83Confident46 Ų4681.2 Ų81.228%0.27941%0.409SS..PPolyproline II helixtrans-84.6149172-67.60000110.5A203 L204 T248V199-A203 HydrophobicContact CB-CB 3.96Å; V199-L204 HydrophobicContact CG2-CB 3.84Å; V199-L204 HydrophobicContact CG2-CD1 4.05Å; V199-L204 HydrophobicContact CG2-CG 4.16Å; V199-T248 VanDerWaalsContact O-CG2 3.25Å; V199-T248 WeakPolarHBondContact O-CG2 3.38Å; V199-T248 PolarHBondContact O-OG1 2.86Å
200S93.8Very high85Confident71 Ų7172.9 Ų72.950%0.49738%0.38SS..PPolyproline II helixtrans-61.4162.4175.865.10000111.8Y202 A203 L204 T248S200-Y202 VanDerWaalsContact C-N 3.34Å; S200-Y202 PolarHBondContact O-N 2.91Å; S200-A203 CarbonylContact O-C 3.53Å; S200-A203 PolarHBondContact O-N 2.88Å; S200-A203 WeakPolarHBondContact OG-CB 3.46Å; S200-A203 PolarHBondContact OG-N 3.26Å; S200-L204 PolarHBondContact O-N 3.35Å; S200-T248 VanDerWaalsContact C-OG1 3.31Å
201A94Very high86.6Confident16 Ų1668.5 Ų68.513%0.13237%0.372CS..Hα-helixtrans-55-48.1-176.300000112.3L204 F205 W233 K245 T248A201-L204 PolarHBondContact O-N 3.47Å; A201-F205 PolarHBondContact O-N 3.19Å; A201-W233 HydrophobicContact CB-CH2 4.08Å; A201-K245 HydrophobicContact CB-CG 4.17Å; A201-T248 WeakPolarHBondContact CA-OG1 3.42Å; A201-T248 PolarHBondContact N-OG1 2.7Å
202Y94.4Very high88.5Confident80 Ų8066.7 Ų66.731%0.31436%0.363SS..Hα-helixtrans-62.5-42.8173.8175.7-122.7000112.2S200 L204 F205 F206 V229 W233S200-Y202 VanDerWaalsContact C-N 3.34Å; S200-Y202 PolarHBondContact O-N 2.91Å; Y202-L204 VanDerWaalsContact C-N 3.27Å; Y202-L204 PolarHBondContact O-N 3.08Å; Y202-F205 HydrophobicContact CD2-CD1 4.44Å; Y202-F205 PolarHBondContact O-N 3.1Å; Y202-F206 HydrophobicContact CE1-CD2 4.45Å; Y202-F206 HydrophobicContact CE2-CD2 4.49Å; Y202-F206 AromaticContact CZ-CD2 3.98Å; Y202-F206 VanDerWaalsContact O-CB 3.24Å; Y202-F206 WeakPolarHBondContact O-CB 3.45Å; Y202-F206 PolarHBondContact O-N 2.9Å; Y202-V229 HydrophobicContact CE2-CG1 4.37Å; Y202-W233 HydrophobicContact CD2-CB 3.85Å; Y202-W233 AromaticContact CD2-CD1 3.76Å; Y202-W233 AromaticContact CD2-CD2 3.62Å; Y202-W233 HydrophobicContact CD2-CD2 3.62Å; Y202-W233 HydrophobicContact CD2-CE3 4.17Å; Y202-W233 AromaticContact CD2-CG 3.44Å; Y202-W233 HydrophobicContact CD2-CG 3.44Å; Y202-W233 VanDerWaalsContact CD2-CG 3.44Å; Y202-W233 HydrophobicContact CE2-CB 3.72Å; Y202-W233 HydrophobicContact CE2-CD2 4.42Å; Y202-W233 AromaticContact CE2-CG 3.81Å; Y202-W233 HydrophobicContact CE2-CG 3.81Å; Y202-W233 HydrophobicContact CG-CD2 4.45Å; Y202-W233 HydrophobicContact CG-CG 4.49Å
203A94.2Very high89.5Confident31 Ų3161.5 Ų61.526%0.25633%0.328SS..Hα-helixtrans-69-23.1178.400000113.5V199 S200 R207V199-A203 HydrophobicContact CB-CB 3.96Å; S200-A203 CarbonylContact O-C 3.53Å; S200-A203 PolarHBondContact O-N 2.88Å; S200-A203 WeakPolarHBondContact OG-CB 3.46Å; S200-A203 PolarHBondContact OG-N 3.26Å; A203-R207 VanDerWaalsContact O-CG 3.3Å; A203-R207 WeakPolarHBondContact O-CG 3.39Å; A203-R207 PolarHBondContact O-N 2.98Å
204L93.6Very high90.7Very high37 Ų3759.3 Ų59.319%0.19431%0.312CS..Hα-helixtrans-75.1-48.5171.9-159.6141.8000110.8V199 S200 A201 Y202 F206 R207 D208 Y244V199-L204 HydrophobicContact CG2-CB 3.84Å; V199-L204 HydrophobicContact CG2-CD1 4.05Å; V199-L204 HydrophobicContact CG2-CG 4.16Å; S200-L204 PolarHBondContact O-N 3.35Å; A201-L204 PolarHBondContact O-N 3.47Å; Y202-L204 VanDerWaalsContact C-N 3.27Å; Y202-L204 PolarHBondContact O-N 3.08Å; L204-F206 VanDerWaalsContact C-N 3.32Å; L204-F206 PolarHBondContact O-N 3.16Å; L204-R207 PolarHBondContact O-N 2.67Å; L204-D208 PolarHBondContact O-N 2.9Å; L204-Y244 HydrophobicContact CD2-CD1 3.71Å; L204-Y244 HydrophobicContact CD2-CE1 3.85Å
205F94.9Very high91.7Very high8 Ų860.1 Ų60.14%0.03533%0.33CS..Hα-helixtrans-56.8-46171.2173.6-101000111.6A201 Y202 R207 D208 T209 V229 M232 W233 L236 Y244A201-F205 PolarHBondContact O-N 3.19Å; Y202-F205 HydrophobicContact CD2-CD1 4.44Å; Y202-F205 PolarHBondContact O-N 3.1Å; F205-R207 VanDerWaalsContact C-N 3.28Å; F205-R207 PolarHBondContact O-N 2.88Å; F205-D208 PolarHBondContact O-N 3.4Å; F205-T209 WeakPolarHBondContact CD2-OG1 3.37Å; F205-T209 HydrophobicContact CE1-CG2 4.33Å; F205-T209 HydrophobicContact CE2-CG2 4.49Å; F205-T209 WeakPolarHBondContact CE2-OG1 3.29Å; F205-T209 HydrophobicContact CZ-CG2 3.98Å; F205-T209 VanDerWaalsContact CZ-OG1 3.26Å; F205-T209 WeakPolarHBondContact CZ-OG1 3.4Å; F205-T209 WeakPolarHBondContact O-CB 3.26Å; F205-T209 PolarHBondContact O-N 3.08Å; F205-T209 PolarHBondContact O-OG1 3.28Å; F205-T209 VanDerWaalsContact O-OG1 3.09Å; F205-V229 HydrophobicContact CD1-CG1 4.15Å; F205-V229 HydrophobicContact CE1-CG1 3.98Å; F205-M232 HydrophobicContact CE1-CB 4.3Å; F205-M232 HydrophobicContact CZ-CB 3.95Å; F205-W233 HydrophobicContact CB-CE3 3.72Å; F205-W233 HydrophobicContact CB-CZ3 3.78Å; F205-W233 HydrophobicContact CD1-CB 3.91Å; F205-W233 HydrophobicContact CD1-CD2 4.32Å; F205-W233 AromaticContact CD1-CE3 3.63Å; F205-W233 HydrophobicContact CD1-CE3 3.63Å; F205-W233 HydrophobicContact CD1-CG 4.47Å; F205-W233 HydrophobicContact CD2-CE3 4.3Å; F205-W233 HydrophobicContact CE1-CB 3.7Å; F205-W233 HydrophobicContact CE1-CE3 4.3Å; F205-W233 AromaticContact CG-CE3 3.61Å; F205-W233 HydrophobicContact CG-CE3 3.61Å; F205-W233 HydrophobicContact CG-CZ3 4.11Å; F205-L236 HydrophobicContact CD2-CD1 3.97Å; F205-L236 HydrophobicContact CE2-CD1 3.8Å; F205-L236 HydrophobicContact CE2-CD2 4.36Å; F205-L236 HydrophobicContact CE2-CG 4.39Å; F205-L236 HydrophobicContact CZ-CD1 4.23Å; F205-L236 HydrophobicContact CZ-CG 4.49Å; F205-Y244 HydrophobicContact CB-CD1 4.06Å; F205-Y244 HydrophobicContact CB-CD2 4.42Å; F205-Y244 HydrophobicContact CB-CE1 4.06Å; F205-Y244 HydrophobicContact CB-CE2 4.42Å; F205-Y244 HydrophobicContact CB-CG 4.27Å; F205-Y244 HydrophobicContact CD2-CD2 4.35Å; F205-Y244 HydrophobicContact CD2-CE1 4.34Å; F205-Y244 AromaticContact CD2-CE2 3.71Å; F205-Y244 HydrophobicContact CD2-CE2 3.71Å; F205-Y244 AromaticContact CD2-CZ 3.71Å
206F95.4Very high92.5Very high34 Ų3465.5 Ų65.515%0.14935%0.354CS..Hα-helixtrans-56.4-43.7-179.4-173.9-78000111.2Y202 L204 Q210 F222 V229Y202-F206 HydrophobicContact CE1-CD2 4.45Å; Y202-F206 HydrophobicContact CE2-CD2 4.49Å; Y202-F206 AromaticContact CZ-CD2 3.98Å; Y202-F206 VanDerWaalsContact O-CB 3.24Å; Y202-F206 WeakPolarHBondContact O-CB 3.45Å; Y202-F206 PolarHBondContact O-N 2.9Å; L204-F206 VanDerWaalsContact C-N 3.32Å; L204-F206 PolarHBondContact O-N 3.16Å; F206-Q210 HydrophobicContact CD1-CB 4.24Å; F206-Q210 HydrophobicContact CE1-CB 4.17Å; F206-Q210 HydrophobicContact CE1-CG 4.22Å; F206-Q210 WeakPolarHBondContact O-CA 3.45Å; F206-Q210 WeakPolarHBondContact O-CB 3.3Å; F206-Q210 PolarHBondContact O-N 3.02Å; F206-F222 AromaticContact CE1-CE2 3.96Å; F206-F222 HydrophobicContact CE1-CE2 3.96Å; F206-F222 HydrophobicContact CE1-CZ 4.11Å; F206-F222 AromaticContact CZ-CE2 3.88Å; F206-F222 HydrophobicContact CZ-CE2 3.88Å; F206-F222 AromaticContact CZ-CZ 3.77Å; F206-F222 HydrophobicContact CZ-CZ 3.77Å; F206-V229 HydrophobicContact CB-CG1 4.02Å; F206-V229 HydrophobicContact CD2-CB 4.09Å; F206-V229 HydrophobicContact CD2-CG1 3.37Å; F206-V229 HydrophobicContact CE2-CB 4.24Å; F206-V229 HydrophobicContact CE2-CG1 4.02Å; F206-V229 HydrophobicContact CG-CG1 3.88Å
207R94.3Very high92.8Very high160 Ų16063.4 Ų63.460%0.60434%0.338SS*.Hα-helixtrans-69.2-41-179.9-71.5174.969.1173.51.2113.2A203 L204 F205 A211A203-R207 VanDerWaalsContact O-CG 3.3Å; A203-R207 WeakPolarHBondContact O-CG 3.39Å; A203-R207 PolarHBondContact O-N 2.98Å; L204-R207 PolarHBondContact O-N 2.67Å; F205-R207 VanDerWaalsContact C-N 3.28Å; F205-R207 PolarHBondContact O-N 2.88Å; R207-A211 WeakPolarHBondContact O-CB 3.23Å; R207-A211 PolarHBondContact O-N 3.45Å
208D93.6Very high93.1Very high57 Ų5760.1 Ų60.131%0.30533%0.333SS..Hα-helixtrans-67-47.4176.5-85.1-6000110.9K80 L204 F205 A211 N212K80-D208 IonicContact NZ-OD1 2.74Å; K80-D208 PolarHBondContact NZ-OD1 2.81Å; K80-D208 IonicContact NZ-OD2 2.69Å; K80-D208 PolarHBondContact NZ-OD2 3.34Å; L204-D208 PolarHBondContact O-N 2.9Å; F205-D208 PolarHBondContact O-N 3.4Å; D208-A211 PolarHBondContact O-N 3.43Å; D208-N212 PolarHBondContact O-N 3.18Å
209T93.9Very high93.4Very high15 Ų1565.5 Ų65.59%0.09236%0.359CS..Hα-helixtrans-74.6-40.1-176.5-53.60000112.7F205 A211 N212 I213 V229 M232F205-T209 WeakPolarHBondContact CD2-OG1 3.37Å; F205-T209 HydrophobicContact CE1-CG2 4.33Å; F205-T209 HydrophobicContact CE2-CG2 4.49Å; F205-T209 WeakPolarHBondContact CE2-OG1 3.29Å; F205-T209 HydrophobicContact CZ-CG2 3.98Å; F205-T209 VanDerWaalsContact CZ-OG1 3.26Å; F205-T209 WeakPolarHBondContact CZ-OG1 3.4Å; F205-T209 WeakPolarHBondContact O-CB 3.26Å; F205-T209 PolarHBondContact O-N 3.08Å; F205-T209 PolarHBondContact O-OG1 3.28Å; F205-T209 VanDerWaalsContact O-OG1 3.09Å; T209-A211 VanDerWaalsContact C-N 3.29Å; T209-A211 PolarHBondContact O-N 2.99Å; T209-N212 PolarHBondContact O-N 2.86Å; T209-I213 HydrophobicContact CG2-CD1 3.84Å; T209-I213 HydrophobicContact CG2-CG1 4.42Å; T209-I213 WeakPolarHBondContact O-CG1 3.07Å; T209-I213 PolarHBondContact O-N 2.96Å; T209-V229 HydrophobicContact CG2-CG2 3.97Å; T209-M232 HydrophobicContact CG2-CE 3.86Å; T209-M232 HydrophobicContact CG2-SD 3.71Å
210Q94.6Very high93.5Very high57 Ų5764.3 Ų64.327%0.26635%0.354SS..Hα-helixtrans-58.6-42.1173.3-176.4-154.4-7.800110.8F206 K214 V225 V229F206-Q210 HydrophobicContact CD1-CB 4.24Å; F206-Q210 HydrophobicContact CE1-CB 4.17Å; F206-Q210 HydrophobicContact CE1-CG 4.22Å; F206-Q210 WeakPolarHBondContact O-CA 3.45Å; F206-Q210 WeakPolarHBondContact O-CB 3.3Å; F206-Q210 PolarHBondContact O-N 3.02Å; Q210-K214 WeakPolarHBondContact O-CB 3.46Å; Q210-K214 PolarHBondContact O-N 2.8Å; Q210-V225 HydrophobicContact CB-CG1 4.16Å; Q210-V225 HydrophobicContact CG-CG1 3.7Å; Q210-V229 HydrophobicContact CB-CG2 4.46Å
211A93.4Very high93.5Very high60 Ų6064.7 Ų64.750%0.49635%0.353SS..Hα-helixtrans-61.8-44.2177.700000111.5R207 D208 T209 K214 A215R207-A211 WeakPolarHBondContact O-CB 3.23Å; R207-A211 PolarHBondContact O-N 3.45Å; D208-A211 PolarHBondContact O-N 3.43Å; T209-A211 VanDerWaalsContact C-N 3.29Å; T209-A211 PolarHBondContact O-N 2.99Å; A211-K214 PolarHBondContact O-N 3.34Å; A211-A215 WeakPolarHBondContact O-CB 3.36Å; A211-A215 PolarHBondContact O-N 3.03Å
212N94.1Very high93.4Very high72 Ų7270 Ų7039%0.38537%0.374SS..Hα-helixtrans-65.1-48.3178.9-161.940.7000112.2D208 T209 K214 A215 Q216D208-N212 PolarHBondContact O-N 3.18Å; T209-N212 PolarHBondContact O-N 2.86Å; N212-K214 VanDerWaalsContact C-N 3.35Å; N212-K214 PolarHBondContact O-N 3.42Å; N212-A215 PolarHBondContact O-N 3.2Å; N212-Q216 WeakPolarHBondContact O-CG 3.49Å; N212-Q216 PolarHBondContact O-N 2.83Å; N212-Q216 VanDerWaalsContact O-N 3.14Å
213I93.2Very high93.5Very high14 Ų1468.1 Ų68.17%0.07238%0.378CS..Hα-helixtrans-63.1-41.5178-63.2163.2000110.8T209 A215 Q216 N217 V225 I228 V229 M232T209-I213 HydrophobicContact CG2-CD1 3.84Å; T209-I213 HydrophobicContact CG2-CG1 4.42Å; T209-I213 WeakPolarHBondContact O-CG1 3.07Å; T209-I213 PolarHBondContact O-N 2.96Å; I213-A215 VanDerWaalsContact C-N 3.33Å; I213-A215 PolarHBondContact O-N 3.03Å; I213-Q216 PolarHBondContact O-N 3.34Å; I213-N217 WeakPolarHBondContact O-CB 3.5Å; I213-N217 PolarHBondContact O-N 3.46Å; I213-V225 HydrophobicContact CB-CG1 4.04Å; I213-V225 HydrophobicContact CD1-CG1 4.26Å; I213-V225 HydrophobicContact CG2-CB 4.43Å; I213-V225 HydrophobicContact CG2-CG1 3.99Å; I213-V225 HydrophobicContact CG2-CG2 3.9Å; I213-I228 HydrophobicContact CD1-CB 4.17Å; I213-I228 HydrophobicContact CD1-CG2 3.63Å; I213-I228 HydrophobicContact CG2-CD1 4.49Å; I213-V229 HydrophobicContact CD1-CG2 3.68Å; I213-M232 HydrophobicContact CD1-SD 4.09Å
214K92.6Very high93.5Very high86 Ų8671.5 Ų71.537%0.37439%0.389SS..Hα-helixtrans-72.5-25.2-178.9-170.955.6167.9174.60113.1Q210 A211 N212 N217 P218 A220Q210-K214 WeakPolarHBondContact O-CB 3.46Å; Q210-K214 PolarHBondContact O-N 2.8Å; A211-K214 PolarHBondContact O-N 3.34Å; N212-K214 VanDerWaalsContact C-N 3.35Å; N212-K214 PolarHBondContact O-N 3.42Å; K214-N217 CarbonylContact O-C 3.45Å; K214-P218 PolarHBondContact NZ-O 3.32Å; K214-P218 WeakPolarHBondContact O-CA 3.5Å; K214-A220 PolarHBondContact NZ-O 3.39Å
215A92.7Very high93.6Very high80 Ų8069.9 Ų69.966%0.66138%0.38SS*.Hα-helixtrans-71.3-40.817000000111.9A211 N212 I213A211-A215 WeakPolarHBondContact O-CB 3.36Å; A211-A215 PolarHBondContact O-N 3.03Å; N212-A215 PolarHBondContact O-N 3.2Å; I213-A215 VanDerWaalsContact C-N 3.33Å; I213-A215 PolarHBondContact O-N 3.03Å
216Q93.4Very high93.6Very high127 Ų12770.7 Ų70.759%0.59339%0.387SS*.Hα-helixtrans-72.2-37.3175.5-65.4173.615.400112.4N212 I213 P218N212-Q216 WeakPolarHBondContact O-CG 3.49Å; N212-Q216 PolarHBondContact O-N 2.83Å; N212-Q216 VanDerWaalsContact O-N 3.14Å; I213-Q216 PolarHBondContact O-N 3.34Å; Q216-P218 WeakPolarHBondContact O-CD 3.43Å
217N89.9Confident93.6Very high83 Ų8377 Ų7744%0.44441%0.414SS..  trans-123.872-175-63.6-87.2000110.6I213 K214 N219 A220I213-N217 WeakPolarHBondContact O-CB 3.5Å; I213-N217 PolarHBondContact O-N 3.46Å; K214-N217 CarbonylContact O-C 3.45Å; N217-N219 PolarHBondContact O-N 2.74Å; N217-N219 VanDerWaalsContact O-N 3.13Å; N217-A220 HydrophobicContact CB-CB 3.82Å; N217-A220 WeakPolarHBondContact O-CB 3.29Å; N217-A220 PolarHBondContact O-N 3.06Å
218P91.6Very high93.6Very high84 Ų8473.1 Ų73.155%0.54541%0.405SS..THydrogen-bonded Turntrans-60.9-25-177.724.2-34.5000113K214 Q216K214-P218 PolarHBondContact NZ-O 3.32Å; K214-P218 WeakPolarHBondContact O-CA 3.5Å; Q216-P218 WeakPolarHBondContact O-CD 3.43Å
219N93.5Very high93.8Very high157 Ų15770.4 Ų70.484%0.8439%0.39SS*.THydrogen-bonded Turntrans-82.6-18.7177.8-65.2-16.2000114N217N217-N219 PolarHBondContact O-N 2.74Å; N217-N219 VanDerWaalsContact O-N 3.13Å
220A91.5Very high93.8Very high21 Ų2171.1 Ų71.117%0.17440%0.398CS..  trans-64.2137-176.800000112K214 N217 V225K214-A220 PolarHBondContact NZ-O 3.39Å; N217-A220 HydrophobicContact CB-CB 3.82Å; N217-A220 WeakPolarHBondContact O-CB 3.29Å; N217-A220 PolarHBondContact O-N 3.06Å; A220-V225 HydrophobicContact CB-CG2 3.93Å
221T95.3Very high93.9Very high79 Ų7972.4 Ų72.449%0.48541%0.413SS..  trans-71.2158.2178.270.20000111.3G223 E224 V225T221-G223 PolarHBondContact O-N 3.09Å; T221-E224 WeakPolarHBondContact CA-OE2 3.49Å; T221-E224 WeakPolarHBondContact CB-OE2 3.47Å; T221-E224 VanDerWaalsContact CG2-OE2 3.3Å; T221-E224 WeakPolarHBondContact CG2-OE2 3.43Å; T221-E224 PolarHBondContact N-OE2 3.34Å; T221-E224 PolarHBondContact O-N 3.33Å; T221-E224 VanDerWaalsContact OG1-CD 3.29Å; T221-E224 WeakPolarHBondContact OG1-CG 3.38Å; T221-E224 PolarHBondContact OG1-N 3.38Å; T221-E224 PolarHBondContact OG1-OE2 2.83Å; T221-V225 WeakPolarHBondContact O-CG2 3.3Å; T221-V225 PolarHBondContact O-N 3.41Å; T221-V225 VanDerWaalsContact O-N 3.13Å
222F91.5Very high94Very high129 Ų12973.9 Ų73.957%0.56641%0.411SS*.Hα-helixtrans-58.6-32.4175.5179.9-99.3000112.5F206 S226F206-F222 AromaticContact CE1-CE2 3.96Å; F206-F222 HydrophobicContact CE1-CE2 3.96Å; F206-F222 HydrophobicContact CE1-CZ 4.11Å; F206-F222 AromaticContact CZ-CE2 3.88Å; F206-F222 HydrophobicContact CZ-CE2 3.88Å; F206-F222 AromaticContact CZ-CZ 3.77Å; F206-F222 HydrophobicContact CZ-CZ 3.77Å; F222-S226 WeakPolarHBondContact CE1-OG 3.43Å; F222-S226 WeakPolarHBondContact CZ-OG 3.22Å; F222-S226 VanDerWaalsContact O-CB 3.29Å; F222-S226 WeakPolarHBondContact O-CB 3.48Å; F222-S226 PolarHBondContact O-N 2.99Å; F222-S226 PolarHBondContact O-OG 3.05Å
223G95.8Very high94.1Very high40 Ų4072.3 Ų72.341%0.41240%0.4SS..Hα-helixtrans-68.3-41.7178.800000113.1T221 S226 K227T221-G223 PolarHBondContact O-N 3.09Å; G223-S226 PolarHBondContact O-N 3.14Å; G223-K227 WeakPolarHBondContact O-CG 3.42Å; G223-K227 PolarHBondContact O-N 2.83Å; G223-K227 VanDerWaalsContact O-N 3.16Å
224E95.1Very high94.3Very high102 Ų10276.7 Ų76.748%0.47742%0.423SS..Hα-helixtrans-66.1-48.6176.2-68.3154.9134.600110.9T221 S226 K227 I228T221-E224 WeakPolarHBondContact CA-OE2 3.49Å; T221-E224 WeakPolarHBondContact CB-OE2 3.47Å; T221-E224 VanDerWaalsContact CG2-OE2 3.3Å; T221-E224 WeakPolarHBondContact CG2-OE2 3.43Å; T221-E224 PolarHBondContact N-OE2 3.34Å; T221-E224 PolarHBondContact O-N 3.33Å; T221-E224 VanDerWaalsContact OG1-CD 3.29Å; T221-E224 WeakPolarHBondContact OG1-CG 3.38Å; T221-E224 PolarHBondContact OG1-N 3.38Å; T221-E224 PolarHBondContact OG1-OE2 2.83Å; E224-S226 VanDerWaalsContact C-N 3.29Å; E224-S226 PolarHBondContact O-N 3.04Å; E224-K227 PolarHBondContact O-N 2.79Å; E224-I228 WeakPolarHBondContact O-CG1 3.49Å; E224-I228 PolarHBondContact O-N 2.75Å; E224-I228 VanDerWaalsContact O-N 3.09Å
225V94.8Very high94.4Very high2 Ų275.9 Ų75.91%0.01244%0.44CS..Hα-helixtrans-59.5-40.8176.8-179.10000111Q210 I213 A220 T221 K227 I228 V229Q210-V225 HydrophobicContact CB-CG1 4.16Å; Q210-V225 HydrophobicContact CG-CG1 3.7Å; I213-V225 HydrophobicContact CB-CG1 4.04Å; I213-V225 HydrophobicContact CD1-CG1 4.26Å; I213-V225 HydrophobicContact CG2-CB 4.43Å; I213-V225 HydrophobicContact CG2-CG1 3.99Å; I213-V225 HydrophobicContact CG2-CG2 3.9Å; A220-V225 HydrophobicContact CB-CG2 3.93Å; T221-V225 WeakPolarHBondContact O-CG2 3.3Å; T221-V225 PolarHBondContact O-N 3.41Å; T221-V225 VanDerWaalsContact O-N 3.13Å; V225-K227 PolarHBondContact O-N 3.02Å; V225-I228 PolarHBondContact O-N 2.93Å; V225-V229 HydrophobicContact CG1-CG2 4.13Å; V225-V229 WeakPolarHBondContact O-CB 3.42Å; V225-V229 VanDerWaalsContact O-CG2 3.23Å; V225-V229 WeakPolarHBondContact O-CG2 3.24Å; V225-V229 PolarHBondContact O-N 3.39Å
226S95.3Very high94.5Very high26 Ų2673.6 Ų73.618%0.18242%0.416CS..Hα-helixtrans-62.1-39.4178-60.50000112.9F222 G223 E224 A230F222-S226 WeakPolarHBondContact CE1-OG 3.43Å; F222-S226 WeakPolarHBondContact CZ-OG 3.22Å; F222-S226 VanDerWaalsContact O-CB 3.29Å; F222-S226 WeakPolarHBondContact O-CB 3.48Å; F222-S226 PolarHBondContact O-N 2.99Å; F222-S226 PolarHBondContact O-OG 3.05Å; G223-S226 PolarHBondContact O-N 3.14Å; E224-S226 VanDerWaalsContact C-N 3.29Å; E224-S226 PolarHBondContact O-N 3.04Å; S226-A230 WeakPolarHBondContact O-CB 3.23Å; S226-A230 PolarHBondContact O-N 3.38Å
227K96.1Very high94.7Very high165 Ų16569.3 Ų69.372%0.71741%0.406SS*.Hα-helixtrans-65.9-43.7176.2-72.3176178.6-174.60111.9G223 E224 V225 A230 S231G223-K227 WeakPolarHBondContact O-CG 3.42Å; G223-K227 PolarHBondContact O-N 2.83Å; G223-K227 VanDerWaalsContact O-N 3.16Å; E224-K227 PolarHBondContact O-N 2.79Å; V225-K227 PolarHBondContact O-N 3.02Å; K227-A230 PolarHBondContact O-N 3.35Å; K227-S231 PolarHBondContact O-N 3.21Å; K227-S231 VanDerWaalsContact O-N 3.08Å
228I94.8Very high94.9Very high79 Ų7970 Ų7041%0.40541%0.406SS..Hα-helixtrans-62.6-46.4177.3-61.9163000109.8I213 E224 V225 A230 S231 M232I213-I228 HydrophobicContact CD1-CB 4.17Å; I213-I228 HydrophobicContact CD1-CG2 3.63Å; I213-I228 HydrophobicContact CG2-CD1 4.49Å; E224-I228 WeakPolarHBondContact O-CG1 3.49Å; E224-I228 PolarHBondContact O-N 2.75Å; E224-I228 VanDerWaalsContact O-N 3.09Å; V225-I228 PolarHBondContact O-N 2.93Å; I228-A230 PolarHBondContact O-N 3.38Å; I228-S231 PolarHBondContact O-N 3.25Å; I228-M232 HydrophobicContact CG2-CG 4.3Å; I228-M232 HydrophobicContact CG2-SD 3.97Å; I228-M232 WeakPolarHBondContact O-CB 3.33Å; I228-M232 VanDerWaalsContact O-CG 3.29Å; I228-M232 WeakPolarHBondContact O-CG 3.5Å; I228-M232 PolarHBondContact O-N 2.84Å
229V96.1Very high95.1Very high0 Ų073.7 Ų73.70%042%0.416CS..Hα-helixtrans-62.5-40.2178.7172.60000112.4Y202 F205 F206 T209 Q210 I213 V225 M232 W233Y202-V229 HydrophobicContact CE2-CG1 4.37Å; F205-V229 HydrophobicContact CD1-CG1 4.15Å; F205-V229 HydrophobicContact CE1-CG1 3.98Å; F206-V229 HydrophobicContact CB-CG1 4.02Å; F206-V229 HydrophobicContact CD2-CB 4.09Å; F206-V229 HydrophobicContact CD2-CG1 3.37Å; F206-V229 HydrophobicContact CE2-CB 4.24Å; F206-V229 HydrophobicContact CE2-CG1 4.02Å; F206-V229 HydrophobicContact CG-CG1 3.88Å; T209-V229 HydrophobicContact CG2-CG2 3.97Å; Q210-V229 HydrophobicContact CB-CG2 4.46Å; I213-V229 HydrophobicContact CD1-CG2 3.68Å; V225-V229 HydrophobicContact CG1-CG2 4.13Å; V225-V229 WeakPolarHBondContact O-CB 3.42Å; V225-V229 VanDerWaalsContact O-CG2 3.23Å; V225-V229 WeakPolarHBondContact O-CG2 3.24Å; V225-V229 PolarHBondContact O-N 3.39Å; V229-M232 PolarHBondContact O-N 2.93Å; V229-W233 WeakPolarHBondContact O-CB 2.94Å; V229-W233 PolarHBondContact O-N 3.05Å
230A95.9Very high95.1Very high30 Ų3070.9 Ų70.925%0.24840%0.398CS..Hα-helixtrans-60.8-53.7174.700000111S226 K227 I228 M232 W233 D234S226-A230 WeakPolarHBondContact O-CB 3.23Å; S226-A230 PolarHBondContact O-N 3.38Å; K227-A230 PolarHBondContact O-N 3.35Å; I228-A230 PolarHBondContact O-N 3.38Å; A230-M232 VanDerWaalsContact C-N 3.29Å; A230-M232 PolarHBondContact O-N 3.22Å; A230-W233 WeakPolarHBondContact O-CB 3.21Å; A230-W233 PolarHBondContact O-N 2.92Å; A230-D234 PolarHBondContact O-N 3.17Å
231S96.7Very high95.2Very high85 Ų8571.6 Ų71.659%0.59440%0.397SS*.Hα-helixtrans-58.2-38.1178176.80000113.2K227 I228 G235K227-S231 PolarHBondContact O-N 3.21Å; K227-S231 VanDerWaalsContact O-N 3.08Å; I228-S231 PolarHBondContact O-N 3.25Å; S231-G235 PolarHBondContact O-N 2.89Å; S231-G235 VanDerWaalsContact O-N 3.09Å
232M95.3Very high95.2Very high90 Ų9072.3 Ų72.344%0.44340%0.395SS..Hα-helixtrans-67.1-37.9173.9-72.5-179.372.700112.7F205 T209 I213 I228 V229 A230 L236F205-M232 HydrophobicContact CE1-CB 4.3Å; F205-M232 HydrophobicContact CZ-CB 3.95Å; T209-M232 HydrophobicContact CG2-CE 3.86Å; T209-M232 HydrophobicContact CG2-SD 3.71Å; I213-M232 HydrophobicContact CD1-SD 4.09Å; I228-M232 HydrophobicContact CG2-CG 4.3Å; I228-M232 HydrophobicContact CG2-SD 3.97Å; I228-M232 WeakPolarHBondContact O-CB 3.33Å; I228-M232 VanDerWaalsContact O-CG 3.29Å; I228-M232 WeakPolarHBondContact O-CG 3.5Å; I228-M232 PolarHBondContact O-N 2.84Å; V229-M232 PolarHBondContact O-N 2.93Å; A230-M232 VanDerWaalsContact C-N 3.29Å; A230-M232 PolarHBondContact O-N 3.22Å; M232-L236 WeakPolarHBondContact O-CG 3.43Å; M232-L236 PolarHBondContact O-N 3.25Å
233W95.7Very high95.4Very high39 Ų3968.7 Ų68.715%0.14838%0.384CS..Hα-helixtrans-66.2-45.8175.9173.1-100000111.4A201 Y202 F205 V229 A230 G235 L236 K241 Y244A201-W233 HydrophobicContact CB-CH2 4.08Å; Y202-W233 HydrophobicContact CD2-CB 3.85Å; Y202-W233 AromaticContact CD2-CD1 3.76Å; Y202-W233 AromaticContact CD2-CD2 3.62Å; Y202-W233 HydrophobicContact CD2-CD2 3.62Å; Y202-W233 HydrophobicContact CD2-CE3 4.17Å; Y202-W233 AromaticContact CD2-CG 3.44Å; Y202-W233 HydrophobicContact CD2-CG 3.44Å; Y202-W233 VanDerWaalsContact CD2-CG 3.44Å; Y202-W233 HydrophobicContact CE2-CB 3.72Å; Y202-W233 HydrophobicContact CE2-CD2 4.42Å; Y202-W233 AromaticContact CE2-CG 3.81Å; Y202-W233 HydrophobicContact CE2-CG 3.81Å; Y202-W233 HydrophobicContact CG-CD2 4.45Å; Y202-W233 HydrophobicContact CG-CG 4.49Å; F205-W233 HydrophobicContact CB-CE3 3.72Å; F205-W233 HydrophobicContact CB-CZ3 3.78Å; F205-W233 HydrophobicContact CD1-CB 3.91Å; F205-W233 HydrophobicContact CD1-CD2 4.32Å; F205-W233 AromaticContact CD1-CE3 3.63Å; F205-W233 HydrophobicContact CD1-CE3 3.63Å; F205-W233 HydrophobicContact CD1-CG 4.47Å; F205-W233 HydrophobicContact CD2-CE3 4.3Å; F205-W233 HydrophobicContact CE1-CB 3.7Å; F205-W233 HydrophobicContact CE1-CE3 4.3Å; F205-W233 AromaticContact CG-CE3 3.61Å; F205-W233 HydrophobicContact CG-CE3 3.61Å; F205-W233 HydrophobicContact CG-CZ3 4.11Å; V229-W233 WeakPolarHBondContact O-CB 2.94Å; V229-W233 PolarHBondContact O-N 3.05Å; A230-W233 WeakPolarHBondContact O-CB 3.21Å; A230-W233 PolarHBondContact O-N 2.92Å; W233-G235 VanDerWaalsContact C-N 3.27Å; W233-G235 PolarHBondContact O-N 3.25Å; W233-L236 HydrophobicContact CE3-CD1 3.7Å; W233-L236 HydrophobicContact CZ3-CD1 4.04Å; W233-L236 WeakPolarHBondContact O-CB 3.38Å; W233-L236 PolarHBondContact O-N 3.02Å; W233-K241 HydrophobicContact CH2-CB 4.28Å; W233-K241 HydrophobicContact CH2-CG 4.06Å; W233-K241 HydrophobicContact CZ2-CG 4.07Å; W233-K241 HydrophobicContact CZ3-CG 4.35Å; W233-K241 WeakPolarHBondContact O-CE 3.42Å; W233-K241 PolarHBondContact O-NZ 3.44Å; W233-Y244 HydrophobicContact CZ3-CD2 4.06Å; W233-Y244 HydrophobicContact CZ3-CG 4.17Å
234D96.4Very high95.4Very high107 Ų10768.3 Ų68.357%0.57237%0.37SS*.Hα-helixtrans-61.1-41.2179.9-61.7-30.7000110.5A230 L236 K241A230-D234 PolarHBondContact O-N 3.17Å; D234-L236 VanDerWaalsContact C-N 3.33Å; D234-L236 PolarHBondContact O-N 3.4Å; D234-K241 PolarHBondContact O-NZ 2.77Å
235G95.8Very high95.3Very high69 Ų6967.5 Ų67.571%0.71137%0.365SS*.THydrogen-bonded Turntrans-72.6-6.5173.900000116.9S231 W233S231-G235 PolarHBondContact O-N 2.89Å; S231-G235 VanDerWaalsContact O-N 3.09Å; W233-G235 VanDerWaalsContact C-N 3.27Å; W233-G235 PolarHBondContact O-N 3.25Å
236L94.6Very high95.3Very high32 Ų3274.4 Ų74.417%0.16840%0.395CS..SBendtrans-67.9140.2172.8-69-175000111F205 M232 W233 D234 Q240 K241 Y244F205-L236 HydrophobicContact CD2-CD1 3.97Å; F205-L236 HydrophobicContact CE2-CD1 3.8Å; F205-L236 HydrophobicContact CE2-CD2 4.36Å; F205-L236 HydrophobicContact CE2-CG 4.39Å; F205-L236 HydrophobicContact CZ-CD1 4.23Å; F205-L236 HydrophobicContact CZ-CG 4.49Å; M232-L236 WeakPolarHBondContact O-CG 3.43Å; M232-L236 PolarHBondContact O-N 3.25Å; W233-L236 HydrophobicContact CE3-CD1 3.7Å; W233-L236 HydrophobicContact CZ3-CD1 4.04Å; W233-L236 WeakPolarHBondContact O-CB 3.38Å; W233-L236 PolarHBondContact O-N 3.02Å; D234-L236 VanDerWaalsContact C-N 3.33Å; D234-L236 PolarHBondContact O-N 3.4Å; L236-Q240 HydrophobicContact CB-CB 4.18Å; L236-Q240 HydrophobicContact CD1-CB 4.34Å; L236-Q240 HydrophobicContact CD2-CB 4.35Å; L236-K241 HydrophobicContact CB-CD 4.41Å; L236-K241 HydrophobicContact CB-CG 3.96Å; L236-K241 HydrophobicContact CD1-CG 4.5Å; L236-K241 VanDerWaalsContact O-CE 3.22Å; L236-K241 WeakPolarHBondContact O-CE 3.35Å; L236-K241 PolarHBondContact O-NZ 3.03Å; L236-Y244 HydrophobicContact CD1-CD2 4.31Å; L236-Y244 HydrophobicContact CD1-CE2 4.24Å
237G96.4Very high95.2Very high37 Ų3776.3 Ų76.338%0.38140%0.398SS..  trans-64.1154.7168.600000111.8E239 Q240 K241G237-E239 VanDerWaalsContact C-N 3.27Å; G237-E239 PolarHBondContact O-N 2.81Å; G237-Q240 WeakPolarHBondContact O-CB 3.4Å; G237-Q240 PolarHBondContact O-N 3.23Å; G237-K241 PolarHBondContact O-N 3.29Å
238E95.2Very high95.1Very high97 Ų9769.6 Ų69.645%0.45337%0.371SS..Hα-helixtrans-62.5-32.9-176.7178.754.4-16200112.3Q240 K241 Q242 K245E238-Q240 VanDerWaalsContact C-N 3.33Å; E238-Q240 PolarHBondContact O-N 3Å; E238-K241 CarbonylContact O-C 3.57Å; E238-K241 PolarHBondContact O-N 2.91Å; E238-Q242 HydrophobicContact CG-CG 4.26Å; E238-Q242 WeakPolarHBondContact O-CB 3.35Å; E238-Q242 VanDerWaalsContact O-CG 3.22Å; E238-Q242 WeakPolarHBondContact O-CG 3.43Å; E238-Q242 PolarHBondContact O-N 2.91Å; E238-Q242 WeakPolarHBondContact OE1-CG 3.4Å; E238-Q242 PolarHBondContact OE1-NE2 2.75Å; E238-K245 IonicContact OE1-NZ 2.62Å; E238-K245 PolarHBondContact OE1-NZ 3.28Å; E238-K245 IonicContact OE2-NZ 2.75Å; E238-K245 PolarHBondContact OE2-NZ 2.95Å
239E95.4Very high95Very high161 Ų16170.1 Ų70.175%0.75237%0.372SS*.Hα-helixtrans-56.4-45.9171.2-175.4-172.4-162.800112.1G237 Q242 V243G237-E239 VanDerWaalsContact C-N 3.27Å; G237-E239 PolarHBondContact O-N 2.81Å; E239-Q242 WeakPolarHBondContact O-CB 3.22Å; E239-Q242 PolarHBondContact O-N 3.33Å; E239-V243 WeakPolarHBondContact O-CG2 3.26Å; E239-V243 PolarHBondContact O-N 2.94Å
240Q94.2Very high95Very high98 Ų9874 Ų7446%0.45840%0.396SS..Hα-helixtrans-66.4-42.2179.3-63.1164.6-21.600110.4L236 G237 E238 Q242 V243 Y244L236-Q240 HydrophobicContact CB-CB 4.18Å; L236-Q240 HydrophobicContact CD1-CB 4.34Å; L236-Q240 HydrophobicContact CD2-CB 4.35Å; G237-Q240 WeakPolarHBondContact O-CB 3.4Å; G237-Q240 PolarHBondContact O-N 3.23Å; E238-Q240 VanDerWaalsContact C-N 3.33Å; E238-Q240 PolarHBondContact O-N 3Å; Q240-Q242 VanDerWaalsContact C-N 3.31Å; Q240-Q242 PolarHBondContact O-N 3.48Å; Q240-V243 PolarHBondContact O-N 3.35Å; Q240-Y244 VanDerWaalsContact O-CD2 3.23Å; Q240-Y244 WeakPolarHBondContact O-CD2 3.15Å; Q240-Y244 PolarHBondContact O-N 3.47Å
241K93.7Very high94.8Very high37 Ų3774.5 Ų74.516%0.16140%0.399CS..Hα-helixtrans-59.7-39.7171.8-71.3165.1170.9149.30111.3W233 D234 L236 G237 E238 Y244 K245W233-K241 HydrophobicContact CH2-CB 4.28Å; W233-K241 HydrophobicContact CH2-CG 4.06Å; W233-K241 HydrophobicContact CZ2-CG 4.07Å; W233-K241 HydrophobicContact CZ3-CG 4.35Å; W233-K241 WeakPolarHBondContact O-CE 3.42Å; W233-K241 PolarHBondContact O-NZ 3.44Å; D234-K241 PolarHBondContact O-NZ 2.77Å; L236-K241 HydrophobicContact CB-CD 4.41Å; L236-K241 HydrophobicContact CB-CG 3.96Å; L236-K241 HydrophobicContact CD1-CG 4.5Å; L236-K241 VanDerWaalsContact O-CE 3.22Å; L236-K241 WeakPolarHBondContact O-CE 3.35Å; L236-K241 PolarHBondContact O-NZ 3.03Å; G237-K241 PolarHBondContact O-N 3.29Å; E238-K241 CarbonylContact O-C 3.57Å; E238-K241 PolarHBondContact O-N 2.91Å; K241-Y244 PolarHBondContact O-N 3.32Å; K241-K245 WeakPolarHBondContact O-CG 3.42Å; K241-K245 PolarHBondContact O-N 3.27Å
242Q95.5Very high94.5Very high93 Ų9376.4 Ų76.444%0.43540%0.397SS..Hα-helixtrans-66-37.1175.3-72.5-69-10.100113.2E238 E239 Q240 Y244 K245 K246E238-Q242 HydrophobicContact CG-CG 4.26Å; E238-Q242 WeakPolarHBondContact O-CB 3.35Å; E238-Q242 VanDerWaalsContact O-CG 3.22Å; E238-Q242 WeakPolarHBondContact O-CG 3.43Å; E238-Q242 PolarHBondContact O-N 2.91Å; E238-Q242 WeakPolarHBondContact OE1-CG 3.4Å; E238-Q242 PolarHBondContact OE1-NE2 2.75Å; E239-Q242 WeakPolarHBondContact O-CB 3.22Å; E239-Q242 PolarHBondContact O-N 3.33Å; Q240-Q242 VanDerWaalsContact C-N 3.31Å; Q240-Q242 PolarHBondContact O-N 3.48Å; Q242-Y244 VanDerWaalsContact C-N 3.28Å; Q242-Y244 PolarHBondContact O-N 3.41Å; Q242-K245 HydrophobicContact CG-CD 4.42Å; Q242-K245 PolarHBondContact O-N 2.79Å; Q242-K246 WeakPolarHBondContact O-CB 3.38Å; Q242-K246 PolarHBondContact O-N 2.64Å
243V95.4Very high94.4Very high54 Ų5478.5 Ų78.533%0.32740%0.403SS..Hα-helixtrans-59.2-40.3171172.70000111.1M83 E239 Q240 R247M83-V243 HydrophobicContact CE-CG1 4.11Å; E239-V243 WeakPolarHBondContact O-CG2 3.26Å; E239-V243 PolarHBondContact O-N 2.94Å; Q240-V243 PolarHBondContact O-N 3.35Å; V243-R247 WeakPolarHBondContact O-CB 2.81Å; V243-R247 WeakPolarHBondContact O-CD 3.47Å; V243-R247 WeakPolarHBondContact O-CG 3.26Å; V243-R247 PolarHBondContact O-N 3.14Å
244Y94.8Very high94.3Very high31 Ų3180 Ų8012%0.12241%0.412CS..Hα-helixtrans-71-39.7174-73.3-75.3000113L204 F205 W233 L236 Q240 K241 Q242 R247 T248L204-Y244 HydrophobicContact CD2-CD1 3.71Å; L204-Y244 HydrophobicContact CD2-CE1 3.85Å; F205-Y244 HydrophobicContact CB-CD1 4.06Å; F205-Y244 HydrophobicContact CB-CD2 4.42Å; F205-Y244 HydrophobicContact CB-CE1 4.06Å; F205-Y244 HydrophobicContact CB-CE2 4.42Å; F205-Y244 HydrophobicContact CB-CG 4.27Å; F205-Y244 HydrophobicContact CD2-CD2 4.35Å; F205-Y244 HydrophobicContact CD2-CE1 4.34Å; F205-Y244 AromaticContact CD2-CE2 3.71Å; F205-Y244 HydrophobicContact CD2-CE2 3.71Å; F205-Y244 AromaticContact CD2-CZ 3.71Å; W233-Y244 HydrophobicContact CZ3-CD2 4.06Å; W233-Y244 HydrophobicContact CZ3-CG 4.17Å; L236-Y244 HydrophobicContact CD1-CD2 4.31Å; L236-Y244 HydrophobicContact CD1-CE2 4.24Å; Q240-Y244 VanDerWaalsContact O-CD2 3.23Å; Q240-Y244 WeakPolarHBondContact O-CD2 3.15Å; Q240-Y244 PolarHBondContact O-N 3.47Å; K241-Y244 PolarHBondContact O-N 3.32Å; Q242-Y244 VanDerWaalsContact C-N 3.28Å; Q242-Y244 PolarHBondContact O-N 3.41Å; Y244-R247 PolarHBondContact O-N 2.9Å; Y244-T248 PolarHBondContact O-N 3.44Å
245K93.9Very high94.1Very high86 Ų8676.4 Ų76.437%0.37439%0.391SS..Hα-helixtrans-56.7-52.9172.9-68.8166.7-174.6175.10111A201 E238 K241 Q242 R247 T248 E249A201-K245 HydrophobicContact CB-CG 4.17Å; E238-K245 IonicContact OE1-NZ 2.62Å; E238-K245 PolarHBondContact OE1-NZ 3.28Å; E238-K245 IonicContact OE2-NZ 2.75Å; E238-K245 PolarHBondContact OE2-NZ 2.95Å; K241-K245 WeakPolarHBondContact O-CG 3.42Å; K241-K245 PolarHBondContact O-N 3.27Å; Q242-K245 HydrophobicContact CG-CD 4.42Å; Q242-K245 PolarHBondContact O-N 2.79Å; K245-R247 VanDerWaalsContact C-N 3.34Å; K245-R247 PolarHBondContact O-N 3.23Å; K245-T248 PolarHBondContact O-N 2.73Å; K245-E249 WeakPolarHBondContact O-CB 3.47Å; K245-E249 PolarHBondContact O-N 2.94Å
246K95.4Very high93.9Very high146 Ų14677.8 Ų77.864%0.63538%0.381SS*.Hα-helixtrans-62.1-35.7178.7-169.7170.9-175.4172.20113Q242 T250Q242-K246 WeakPolarHBondContact O-CB 3.38Å; Q242-K246 PolarHBondContact O-N 2.64Å; K246-T250 WeakPolarHBondContact O-CB 3.26Å; K246-T250 PolarHBondContact O-N 3.34Å; K246-T250 PolarHBondContact O-OG1 3.39Å
247R91.8Very high93.8Very high66 Ų6682.1 Ų82.125%0.24940%0.399CS..Hα-helixtrans-64.6-48.2172.9-80.4170.7170.9-170.7-4.3112.3M83 V243 Y244 K245 E249 T250 A251M83-R247 PolarHBondContact SD-NH2 2.89Å; V243-R247 WeakPolarHBondContact O-CB 2.81Å; V243-R247 WeakPolarHBondContact O-CD 3.47Å; V243-R247 WeakPolarHBondContact O-CG 3.26Å; V243-R247 PolarHBondContact O-N 3.14Å; Y244-R247 PolarHBondContact O-N 2.9Å; K245-R247 VanDerWaalsContact C-N 3.34Å; K245-R247 PolarHBondContact O-N 3.23Å; R247-E249 VanDerWaalsContact C-N 3.34Å; R247-T250 PolarHBondContact O-N 2.73Å; R247-A251 WeakPolarHBondContact O-CB 3.4Å; R247-A251 PolarHBondContact O-N 2.64Å
248T93.6Very high93.5Very high25 Ų2584.6 Ų84.615%0.15340%0.401CS..Hα-helixtrans-62.4-40.5175.5-79.10000111.7V199 S200 A201 Y244 K245 A251 K252V199-T248 VanDerWaalsContact O-CG2 3.25Å; V199-T248 WeakPolarHBondContact O-CG2 3.38Å; V199-T248 PolarHBondContact O-OG1 2.86Å; S200-T248 VanDerWaalsContact C-OG1 3.31Å; A201-T248 WeakPolarHBondContact CA-OG1 3.42Å; A201-T248 PolarHBondContact N-OG1 2.7Å; Y244-T248 PolarHBondContact O-N 3.44Å; K245-T248 PolarHBondContact O-N 2.73Å; T248-A251 PolarHBondContact O-N 2.9Å; T248-K252 WeakPolarHBondContact O-CB 3.44Å; T248-K252 PolarHBondContact O-N 3.1Å
249E94.4Very high93.3Very high90 Ų9081.3 Ų81.342%0.42139%0.386SS..Hα-helixtrans-64-44.6176.6-162.6-139.2156.600112K245 R247 A251 K252 K253K245-E249 WeakPolarHBondContact O-CB 3.47Å; K245-E249 PolarHBondContact O-N 2.94Å; R247-E249 VanDerWaalsContact C-N 3.34Å; E249-A251 VanDerWaalsContact C-N 3.35Å; E249-A251 PolarHBondContact O-N 3.37Å; E249-K252 WeakPolarHBondContact O-CB 3.35Å; E249-K252 PolarHBondContact O-N 3.46Å; E249-K252 VanDerWaalsContact O-N 3.14Å; E249-K253 PolarHBondContact O-N 2.82Å; E249-K253 WeakPolarHBondContact OE1-CE 3.46Å; E249-K253 IonicContact OE1-NZ 2.64Å; E249-K253 PolarHBondContact OE1-NZ 3.22Å
250T94.2Very high93Very high82 Ų8276.5 Ų76.550%0.50337%0.373SS..Hα-helixtrans-60.5-44.2174.2-55.30000111K246 R247 K252 K253 E254K246-T250 WeakPolarHBondContact O-CB 3.26Å; K246-T250 PolarHBondContact O-N 3.34Å; K246-T250 PolarHBondContact O-OG1 3.39Å; R247-T250 PolarHBondContact O-N 2.73Å; T250-K252 VanDerWaalsContact C-N 3.3Å; T250-K252 PolarHBondContact O-N 2.84Å; T250-K253 PolarHBondContact O-N 3.42Å; T250-E254 WeakPolarHBondContact O-CB 3.37Å; T250-E254 PolarHBondContact O-N 2.87Å
251A92.4Very high92.7Very high39 Ų3974.8 Ų74.832%0.32238%0.376SS..Hα-helixtrans-64.7-31.5175.200000112.9P198 R247 T248 E249 Y255P198-A251 HydrophobicContact CB-CB 4.14Å; R247-A251 WeakPolarHBondContact O-CB 3.4Å; R247-A251 PolarHBondContact O-N 2.64Å; T248-A251 PolarHBondContact O-N 2.9Å; E249-A251 VanDerWaalsContact C-N 3.35Å; E249-A251 PolarHBondContact O-N 3.37Å; A251-Y255 VanDerWaalsContact O-CB 3.25Å; A251-Y255 WeakPolarHBondContact O-CB 3.25Å; A251-Y255 PolarHBondContact O-N 2.87Å
252K91.6Very high92.5Very high125 Ų12576.2 Ų76.254%0.54338%0.381SS..Hα-helixtrans-69.2-44173.6-174.4-176.6178.5-174.50111.8P198 T248 E249 T250 Y255 L256P198-K252 HydrophobicContact CB-CB 4.46Å; P198-K252 HydrophobicContact CG-CB 3.96Å; P198-K252 HydrophobicContact CG-CG 4.26Å; T248-K252 WeakPolarHBondContact O-CB 3.44Å; T248-K252 PolarHBondContact O-N 3.1Å; E249-K252 WeakPolarHBondContact O-CB 3.35Å; E249-K252 PolarHBondContact O-N 3.46Å; E249-K252 VanDerWaalsContact O-N 3.14Å; T250-K252 VanDerWaalsContact C-N 3.3Å; T250-K252 PolarHBondContact O-N 2.84Å; K252-Y255 PolarHBondContact O-N 3.25Å; K252-L256 WeakPolarHBondContact O-CG 3.39Å; K252-L256 PolarHBondContact O-N 3.2Å; K252-L256 VanDerWaalsContact O-N 3.1Å
253K93.1Very high92.1Very high134 Ų13479.5 Ų79.558%0.58339%0.39SS*.Hα-helixtrans-60.4-45.3173.6-76169.5165.7168.80111.1E249 T250 L256 K257E249-K253 PolarHBondContact O-N 2.82Å; E249-K253 WeakPolarHBondContact OE1-CE 3.46Å; E249-K253 IonicContact OE1-NZ 2.64Å; E249-K253 PolarHBondContact OE1-NZ 3.22Å; T250-K253 PolarHBondContact O-N 3.42Å; K253-L256 PolarHBondContact O-N 3.45Å; K253-K257 PolarHBondContact O-N 2.9Å
254E92.1Very high91.7Very high70 Ų7079.9 Ų79.933%0.32740%0.398SS..Hα-helixtrans-65.2-44177-175.358.1-154.800112.8T250 L256 K257 Q258T250-E254 WeakPolarHBondContact O-CB 3.37Å; T250-E254 PolarHBondContact O-N 2.87Å; E254-L256 VanDerWaalsContact C-N 3.32Å; E254-L256 PolarHBondContact O-N 2.97Å; E254-K257 WeakPolarHBondContact O-CB 3.25Å; E254-K257 PolarHBondContact O-N 3.4Å; E254-K257 VanDerWaalsContact OE1-CE 3.26Å; E254-K257 WeakPolarHBondContact OE1-CE 3.37Å; E254-K257 IonicContact OE1-NZ 2.64Å; E254-K257 PolarHBondContact OE1-NZ 2.62Å; E254-K257 WeakPolarHBondContact OE2-CE 3.45Å; E254-K257 IonicContact OE2-NZ 3.96Å; E254-K257 PolarHBondContact OE2-NZ 3.04Å; E254-Q258 HydrophobicContact CG-CG 4.45Å; E254-Q258 WeakPolarHBondContact O-CG 3.3Å; E254-Q258 PolarHBondContact O-N 2.85Å; E254-Q258 PolarHBondContact OE1-NE2 3.19Å
255Y92.3Very high91.1Very high33 Ų3381 Ų8113%0.12941%0.411CS..Hα-helixtrans-56.9-42.5175.2163.5-90.3000112.2P195 V196 K197 A251 K252 Q258 L259P195-Y255 HydrophobicContact CB-CD2 4.09Å; P195-Y255 HydrophobicContact CB-CE2 4.37Å; P195-Y255 HydrophobicContact CG-CE2 4.43Å; P195-Y255 VanDerWaalsContact O-CE2 3.26Å; P195-Y255 WeakPolarHBondContact O-CE2 3.36Å; V196-Y255 WeakPolarHBondContact O-CD2 3.32Å; K197-Y255 HydrophobicContact CB-CE2 4.28Å; K197-Y255 HydrophobicContact CG-CE2 3.75Å; A251-Y255 VanDerWaalsContact O-CB 3.25Å; A251-Y255 WeakPolarHBondContact O-CB 3.25Å; A251-Y255 PolarHBondContact O-N 2.87Å; K252-Y255 PolarHBondContact O-N 3.25Å; Y255-Q258 PolarHBondContact O-N 3.47Å; Y255-L259 HydrophobicContact CE1-CD2 4.07Å; Y255-L259 VanDerWaalsContact O-CB 3.28Å; Y255-L259 WeakPolarHBondContact O-CB 3.28Å; Y255-L259 PolarHBondContact O-N 3.39Å
256L91.7Very high90.6Very high98 Ų9881 Ų8151%0.51341%0.414SS..Hα-helixtrans-65.6-41.9178.5-70.7170.8000111.7K252 K253 E254 L259 A260K252-L256 WeakPolarHBondContact O-CG 3.39Å; K252-L256 PolarHBondContact O-N 3.2Å; K252-L256 VanDerWaalsContact O-N 3.1Å; K253-L256 PolarHBondContact O-N 3.45Å; E254-L256 VanDerWaalsContact C-N 3.32Å; E254-L256 PolarHBondContact O-N 2.97Å; L256-L259 PolarHBondContact O-N 2.62Å; L256-A260 PolarHBondContact O-N 3.14Å
257K92.6Very high89.7Confident123 Ų12378.8 Ų78.854%0.53541%0.413SS..Hα-helixtrans-61.2-45.4174.6-168.2-163.776.8-163.30111.6K253 E254 A260 A261K253-K257 PolarHBondContact O-N 2.9Å; E254-K257 WeakPolarHBondContact O-CB 3.25Å; E254-K257 PolarHBondContact O-N 3.4Å; E254-K257 VanDerWaalsContact OE1-CE 3.26Å; E254-K257 WeakPolarHBondContact OE1-CE 3.37Å; E254-K257 IonicContact OE1-NZ 2.64Å; E254-K257 PolarHBondContact OE1-NZ 2.62Å; E254-K257 WeakPolarHBondContact OE2-CE 3.45Å; E254-K257 IonicContact OE2-NZ 3.96Å; E254-K257 PolarHBondContact OE2-NZ 3.04Å; K257-A260 PolarHBondContact O-N 3.42Å; K257-A261 PolarHBondContact O-N 3.04Å
258Q90.5Very high88.9Confident89 Ų8979.1 Ų79.142%0.41643%0.425SS..Hα-helixtrans-66.8-36.9177.2-69.3179.18.400112.2P195 E254 Y255 A261 Y262P195-Q258 HydrophobicContact CB-CB 3.9Å; P195-Q258 HydrophobicContact CG-CB 4.35Å; E254-Q258 HydrophobicContact CG-CG 4.45Å; E254-Q258 WeakPolarHBondContact O-CG 3.3Å; E254-Q258 PolarHBondContact O-N 2.85Å; E254-Q258 PolarHBondContact OE1-NE2 3.19Å; Y255-Q258 PolarHBondContact O-N 3.47Å; Q258-A261 PolarHBondContact O-N 2.74Å; Q258-Y262 VanDerWaalsContact O-CB 3.25Å; Q258-Y262 WeakPolarHBondContact O-CB 3.25Å; Q258-Y262 PolarHBondContact O-N 3.22Å
259L89.9Confident87.5Confident28 Ų2884.3 Ų84.315%0.14745%0.447CS..Hα-helixtrans-66.6-37.7175.5-17863.2000112.2P195 Y255 L256 R263P195-L259 HydrophobicContact CG-CB 4.12Å; P195-L259 HydrophobicContact CG-CD1 4.24Å; Y255-L259 HydrophobicContact CE1-CD2 4.07Å; Y255-L259 VanDerWaalsContact O-CB 3.28Å; Y255-L259 WeakPolarHBondContact O-CB 3.28Å; Y255-L259 PolarHBondContact O-N 3.39Å; L256-L259 PolarHBondContact O-N 2.62Å; L259-R263 WeakPolarHBondContact O-CB 3.47Å; L259-R263 VanDerWaalsContact O-CG 3.25Å; L259-R263 WeakPolarHBondContact O-CG 3.1Å; L259-R263 PolarHBondContact O-N 3.47Å
260A89.4Confident85.9Confident59 Ų5984.3 Ų84.349%0.48846%0.457SS..Hα-helixtrans-64.7-47.9172.900000111.5L256 K257 Y262 R263 A264L256-A260 PolarHBondContact O-N 3.14Å; K257-A260 PolarHBondContact O-N 3.42Å; A260-Y262 PolarHBondContact O-N 3.41Å; A260-R263 PolarHBondContact O-N 3.29Å; A260-A264 PolarHBondContact O-N 3.17Å
261A89.1Confident84Confident63 Ų6390.6 Ų90.652%0.52147%0.473SS..Hα-helixtrans-61.5-41.217600000112.4K257 Q258 A264 S265K257-A261 PolarHBondContact O-N 3.04Å; Q258-A261 PolarHBondContact O-N 2.74Å; A261-A264 PolarHBondContact O-N 3.38Å; A261-S265 WeakPolarHBondContact O-CB 3.49Å; A261-S265 PolarHBondContact O-N 3.04Å
262Y88.3Confident81.8Confident66 Ų6692 Ų9226%0.25948%0.481SS..Hα-helixtrans-62.5-46.9176.2-178.7-117.3000111.5N193 Q258 A260 A264 S265 L266N193-Y262 HydrophobicContact CB-CE2 4.14Å; Q258-Y262 VanDerWaalsContact O-CB 3.25Å; Q258-Y262 WeakPolarHBondContact O-CB 3.25Å; Q258-Y262 PolarHBondContact O-N 3.22Å; A260-Y262 PolarHBondContact O-N 3.41Å; Y262-A264 PolarHBondContact O-N 2.98Å; Y262-S265 WeakPolarHBondContact CA-OG 3.15Å; Y262-S265 PolarHBondContact O-N 3.39Å; Y262-S265 VanDerWaalsContact O-N 3.17Å; Y262-S265 PolarHBondContact O-OG 3.42Å; Y262-L266 HydrophobicContact CD1-CD1 4.12Å; Y262-L266 HydrophobicContact CE1-CD1 3.67Å; Y262-L266 HydrophobicContact CE1-CG 4.37Å; Y262-L266 HydrophobicContact CE2-CD1 4.45Å; Y262-L266 HydrophobicContact CE2-CD2 4.31Å; Y262-L266 HydrophobicContact CE2-CG 4.3Å; Y262-L266 WeakPolarHBondContact O-CG 3.44Å; Y262-L266 PolarHBondContact O-N 2.88Å
263R87.2Confident79.4Confident163 Ų16391.7 Ų91.762%0.61549%0.485SS*.Hα-helixtrans-58.2-46174.6-75169173.8-172-4.5112.3L259 A260 S265 L266 V267L259-R263 WeakPolarHBondContact O-CB 3.47Å; L259-R263 VanDerWaalsContact O-CG 3.25Å; L259-R263 WeakPolarHBondContact O-CG 3.1Å; L259-R263 PolarHBondContact O-N 3.47Å; A260-R263 PolarHBondContact O-N 3.29Å; R263-S265 VanDerWaalsContact C-N 3.33Å; R263-S265 PolarHBondContact O-N 2.99Å; R263-L266 PolarHBondContact O-N 3.38Å; R263-V267 PolarHBondContact O-N 3.21Å
264A86.6Confident77.5Confident61 Ų6190.9 Ų90.950%0.50449%0.494SS..Hα-helixtrans-60.3-43.417500000111.6A260 A261 Y262 L266 V267 S268A260-A264 PolarHBondContact O-N 3.17Å; A261-A264 PolarHBondContact O-N 3.38Å; Y262-A264 PolarHBondContact O-N 2.98Å; A264-L266 VanDerWaalsContact C-N 3.35Å; A264-L266 PolarHBondContact O-N 3.46Å; A264-V267 PolarHBondContact O-N 3.33Å; A264-S268 PolarHBondContact O-N 3.35Å; A264-S268 PolarHBondContact O-OG 3.27Å
265S83.9Confident75.6Confident55 Ų5592 Ų9239%0.38551%0.509SS..Hα-helixtrans-62.7-37.7178.774.90000113.1A261 Y262 R263 S268 Q269A261-S265 WeakPolarHBondContact O-CB 3.49Å; A261-S265 PolarHBondContact O-N 3.04Å; Y262-S265 WeakPolarHBondContact CA-OG 3.15Å; Y262-S265 PolarHBondContact O-N 3.39Å; Y262-S265 VanDerWaalsContact O-N 3.17Å; Y262-S265 PolarHBondContact O-OG 3.42Å; R263-S265 VanDerWaalsContact C-N 3.33Å; R263-S265 PolarHBondContact O-N 2.99Å; S265-S268 WeakPolarHBondContact CA-OG 3.31Å; S265-S268 PolarHBondContact O-N 2.68Å; S265-S268 PolarHBondContact O-OG 3.28Å; S265-Q269 VanDerWaalsContact O-CB 3.26Å; S265-Q269 WeakPolarHBondContact O-CB 3.48Å; S265-Q269 PolarHBondContact O-N 3Å
266L82.4Confident73.5Confident87 Ų8798.8 Ų98.846%0.45554%0.542SS..Hα-helixtrans-65.1-40.4175.4-71.5175.4000112Y262 R263 A264 Q269 S270Y262-L266 HydrophobicContact CD1-CD1 4.12Å; Y262-L266 HydrophobicContact CE1-CD1 3.67Å; Y262-L266 HydrophobicContact CE1-CG 4.37Å; Y262-L266 HydrophobicContact CE2-CD1 4.45Å; Y262-L266 HydrophobicContact CE2-CD2 4.31Å; Y262-L266 HydrophobicContact CE2-CG 4.3Å; Y262-L266 WeakPolarHBondContact O-CG 3.44Å; Y262-L266 PolarHBondContact O-N 2.88Å; R263-L266 PolarHBondContact O-N 3.38Å; A264-L266 VanDerWaalsContact C-N 3.35Å; A264-L266 PolarHBondContact O-N 3.46Å; L266-Q269 PolarHBondContact O-N 2.91Å; L266-S270 PolarHBondContact O-N 3.48Å
267V76.2Confident71.6Confident99 Ų99102.8 Ų102.860%0.656%0.56SS**Hα-helixtrans-63.9-47.3175.7175.50000110.5R263 A264 Q269 S270R263-V267 PolarHBondContact O-N 3.21Å; A264-V267 PolarHBondContact O-N 3.33Å; V267-Q269 VanDerWaalsContact C-N 3.33Å; V267-Q269 PolarHBondContact O-N 3.14Å; V267-S270 PolarHBondContact O-N 2.87Å; V267-S270 PolarHBondContact O-OG 3.16Å
268S74.6Confident69.4Low72 Ų72105.5 Ų105.550%0.50357%0.572SS.*Hα-helixtrans-63.5-37.8175.751.10000112.9A264 S265 S270 Y271A264-S268 PolarHBondContact O-N 3.35Å; A264-S268 PolarHBondContact O-OG 3.27Å; S265-S268 WeakPolarHBondContact CA-OG 3.31Å; S265-S268 PolarHBondContact O-N 2.68Å; S265-S268 PolarHBondContact O-OG 3.28Å; S268-S270 VanDerWaalsContact C-N 3.3Å; S268-S270 PolarHBondContact O-N 3Å; S268-Y271 PolarHBondContact O-N 3.26Å; S268-Y271 VanDerWaalsContact O-N 3.14Å
269Q66Low67Low134 Ų134104.2 Ų104.263%0.62658%0.577SS**Hα-helixtrans-64.3-36.9178.2-167.567.749.100111.5S265 L266 V267 Y271 S272S265-Q269 VanDerWaalsContact O-CB 3.26Å; S265-Q269 WeakPolarHBondContact O-CB 3.48Å; S265-Q269 PolarHBondContact O-N 3Å; L266-Q269 PolarHBondContact O-N 2.91Å; V267-Q269 VanDerWaalsContact C-N 3.33Å; V267-Q269 PolarHBondContact O-N 3.14Å; Q269-Y271 PolarHBondContact O-N 2.71Å; Q269-S272 PolarHBondContact O-N 2.94Å; Q269-S272 PolarHBondContact O-OG 3.36Å
270S60Low64.9Low90 Ų90109 Ų10963%0.62961%0.609SS**Hα-helixtrans-67.2-14.4176.473.90000114.5L266 V267 S268L266-S270 PolarHBondContact O-N 3.48Å; V267-S270 PolarHBondContact O-N 2.87Å; V267-S270 PolarHBondContact O-OG 3.16Å; S268-S270 VanDerWaalsContact C-N 3.3Å; S268-S270 PolarHBondContact O-N 3Å
271Y54.5Low62.8Low214 Ų214114.7 Ų114.784%0.83963%0.626SS**THydrogen-bonded Turntrans-97.4-0.6177.2-127.1-91.9000113.4S268 Q269S268-Y271 PolarHBondContact O-N 3.26Å; S268-Y271 VanDerWaalsContact O-N 3.14Å; Q269-Y271 PolarHBondContact O-N 2.71Å
272S46.6Very low60.4Low69 Ų69117.3 Ų117.348%0.48364%0.64SS.*SBendtrans-113.820.6-173.5590000114.8Q269 P274Q269-S272 PolarHBondContact O-N 2.94Å; Q269-S272 PolarHBondContact O-OG 3.36Å; S272-P274 VanDerWaalsContact C-CD 3.49Å; S272-P274 VanDerWaalsContact O-CD 3.3Å; S272-P274 WeakPolarHBondContact O-CD 3.25Å
273D39.8Very low58.1Low119 Ų119119.3 Ų119.364%0.63667%0.67SS**  trans-113.883.6171.6-171.38.3000112.1S275D273-S275 PolarHBondContact O-N 3.07Å; D273-S275 WeakPolarHBondContact OD1-CB 3.33Å; D273-S275 PolarHBondContact OD1-OG 3.32Å
274P52.8Low55.8Low116 Ų116116.5 Ų116.575%0.75368%0.675SS**  trans-82.356.8177.335.7-36.8000112.1S272S272-P274 VanDerWaalsContact C-CD 3.49Å; S272-P274 VanDerWaalsContact O-CD 3.3Å; S272-P274 WeakPolarHBondContact O-CD 3.25Å
275S53.3Low53.7Low93 Ų93122 Ų12265%0.6570%0.696SS**  trans-119.814.9-171.1-51.60000116.9D273D273-S275 PolarHBondContact O-N 3.07Å; D273-S275 WeakPolarHBondContact OD1-CB 3.33Å; D273-S275 PolarHBondContact OD1-OG 3.32Å
276E48.2Very low51.5Low176 Ų176125 Ų12582%0.82272%0.717SS**  trans-14066.6166.6-153.5169.6-178.300115.4K278E276-K278 HydrophobicContact CG-CB 4.38Å
277M51.5Low49.6Very low183 Ų183126 Ų12690%0.90173%0.732SS**  trans-99.662.1156.354.9178168.800111A279M277-A279 PolarHBondContact O-N 3.41Å
278K45.6Very low48.3Very low180 Ų180126.6 Ų126.678%0.78374%0.738SS**  trans-81.8100.6177.8-172165.9-175.7172.40110.9E276E276-K278 HydrophobicContact CG-CB 4.38Å
279A40.7Very low46.5Very low62 Ų62128.3 Ų128.351%0.51275%0.75SS.*  trans-58.4143.5174.700000112.1M277 H281M277-A279 PolarHBondContact O-N 3.41Å; A279-H281 PolarHBondContact O-N 3.32Å
280P45.5Very low46.1Very low128 Ų128127.4 Ų127.483%0.83176%0.756SS**  trans-76.3112-178.130.2-33.8000111
281H46.7Very low45.1Very low179 Ų179130.5 Ų130.583%0.82977%0.771SS**  trans-106.6132166.9-76.4-80.1000110.6A279A279-H281 PolarHBondContact O-N 3.32Å
282S38.1Very low44.3Very low117 Ų117125 Ų12582%0.81876%0.763SS**  trans-64.5138.4-163.1-49.90000114.6
283A40.9Very low43.9Very low108 Ų108129.5 Ų129.589%0.89378%0.779SS**  trans-91.1104.3161.300000109.6
284S38.5Very low43.9Very low104 Ų104132.9 Ų132.973%0.72779%0.788SS**  trans-131.383.3172.559.40000109.8
285N41.5Very low43.6Very low176 Ų176133 Ų13394%0.94179%0.787SS**  trans-110.995.3-175.7-144.938.8000109.7
286S38.7Very low43.3Very low118 Ų118134.3 Ų134.383%0.82579%0.793SS**  trans-148.4136.8172.952.90000111.7
287S41.2Very low42.7Very low110 Ų110135.3 Ų135.377%0.76980%0.795SS**  trans-164.4138.1-178.1-166.50000105.2
288P50.2Low42.9Very low111 Ų111132.1 Ų132.172%0.72179%0.788SS**  -150.9146.37538.1-18.6000117.9
289S35.9Very low42.3Very low108 Ų108129.2 Ų129.276%0.75579%0.79SS**  trans56.9170133.9-57.80000121.7
290P58Low42.2Very low115 Ų115131.8 Ų131.875%0.74780%0.799SS**  cis-130.8172-48.738.1-24.5000112.5
291T38.8Very low41.9Very low154 Ų154136.4 Ų136.495%0.94580%0.802SS**  trans-163.5157.5148.7-83.90000111.2
292S38.3Very low42.1Very low98 Ų98132.9 Ų132.969%0.68580%0.795SS**  trans-102.9170.9-160.8-166.40000115.2
293M37.3Very low41.9Very low164 Ų164130.6 Ų130.681%0.80879%0.79SS**  trans67.1126.6165.8-48.1-163.6-70.200116.3
294F41.2Very low41.9Very low191 Ų191133.8 Ų133.884%0.83879%0.786SS**  -157.5168.764.9-144.9-107.6000112.6
295T45.1Very low42.6Very low118 Ų118134.8 Ų134.872%0.72479%0.79SS**  trans-127.8154.816667.30000109.5
296P46.6Very low42.3Very low121 Ų121129.3 Ų129.379%0.78678%0.775SS**  -144.3162.8102.237.3-22.7000115.6
297K35.7Very low43Very low196 Ų196129.4 Ų129.485%0.85277%0.773SS**  trans-90.8-168.2161.2-53.4176.7173.3175.30108.7
298P57.4Low42.8Very low116 Ų116132.1 Ų132.175%0.75377%0.773SS**  cis-131.5179.8-15.534.2-15000114
299S31.7Very low42.1Very low120 Ų120131.5 Ų131.584%0.83978%0.777SS**  -156.1153.4126.4-162.90000111
300V38.7Very low42.3Very low116 Ų116132 Ų13270%0.70378%0.78SS**  trans-151.9134.1-175.8169.60000108.4
301Y40.4Very low42.2Very low225 Ų225131.9 Ų131.988%0.88278%0.78SS**  trans-167.8144.6136.9-118.1-79.3000111.7
302P50.5Low42Very low105 Ų105129.9 Ų129.968%0.68277%0.772SS**  trans-100.9160.9174.8813.8000113.4
303G33Very low41.8Very low69 Ų69130.6 Ų130.671%0.71178%0.777SS**  trans-158.7162.1175.500000113.4
304H41.3Very low41.9Very low174 Ų174130.8 Ų130.881%0.80678%0.78SS**  trans-151171.8-16722-105.7000109.5
305P54Low41.8Very low126 Ų126126.4 Ų126.482%0.81877%0.773SS**  cis-128.4-162.1438-17.4000114.3
306G34.3Very low41.3Very low61 Ų61126.1 Ų126.163%0.62978%0.776SS**  trans-80.3-149.717300000114
307P53.7Low41.1Very low120 Ų120128.6 Ų128.678%0.77978%0.777SS**  cis-87.8-143.111.936.4-35000113.7
308H37.6Very low42.2Very low167 Ų167124 Ų12477%0.77377%0.767SS**  cis-161.7164.415.333.7-112.6000115.7
309A35.5Very low41.2Very low97 Ų97126.8 Ų126.880%0.80277%0.769SS**  trans60.8123.6159.500000121.3
310S38.2Very low41.5Very low118 Ų118126.9 Ų126.983%0.82577%0.77SS**  trans-114.9-165.4164.8-44.50000108.1
311P56Low41.5Very low113 Ų113129.3 Ų129.373%0.73478%0.778SS**  cis-137.7178-5.143.2-26.4000115.5
312S34.8Very low42Very low113 Ų113124.7 Ų124.779%0.7978%0.776SS**  trans162.8138.6133.3-73.40000110.4
313S35.8Very low41.2Very low113 Ų113123.4 Ų123.479%0.7978%0.781SS**  cis-167.4145.5-20.942.80000107.5
314I39.3Very low41.5Very low167 Ų167129 Ų12986%0.85679%0.794SS**  trans-122.2132.1-169.9-70.1175000112.7
315S39.2Very low41.3Very low99 Ų99123.8 Ų123.869%0.69279%0.787SS**  trans61.1132.4155.4-164.20000121.2
316S34.2Very low41.1Very low113 Ų113124.2 Ų124.279%0.7979%0.79SS**  trans-159.3149.714454.20000112.6
317H41Very low41.4Very low173 Ų173129.1 Ų129.180%0.80180%0.796SS**  trans-126.5-172.4169.3-55.4-76.8000107.5
318P59.8Low41Very low99 Ų99131.3 Ų131.364%0.64380%0.8SS**  cis-131.8-166.7-29.917.88.6000113.2
319H37.2Very low41.9Very low174 Ų174127.9 Ų127.981%0.80679%0.792SS**  trans78.5118.5156.1-60.3-68.8000122.5
320S36.5Very low42.8Very low123 Ų123128.7 Ų128.786%0.8679%0.79SS**  177.3177.4112.442.40000112.7
321L38.8Very low43.7Very low167 Ų167128.1 Ų128.187%0.87478%0.783SS**  trans-124.1-177-164.9-79.1169.9000111.7
322P51.6Low42.9Very low127 Ų127130.5 Ų130.583%0.82578%0.784SS**  cis-129.6-179.1-17.324.7-1.1000114.3
323G33Very low43.3Very low78 Ų78133.1 Ų133.180%0.80478%0.783SS**  trans-160.211517200000115.9
324L39.3Very low43.3Very low188 Ų188135.1 Ų135.198%0.98478%0.78SS**  trans-46.1141.4-172.7-59.8164.7000118.7
325G37.2Very low43.1Very low64 Ų64134 Ų13466%0.6677%0.774SS**  trans177.1123.3163.800000113
326P49.4Very low43.4Very low135 Ų135137.9 Ų137.988%0.87778%0.781SS**  trans-85.7137.5-167.832.4-34.8000114.4
327H40.6Very low44.5Very low163 Ų163137.7 Ų137.776%0.75578%0.777SS**  trans-113.4145167.358.9-88.9000110.1
328I46.6Very low44.3Very low167 Ų167138.1 Ų138.186%0.85678%0.779SS**  trans-112110.8-179.8-58.7174.4000109
329P56.4Low43.4Very low94 Ų94140.3 Ų140.361%0.6179%0.785SS**PPolyproline II helixtrans-86.7150.6173.933.8-33000112.2
330P54.6Low43.6Very low115 Ų115140.8 Ų140.875%0.74779%0.788SS**PPolyproline II helixtrans-78.6154.6173.433.4-35000112
331P55.9Low43.6Very low105 Ų105139.2 Ų139.268%0.68278%0.782SS**PPolyproline II helixtrans-76.2134.5-178.730.5-34.6000112.7
332H40.6Very low43.4Very low163 Ų163140.1 Ų140.176%0.75579%0.787SS**  trans-119.2119.7169.6178.3-86.1000108.8
333H41.7Very low42.6Very low169 Ų169139.4 Ų139.478%0.78279%0.785SS**  trans-107.8109.5-173.8-61.4-63.8000111.8
334Q36.7Very low42.8Very low154 Ų154141.3 Ų141.372%0.7279%0.786SS**  trans-148.3107.1167.1-149.5-177.141.300112.9
335I35.9Very low42.7Very low143 Ų143144.2 Ų144.273%0.73378%0.784SS**  trans50.5117.1136.6-57174.4000119.4
336H43.5Very low42.6Very low182 Ų182145 Ų14584%0.84379%0.791SS**  -168163.5108.4-123.9-171.2000112.7
337P58.5Low42.2Very low108 Ų108145.4 Ų145.470%0.70179%0.792SS**  trans-107.8173.3-176.141.3-34.9000114.4
338Q37.2Very low42.2Very low182 Ų182144 Ų14485%0.8579%0.794SS**  trans-142.2163.5158.7-144.2-153-102.700112.5
339L40.9Very low42.5Very low146 Ų146141.6 Ų141.676%0.76479%0.79SS**  trans-97.5148.8-170.3-64.2153.7000113.2
340Q40.5Very low41.5Very low184 Ų184148.5 Ų148.586%0.8680%0.803SS**  170.6134.2120.6-89.51617.600108.5
341A36.5Very low40.4Very low89 Ų89147.3 Ų147.374%0.73680%0.803SS**  cis117.5101.515.100000111.3
342L33.9Very low39.3Very low186 Ų186147.3 Ų147.397%0.97481%0.806SS**  trans-143.5166.7155.5-86.1-172.4000109.7
343S36.2Very low39.4Very low113 Ų113145.7 Ų145.779%0.7981%0.807SS**  trans-132.1146.2-149.6-179.30000114.8
344S37.6Very low39.8Very low117 Ų117143.7 Ų143.782%0.81881%0.809SS**  trans-152.9155.2157.6540000111.4
345R37.1Very low40.1Very low250 Ų250143.9 Ų143.994%0.94381%0.81SS**  trans-98.6149.2-164-66.8144.956.8-175.9-2.1112.5
346G34.2Very low40.1Very low80 Ų80145.4 Ų145.483%0.82581%0.814SS**  trans-170.4102.6172.800000114.8
347T40.3Very low39.6Very low143 Ų143140 Ų14088%0.87781%0.807SS**  trans-56.8145.5-172.643.40000119.1
348V40.7Very low38.4Very low134 Ų134139.2 Ų139.281%0.81281%0.81SS**  trans-62.1167.3158.4-74.30000112.5
349P53.4Low38.6Very low117 Ų117138.8 Ų138.876%0.7681%0.812SS**  cis-152.8151.136.742-19.1000123.3
350R35.3Very low38.4Very low238 Ų238137.5 Ų137.590%0.89882%0.816SS**  trans19.6128.2131.7171.8-177.6157.7171.4-5.3121.9
351A32.1Very low38.6Very low90 Ų90136.8 Ų136.874%0.74482%0.817SS**  trans-157.7110.1138.400000108.1
352S33.5Very low38.4Very low105 Ų105136.3 Ų136.373%0.73482%0.821SS**  77.1123.977.164.70000116
353V41.4Very low38.5Very low130 Ų130134.3 Ų134.379%0.78881%0.811SS**  trans-104.9149.6-169.3171.90000111.5
354P51.5Low38.8Very low126 Ų126135.4 Ų135.482%0.81881%0.812SS**  -133.5-177.3124.414.77.7000114.1
355H41.8Very low38.7Very low159 Ų159134.1 Ų134.174%0.73681%0.809SS**  trans-140-178.2-168.8-150.677.5000110.4
356Q35.4Very low38.6Very low175 Ų175127 Ų12782%0.81880%0.803SS**  trans72.8150.4-178.4-37.7-60.3-18.200114.8
357G32.9Very low38.6Very low67 Ų67127.6 Ų127.669%0.69180%0.801SS**  cis170.4159.3-10.400000113.9
358A33.9Very low38.3Very low93 Ų93126.5 Ų126.577%0.76980%0.799SS**  trans64.9123159.100000123.5
359L41.8Very low38.3Very low173 Ų173126.4 Ų126.491%0.90680%0.799SS**  trans52.9125.4135-54.9174.4000122.8
360S37.3Very low38.3Very low119 Ų119126.9 Ų126.983%0.83280%0.802SS**  -177.4173.9108.8-158.30000113.1
361L42.8Very low39.5Very low168 Ų168120.8 Ų120.888%0.8879%0.793SS**  trans-97.2157.7173-7573.7000111.3
362G33.3Very low39.7Very low80 Ų80124.3 Ų124.383%0.82580%0.799SS**  trans-175.179.7177.700000118.2
363N36.8Very low39.9Very low144 Ų144128 Ų12877%0.7781%0.805SS**  trans-13.8138.2162.9-76.620.1000123.6
364V41.4Very low39.6Very low135 Ų135127.8 Ų127.882%0.81880%0.803SS**  trans69.2144.1133.6-53.20000125.1
365A35.5Very low38.7Very low91 Ų91127.7 Ų127.775%0.75281%0.805SS**  117.1107.9128.300000121.5
366A35.6Very low38.2Very low99 Ų99129.3 Ų129.382%0.81881%0.813SS**  86.4161.2126.300000123
367A34Very low38.3Very low94 Ų94124.8 Ų124.878%0.77781%0.805SS**  trans69.4141.317700000117.8
368S33.9Very low38.5Very low120 Ų120129.5 Ų129.584%0.83981%0.809SS**  cis-161.1165.7-15-98.60000111
369T41.1Very low38.7Very low132 Ų132132.2 Ų132.281%0.8181%0.81SS**  trans-91.5165.9176.254.30000113.1
370P53.3Low38.3Very low127 Ų127127.6 Ų127.683%0.82580%0.804SS**  -142176.7101.425.9-4000115.4
371P60.1Low38.1Very low110 Ų110126 Ų12671%0.71481%0.806SS**  trans-131.5-152.9-157.944.3-27.5000116.5
372L37Very low37.8Very low163 Ų163125.1 Ų125.185%0.85380%0.802SS**  trans94.2152.3176.5-50.9-178.3000115
373Q36.3Very low38.1Very low184 Ų184129.7 Ų129.786%0.8680%0.801SS**  cis-145.116718.3-171.7171.7-11.500113.9
374V35.1Very low38.3Very low125 Ų125127.8 Ų127.876%0.75880%0.799SS**  trans-105.7152-175.4161.50000113.8
375S32.8Very low39.2Very low123 Ų123126.3 Ų126.386%0.8679%0.793SS**  trans-163156.3148-83.10000113.7
376Q32.1Very low39.2Very low194 Ų194130 Ų13091%0.90779%0.794SS**  trans-156.6133.8-171.2174.5-16438.900111.6
377A36.3Very low39.5Very low79 Ų79132.9 Ų132.965%0.65379%0.79SS**  trans-179123.4157.400000109.8
378H37.8Very low39.6Very low167 Ų167137.1 Ų137.177%0.77379%0.794SS**  74.915190.2104.5-16.3000114.9
379L39.2Very low39.7Very low150 Ų150139.4 Ų139.479%0.78579%0.791SS**  cis-164.1144.98.5-140.4-175.5000111.2
380G33.2Very low39.9Very low76 Ų76139.2 Ų139.278%0.78478%0.781SS**  trans71.5157.8146.100000121.7
381G33.3Very low39Very low84 Ų84139.9 Ų139.987%0.86677%0.772SS**  trans157.348.1170.800000120.2
382L36.4Very low38.1Very low151 Ų151141.6 Ų141.679%0.79178%0.775SS**  trans-57.7135.2-178.1-175.577.5000116.6
383H39.8Very low37.9Very low175 Ų175137.3 Ų137.381%0.8177%0.77SS**  171.4164.7127.6-93.4118.5000116.9
384S39.4Very low37.8Very low104 Ų104131 Ų13173%0.72776%0.755SS**  trans-174174.5178.7-1620000108.2
385P61.1Low38Very low105 Ų105134.4 Ų134.468%0.68276%0.762SS**  cis-123.9-174.8-28.339.5-24.6000113.2
386H35.3Very low38.2Very low169 Ų169133.8 Ų133.878%0.78276%0.758SS**  trans-154.1159145-151.7-90.3000114.6
387H41.7Very low38.6Very low158 Ų158132.9 Ų132.973%0.73176%0.758SS**  trans-97.3165.6-177.8-57-119.4000113.7
388Q37.3Very low38.6Very low184 Ų184132.9 Ų132.986%0.8677%0.766SS**  160.9170.4121.5-166.517296.400111.5
389H35.8Very low38.6Very low168 Ų168133.1 Ų133.178%0.77877%0.769SS**  -169.2149.6-74-173.333.9000109
390Q43.7Very low38.5Very low127 Ų127131.2 Ų131.259%0.59376%0.764SS**  trans68164.1166.8-61-49.762.700121
391H36.2Very low38.7Very low141 Ų141135.7 Ų135.765%0.65376%0.764SS**  cis-177.3150.3-32.5-173.4-143.9000112.2
392L39.5Very low39.1Very low147 Ų147137.4 Ų137.477%0.7776%0.763SS**  trans79.7135.2146.9-153.159.1000123.8
393G34.6Very low40.2Very low72 Ų72136 Ų13674%0.74276%0.763SS**  trans93.5134.8148.500000117.3
394G33.8Very low40.1Very low53 Ų53132.2 Ų132.255%0.54676%0.762SS.*  cis152.4138.4-11.800000113.6
395H39.2Very low40Very low195 Ų195134.9 Ų134.990%0.90377%0.766SS**  trans68.1160.2164.9-26.9-68000115.2
396S35.7Very low39Very low111 Ų111135.5 Ų135.578%0.77677%0.768SS**  cis-156.5170.8-26-170.30000110
397L42.1Very low39.1Very low174 Ų174134.9 Ų134.991%0.91177%0.766SS**  trans-38.2146.5174.5-66.1152.2000117.5
398G35.4Very low38.7Very low79 Ų79131 Ų13181%0.81477%0.769SS**  trans-164.9130.2162.500000112.7
399M39Very low38.6Very low172 Ų172130.9 Ų130.985%0.84776%0.761SS**  trans-97.9173.4176.8-78.1179.45800112.6
400T36.8Very low39.1Very low110 Ų110130.7 Ų130.768%0.67576%0.76SS**  trans101.2119.9149.666.90000121
401H37.3Very low39.8Very low171 Ų171128.8 Ų128.879%0.79276%0.759SS**  trans49124.5138.9-49.8-50.8000123
402S42Very low39.8Very low120 Ų120127.1 Ų127.184%0.83976%0.763SS**  trans-80.9162.1160.4-36.30000112.7
403P58.1Low39.8Very low121 Ų121128.2 Ų128.279%0.78677%0.769SS**  trans-140.5133.7151.735-18.5000117.7
404A38.6Very low39.7Very low95 Ų95132.6 Ų132.679%0.78577%0.77SS**  78170.8129.800000124
405I37.1Very low40.1Very low161 Ų161134.9 Ų134.983%0.82678%0.778SS**  trans89.2135.2165-60.3176.5000116.2
406T40.7Very low39.6Very low118 Ų118131 Ų13172%0.72476%0.764SS**  cis177.7149.3-13.8-86.40000106.5
407Q36.7Very low39.6Very low156 Ų156135.8 Ų135.873%0.72977%0.766SS**  cis-155.6-168.20.5-133.2177.726.500109.3Y409Q407-Y409 HydrophobicContact CG-CE2 4.31Å
408G33.6Very low39.3Very low77 Ų77135.6 Ų135.679%0.79476%0.761SS**  trans16865.4166.500000121.2
409Y34.8Very low39.7Very low180 Ų180137.4 Ų137.471%0.70676%0.761SS**  trans-47.6156.3169.8-76.2-76000117Q407Q407-Y409 HydrophobicContact CG-CE2 4.31Å
410H45.4Very low39.5Very low164 Ų164137.9 Ų137.976%0.75976%0.763SS**  cis-158.9-150.4-3-154.4-155.8000111.5
411P60.2Low39.3Very low88 Ų88135.9 Ų135.957%0.57177%0.765SS**  -132.5-173.5-122.546.7-27.7000118.2
412S35.4Very low39.1Very low105 Ų105131.9 Ų131.973%0.73477%0.769SS**  136.8114.7125.7640000117.2
413L39.3Very low38.7Very low171 Ų171131.2 Ų131.290%0.89577%0.772SS**  -178.9155.9109.6-95.5169.6000111.7
414Q33.3Very low37.6Very low164 Ų164133.8 Ų133.877%0.76678%0.775SS**  trans-74.8146.2179.3-140.887.5-8.100110.1
415S40.4Very low37.5Very low101 Ų101137.1 Ų137.171%0.70678%0.779SS**  162.2167.173.5-97.70000107
416D30.2Very low37.3Very low113 Ų113136.7 Ų136.760%0.60478%0.778SS**  cis-166.8179.6-22.5-109.9-76.3000105.3
417Y34.9Very low36.9Very low212 Ų212136.3 Ų136.383%0.83178%0.78SS**  cis-137.6-145.111.6-161.9-112.8000109
418Q36.5Very low36.6Very low169 Ų169132.6 Ų132.679%0.7978%0.784SS**  trans-136.1162.9-176.9-65.6-172.212.800116.7
419S42.7Very low36.6Very low117 Ų117133.1 Ų133.182%0.81878%0.781SS**  trans-98.4138.4169.7176.60000111.5
420M36Very low36.7Very low182 Ų182130.6 Ų130.690%0.89778%0.784SS**  trans-153150.9171.4-84.2-85.3-84.400106.5
421G32.3Very low36.3Very low69 Ų69130.6 Ų130.671%0.71179%0.786SS**  cis175.5140.7-300000107.8
422G33.3Very low35.2Very low86 Ų86131.2 Ų131.289%0.88779%0.793SS**  trans-84.7151.8-17000000115.2
423A32.4Very low35.9Very low107 Ų107132.1 Ų132.188%0.88480%0.796SS**  trans-148.8162166.800000110.9
424M34.8Very low35.6Very low175 Ų175128.9 Ų128.986%0.86279%0.788SS**  trans-103.7159.5-175.7-62.1177.417800111.9
425L38.4Very low36.1Very low165 Ų165128.1 Ų128.186%0.86479%0.794SS**  151.4153118.1-80.7177.1000114.7
426N32.8Very low35.7Very low152 Ų152128 Ų12881%0.81379%0.785SS**  trans91.7150.4146.7-144.820.4000120.7
427S31.5Very low36.1Very low109 Ų109133.5 Ų133.576%0.76280%0.799SS**  trans-81.7167-169.356.90000114.8
428G30.1Very low36.4Very low78 Ų78129.5 Ų129.580%0.80479%0.788SS**  trans178.5126.2167.500000110.4
429A34.9Very low36.4Very low89 Ų89128.4 Ų128.474%0.73678%0.783SS**  trans-108.2-176.817500000110.6
430V36.8Very low36.4Very low127 Ų127131.1 Ų131.177%0.7779%0.787SS**  trans66.4129.7171.7-49.40000115.1
431M36.8Very low36.2Very low164 Ų164125.9 Ų125.981%0.80878%0.779SS**  cis-160.6152.246.2-71.7-95.546.900111.4
432S37.1Very low36.4Very low101 Ų101133.7 Ų133.771%0.70679%0.788SS**  trans-94159.1155-55.10000109.9
433P49.8Very low36.5Very low123 Ų123138.5 Ų138.580%0.79979%0.787SS**  -123138.595.61.319.6000111.1
434S32.9Very low36.9Very low104 Ų104139.4 Ų139.473%0.72778%0.781SS**  70.995.361.4-163.80000113.5
435V43Very low37.5Very low147 Ų147137 Ų13789%0.89178%0.779SS**  trans-131.3116.6144.4-175.60000105.7
436D32.8Very low37.3Very low98 Ų98136.1 Ų136.152%0.52478%0.775SS.*  trans-103.9142.8179.2-171.2-84.6000110.3H438D436-H438 WeakPolarHBondContact OD1-CB 3.18Å; D436-H438 IonicContact OD1-CD2 3.29Å; D436-H438 PolarHBondContact OD1-CD2 3.27Å; D436-H438 VanDerWaalsContact OD1-CD2 3.29Å; D436-H438 IonicContact OD1-CG 3.59Å; D436-H438 PolarHBondContact OD1-N 3.02Å; D436-H438 IonicContact OD2-CD2 3.21Å; D436-H438 PolarHBondContact OD2-CD2 2.86Å; D436-H438 IonicContact OD2-NE2 3.87Å
437Y38.6Very low37.4Very low230 Ų230137.8 Ų137.890%0.90278%0.777SS**  trans-143.183.8160.9-114.2-79.6000110.4
438H40.2Very low37.7Very low128 Ų128140.6 Ų140.659%0.59378%0.778SS**  trans-66.1154-177.9-112.2-135.3000116D436D436-H438 WeakPolarHBondContact OD1-CB 3.18Å; D436-H438 IonicContact OD1-CD2 3.29Å; D436-H438 PolarHBondContact OD1-CD2 3.27Å; D436-H438 VanDerWaalsContact OD1-CD2 3.29Å; D436-H438 IonicContact OD1-CG 3.59Å; D436-H438 PolarHBondContact OD1-N 3.02Å; D436-H438 IonicContact OD2-CD2 3.21Å; D436-H438 PolarHBondContact OD2-CD2 2.86Å; D436-H438 IonicContact OD2-NE2 3.87Å
439Q37.1Very low38.4Very low146 Ų146142 Ų14268%0.68277%0.773SS**  trans74.8115.3147.7-111.27797.100122.7
440L42.4Very low38.2Very low174 Ų174142 Ų14291%0.91177%0.767SS**  139.4133.2128.1-75.1159.5000110.3
441G31.2Very low38.1Very low71 Ų71144.3 Ų144.373%0.73278%0.775SS**  cis-159.3165.8-6.600000109.8
442R36.7Very low37.9Very low234 Ų234141.7 Ų141.788%0.88376%0.764SS**  trans-74.4147.4-175-62-73.1-172.9-170-1.4112.1
443H36.3Very low37.9Very low187 Ų187147.3 Ų147.387%0.86677%0.77SS**  -172.2143.1114.2-104.8-75.3000112.6
444T41Very low37.1Very low125 Ų125146 Ų14677%0.76776%0.764SS**  trans-111.4155.2162.353.10000108.8
445P46.1Very low37.2Very low126 Ų126147.1 Ų147.182%0.81877%0.766SS**  -144.8-179.899.338.1-21.9000115
446N34.6Very low36.8Very low146 Ų146148.4 Ų148.478%0.78176%0.763SS**  trans-55142.2179.4-73-53000114.8
447H36.4Very low36.9Very low187 Ų187154 Ų15487%0.86678%0.778SS**  -177145.5101.1-102.2-83.7000113
448H35.9Very low37Very low168 Ų168152.8 Ų152.878%0.77878%0.78SS**  trans-104.1157166.8-166.7-121.5000106.8
449P45.1Very low36.6Very low106 Ų106150.2 Ų150.269%0.68879%0.788SS**  cis-143.7-176.530.844.5-25.1000119
450S31.9Very low36.5Very low89 Ų89151.4 Ų151.462%0.62280%0.799SS**  trans7996.5148.4-160.20000119.6
451L34.3Very low36.2Very low176 Ų176147.1 Ų147.192%0.92180%0.797SS**  trans-81.9115.9143.1-94.767000108.2
452D32.2Very low36.5Very low110 Ų110149.2 Ų149.259%0.58880%0.8SS**  trans-105.1145.6161.3-179.333000109.6S454D452-S454 PolarHBondContact OD1-N 2.58Å; D452-S454 PolarHBondContact OD1-OG 3.29Å; D452-S454 WeakPolarHBondContact OD2-CB 3.4Å; D452-S454 PolarHBondContact OD2-OG 3.06Å
453W36.6Very low37Very low219 Ų219145.4 Ų145.483%0.8380%0.797SS**  trans-118.926.5-176.749.7-87.4000111.7T455W453-T455 PolarHBondContact O-N 2.91Å; W453-T455 PolarHBondContact O-OG1 3.33Å
454S33.2Very low37.2Very low96 Ų96145.6 Ų145.667%0.67180%0.798SS**  trans-48.9101.6176.9-78.30000112.4D452 E456D452-S454 PolarHBondContact OD1-N 2.58Å; D452-S454 PolarHBondContact OD1-OG 3.29Å; D452-S454 WeakPolarHBondContact OD2-CB 3.4Å; D452-S454 PolarHBondContact OD2-OG 3.06Å; S454-E456 PolarHBondContact O-N 3.46Å
455T35.6Very low37.4Very low127 Ų127150 Ų15078%0.77980%0.8SS**  trans-78.1111.1-179.2-63.50000109.5W453 Y457W453-T455 PolarHBondContact O-N 2.91Å; W453-T455 PolarHBondContact O-OG1 3.33Å; T455-Y457 PolarHBondContact O-N 3.41Å
456E34.5Very low37.1Very low174 Ų174151.6 Ų151.681%0.81380%0.802SS**  trans-55.2118172.3-179.9-174.2144.300111.3S454S454-E456 PolarHBondContact O-N 3.46Å
457Y34.3Very low37.7Very low216 Ų216153.4 Ų153.485%0.84780%0.803SS**  trans-165.961.4151.9-121.8-72.5000114.9T455T455-Y457 PolarHBondContact O-N 3.41Å
458H41.1Very low38.5Very low203 Ų203150.6 Ų150.694%0.9480%0.801SS**  trans-136.489.8165.1-88.2-52.2000112.3
459G31.6Very low39.1Very low74 Ų74150.7 Ų150.776%0.76381%0.807SS**  trans-141.389.7175.100000111.8G461G459-G461 PolarHBondContact O-N 3.38Å
460N36.4Very low39.3Very low172 Ų172156 Ų15692%0.9282%0.815SS**  trans-67.9122.6171-94.2-18.1000109.4S462N460-S462 PolarHBondContact O-N 3.21Å; N460-S462 VanDerWaalsContact O-N 3.07Å
461G36Very low40Very low84 Ų84159.1 Ų159.187%0.86682%0.823SS**  trans-63.9108.6178.600000112.2G459G459-G461 PolarHBondContact O-N 3.38Å
462S36.5Very low40.3Very low114 Ų114159.7 Ų159.780%0.79784%0.843SS**  trans-94.8140.6164-170.80000109.7N460 Q464N460-S462 PolarHBondContact O-N 3.21Å; N460-S462 VanDerWaalsContact O-N 3.07Å; S462-Q464 PolarHBondContact O-N 2.92Å
463L47.3Very low40.7Very low155 Ų155162.2 Ų162.281%0.81286%0.855SS**  trans-66.3121.9174.2-97.460.3000110.3
464Q40.3Very low41Very low190 Ų190159.2 Ų159.289%0.88886%0.857SS**  trans-137.1131143.4-139159.913.100109.8S462S462-Q464 PolarHBondContact O-N 2.92Å
465R44.7Very low41.4Very low217 Ų217162.7 Ų162.782%0.81987%0.867SS**  trans-86.8137170.7-52.1174.7-175.5102.2-2.5106.3
466D40.6Very low41.7Very low160 Ų160164.8 Ų164.886%0.85687%0.872SS**  trans-151.3161.6135.6-105-45.1000111.2
467K46.3Very low42.2Very low184 Ų184164.3 Ų164.380%0.888%0.876SS**  trans-98.5139.3-164.5-60168.6-176170.10111.3L469K467-L469 PolarHBondContact O-N 3.29Å
468P55Low42.7Very low128 Ų128160.8 Ų160.883%0.83188%0.878SS**  trans-70.9124.3162.130.5-31.6000109.3
469L48.6Very low42.8Very low171 Ų171157.8 Ų157.890%0.89587%0.873SS**  trans-122.5120.2159.6-92.8172000108K467K467-L469 PolarHBondContact O-N 3.29Å
470Y49.4Very low43.7Very low217 Ų217164.2 Ų164.285%0.85188%0.882SS**  trans-136.2106176.2-168.2-79.3000106.9
471L46.2Very low44.3Very low154 Ų154163.6 Ų163.681%0.80688%0.879SS**  trans-170.1141.9151.2-130.471.5000110.7
472S40.6Very low45Very low189 Ų189170.8 Ų170.8100%1.32288%0.88SS**  trans370151.9-60.90000119.3

Retrieved 472 of 472 residues in 284.9 ms (Link to these results)