A0A078BPG4_CAEEL Loading...

TSC22 domain family protein 1-like

AlphaFold DB , UniProt , Accession A0A078BPG4, Species CAEEL (Caenorhabditis elegans), Gene n/a, Length 207 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
1M43.2Very low49.6Very low245 Ų245146.3 Ų146.3100%1.20784%0.844SS**  0142.10-69.3161.972.900107.8
2S43.5Very low50.1Low122 Ų122143.5 Ų143.585%0.85384%0.835SS**  trans-81.8157.7-165.5-159.80000114.1
3S49.1Very low50.1Low113 Ų113142.8 Ų142.879%0.7983%0.833SS**  trans-71.2153.1-175.655.20000114.7
4G42.8Very low50.3Low79 Ų79142.4 Ų142.481%0.81482%0.819SS**  trans-156.647.4176.200000115.3S6G4-S6 PolarHBondContact O-N 2.75Å
5G48.1Very low50.7Low77 Ų77142.1 Ų142.179%0.79482%0.821SS**  trans-73.2110.6175.700000112.2R7G5-R7 PolarHBondContact O-N 3.1Å
6S55.6Low50.8Low109 Ų109145.8 Ų145.876%0.76282%0.817SS**  trans-7492.1-179.2-1660000111.9G4 F8G4-S6 PolarHBondContact O-N 2.75Å; S6-F8 PolarHBondContact O-N 3.29Å
7R59.2Low50.7Low229 Ų229143.8 Ų143.886%0.86481%0.805SS**  trans-85.996.8178.6-172.7173.9-179.5170.3-0.4110.1G5 K9G5-R7 PolarHBondContact O-N 3.1Å; R7-K9 PolarHBondContact O-N 3.25Å; R7-K9 VanDerWaalsContact O-N 3.09Å
8F47.2Very low51.1Low193 Ų193142.3 Ų142.385%0.84680%0.802SS**  trans-52.2115.9170-88.7-98.7000110.1S6S6-F8 PolarHBondContact O-N 3.29Å
9K55.9Low51.1Low189 Ų189146.5 Ų146.582%0.82281%0.806SS**  trans-85.7110.4170.4-72.6-173176.7-177.70108.3R7 V11R7-K9 PolarHBondContact O-N 3.25Å; R7-K9 VanDerWaalsContact O-N 3.09Å; K9-V11 PolarHBondContact O-N 3.36Å
10V52.3Low51.2Low138 Ų138147.8 Ų147.884%0.83680%0.803SS**  trans-67.9115.1166.1-178.40000107.4
11V48.9Very low51.2Low115 Ų115145 Ų14570%0.69780%0.795SS**  trans-80.1130.3172.8-176.80000107.6K9 V13K9-V11 PolarHBondContact O-N 3.36Å; V11-V13 PolarHBondContact O-N 3.14Å
12P55.7Low51.7Low113 Ų113138.3 Ų138.373%0.73477%0.769SS**  trans-62.5130173.2-18.331.1000109.8E14P12-E14 PolarHBondContact O-N 3.47Å; P12-E14 VanDerWaalsContact O-N 3.16Å
13V50.2Low52Low134 Ų134138.9 Ų138.981%0.81276%0.763SS**  trans-70.9108.2167.5174.40000107.2V11 T15V11-V13 PolarHBondContact O-N 3.14Å; V13-T15 PolarHBondContact O-N 3.29Å
14E52.1Low52.4Low137 Ų137137.4 Ų137.464%0.6477%0.765SS**  trans-60.6108.7168.7-90.3-171.6163.900108.9P12 R16P12-E14 PolarHBondContact O-N 3.47Å; P12-E14 VanDerWaalsContact O-N 3.16Å; E14-R16 HydrophobicContact CB-CG 4.1Å; E14-R16 PolarHBondContact O-N 3.3Å; E14-R16 IonicContact OE2-CZ 3.45Å; E14-R16 IonicContact OE2-NE 2.94Å; E14-R16 PolarHBondContact OE2-NE 2.99Å; E14-R16 IonicContact OE2-NH2 3.02Å; E14-R16 PolarHBondContact OE2-NH2 3.02Å
15T56.1Low52.9Low138 Ų138142.2 Ų142.285%0.84776%0.764SS**  trans-67.585.1165.2-44.20000108.3V13 D17V13-T15 PolarHBondContact O-N 3.29Å; T15-D17 PolarHBondContact O-N 3.48Å
16R53.3Low52.9Low201 Ų201147.1 Ų147.176%0.75877%0.766SS**  trans-7291.6-180-74-166.5168.9-156.1-8.1110.7E14E14-R16 HydrophobicContact CB-CG 4.1Å; E14-R16 PolarHBondContact O-N 3.3Å; E14-R16 IonicContact OE2-CZ 3.45Å; E14-R16 IonicContact OE2-NE 2.94Å; E14-R16 PolarHBondContact OE2-NE 2.99Å; E14-R16 IonicContact OE2-NH2 3.02Å; E14-R16 PolarHBondContact OE2-NH2 3.02Å
17D49.5Very low52.4Low113 Ų113147.1 Ų147.160%0.60477%0.772SS**  trans-59.6119.4168.7-149.1-12.5000108.8T15 Y19 F20T15-D17 PolarHBondContact O-N 3.48Å; D17-Y19 PolarHBondContact O-N 3.06Å; D17-F20 PolarHBondContact O-N 3.2Å; D17-F20 VanDerWaalsContact O-N 3.16Å
18P56.4Low51.7Low116 Ų116144 Ų14475%0.75377%0.771SS**THydrogen-bonded Turntrans-67.74.4-167.925.4-35000115.1
19Y51.3Low51.8Low222 Ų222139 Ų13987%0.87177%0.766SS**THydrogen-bonded Turntrans-113.5-0.8179.1-73.5-79.2000114.8D17D17-Y19 PolarHBondContact O-N 3.06Å
20F53.3Low51.6Low173 Ų173139.2 Ų139.276%0.75977%0.767SS**  trans-107.5115.4179.3-162.6-98.6000112.4D17D17-F20 PolarHBondContact O-N 3.2Å; D17-F20 VanDerWaalsContact O-N 3.16Å
21S50.5Low51.1Low90 Ų90138.9 Ų138.963%0.62977%0.767SS**  trans-105.9127.4174.3-170.20000110N23S21-N23 VanDerWaalsContact C-N 3.28Å; S21-N23 PolarHBondContact O-N 3.12Å
22P54.9Low51.1Low103 Ų103139.5 Ų139.567%0.66977%0.772SS**SBendtrans-71.1-20.3-171.2-16.729.8000114.5
23N49.8Very low50.5Low134 Ų134138.4 Ų138.472%0.71777%0.772SS**SBendtrans-105.998.1-173.1-67.9-12.6000109.4S21 K25S21-N23 VanDerWaalsContact C-N 3.28Å; S21-N23 PolarHBondContact O-N 3.12Å; N23-K25 VanDerWaalsContact C-N 3.28Å; N23-K25 PolarHBondContact O-N 2.98Å
24G56.3Low50Low82 Ų82136.2 Ų136.285%0.84577%0.768SS**  trans-68.967.1-170.400000116.1
25K53.9Low49.8Very low180 Ų180137.1 Ų137.178%0.78378%0.776SS**  trans-135.9139163.6-63.2-168.4178.7-173.80108.9N23N23-K25 VanDerWaalsContact C-N 3.28Å; N23-K25 PolarHBondContact O-N 2.98Å
26H48.5Very low49.1Very low180 Ų180139.6 Ų139.683%0.83378%0.775SS**  trans76.381.9-168-46.4-69.7000115.1I28H26-I28 PolarHBondContact O-N 3.37Å
27A45Very low48.5Very low109 Ų109137.2 Ų137.290%0.90178%0.777SS**  trans-74.4111.6160.900000109.5
28I44.9Very low48.2Very low163 Ų163139.7 Ų139.784%0.83679%0.789SS**PPolyproline II helixtrans-81.7119.5167.4-61.4175.1000107.3H26H26-I28 PolarHBondContact O-N 3.37Å
29A48.9Very low47.7Very low90 Ų90142.1 Ų142.174%0.74479%0.79SS**PPolyproline II helixtrans-66.1138.5-178.900000111.5
30K51.6Low47.7Very low193 Ų193137.2 Ų137.284%0.83979%0.785SS**PPolyproline II helixtrans-60.6142.6169-67.3-179.3177.8-179.20109.6T32K30-T32 PolarHBondContact O-N 3Å
31P42.3Very low47Very low130 Ų130134.4 Ų134.484%0.84479%0.787SS**  trans-68.498.5170.428.1-32.8000109.8A33P31-A33 PolarHBondContact O-N 3.05Å
32T47.8Very low46.3Very low128 Ų128135.2 Ų135.279%0.78579%0.792SS**  trans-64.8115165.1-81.10000108.5K30 A34K30-T32 PolarHBondContact O-N 3Å; T32-A34 PolarHBondContact O-N 3.08Å; T32-A34 VanDerWaalsContact O-N 3.1Å
33A43.5Very low45.5Very low91 Ų91136 Ų13675%0.75280%0.8SS**  trans-68.4105.4168.600000108.8P31 I35P31-A33 PolarHBondContact O-N 3.05Å; A33-I35 PolarHBondContact O-N 3.35Å; A33-I35 VanDerWaalsContact O-N 3.11Å
34A40.7Very low45.2Very low88 Ų88135.3 Ų135.373%0.72780%0.804SS**  trans-69.2106.6177.200000110.3T32 K36T32-A34 PolarHBondContact O-N 3.08Å; T32-A34 VanDerWaalsContact O-N 3.1Å; A34-K36 PolarHBondContact O-N 2.79Å; A34-K36 VanDerWaalsContact O-N 3.11Å
35I46.8Very low44.3Very low155 Ų155137.4 Ų137.480%0.79581%0.805SS**  trans-67.3107.7167.3-61.7175.1000107.2A33 N37A33-I35 PolarHBondContact O-N 3.35Å; A33-I35 VanDerWaalsContact O-N 3.11Å; I35-N37 PolarHBondContact O-N 3.09Å; I35-N37 VanDerWaalsContact O-N 3.14Å
36K42.5Very low43.6Very low190 Ų190135.1 Ų135.183%0.82681%0.806SS**  trans-68.4108.5169.8-82.4-176.2173.4-179.90108.9A34 I38A34-K36 PolarHBondContact O-N 2.79Å; A34-K36 VanDerWaalsContact O-N 3.11Å; K36-I38 PolarHBondContact O-N 2.89Å; K36-I38 VanDerWaalsContact O-N 3.16Å
37N39.3Very low43.1Very low152 Ų152133.3 Ų133.381%0.81381%0.807SS**  trans-55.7115.8164.5-84.1-35000109.5I35I35-N37 PolarHBondContact O-N 3.09Å; I35-N37 VanDerWaalsContact O-N 3.14Å
38I43.2Very low42.9Very low164 Ų164136.5 Ų136.584%0.84180%0.803SS**  trans-88.5113.6166.4-61.1176.8000106.7K36K36-I38 PolarHBondContact O-N 2.89Å; K36-I38 VanDerWaalsContact O-N 3.16Å
39H46.1Very low43.3Very low167 Ų167134 Ų13477%0.77380%0.798SS**  trans-71.6145.1178.4-124.5-102.1000111
40P51.8Low42.7Very low119 Ų119136.1 Ų136.177%0.77380%0.802SS**  trans-79.5129172.231.6-32.4000110.6
41S38.2Very low42Very low115 Ų115132.6 Ų132.680%0.80480%0.801SS**  trans-162104.8171.6-177.20000111.9
42S36.9Very low41.7Very low106 Ų106129.6 Ų129.674%0.74179%0.794SS**  trans174.8100.4130.358.90000112.3
43S38.7Very low41.3Very low119 Ų119131.8 Ų131.883%0.83280%0.799SS**  trans62.7135.7144.4-52.90000122.5
44P43Very low41.8Very low121 Ų121132.8 Ų132.879%0.78680%0.798SS**  trans-90.2150169.736.9-32.9000112.3
45S37.6Very low41.5Very low126 Ų126134.5 Ų134.588%0.88180%0.8SS**  trans-121.2120.2162.7-820000110.4
46V38.8Very low41.1Very low131 Ų131134.6 Ų134.679%0.79480%0.797SS**  trans-83.2126.7175.7171.20000109.6
47V38.2Very low41.3Very low142 Ų142134.1 Ų134.186%0.86180%0.797SS**  trans-140137.7152.8-172.90000108.7
48Q39.9Very low41.1Very low176 Ų176137.3 Ų137.382%0.82280%0.798SS**  trans-95.2179.1-174.9-106.9-164.6-1500112.5
49P53.8Low40.9Very low110 Ų110135.4 Ų135.471%0.71480%0.796SS**  trans-105.9164-144.640.8-37.5000115.9
50T36.9Very low40.7Very low135 Ų135130.8 Ų130.883%0.82879%0.787SS**  trans-138.3113161.745.10000113
51S37.1Very low40.2Very low119 Ų119130.5 Ų130.583%0.83279%0.787SS**  trans24.2128.9143.758.30000122.5
52G34.1Very low40.7Very low68 Ų68132.8 Ų132.870%0.70179%0.785SS**  129.994.9115.800000121.2
53I40Very low40.9Very low173 Ų173135.8 Ų135.889%0.88779%0.792SS**  trans74.8147.9141.2-64.7178.7000118.3
54P53.8Low41.1Very low112 Ų112137.6 Ų137.673%0.72779%0.791SS**  trans-120.8-162.3-15440.1-23.3000115.4
55V34.7Very low41.4Very low125 Ų125135.8 Ų135.876%0.75879%0.786SS**  trans92.2112168.8-169.80000116.6
56Q39Very low41.9Very low157 Ų157135.7 Ų135.773%0.73478%0.782SS**  -179.5115.9109.8-175.561.145.900110.9
57Q45.5Very low42.1Very low179 Ų179136.5 Ų136.584%0.83678%0.782SS**  trans-78.8131.8172.3-153.1170.914.900109.3
58R35.8Very low42.6Very low220 Ų220135 Ų13583%0.8378%0.776SS**  trans-142.4117169.8-169-171.8-62.8-161.82.6109.4A60R58-A60 PolarHBondContact O-N 3.36Å
59P39.8Very low43Very low124 Ų124135.7 Ų135.781%0.80578%0.776SS**  trans-75.1108.3174.929.6-31.4000109.4S61P59-S61 PolarHBondContact O-N 3.25Å
60A41.4Very low42.8Very low70 Ų70135.1 Ų135.158%0.57977%0.772SS**  trans-77104.1168.900000109.1R58 H62R58-A60 PolarHBondContact O-N 3.36Å; A60-H62 PolarHBondContact O-N 2.9Å; A60-H62 PolarHBondContact O-ND1 3.28Å
61S42Very low43.2Very low112 Ų112134.8 Ų134.878%0.78377%0.769SS**  trans-6597.5171.136.20000110.3P59 L63P59-S61 PolarHBondContact O-N 3.25Å; S61-L63 PolarHBondContact O-N 3.31Å
62H47.1Very low43.3Very low163 Ų163138.7 Ų138.776%0.75577%0.768SS**  trans-76.193.8176.3-73.658.1000109.6A60 I64A60-H62 PolarHBondContact O-N 2.9Å; A60-H62 PolarHBondContact O-ND1 3.28Å; H62-I64 PolarHBondContact O-N 3.31Å; H62-I64 VanDerWaalsContact O-N 3.14Å
63L41.6Very low44.3Very low170 Ų170141.4 Ų141.489%0.8977%0.77SS**  trans-66.6106.1166.3-76.6164.6000108.8S61 A65S61-L63 PolarHBondContact O-N 3.31Å; L63-A65 PolarHBondContact O-N 2.83Å; L63-A65 VanDerWaalsContact O-N 3.11Å
64I42.3Very low44.4Very low157 Ų157139.4 Ų139.481%0.80577%0.766SS**  trans-71.8104175.2-63.6167.3000107.9H62H62-I64 PolarHBondContact O-N 3.31Å; H62-I64 VanDerWaalsContact O-N 3.14Å
65A49.9Very low43.7Very low82 Ų82139.3 Ų139.368%0.67877%0.765SS**PPolyproline II helixtrans-66.6134.3170.500000109.8L63 N67L63-A65 PolarHBondContact O-N 2.83Å; L63-A65 VanDerWaalsContact O-N 3.11Å; A65-N67 PolarHBondContact O-N 3.45Å
66P47.6Very low44.3Very low125 Ų125143.2 Ų143.281%0.81277%0.772SS**PPolyproline II helixtrans-67.4126.9177.226.8-32.9000110.5
67N43.5Very low44.7Very low148 Ų148141.8 Ų141.879%0.79177%0.774SS**PPolyproline II helixtrans-58124.3179.5-171.825000111A65 K69A65-N67 PolarHBondContact O-N 3.45Å; N67-K69 PolarHBondContact O-N 3.48Å
68P49.7Very low44.7Very low111 Ų111137 Ų13772%0.72177%0.765SS**PPolyproline II helixtrans-64.6133.7178.625.5-33.8000111.1
69K47.4Very low45.3Very low189 Ų189132.7 Ų132.782%0.82277%0.766SS**PPolyproline II helixtrans-65.7140.8179.1-63.9179.7-179.5178.90110.4N67 V71N67-K69 PolarHBondContact O-N 3.48Å; K69-V71 PolarHBondContact O-N 3.45Å
70P48.7Very low45.9Very low98 Ų98133.1 Ų133.164%0.63677%0.766SS**PPolyproline II helixtrans-64.3124.8175.926.8-33.6000110.5Y72P70-Y72 HydrophobicContact CB-CE2 4.33Å; P70-Y72 HydrophobicContact CG-CE2 4.04Å; P70-Y72 PolarHBondContact O-N 2.93Å
71V45.8Very low46.5Very low128 Ų128134 Ų13478%0.77677%0.773SS**  trans-85.4108173.8178.40000108K69 T73K69-V71 PolarHBondContact O-N 3.45Å; V71-T73 HydrophobicContact CG1-CG2 4.42Å; V71-T73 PolarHBondContact O-N 2.89Å
72Y40.3Very low46.5Very low202 Ų202136.8 Ų136.879%0.79277%0.774SS**  trans-77.5103.5172.6-69.3-89.6000109.8P70P70-Y72 HydrophobicContact CB-CE2 4.33Å; P70-Y72 HydrophobicContact CG-CE2 4.04Å; P70-Y72 PolarHBondContact O-N 2.93Å
73T54.1Low46.3Very low124 Ų124135 Ų13576%0.76177%0.774SS**  trans-81.7115.9168.843.80000109.6V71 P75V71-T73 HydrophobicContact CG1-CG2 4.42Å; V71-T73 PolarHBondContact O-N 2.89Å; T73-P75 WeakPolarHBondContact O-CD 3.27Å
74V41.9Very low46.6Very low132 Ų132135.1 Ų135.180%0.877%0.767SS**  trans-69.9126.9174.6-178.10000108.9K76V74-K76 PolarHBondContact O-N 3.24Å
75P40.6Very low46.8Very low109 Ų109131.3 Ų131.371%0.70876%0.76SS**  trans-59.4120.9173-24.134.8000110.6T73 V77T73-P75 WeakPolarHBondContact O-CD 3.27Å; P75-V77 PolarHBondContact O-N 3.17Å
76K45.5Very low46.7Very low208 Ų208131.4 Ų131.490%0.90476%0.755SS**  trans-73.292.9177.5-173.8173.9-178.8176.70109.4V74 A78V74-K76 PolarHBondContact O-N 3.24Å; K76-A78 PolarHBondContact O-N 3.28Å
77V48.8Very low46.9Very low127 Ų127129.9 Ų129.977%0.7774%0.744SS**PPolyproline II helixtrans-59.2129.8175.6-163.80000109.1P75P75-V77 PolarHBondContact O-N 3.17Å
78A45.5Very low47.2Very low78 Ų78127.8 Ų127.865%0.64573%0.732SS**PPolyproline II helixtrans-67.8143177.800000110.4K76 T80K76-A78 PolarHBondContact O-N 3.28Å; A78-T80 PolarHBondContact O-N 3.02Å
79P47.2Very low47.1Very low130 Ų130128.3 Ų128.384%0.84473%0.727SS**PPolyproline II helixtrans-65.8120.6-179.126-33.3000111.2
80T54Low47.1Very low132 Ų132125.7 Ų125.781%0.8172%0.718SS**PPolyproline II helixtrans-62152.7174.7-410000111.1A78 Q82A78-T80 PolarHBondContact O-N 3.02Å; T80-Q82 PolarHBondContact O-N 3.15Å
81A53.3Low46.9Very low89 Ų89127.2 Ų127.274%0.73673%0.727SS**PPolyproline II helixtrans-46.7130-166.600000115.5V83A81-V83 PolarHBondContact O-N 2.92Å
82Q42.6Very low47.5Very low170 Ų170124.2 Ų124.279%0.79471%0.71SS**  trans-74.3108.5173.1-70.3-168.3-20.500111T80 K84T80-Q82 PolarHBondContact O-N 3.15Å; Q82-K84 PolarHBondContact O-N 3.16Å
83V43Very low48Very low126 Ų126121.8 Ų121.876%0.76472%0.715SS**  trans-75.899.9169.3-178.10000109.1A81 A85A81-V83 PolarHBondContact O-N 2.92Å; V83-A85 PolarHBondContact O-N 3.06Å
84K47.1Very low47.8Very low172 Ų172123 Ų12375%0.74872%0.717SS**  trans-85.497.9169.1-78.3-172.5175.6-178.60110.1Q82Q82-K84 PolarHBondContact O-N 3.16Å
85A46.7Very low48.3Very low78 Ų78120.1 Ų120.165%0.64571%0.714SS**  trans-83.8117.4166.400000109.7V83V83-A85 PolarHBondContact O-N 3.06Å
86S48.3Very low48.7Very low84 Ų84122.3 Ų122.359%0.58772%0.715SS**EExtended strand (participates in β ladder)trans-108.4117.7174.3-68.70000109.8
87T50.7Low48.8Very low92 Ų92117.3 Ų117.356%0.56470%0.701SS**EExtended strand (participates in β ladder)trans-105.8116.9173.8-58.90000108.9I89 V99T87-I89 HydrophobicContact CG2-CG1 4.27Å; T87-V99 HydrophobicContact CG2-CG1 4.31Å
88I50.7Low48.6Very low105 Ų105118.4 Ų118.454%0.53870%0.696SS.*EExtended strand (participates in β ladder)trans-103.2116.1176.7-63.5175.2000108.5Q90I88-Q90 HydrophobicContact CG2-CG 4.01Å
89I48Very low48.6Very low122 Ų122119 Ų11963%0.62669%0.691SS**EExtended strand (participates in β ladder)trans-100.5108.5173.2-55.8176.9000107.5T87 V97T87-I89 HydrophobicContact CG2-CG1 4.27Å; I89-V97 HydrophobicContact CG2-CG1 4.31Å
90Q45.5Very low48.7Very low134 Ų134116.1 Ų116.163%0.62667%0.674SS**EExtended strand (participates in β ladder)trans-102.5123.2170.9-7717330.800109.6I88 T92I88-Q90 HydrophobicContact CG2-CG 4.01Å; Q90-T92 PolarHBondContact O-N 2.8Å
91P44.9Very low48.3Very low129 Ų129114.1 Ų114.184%0.83867%0.666SS**PPolyproline II helixtrans-70124.7173.728.5-32.3000109.6
92T58.3Low48Very low66 Ų66116.8 Ų116.841%0.40566%0.663SS.*PPolyproline II helixtrans-99.5142.8169.9780000110Q90 N94 G95 Q96Q90-T92 PolarHBondContact O-N 2.8Å; T92-N94 PolarHBondContact O-N 3.18Å; T92-G95 PolarHBondContact O-N 3.06Å; T92-Q96 PolarHBondContact OG1-O 3.42Å
93V51.6Low48.1Very low150 Ų150113.2 Ų113.291%0.90965%0.653SS**THydrogen-bonded Turntrans-69.5-4.1-170.7-139.20000114
94N49.4Very low48.3Very low150 Ų150115.2 Ų115.280%0.80265%0.654SS**THydrogen-bonded Turntrans-11620-175.7-64.47.1000113.1T92 Q96T92-N94 PolarHBondContact O-N 3.18Å; N94-Q96 VanDerWaalsContact C-N 3.3Å; N94-Q96 PolarHBondContact O-N 2.92Å
95G53.6Low48.1Very low71 Ų71113.5 Ų113.573%0.73265%0.651SS**SBendtrans75.93.4171.500000116.6T92T92-G95 PolarHBondContact O-N 3.06Å
96Q49.3Very low47.9Very low156 Ų156116 Ų11673%0.72966%0.664SS**  trans-91.1109.2170.9-75.5-168.8-12.200110.9T92 N94 K98T92-Q96 PolarHBondContact OG1-O 3.42Å; N94-Q96 VanDerWaalsContact C-N 3.3Å; N94-Q96 PolarHBondContact O-N 2.92Å; Q96-K98 PolarHBondContact O-N 2.99Å; Q96-K98 VanDerWaalsContact O-N 3.14Å
97V46.7Very low47.7Very low102 Ų102117 Ų11762%0.61867%0.667SS**  trans-75.999.9171.1-174.40000108.8I89 V99I89-V97 HydrophobicContact CG2-CG1 4.31Å; V97-V99 HydrophobicContact CG1-CG2 3.85Å; V97-V99 PolarHBondContact O-N 3.47Å
98K45.3Very low47.4Very low151 Ų151116.6 Ų116.666%0.65768%0.681SS**EExtended strand (participates in β ladder)trans-82.795.4173.5-171.8-177.3177.2-172.70109.4Q96Q96-K98 PolarHBondContact O-N 2.99Å; Q96-K98 VanDerWaalsContact O-N 3.14Å
99V45.2Very low46.8Very low89 Ų89117.1 Ų117.154%0.53969%0.689SS.*EExtended strand (participates in β ladder)trans-82.2114.5173.4-174.70000109.2T87 V97T87-V99 HydrophobicContact CG2-CG1 4.31Å; V97-V99 HydrophobicContact CG1-CG2 3.85Å; V97-V99 PolarHBondContact O-N 3.47Å
100S49.3Very low46.4Very low70 Ų70120.5 Ų120.549%0.4970%0.704SS.*EExtended strand (participates in β ladder)trans-104.1118.6167.1-66.10000108.9
101S45.8Very low45.9Very low91 Ų91120.2 Ų120.264%0.63671%0.712SS**EExtended strand (participates in β ladder)trans-113.5119.2170.157.60000109
102E45.6Very low45.7Very low144 Ų144119 Ų11967%0.67371%0.712SS**EExtended strand (participates in β ladder)trans-115.4119.8-179.8-161.1171-134.500109.3Q104E102-Q104 HydrophobicContact CG-CG 4.48Å
103T45.9Very low44.6Very low96 Ų96125.1 Ų125.159%0.58974%0.736SS**  trans-111.395.8179.6-55.90000108.3I105T103-I105 HydrophobicContact CG2-CG1 4.23Å; T103-I105 PolarHBondContact O-N 3.19Å
104Q46.3Very low44.1Very low167 Ų167122.4 Ų122.478%0.7873%0.729SS**  trans-81.2112.5176.1-65.1-161.19.300110.5E102E102-Q104 HydrophobicContact CG-CG 4.48Å
105I43.2Very low43.7Very low136 Ų136123.1 Ų123.170%0.69773%0.733SS**  trans-103.1104.5173.6-34.4175.6000107.2T103 T107T103-I105 HydrophobicContact CG2-CG1 4.23Å; T103-I105 PolarHBondContact O-N 3.19Å; I105-T107 VanDerWaalsContact C-N 3.33Å; I105-T107 HydrophobicContact CG2-CG2 3.99Å; I105-T107 PolarHBondContact O-N 3.14Å
106S42.8Very low43.1Very low130 Ų130128.4 Ų128.491%0.90974%0.739SS**  trans-81.980.2177.3-1670000110.4
107T43.8Very low42.5Very low106 Ų106125.8 Ų125.865%0.6574%0.738SS**  trans-95.3101.5171.5480000110.3I105 V109I105-T107 VanDerWaalsContact C-N 3.33Å; I105-T107 HydrophobicContact CG2-CG2 3.99Å; I105-T107 PolarHBondContact O-N 3.14Å; T107-V109 VanDerWaalsContact C-N 3.28Å; T107-V109 PolarHBondContact O-N 3.13Å
108G45Very low42.4Very low83 Ų83131.9 Ų131.986%0.85675%0.749SS**  trans-73.876171.700000112.2
109V36.7Very low42.4Very low116 Ų116136.2 Ų136.270%0.70376%0.762SS**  trans-134.7118.9170.2-175.60000109.2T107 V111T107-V109 VanDerWaalsContact C-N 3.28Å; T107-V109 PolarHBondContact O-N 3.13Å; V109-V111 HydrophobicContact CG1-CG2 4.35Å; V109-V111 PolarHBondContact O-N 2.8Å
110M39.6Very low42Very low193 Ų193138.6 Ų138.695%0.95178%0.777SS**  trans-81.4112.1178.2-68-89.9-7800109.9
111V35.3Very low41.8Very low129 Ų129144.8 Ų144.878%0.78280%0.795SS**  trans-130.5123.2161.3-174.10000107.9V109V109-V111 HydrophobicContact CG1-CG2 4.35Å; V109-V111 PolarHBondContact O-N 2.8Å
112A41.3Very low41.4Very low102 Ų102152.5 Ų152.584%0.84381%0.81SS**  trans-90.5129.3179.100000110
113E35.5Very low41.2Very low196 Ų196150 Ų15092%0.91681%0.814SS**  trans-142.9133.9162-162.2154.7-156.800110.6
114A40.3Very low41.2Very low92 Ų92151.6 Ų151.676%0.7683%0.826SS**  trans-88.4143.7-171.200000111.1
115N40.5Very low40.9Very low165 Ų165151.3 Ų151.388%0.88283%0.829SS**  trans-138.9111.6164.6-137-27.6000111.9
116Q40.8Very low40.8Very low182 Ų182150.6 Ų150.685%0.8583%0.831SS**  trans-86.2134.8169.2-62.21755.200108.6
117S37.7Very low40.4Very low101 Ų101156.2 Ų156.271%0.70683%0.832SS**  -178.3127.9128.5-157.20000114.4
118R44Very low40.3Very low230 Ų230155.2 Ų155.287%0.86883%0.834SS**  trans54.290.2143.2-69.9177.1171.5176-2.6121.3T120R118-T120 PolarHBondContact O-N 2.96Å
119R45.5Very low40.1Very low243 Ų243160.5 Ų160.592%0.91783%0.833SS**  -23.5121123.9174-170.9-175.1-179.51.8114.9
120T37.6Very low40.2Very low139 Ų139161.2 Ų161.285%0.85384%0.838SS**  trans-152.413413736.30000111.3R118R118-T120 PolarHBondContact O-N 2.96Å
121K45.7Very low40.7Very low200 Ų200159 Ų15987%0.8784%0.835SS**  trans-92.2137167.9-59.5179.8-177.7-1740109
122R35.7Very low41.2Very low252 Ų252158.4 Ų158.495%0.95183%0.832SS**  trans175.1128.7141.6-102.2163.9171.1-147.8-6.2112.2
123A42Very low41.8Very low91 Ų91158.5 Ų158.575%0.75283%0.832SS**  trans-82.5163.1155.900000109.5
124P46.9Very low42.5Very low131 Ų131153.6 Ų153.685%0.85183%0.826SS**  -149173.896.739.5-23.1000117
125L38.5Very low43.2Very low160 Ų160154.1 Ų154.184%0.83882%0.823SS**  trans-109.1156.9170.3-144.474.5000107.6
126V41.4Very low44Very low121 Ų121151.3 Ų151.373%0.73382%0.815SS**  cis-146.7144.79.3-151.10000109.4
127R34.9Very low44.8Very low249 Ų249146.5 Ų146.594%0.9480%0.799SS**  trans-158.5134.2144.7-159.571.1-178.1-166.4-0.6111.6
128A41.2Very low45.7Very low84 Ų84145.1 Ų145.169%0.69479%0.794SS**  trans-108.4167.6-176.400000113.2
129K40.8Very low46.3Very low194 Ų194140 Ų14084%0.84378%0.78SS**  trans72.196.8169.8-70.6-178.9170.9179.60118.1
130T38.1Very low47Very low131 Ų131133.1 Ų133.180%0.80476%0.761SS**  -132.9129.9117.3-390000108.2V132T130-V132 HydrophobicContact CG2-CG2 4.05Å; T130-V132 PolarHBondContact O-N 3.26Å
131V51.5Low48.1Very low146 Ų146130.7 Ų130.789%0.88575%0.745SS**  trans-87108.2174.8-153.70000107
132V45.7Very low49Very low118 Ų118126.4 Ų126.472%0.71573%0.732SS**  trans-125.6120.9171.2-172.30000106.9T130 A134T130-V132 HydrophobicContact CG2-CG2 4.05Å; T130-V132 PolarHBondContact O-N 3.26Å; V132-A134 VanDerWaalsContact C-N 3.33Å; V132-A134 PolarHBondContact O-N 3.02Å
133A53.7Low51.3Low103 Ų103117.9 Ų117.985%0.85171%0.705SS**  trans-69.889.6179.200000109.8S135A133-S135 PolarHBondContact O-N 3.28Å
134A50.9Low53.6Low94 Ų94118 Ų11878%0.77769%0.692SS**PPolyproline II helixtrans-71.1119.3164.900000108.3V132V132-A134 VanDerWaalsContact C-N 3.33Å; V132-A134 PolarHBondContact O-N 3.02Å
135S53.5Low55.8Low102 Ų102115.5 Ų115.571%0.71367%0.672SS**PPolyproline II helixtrans-46.8143.7176.5-173.10000111.9A133A133-S135 PolarHBondContact O-N 3.28Å
136P58.4Low58.4Low107 Ų107111.8 Ų111.870%0.69565%0.652SS**PPolyproline II helixtrans-52.6136.7170.823.7-34.3000110A138P136-A138 PolarHBondContact O-N 2.94Å
137P56.4Low60.9Low80 Ų80112.8 Ų112.852%0.51965%0.647SS.*PPolyproline II helixtrans-69120.8-164.825.4-34.1000111.6H139 N140P137-H139 HydrophobicContact CB-CB 3.93Å; P137-H139 PolarHBondContact O-N 2.84Å; P137-N140 PolarHBondContact O-N 2.92Å; P137-N140 VanDerWaalsContact O-N 3.13Å; P137-N140 PolarHBondContact O-ND2 2.84Å
138A57.5Low63.8Low73 Ų73105.7 Ų105.760%0.60363%0.626SS**THydrogen-bonded Turntrans-55.9-14.1167.800000113.1P136 N140 V141P136-A138 PolarHBondContact O-N 2.94Å; A138-N140 PolarHBondContact O-N 2.87Å; A138-N140 VanDerWaalsContact O-N 3.1Å; A138-V141 PolarHBondContact O-N 3.45Å
139H57.1Low66.4Low123 Ų123106.9 Ų106.957%0.56962%0.618SS**Hα-helixtrans-50.2-27.5169.6-151.7-17.3000113.8P137 N143P137-H139 HydrophobicContact CB-CB 3.93Å; P137-H139 PolarHBondContact O-N 2.84Å; H139-N143 PolarHBondContact ND1-OD1 2.92Å; H139-N143 WeakPolarHBondContact O-CB 3.41Å; H139-N143 PolarHBondContact O-N 2.84Å; H139-N143 PolarHBondContact O-OD1 3.16Å
140N58.7Low69.1Low98 Ų98104 Ų10452%0.52461%0.607SS.*Hα-helixtrans-72.7-35.1178.2-62.5-35.7000112.8P137 A138 N143 I144P137-N140 PolarHBondContact O-N 2.92Å; P137-N140 VanDerWaalsContact O-N 3.13Å; P137-N140 PolarHBondContact O-ND2 2.84Å; A138-N140 PolarHBondContact O-N 2.87Å; A138-N140 VanDerWaalsContact O-N 3.1Å; N140-N143 PolarHBondContact O-N 3.18Å; N140-I144 WeakPolarHBondContact O-CD1 3.04Å; N140-I144 WeakPolarHBondContact O-CG1 3.47Å; N140-I144 PolarHBondContact O-N 3.46Å
141V61.3Low71.9Confident87 Ų87100.3 Ų100.353%0.52759%0.59SS.*Hα-helixtrans-74-48.9-175.8-176.80000110.3A138 N143 I144 D145A138-V141 PolarHBondContact O-N 3.45Å; V141-N143 PolarHBondContact O-N 3.39Å; V141-N143 VanDerWaalsContact O-N 3.12Å; V141-I144 WeakPolarHBondContact O-CA 3.49Å; V141-I144 WeakPolarHBondContact O-CB 3.42Å; V141-I144 PolarHBondContact O-N 3.2Å; V141-D145 PolarHBondContact O-N 3.49Å; V141-D145 VanDerWaalsContact O-N 3.11Å
142L65.5Low74.1Confident111 Ų11198.4 Ų98.458%0.58157%0.573SS**Hα-helixtrans-56.5-31.2174.3-59.4176.6000112.5N146L142-N146 VanDerWaalsContact O-CG 3.24Å; L142-N146 PolarHBondContact O-N 2.96Å; L142-N146 PolarHBondContact O-ND2 3.23Å; L142-N146 VanDerWaalsContact O-ND2 3.15Å
143N82.3Confident76.6Confident73 Ų7396.4 Ų96.439%0.3956%0.558SS.*Hα-helixtrans-79.4-19.5177-71.521.8000113.4H139 N140 V141 K147H139-N143 PolarHBondContact ND1-OD1 2.92Å; H139-N143 WeakPolarHBondContact O-CB 3.41Å; H139-N143 PolarHBondContact O-N 2.84Å; H139-N143 PolarHBondContact O-OD1 3.16Å; N140-N143 PolarHBondContact O-N 3.18Å; V141-N143 PolarHBondContact O-N 3.39Å; V141-N143 VanDerWaalsContact O-N 3.12Å; N143-K147 VanDerWaalsContact O-CD 3.31Å; N143-K147 WeakPolarHBondContact O-CD 3.36Å; N143-K147 VanDerWaalsContact O-CG 3.25Å; N143-K147 WeakPolarHBondContact O-CG 3.26Å
144I90.6Very high78.7Confident92 Ų9297.5 Ų97.547%0.47255%0.549SS..Hα-helixtrans-80.2-46.2173.8-71.3162000109.8N140 V141 N146 K147 I148N140-I144 WeakPolarHBondContact O-CD1 3.04Å; N140-I144 WeakPolarHBondContact O-CG1 3.47Å; N140-I144 PolarHBondContact O-N 3.46Å; V141-I144 WeakPolarHBondContact O-CA 3.49Å; V141-I144 WeakPolarHBondContact O-CB 3.42Å; V141-I144 PolarHBondContact O-N 3.2Å; I144-N146 VanDerWaalsContact C-N 3.33Å; I144-N146 PolarHBondContact O-N 2.91Å; I144-K147 CarbonylContact O-C 3.58Å; I144-K147 WeakPolarHBondContact O-CA 3.5Å; I144-K147 WeakPolarHBondContact O-CB 3.44Å; I144-K147 PolarHBondContact O-N 3.24Å; I144-I148 HydrophobicContact CG2-CD1 3.81Å; I144-I148 HydrophobicContact CG2-CG1 4.35Å; I144-I148 WeakPolarHBondContact O-CG1 3.21Å; I144-I148 PolarHBondContact O-N 3.35Å
145D93.7Very high81Confident80 Ų8097.8 Ų97.843%0.42854%0.541SS..Hα-helixtrans-58.3-47.3178.9-59.5-30.2000110.6V141 K147 I148 E149V141-D145 PolarHBondContact O-N 3.49Å; V141-D145 VanDerWaalsContact O-N 3.11Å; D145-K147 PolarHBondContact O-N 3.08Å; D145-I148 WeakPolarHBondContact O-CB 3.46Å; D145-I148 PolarHBondContact O-N 2.83Å; D145-E149 PolarHBondContact O-N 3.45Å
146N92.9Very high83.1Confident81 Ų8197.9 Ų97.943%0.43353%0.529SS..Hα-helixtrans-58-30.4173.2-73-20.1000113.8L142 I144 Q150L142-N146 VanDerWaalsContact O-CG 3.24Å; L142-N146 PolarHBondContact O-N 2.96Å; L142-N146 PolarHBondContact O-ND2 3.23Å; L142-N146 VanDerWaalsContact O-ND2 3.15Å; I144-N146 VanDerWaalsContact C-N 3.33Å; I144-N146 PolarHBondContact O-N 2.91Å; N146-Q150 WeakPolarHBondContact O-CB 3.37Å; N146-Q150 VanDerWaalsContact O-CG 3.28Å; N146-Q150 WeakPolarHBondContact O-CG 3.26Å; N146-Q150 PolarHBondContact O-N 2.99Å; N146-Q150 PolarHBondContact O-NE2 3.2Å
147K94.6Very high85Confident142 Ų14295.8 Ų95.862%0.61751%0.514SS*.Hα-helixtrans-78.5-34.2176-78.8168.5176.4-74.80111.8N143 I144 D145 A151N143-K147 VanDerWaalsContact O-CD 3.31Å; N143-K147 WeakPolarHBondContact O-CD 3.36Å; N143-K147 VanDerWaalsContact O-CG 3.25Å; N143-K147 WeakPolarHBondContact O-CG 3.26Å; I144-K147 CarbonylContact O-C 3.58Å; I144-K147 WeakPolarHBondContact O-CA 3.5Å; I144-K147 WeakPolarHBondContact O-CB 3.44Å; I144-K147 PolarHBondContact O-N 3.24Å; D145-K147 PolarHBondContact O-N 3.08Å; K147-A151 WeakPolarHBondContact O-CB 3.34Å; K147-A151 PolarHBondContact O-N 2.78Å
148I95.4Very high87Confident100 Ų10098.3 Ų98.351%0.51352%0.518SS..Hα-helixtrans-66.8-45.1173.7-66.7167.8000109.6I144 D145 A151 M152I144-I148 HydrophobicContact CG2-CD1 3.81Å; I144-I148 HydrophobicContact CG2-CG1 4.35Å; I144-I148 WeakPolarHBondContact O-CG1 3.21Å; I144-I148 PolarHBondContact O-N 3.35Å; D145-I148 WeakPolarHBondContact O-CB 3.46Å; D145-I148 PolarHBondContact O-N 2.83Å; I148-A151 PolarHBondContact O-N 3.11Å; I148-M152 WeakPolarHBondContact O-CB 3.07Å; I148-M152 PolarHBondContact O-N 3.38Å
149E96Very high88.9Confident110 Ų110100 Ų10051%0.51452%0.517SS..Hα-helixtrans-59.8-47.1174.8-71.4-166.8149.300112D145 A151 M152 D153D145-E149 PolarHBondContact O-N 3.45Å; E149-A151 VanDerWaalsContact C-N 3.34Å; E149-A151 PolarHBondContact O-N 3.14Å; E149-M152 PolarHBondContact O-N 2.74Å; E149-M152 VanDerWaalsContact O-N 3.16Å; E149-D153 WeakPolarHBondContact O-CB 3.38Å; E149-D153 PolarHBondContact O-N 3.05Å
150Q96.4Very high90.9Very high132 Ų132100.3 Ų100.362%0.61752%0.52SS*.Hα-helixtrans-58.1-43175-79.9166.971.600113N146 L154N146-Q150 WeakPolarHBondContact O-CB 3.37Å; N146-Q150 VanDerWaalsContact O-CG 3.28Å; N146-Q150 WeakPolarHBondContact O-CG 3.26Å; N146-Q150 PolarHBondContact O-N 2.99Å; N146-Q150 PolarHBondContact O-NE2 3.2Å; Q150-L154 WeakPolarHBondContact O-CB 3.23Å; Q150-L154 PolarHBondContact O-N 2.96Å
151A97.4Very high92.7Very high55 Ų55101.4 Ų101.446%0.45552%0.52SS..Hα-helixtrans-66.4-40.1176.600000111.7K147 I148 E149 L154 V155K147-A151 WeakPolarHBondContact O-CB 3.34Å; K147-A151 PolarHBondContact O-N 2.78Å; I148-A151 PolarHBondContact O-N 3.11Å; E149-A151 VanDerWaalsContact C-N 3.34Å; E149-A151 PolarHBondContact O-N 3.14Å; A151-L154 PolarHBondContact O-N 3.46Å; A151-V155 VanDerWaalsContact O-CG2 3.32Å; A151-V155 WeakPolarHBondContact O-CG2 3.33Å; A151-V155 PolarHBondContact O-N 3.35Å
152M98.1Very high94.5Very high106 Ų10699 Ų9952%0.52251%0.51SS..Hα-helixtrans-67.4-41.4177.9-177.8171.464.700112.2I148 E149 V155 K156I148-M152 WeakPolarHBondContact O-CB 3.07Å; I148-M152 PolarHBondContact O-N 3.38Å; E149-M152 PolarHBondContact O-N 2.74Å; E149-M152 VanDerWaalsContact O-N 3.16Å; M152-V155 PolarHBondContact O-N 3.44Å; M152-K156 VanDerWaalsContact O-CB 3.27Å; M152-K156 WeakPolarHBondContact O-CB 3.5Å; M152-K156 PolarHBondContact O-N 2.88Å
153D97.8Very high96.1Very high76 Ų7697.5 Ų97.541%0.40651%0.505SS..Hα-helixtrans-69.6-34.1176.2-81.6-20.5000112.3E149 K156 T157E149-D153 WeakPolarHBondContact O-CB 3.38Å; E149-D153 PolarHBondContact O-N 3.05Å; D153-K156 WeakPolarHBondContact OD1-CE 3.35Å; D153-K156 IonicContact OD1-NZ 2.64Å; D153-K156 PolarHBondContact OD1-NZ 3.44Å; D153-T157 WeakPolarHBondContact O-CB 3.49Å; D153-T157 PolarHBondContact O-N 3Å; D153-T157 PolarHBondContact O-OG1 3Å
154L97.9Very high96.8Very high125 Ų125102 Ų10265%0.65452%0.517SS*.Hα-helixtrans-63.3-46.6170-178.762.9000111.4Q150 A151 T157 H158Q150-L154 WeakPolarHBondContact O-CB 3.23Å; Q150-L154 PolarHBondContact O-N 2.96Å; A151-L154 PolarHBondContact O-N 3.46Å; L154-T157 PolarHBondContact O-N 3.37Å; L154-H158 WeakPolarHBondContact O-CB 3.42Å; L154-H158 PolarHBondContact O-N 3.45Å
155V98.3Very high97.2Very high101 Ų101104.3 Ų104.361%0.61253%0.526SS*.Hα-helixtrans-61.5-45.7176.3167.90000111.3A151 M152 T157 H158 L159A151-V155 VanDerWaalsContact O-CG2 3.32Å; A151-V155 WeakPolarHBondContact O-CG2 3.33Å; A151-V155 PolarHBondContact O-N 3.35Å; M152-V155 PolarHBondContact O-N 3.44Å; V155-T157 PolarHBondContact O-N 3.49Å; V155-H158 PolarHBondContact O-N 3.28Å; V155-L159 WeakPolarHBondContact O-CB 3.49Å; V155-L159 PolarHBondContact O-N 2.94Å
156K98.5Very high97.4Very high104 Ų104106.9 Ų106.945%0.45254%0.535SS..Hα-helixtrans-57.2-49.1175.7-177.1-168.8-62.3161.30111.1M152 D153 L159 M160M152-K156 VanDerWaalsContact O-CB 3.27Å; M152-K156 WeakPolarHBondContact O-CB 3.5Å; M152-K156 PolarHBondContact O-N 2.88Å; D153-K156 WeakPolarHBondContact OD1-CE 3.35Å; D153-K156 IonicContact OD1-NZ 2.64Å; D153-K156 PolarHBondContact OD1-NZ 3.44Å; K156-L159 PolarHBondContact O-N 2.99Å; K156-M160 HydrophobicContact CG-SD 4.34Å; K156-M160 WeakPolarHBondContact O-CB 3.35Å; K156-M160 VanDerWaalsContact O-CG 3.27Å; K156-M160 WeakPolarHBondContact O-CG 3.29Å; K156-M160 PolarHBondContact O-N 2.91Å
157T98.1Very high97.7Very high62 Ų62105.8 Ų105.838%0.3853%0.531SS..Hα-helixtrans-63.1-45.1178.9-59.80000111.6D153 L154 V155 M160 F161D153-T157 WeakPolarHBondContact O-CB 3.49Å; D153-T157 PolarHBondContact O-N 3Å; D153-T157 PolarHBondContact O-OG1 3Å; L154-T157 PolarHBondContact O-N 3.37Å; V155-T157 PolarHBondContact O-N 3.49Å; T157-M160 PolarHBondContact O-N 3.29Å; T157-F161 HydrophobicContact CG2-CD2 3.82Å; T157-F161 HydrophobicContact CG2-CE2 3.38Å; T157-F161 HydrophobicContact CG2-CZ 4.33Å; T157-F161 WeakPolarHBondContact O-CD2 3.36Å; T157-F161 PolarHBondContact O-N 3.45Å
158H98.2Very high97.9Very high133 Ų133102.3 Ų102.362%0.61652%0.519SS*.Hα-helixtrans-63.8-43.4178-174.455.2000112.1L154 V155 F161 A162L154-H158 WeakPolarHBondContact O-CB 3.42Å; L154-H158 PolarHBondContact O-N 3.45Å; V155-H158 PolarHBondContact O-N 3.28Å; H158-F161 PolarHBondContact O-N 3.24Å; H158-A162 WeakPolarHBondContact O-CB 3.44Å; H158-A162 PolarHBondContact O-N 2.94Å
159L98.5Very high98Very high109 Ų10999.8 Ų99.857%0.57152%0.517SS*.Hα-helixtrans-63.9-41.2175.6-176.564.6000111.7V155 K156 F161 A162 V163V155-L159 WeakPolarHBondContact O-CB 3.49Å; V155-L159 PolarHBondContact O-N 2.94Å; K156-L159 PolarHBondContact O-N 2.99Å; L159-F161 VanDerWaalsContact C-N 3.31Å; L159-F161 PolarHBondContact O-N 3.24Å; L159-A162 PolarHBondContact O-N 3.01Å; L159-V163 HydrophobicContact CD1-CG2 3.76Å; L159-V163 HydrophobicContact CG-CG2 4.12Å; L159-V163 VanDerWaalsContact O-CB 3.3Å; L159-V163 WeakPolarHBondContact O-CB 3.4Å; L159-V163 VanDerWaalsContact O-CG2 3.25Å; L159-V163 WeakPolarHBondContact O-CG2 3.23Å; L159-V163 PolarHBondContact O-N 3.1Å
160M97.9Very high98.2Very high129 Ų12999.5 Ų99.564%0.63552%0.519SS*.Hα-helixtrans-60.3-39.7175.4-76.8177.767.200112.4K156 T157 R164K156-M160 HydrophobicContact CG-SD 4.34Å; K156-M160 WeakPolarHBondContact O-CB 3.35Å; K156-M160 VanDerWaalsContact O-CG 3.27Å; K156-M160 WeakPolarHBondContact O-CG 3.29Å; K156-M160 PolarHBondContact O-N 2.91Å; T157-M160 PolarHBondContact O-N 3.29Å; M160-R164 VanDerWaalsContact O-CB 3.27Å; M160-R164 WeakPolarHBondContact O-CB 3.39Å; M160-R164 PolarHBondContact O-N 2.74Å
161F98.2Very high98.3Very high121 Ų121100.7 Ų100.753%0.53152%0.518SS..Hα-helixtrans-70.6-51174.9-70.7-53.4000112.1T157 H158 L159 V163 R164 E165T157-F161 HydrophobicContact CG2-CD2 3.82Å; T157-F161 HydrophobicContact CG2-CE2 3.38Å; T157-F161 HydrophobicContact CG2-CZ 4.33Å; T157-F161 WeakPolarHBondContact O-CD2 3.36Å; T157-F161 PolarHBondContact O-N 3.45Å; H158-F161 PolarHBondContact O-N 3.24Å; L159-F161 VanDerWaalsContact C-N 3.31Å; L159-F161 PolarHBondContact O-N 3.24Å; F161-V163 PolarHBondContact O-N 3.11Å; F161-R164 WeakPolarHBondContact O-CB 3.4Å; F161-R164 PolarHBondContact O-N 2.9Å; F161-E165 WeakPolarHBondContact O-CG 3.3Å; F161-E165 PolarHBondContact O-N 3.43Å
162A98.2Very high98.3Very high37 Ų3799.6 Ų99.631%0.30651%0.512SS..Hα-helixtrans-58.7-45.4-179.200000112.5H158 L159 R164 E165 E166H158-A162 WeakPolarHBondContact O-CB 3.44Å; H158-A162 PolarHBondContact O-N 2.94Å; L159-A162 PolarHBondContact O-N 3.01Å; A162-R164 VanDerWaalsContact C-N 3.3Å; A162-R164 PolarHBondContact O-N 3.38Å; A162-E165 PolarHBondContact O-N 3.44Å; A162-E166 WeakPolarHBondContact O-CG 3.4Å; A162-E166 PolarHBondContact O-N 2.9Å
163V98.6Very high98.3Very high80 Ų80101.3 Ų101.349%0.48552%0.516SS..Hα-helixtrans-63.8-36.2176.5171.80000111.5L159 F161 V167L159-V163 HydrophobicContact CD1-CG2 3.76Å; L159-V163 HydrophobicContact CG-CG2 4.12Å; L159-V163 VanDerWaalsContact O-CB 3.3Å; L159-V163 WeakPolarHBondContact O-CB 3.4Å; L159-V163 VanDerWaalsContact O-CG2 3.25Å; L159-V163 WeakPolarHBondContact O-CG2 3.23Å; L159-V163 PolarHBondContact O-N 3.1Å; F161-V163 PolarHBondContact O-N 3.11Å; V163-V167 HydrophobicContact CG1-CG2 4.4Å; V163-V167 WeakPolarHBondContact O-CB 3.5Å; V163-V167 VanDerWaalsContact O-CG2 3.22Å; V163-V167 WeakPolarHBondContact O-CG2 3.36Å; V163-V167 PolarHBondContact O-N 3.14Å
164R98.1Very high98.4Very high167 Ų167102.1 Ų102.163%0.6352%0.52SS*.Hα-helixtrans-67.2-46.4176.7-174.3179.2-163146.85.9111.7M160 F161 A162 V167 D168M160-R164 VanDerWaalsContact O-CB 3.27Å; M160-R164 WeakPolarHBondContact O-CB 3.39Å; M160-R164 PolarHBondContact O-N 2.74Å; F161-R164 WeakPolarHBondContact O-CB 3.4Å; F161-R164 PolarHBondContact O-N 2.9Å; A162-R164 VanDerWaalsContact C-N 3.3Å; A162-R164 PolarHBondContact O-N 3.38Å; R164-V167 PolarHBondContact O-N 3.07Å; R164-D168 IonicContact NE-OD2 3.97Å; R164-D168 WeakPolarHBondContact O-CB 3.45Å; R164-D168 PolarHBondContact O-N 3.25Å
165E98.3Very high98.4Very high141 Ų141101.9 Ų101.966%0.65951%0.514SS*.Hα-helixtrans-61-44.3178.1-71.9178.1174.600111.5F161 A162 G169F161-E165 WeakPolarHBondContact O-CG 3.3Å; F161-E165 PolarHBondContact O-N 3.43Å; A162-E165 PolarHBondContact O-N 3.44Å; E165-G169 PolarHBondContact O-N 3Å
166E98.3Very high98.4Very high133 Ų133102.2 Ų102.262%0.62151%0.512SS*.Hα-helixtrans-63.2-43.9174.6-71.7-63.4146.900112.3A162 G169 L170A162-E166 WeakPolarHBondContact O-CG 3.4Å; A162-E166 PolarHBondContact O-N 2.9Å; E166-G169 PolarHBondContact O-N 3.36Å; E166-L170 WeakPolarHBondContact O-CB 3.25Å; E166-L170 VanDerWaalsContact O-CG 3.24Å; E166-L170 WeakPolarHBondContact O-CG 3.22Å; E166-L170 PolarHBondContact O-N 2.85Å
167V98.7Very high98.4Very high58 Ų58101.9 Ų101.935%0.35252%0.515SS..Hα-helixtrans-64.6-44.6177.9165.90000111.9V163 R164 L170 R171V163-V167 HydrophobicContact CG1-CG2 4.4Å; V163-V167 WeakPolarHBondContact O-CB 3.5Å; V163-V167 VanDerWaalsContact O-CG2 3.22Å; V163-V167 WeakPolarHBondContact O-CG2 3.36Å; V163-V167 PolarHBondContact O-N 3.14Å; R164-V167 PolarHBondContact O-N 3.07Å; V167-L170 PolarHBondContact O-N 2.87Å; V167-R171 WeakPolarHBondContact O-CB 3.42Å; V167-R171 WeakPolarHBondContact O-CD 3.5Å; V167-R171 VanDerWaalsContact O-CG 3.25Å; V167-R171 WeakPolarHBondContact O-CG 3.38Å; V167-R171 PolarHBondContact O-N 3.4Å
168D98.4Very high98.4Very high70 Ų70103.7 Ų103.737%0.37452%0.519SS..Hα-helixtrans-72.4-32.8-179.8-70.5-25.3000111.3R164 R171 G172R164-D168 IonicContact NE-OD2 3.97Å; R164-D168 WeakPolarHBondContact O-CB 3.45Å; R164-D168 PolarHBondContact O-N 3.25Å; D168-R171 PolarHBondContact O-N 2.99Å; D168-R171 IonicContact OD1-CZ 3.78Å; D168-R171 IonicContact OD1-NH1 2.74Å; D168-R171 PolarHBondContact OD1-NH1 3.11Å; D168-G172 PolarHBondContact O-N 3.16Å
169G98.5Very high98.4Very high46 Ų4699.4 Ų99.447%0.47450%0.5SS..Hα-helixtrans-64-44.5169.500000113.3E165 E166 G172 K173E165-G169 PolarHBondContact O-N 3Å; E166-G169 PolarHBondContact O-N 3.36Å; G169-G172 PolarHBondContact O-N 2.64Å; G169-K173 PolarHBondContact O-N 3.35Å
170L98.8Very high98.4Very high104 Ų10498.4 Ų98.455%0.54549%0.493SS..Hα-helixtrans-63-41.9174.3-74.4171.5000111.8E166 V167 K173 I174E166-L170 WeakPolarHBondContact O-CB 3.25Å; E166-L170 VanDerWaalsContact O-CG 3.24Å; E166-L170 WeakPolarHBondContact O-CG 3.22Å; E166-L170 PolarHBondContact O-N 2.85Å; V167-L170 PolarHBondContact O-N 2.87Å; L170-K173 PolarHBondContact O-N 3.3Å; L170-I174 VanDerWaalsContact O-CG1 3.29Å; L170-I174 WeakPolarHBondContact O-CG1 3.49Å; L170-I174 PolarHBondContact O-N 2.84Å
171R98.5Very high98.5Very high157 Ų15795.7 Ų95.759%0.59248%0.483SS*.Hα-helixtrans-59.3-46.1174.5-75.9164.9170168.1-3.3112.2V167 D168 K173 I174 F175V167-R171 WeakPolarHBondContact O-CB 3.42Å; V167-R171 WeakPolarHBondContact O-CD 3.5Å; V167-R171 VanDerWaalsContact O-CG 3.25Å; V167-R171 WeakPolarHBondContact O-CG 3.38Å; V167-R171 PolarHBondContact O-N 3.4Å; D168-R171 PolarHBondContact O-N 2.99Å; D168-R171 IonicContact OD1-CZ 3.78Å; D168-R171 IonicContact OD1-NH1 2.74Å; D168-R171 PolarHBondContact OD1-NH1 3.11Å; R171-K173 VanDerWaalsContact C-N 3.35Å; R171-K173 PolarHBondContact O-N 3.47Å; R171-I174 PolarHBondContact O-N 3.16Å; R171-F175 WeakPolarHBondContact O-CB 3.24Å; R171-F175 PolarHBondContact O-N 3.25Å
172G98.6Very high98.4Very high32 Ų3296.3 Ų96.333%0.3348%0.482SS..Hα-helixtrans-58.5-46.317500000112D168 G169 I174 F175 D176D168-G172 PolarHBondContact O-N 3.16Å; G169-G172 PolarHBondContact O-N 2.64Å; G172-I174 PolarHBondContact O-N 2.86Å; G172-F175 PolarHBondContact O-N 3.36Å; G172-D176 PolarHBondContact O-N 3.49Å
173K98.5Very high98.4Very high142 Ų142101.5 Ų101.562%0.61749%0.494SS*.Hα-helixtrans-64.7-37.3178.6-170.5166.2-176.7173.30113.4G169 L170 R171 L177G169-K173 PolarHBondContact O-N 3.35Å; L170-K173 PolarHBondContact O-N 3.3Å; R171-K173 VanDerWaalsContact C-N 3.35Å; R171-K173 PolarHBondContact O-N 3.47Å; K173-L177 HydrophobicContact CG-CD1 4.15Å; K173-L177 WeakPolarHBondContact O-CB 3.17Å; K173-L177 WeakPolarHBondContact O-CD1 3.3Å; K173-L177 VanDerWaalsContact O-CG 3.23Å; K173-L177 WeakPolarHBondContact O-CG 3.06Å; K173-L177 PolarHBondContact O-N 2.89Å; K173-L177 VanDerWaalsContact O-N 3.08Å
174I98.6Very high98.4Very high94 Ų94101.5 Ų101.548%0.48249%0.491SS..Hα-helixtrans-62.3-50.4172.9-70.7163.2000109.8L170 R171 G172 D176 L177 E178L170-I174 VanDerWaalsContact O-CG1 3.29Å; L170-I174 WeakPolarHBondContact O-CG1 3.49Å; L170-I174 PolarHBondContact O-N 2.84Å; R171-I174 PolarHBondContact O-N 3.16Å; G172-I174 PolarHBondContact O-N 2.86Å; I174-D176 PolarHBondContact O-N 3.43Å; I174-L177 PolarHBondContact O-N 2.89Å; I174-E178 HydrophobicContact CG2-CG 4.29Å; I174-E178 WeakPolarHBondContact CG2-OE1 3.36Å; I174-E178 WeakPolarHBondContact O-CG 3.5Å; I174-E178 PolarHBondContact O-N 3.37Å
175F98.5Very high98.4Very high120 Ų12099.2 Ų99.253%0.52649%0.487SS..Hα-helixtrans-57.8-44.8179.4177.7-104.7000112.6R171 G172 E178 N179R171-F175 WeakPolarHBondContact O-CB 3.24Å; R171-F175 PolarHBondContact O-N 3.25Å; G172-F175 PolarHBondContact O-N 3.36Å; F175-E178 PolarHBondContact O-N 2.92Å; F175-N179 VanDerWaalsContact CD1-ND2 3.3Å; F175-N179 WeakPolarHBondContact CD1-ND2 3.3Å; F175-N179 WeakPolarHBondContact CE1-ND2 3.36Å; F175-N179 WeakPolarHBondContact CZ-ND2 3.42Å; F175-N179 WeakPolarHBondContact O-CB 3.37Å; F175-N179 PolarHBondContact O-N 3.29Å; F175-N179 PolarHBondContact O-ND2 2.86Å
176D98.5Very high98.3Very high107 Ų10795 Ų9557%0.57248%0.476SS*.Hα-helixtrans-64.3-41.2177.3-74.8-21.5000112.5G172 I174 N179 H180G172-D176 PolarHBondContact O-N 3.49Å; I174-D176 PolarHBondContact O-N 3.43Å; D176-N179 PolarHBondContact O-N 3.34Å; D176-H180 WeakPolarHBondContact O-CB 3.42Å; D176-H180 PolarHBondContact O-N 2.89Å
177L98.7Very high98.1Very high98 Ų9893.1 Ų93.151%0.51347%0.467SS..Hα-helixtrans-66.5-44176.3-73.3170.7000111.9K173 I174 N179 H180 V181K173-L177 HydrophobicContact CG-CD1 4.15Å; K173-L177 WeakPolarHBondContact O-CB 3.17Å; K173-L177 WeakPolarHBondContact O-CD1 3.3Å; K173-L177 VanDerWaalsContact O-CG 3.23Å; K173-L177 WeakPolarHBondContact O-CG 3.06Å; K173-L177 PolarHBondContact O-N 2.89Å; K173-L177 VanDerWaalsContact O-N 3.08Å; I174-L177 PolarHBondContact O-N 2.89Å; L177-N179 VanDerWaalsContact C-N 3.34Å; L177-N179 PolarHBondContact O-N 2.98Å; L177-H180 PolarHBondContact O-N 3.19Å; L177-V181 WeakPolarHBondContact O-CG2 3.48Å; L177-V181 PolarHBondContact O-N 2.88Å
178E98.5Very high97.9Very high100 Ų10094 Ų9447%0.46747%0.471SS..Hα-helixtrans-60.2-42.6174.7-74178.9178.100111.9I174 F175 H180 V181 R182I174-E178 HydrophobicContact CG2-CG 4.29Å; I174-E178 WeakPolarHBondContact CG2-OE1 3.36Å; I174-E178 WeakPolarHBondContact O-CG 3.5Å; I174-E178 PolarHBondContact O-N 3.37Å; F175-E178 PolarHBondContact O-N 2.92Å; E178-H180 VanDerWaalsContact C-N 3.33Å; E178-V181 PolarHBondContact O-N 3.12Å; E178-R182 VanDerWaalsContact O-CB 3.3Å; E178-R182 WeakPolarHBondContact O-CB 3.4Å; E178-R182 PolarHBondContact O-N 3.06Å
179N98.3Very high97.6Very high42 Ų4292.6 Ų92.623%0.22547%0.466CS..Hα-helixtrans-65.9-35.4175.6-71.2-34.1000112.3F175 D176 L177 R182 R183F175-N179 VanDerWaalsContact CD1-ND2 3.3Å; F175-N179 WeakPolarHBondContact CD1-ND2 3.3Å; F175-N179 WeakPolarHBondContact CE1-ND2 3.36Å; F175-N179 WeakPolarHBondContact CZ-ND2 3.42Å; F175-N179 WeakPolarHBondContact O-CB 3.37Å; F175-N179 PolarHBondContact O-N 3.29Å; F175-N179 PolarHBondContact O-ND2 2.86Å; D176-N179 PolarHBondContact O-N 3.34Å; L177-N179 VanDerWaalsContact C-N 3.34Å; L177-N179 PolarHBondContact O-N 2.98Å; N179-R182 PolarHBondContact OD1-NH1 2.9Å; N179-R183 WeakPolarHBondContact O-CB 3.25Å; N179-R183 PolarHBondContact O-N 3.18Å
180H98.4Very high97.3Very high89 Ų8995.4 Ų95.441%0.41247%0.469SS..Hα-helixtrans-69.6-47.1175.4-17439.4000111.6D176 L177 E178 R183 L184D176-H180 WeakPolarHBondContact O-CB 3.42Å; D176-H180 PolarHBondContact O-N 2.89Å; L177-H180 PolarHBondContact O-N 3.19Å; E178-H180 VanDerWaalsContact C-N 3.33Å; H180-R183 WeakPolarHBondContact O-CB 3.27Å; H180-R183 PolarHBondContact O-N 2.94Å; H180-L184 WeakPolarHBondContact O-CG 3.27Å; H180-L184 PolarHBondContact O-N 3.39Å
181V98.4Very high97Very high72 Ų7295.1 Ų95.144%0.43647%0.467SS..Hα-helixtrans-57.4-51.6175.2169.50000110.4L177 E178 R183 L184 E185L177-V181 WeakPolarHBondContact O-CG2 3.48Å; L177-V181 PolarHBondContact O-N 2.88Å; E178-V181 PolarHBondContact O-N 3.12Å; V181-R183 PolarHBondContact O-N 3.11Å; V181-L184 CarbonylContact O-C 3.59Å; V181-L184 PolarHBondContact O-N 3.05Å; V181-E185 HydrophobicContact CG1-CG 4.13Å; V181-E185 WeakPolarHBondContact O-CB 3.45Å; V181-E185 WeakPolarHBondContact O-CG 3.27Å; V181-E185 PolarHBondContact O-N 2.88Å
182R98.1Very high96.6Very high133 Ų13392.7 Ų92.750%0.50246%0.461SS..Hα-helixtrans-57.7-35179.7-165.1-175-53.2113.58.1112.9E178 N179 A186E178-R182 VanDerWaalsContact O-CB 3.3Å; E178-R182 WeakPolarHBondContact O-CB 3.4Å; E178-R182 PolarHBondContact O-N 3.06Å; N179-R182 PolarHBondContact OD1-NH1 2.9Å; R182-A186 PolarHBondContact O-N 3.38Å; R182-A186 VanDerWaalsContact O-N 3.14Å
183R98.1Very high96Very high146 Ų146101 Ų10155%0.55148%0.482SS*.Hα-helixtrans-69.1-48.9174.9-166.5-163.9-49.5167.76.9111.4N179 H180 V181 E185 A186 E187N179-R183 WeakPolarHBondContact O-CB 3.25Å; N179-R183 PolarHBondContact O-N 3.18Å; H180-R183 WeakPolarHBondContact O-CB 3.27Å; H180-R183 PolarHBondContact O-N 2.94Å; V181-R183 PolarHBondContact O-N 3.11Å; R183-E185 VanDerWaalsContact C-N 3.3Å; R183-E185 PolarHBondContact O-N 3.18Å; R183-A186 PolarHBondContact O-N 2.81Å; R183-E187 WeakPolarHBondContact CD-OE1 3.33Å; R183-E187 WeakPolarHBondContact CG-OE1 3.49Å; R183-E187 WeakPolarHBondContact O-CG 3.45Å; R183-E187 PolarHBondContact O-N 3.01Å
184L98.1Very high95.6Very high80 Ų8099.4 Ų99.442%0.41949%0.485SS..Hα-helixtrans-61.6-37.6176.9-70.3176.7000111.9H180 V181 E187 N188H180-L184 WeakPolarHBondContact O-CG 3.27Å; H180-L184 PolarHBondContact O-N 3.39Å; V181-L184 CarbonylContact O-C 3.59Å; V181-L184 PolarHBondContact O-N 3.05Å; L184-E187 PolarHBondContact O-N 3.46Å; L184-N188 WeakPolarHBondContact O-CB 3.41Å; L184-N188 PolarHBondContact O-N 3.35Å
185E96.8Very high95.1Very high120 Ų12097.3 Ų97.356%0.56147%0.474SS*.Hα-helixtrans-64-41.7174.4-73.4176.1153.800112V181 R183 S189V181-E185 HydrophobicContact CG1-CG 4.13Å; V181-E185 WeakPolarHBondContact O-CB 3.45Å; V181-E185 WeakPolarHBondContact O-CG 3.27Å; V181-E185 PolarHBondContact O-N 2.88Å; R183-E185 VanDerWaalsContact C-N 3.3Å; R183-E185 PolarHBondContact O-N 3.18Å; E185-S189 VanDerWaalsContact O-CB 3.26Å; E185-S189 WeakPolarHBondContact O-CB 3.32Å; E185-S189 PolarHBondContact O-N 3.39Å
186A96.1Very high94.4Very high52 Ų5295.7 Ų95.743%0.4348%0.476SS..Hα-helixtrans-64.8-47.9174.800000111.6R182 R183 S189 I190R182-A186 PolarHBondContact O-N 3.38Å; R182-A186 VanDerWaalsContact O-N 3.14Å; R183-A186 PolarHBondContact O-N 2.81Å; A186-S189 PolarHBondContact O-N 3.19Å; A186-I190 WeakPolarHBondContact O-CG1 3.16Å; A186-I190 PolarHBondContact O-N 3.28Å
187E95.6Very high93.6Very high93 Ų9396.2 Ų96.244%0.43548%0.479SS..Hα-helixtrans-58.7-48.1175.3-71.3170.9-157.200111.4R183 L184 S189 I190 L191R183-E187 WeakPolarHBondContact CD-OE1 3.33Å; R183-E187 WeakPolarHBondContact CG-OE1 3.49Å; R183-E187 WeakPolarHBondContact O-CG 3.45Å; R183-E187 PolarHBondContact O-N 3.01Å; L184-E187 PolarHBondContact O-N 3.46Å; E187-S189 PolarHBondContact O-N 3.06Å; E187-I190 PolarHBondContact O-N 2.96Å; E187-I190 VanDerWaalsContact O-N 3.13Å; E187-L191 WeakPolarHBondContact O-CG 3.34Å; E187-L191 PolarHBondContact O-N 3.43Å
188N94.5Very high92.7Very high78 Ų7896.5 Ų96.542%0.41748%0.481SS..Hα-helixtrans-63.4-39.2178.1-166.5-76.9000111.7L184 I190 L191 K192L184-N188 WeakPolarHBondContact O-CB 3.41Å; L184-N188 PolarHBondContact O-N 3.35Å; N188-I190 VanDerWaalsContact C-N 3.32Å; N188-I190 PolarHBondContact O-N 2.71Å; N188-L191 PolarHBondContact O-N 3.04Å; N188-K192 WeakPolarHBondContact O-CB 3.48Å; N188-K192 WeakPolarHBondContact O-CG 3.47Å; N188-K192 PolarHBondContact O-N 2.95Å; N188-K192 VanDerWaalsContact OD1-CD 3.26Å; N188-K192 WeakPolarHBondContact OD1-CD 3.49Å; N188-K192 WeakPolarHBondContact OD1-CE 3.45Å; N188-K192 PolarHBondContact OD1-NZ 3Å
189S92.1Very high91.9Very high39 Ų3995 Ų9527%0.27348%0.478SS..Hα-helixtrans-67.2-30174.1179.90000112.9E185 A186 E187 R193E185-S189 VanDerWaalsContact O-CB 3.26Å; E185-S189 WeakPolarHBondContact O-CB 3.32Å; E185-S189 PolarHBondContact O-N 3.39Å; A186-S189 PolarHBondContact O-N 3.19Å; E187-S189 PolarHBondContact O-N 3.06Å; S189-R193 WeakPolarHBondContact O-CD 3.49Å; S189-R193 VanDerWaalsContact O-CG 3.23Å; S189-R193 WeakPolarHBondContact O-CG 3.43Å; S189-R193 PolarHBondContact O-NE 3.25Å; S189-R193 PolarHBondContact OG-NE 3.1Å; S189-R193 PolarHBondContact OG-NH2 3.13Å
190I92.8Very high91.1Very high105 Ų10594.5 Ų94.554%0.53848%0.476SS..Hα-helixtrans-72.4-52.3173.4-68.5163.7000108.8A186 E187 N188 K192 R193 T194A186-I190 WeakPolarHBondContact O-CG1 3.16Å; A186-I190 PolarHBondContact O-N 3.28Å; E187-I190 PolarHBondContact O-N 2.96Å; E187-I190 VanDerWaalsContact O-N 3.13Å; N188-I190 VanDerWaalsContact C-N 3.32Å; N188-I190 PolarHBondContact O-N 2.71Å; I190-K192 VanDerWaalsContact C-N 3.32Å; I190-K192 PolarHBondContact O-N 3.48Å; I190-R193 WeakPolarHBondContact O-CB 3.38Å; I190-R193 PolarHBondContact O-N 3.15Å; I190-T194 PolarHBondContact O-N 3.37Å; I190-T194 PolarHBondContact O-OG1 3.23Å
191L91.9Very high90.2Very high99 Ų9995.9 Ų95.952%0.51848%0.48SS..Hα-helixtrans-53.8-46178.8-69.4169.4000112.1E187 N188 R193 T194 I195E187-L191 WeakPolarHBondContact O-CG 3.34Å; E187-L191 PolarHBondContact O-N 3.43Å; N188-L191 PolarHBondContact O-N 3.04Å; L191-R193 PolarHBondContact O-N 2.82Å; L191-T194 PolarHBondContact O-N 3.45Å; L191-T194 VanDerWaalsContact O-N 3.15Å; L191-I195 HydrophobicContact CB-CD1 4.16Å; L191-I195 WeakPolarHBondContact O-CB 3.48Å; L191-I195 WeakPolarHBondContact O-CD1 3.22Å; L191-I195 WeakPolarHBondContact O-CG1 3.36Å; L191-I195 PolarHBondContact O-N 3.22Å
192K88.9Confident89.3Confident106 Ų10698.4 Ų98.446%0.46149%0.487SS..Hα-helixtrans-60.4-26.8176.1-80.9174.2171.3155.20114.5N188 I190 L200N188-K192 WeakPolarHBondContact O-CB 3.48Å; N188-K192 WeakPolarHBondContact O-CG 3.47Å; N188-K192 PolarHBondContact O-N 2.95Å; N188-K192 VanDerWaalsContact OD1-CD 3.26Å; N188-K192 WeakPolarHBondContact OD1-CD 3.49Å; N188-K192 WeakPolarHBondContact OD1-CE 3.45Å; N188-K192 PolarHBondContact OD1-NZ 3Å; I190-K192 VanDerWaalsContact C-N 3.32Å; I190-K192 PolarHBondContact O-N 3.48Å; K192-L200 HydrophobicContact CG-CD1 4.11Å
193R87.6Confident88.4Confident205 Ų20596 Ų9677%0.77448%0.484SS*.Hα-helixtrans-87-27176.5-65.9171.2-159.6-174.410.5112.5S189 I190 L191S189-R193 WeakPolarHBondContact O-CD 3.49Å; S189-R193 VanDerWaalsContact O-CG 3.23Å; S189-R193 WeakPolarHBondContact O-CG 3.43Å; S189-R193 PolarHBondContact O-NE 3.25Å; S189-R193 PolarHBondContact OG-NE 3.1Å; S189-R193 PolarHBondContact OG-NH2 3.13Å; I190-R193 WeakPolarHBondContact O-CB 3.38Å; I190-R193 PolarHBondContact O-N 3.15Å; L191-R193 PolarHBondContact O-N 2.82Å
194T88.6Confident87.3Confident109 Ų10994.7 Ų94.767%0.66948%0.484SS*.Hα-helixtrans-91.2-27.6-177.3-53.30000113.1I190 L191I190-T194 PolarHBondContact O-N 3.37Å; I190-T194 PolarHBondContact O-OG1 3.23Å; L191-T194 PolarHBondContact O-N 3.45Å; L191-T194 VanDerWaalsContact O-N 3.15Å
195I88.3Confident86.1Confident50 Ų5098 Ų9826%0.25650%0.501SS..SBendtrans-76.9132.3179.8-68.3165.9000110.3L191 T199 L200L191-I195 HydrophobicContact CB-CD1 4.16Å; L191-I195 WeakPolarHBondContact O-CB 3.48Å; L191-I195 WeakPolarHBondContact O-CD1 3.22Å; L191-I195 WeakPolarHBondContact O-CG1 3.36Å; L191-I195 PolarHBondContact O-N 3.22Å; I195-T199 HydrophobicContact CG2-CG2 3.99Å; I195-L200 HydrophobicContact CG2-CB 4.28Å; I195-L200 HydrophobicContact CG2-CD1 4.46Å
196P84.5Confident84.7Confident87 Ų87100.5 Ų100.557%0.56551%0.51SS*.  trans-56.7140.1174-26.435.3000113D198 T199 L200P196-D198 PolarHBondContact O-N 3.38Å; P196-D198 VanDerWaalsContact O-N 3.08Å; P196-T199 WeakPolarHBondContact O-CB 3.49Å; P196-T199 PolarHBondContact O-N 3.39Å; P196-L200 PolarHBondContact O-N 2.9Å
197N81.6Confident82.7Confident118 Ų118108 Ų10863%0.63154%0.542SS*.Hα-helixtrans-53.3-35.7-174.1-74.2-67.3000114.1L200 K201N197-L200 WeakPolarHBondContact O-CB 3.4Å; N197-L200 PolarHBondContact O-N 3.3Å; N197-K201 VanDerWaalsContact O-CG 3.27Å; N197-K201 WeakPolarHBondContact O-CG 3.28Å; N197-K201 PolarHBondContact O-N 3.24Å
198D80.3Confident82Confident104 Ų104108.8 Ų108.856%0.55655%0.548SS*.Hα-helixtrans-75-35.1-178.3-59.2-39.1000112.5P196 L200 K201 Q202P196-D198 PolarHBondContact O-N 3.38Å; P196-D198 VanDerWaalsContact O-N 3.08Å; D198-L200 VanDerWaalsContact C-N 3.35Å; D198-K201 PolarHBondContact O-N 3.17Å; D198-K201 IonicContact OD1-NZ 2.75Å; D198-K201 PolarHBondContact OD1-NZ 3.38Å; D198-Q202 WeakPolarHBondContact O-CG 3.34Å; D198-Q202 PolarHBondContact O-N 3.01Å; D198-Q202 VanDerWaalsContact O-N 3.14Å
199T82Confident81.4Confident68 Ų68110.4 Ų110.442%0.41755%0.554SS.*Hα-helixtrans-65.1-40.2169.2-49.30000110.9I195 P196 Q202 L203I195-T199 HydrophobicContact CG2-CG2 3.99Å; P196-T199 WeakPolarHBondContact O-CB 3.49Å; P196-T199 PolarHBondContact O-N 3.39Å; T199-Q202 PolarHBondContact O-N 2.69Å; T199-L203 WeakPolarHBondContact O-CG 3.45Å; T199-L203 PolarHBondContact O-N 3.48Å; T199-L203 VanDerWaalsContact O-N 3.12Å
200L81.2Confident80.8Confident32 Ų32114.4 Ų114.417%0.16857%0.57CS.*Hα-helixtrans-62.2-44.2176.8-165.478.5000112K192 I195 P196 N197 D198 Q202 L203 H204K192-L200 HydrophobicContact CG-CD1 4.11Å; I195-L200 HydrophobicContact CG2-CB 4.28Å; I195-L200 HydrophobicContact CG2-CD1 4.46Å; P196-L200 PolarHBondContact O-N 2.9Å; N197-L200 WeakPolarHBondContact O-CB 3.4Å; N197-L200 PolarHBondContact O-N 3.3Å; D198-L200 VanDerWaalsContact C-N 3.35Å; L200-Q202 PolarHBondContact O-N 3.4Å; L200-L203 PolarHBondContact O-N 3.03Å; L200-H204 PolarHBondContact O-N 2.94Å
201K80.1Confident80.1Confident117 Ų117114.9 Ų114.951%0.50957%0.572SS.*Hα-helixtrans-59-44.1174.4-69.4165.4-162.71630111.7N197 D198 L203 H204 L205N197-K201 VanDerWaalsContact O-CG 3.27Å; N197-K201 WeakPolarHBondContact O-CG 3.28Å; N197-K201 PolarHBondContact O-N 3.24Å; D198-K201 PolarHBondContact O-N 3.17Å; D198-K201 IonicContact OD1-NZ 2.75Å; D198-K201 PolarHBondContact OD1-NZ 3.38Å; K201-L203 VanDerWaalsContact C-N 3.26Å; K201-L203 PolarHBondContact O-N 3.14Å; K201-H204 PolarHBondContact O-N 3.24Å; K201-L205 WeakPolarHBondContact O-CG 3.25Å; K201-L205 PolarHBondContact O-N 3.47Å; K201-L205 VanDerWaalsContact O-N 3.1Å
202Q78.9Confident79.3Confident126 Ų126115.9 Ų115.959%0.58958%0.575SS**Hα-helixtrans-63.9-29.4177.7-72.3-179.213.600113.4D198 T199 L200D198-Q202 WeakPolarHBondContact O-CG 3.34Å; D198-Q202 PolarHBondContact O-N 3.01Å; D198-Q202 VanDerWaalsContact O-N 3.14Å; T199-Q202 PolarHBondContact O-N 2.69Å; L200-Q202 PolarHBondContact O-N 3.4Å
203L78.1Confident78.7Confident83 Ų83116.6 Ų116.644%0.43558%0.583SS.*Hα-helixtrans-75.5-43.1173.9-68.1171000111.7T199 L200 K201 L205 K206 L207T199-L203 WeakPolarHBondContact O-CG 3.45Å; T199-L203 PolarHBondContact O-N 3.48Å; T199-L203 VanDerWaalsContact O-N 3.12Å; L200-L203 PolarHBondContact O-N 3.03Å; K201-L203 VanDerWaalsContact C-N 3.26Å; K201-L203 PolarHBondContact O-N 3.14Å; L203-L205 PolarHBondContact O-N 3.48Å; L203-K206 PolarHBondContact O-N 3.38Å; L203-L207 WeakPolarHBondContact O-CD1 3.31Å
204H76.1Confident78Confident118 Ų118110.3 Ų110.355%0.54657%0.569SS.*Hα-helixtrans-64.3-20.6175.4-71.9173.5000114L200 K201 K206L200-H204 PolarHBondContact O-N 2.94Å; K201-H204 PolarHBondContact O-N 3.24Å; H204-K206 VanDerWaalsContact C-N 3.3Å
205L73.4Confident77.2Confident148 Ų148110.4 Ų110.478%0.77556%0.562SS**THydrogen-bonded Turntrans-83.70.9174-75.7161.7000113.8K201 L203K201-L205 WeakPolarHBondContact O-CG 3.25Å; K201-L205 PolarHBondContact O-N 3.47Å; K201-L205 VanDerWaalsContact O-N 3.1Å; L203-L205 PolarHBondContact O-N 3.48Å
206K65.6Low76.3Confident174 Ų174115.4 Ų115.476%0.75759%0.587SS**  trans-123.71.3-174.4-74.5-176.4175.7-178.60114.8L203 H204L203-K206 PolarHBondContact O-N 3.38Å; H204-K206 VanDerWaalsContact C-N 3.3Å
207L54.2Low75.6Confident210 Ų210118 Ų118100%1.09959%0.589SS**  trans-110.40168-79.497.7000109.9L203L203-L207 WeakPolarHBondContact O-CD1 3.31Å

Retrieved 207 of 207 residues in 63.1 ms (Link to these results)