A0A077ZBR9_TRITR Loading...

Enkurin domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZBR9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 277 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
1M49.1Very low60.9Low236 Ų236154 Ų154100%1.16382%0.822SS**  084.30-79.5-80.7172.800108.4
2H56.1Low60Low185 Ų185155.4 Ų155.486%0.85682%0.824SS**  trans-154.6140.6160.3-92.1-66.4000106.8
3P66.6Low60Low122 Ų122157.8 Ų157.879%0.79283%0.828SS**  trans-82.6147.5-16230.8-29.1000112.5
4V55.8Low59.9Low122 Ų122154.3 Ų154.374%0.73982%0.822SS**  trans-74115.9-180176.40000109.6K6V4-K6 HydrophobicContact CG1-CG 4.05Å; V4-K6 PolarHBondContact O-N 2.85Å
5E66.2Low60.1Low181 Ų181160.3 Ų160.385%0.84683%0.829SS**  trans-89.5102172.8-153.1171.6-16000109.2
6K65.2Low60.5Low190 Ų190153.4 Ų153.483%0.82681%0.81SS**  trans-83.2109.5176.3-68.5178.8178.4176.80108.8V4V4-K6 HydrophobicContact CG1-CG 4.05Å; V4-K6 PolarHBondContact O-N 2.85Å
7Q68.5Low60.7Low168 Ų168152.1 Ų152.179%0.78581%0.812SS**  trans-77.9149.4169.4-72.9-125.3-17.200111.6
8P64Low60.5Low107 Ų107152.7 Ų152.770%0.69581%0.812SS**  trans-74.4139.9-165.729.4-34.3000113V10P8-V10 PolarHBondContact O-N 3.3Å
9I57.1Low60.3Low169 Ų169149.7 Ų149.787%0.86780%0.804SS**  trans-66.1108169.7-64.4164.2000107.7A11I9-A11 PolarHBondContact O-N 2.81Å
10V61.9Low60.1Low134 Ų134149.1 Ų149.181%0.81281%0.806SS**  trans-76.9113.1171.4-1770000108.1P8P8-V10 PolarHBondContact O-N 3.3Å
11A59.8Low60.2Low80 Ų80148.8 Ų148.866%0.66180%0.803SS**  trans-74.3131.617900000111.9I9I9-A11 PolarHBondContact O-N 2.81Å
12M50.2Low60.8Low171 Ų171143.1 Ų143.184%0.84278%0.784SS**  trans35.7106.8142.8-60.9-178.373.400119.2
13E59.7Low60.9Low187 Ų187140.6 Ų140.687%0.87478%0.776SS**  trans-116.2102.1141-78.4-171.8153.700109R15E13-R15 PolarHBondContact O-N 3.13Å; E13-R15 VanDerWaalsContact O-N 3.09Å
14S58.4Low60.6Low108 Ų108143 Ų14376%0.75578%0.777SS**  trans-64.9101.9168.850.40000109.4G16S14-G16 PolarHBondContact O-N 3.06Å
15R62.7Low60.8Low244 Ų244142.6 Ų142.692%0.92178%0.777SS**  trans-68.597.6164.3-70.7-175.8177.4-180-0.8108.2E13E13-R15 PolarHBondContact O-N 3.13Å; E13-R15 VanDerWaalsContact O-N 3.09Å
16G66.8Low60.6Low51 Ų51144.1 Ų144.153%0.52678%0.775SS.*  trans-55.6160167.300000111.2S14 M18S14-G16 PolarHBondContact O-N 3.06Å; G16-M18 PolarHBondContact O-N 3.1Å
17P63Low60.3Low130 Ų130140 Ų14084%0.84477%0.769SS**  trans-62.4115179.927.7-31.6000107.5S19P17-S19 PolarHBondContact O-N 3.24Å
18M57.7Low60Low163 Ų163137.4 Ų137.480%0.80377%0.767SS**  trans-52.8115.9168.9-86.9-134.663.300107.5G16 V20G16-M18 PolarHBondContact O-N 3.1Å; M18-V20 VanDerWaalsContact C-N 3.32Å; M18-V20 PolarHBondContact O-N 2.68Å
19S56.5Low60.2Low96 Ų96144 Ų14467%0.67178%0.778SS**  trans-51.8100.9164.449.10000107.6P17 L21P17-S19 PolarHBondContact O-N 3.24Å; S19-L21 VanDerWaalsContact C-N 3.28Å; S19-L21 PolarHBondContact O-N 3.2Å
20V56.7Low60.5Low138 Ų138140.8 Ų140.884%0.83677%0.766SS**  trans-67.895.6170-179.40000105.2M18M18-V20 VanDerWaalsContact C-N 3.32Å; M18-V20 PolarHBondContact O-N 2.68Å
21L63.3Low60.9Low142 Ų142143 Ų14374%0.74376%0.76SS**PPolyproline II helixtrans-47.5137.7163.1-94.1136.3000107.9S19 D23S19-L21 VanDerWaalsContact C-N 3.28Å; S19-L21 PolarHBondContact O-N 3.2Å; L21-D23 PolarHBondContact O-N 2.89Å
22P60.4Low61.5Low118 Ų118144.6 Ų144.677%0.76676%0.763SS**PPolyproline II helixtrans-59.6116.1173.226.2-30.8000106.8E24P22-E24 PolarHBondContact O-N 2.76Å
23D57.7Low62.5Low131 Ų131142.1 Ų142.170%0.70175%0.75SS**PPolyproline II helixtrans-49.3117.1173.8-105.9-17.3000107.2L21L21-D23 PolarHBondContact O-N 2.89Å
24E60.6Low62.7Low173 Ų173135.3 Ų135.381%0.80873%0.725SS**  trans-45133.9166.5-123.5-167.1163.800107.4P22 R26P22-E24 PolarHBondContact O-N 2.76Å; E24-R26 PolarHBondContact O-N 3.3Å
25P61.1Low63Low113 Ų113139.1 Ų139.173%0.73472%0.723SS**  trans-55.8110.5-178.922.8-32.2000107.4C27P25-C27 VanDerWaalsContact C-N 3.29Å; P25-C27 PolarHBondContact O-N 2.77Å
26R60.6Low63.1Low213 Ų213133 Ų13380%0.80471%0.705SS**  trans-5898179.1-73.4-175.6180-1680.9107.2E24 P28E24-R26 PolarHBondContact O-N 3.3Å; R26-P28 WeakPolarHBondContact O-CD 3.38Å
27C58.9Low62.9Low104 Ų104134.9 Ų134.970%0.70370%0.703SS**  trans-52.2125.5174.8-73.10000107.4P25 R29P25-C27 VanDerWaalsContact C-N 3.29Å; P25-C27 PolarHBondContact O-N 2.77Å; C27-R29 PolarHBondContact O-N 2.98Å
28P63.8Low62.8Low114 Ų114137.2 Ų137.274%0.7470%0.696SS**  trans-52.4119.4174.6-23.932.1000107.9R26 V30R26-P28 WeakPolarHBondContact O-CD 3.38Å; P28-V30 PolarHBondContact O-N 3.47Å
29R66.6Low63Low246 Ų246135.4 Ų135.493%0.92869%0.686SS**  trans-67.385.7173.1-76-176.5178.5137.2-1.3107.8C27 R31C27-R29 PolarHBondContact O-N 2.98Å; R29-R31 PolarHBondContact O-N 3.16Å; R29-R31 VanDerWaalsContact O-N 3.16Å
30V64.9Low63.2Low101 Ų101137.1 Ų137.161%0.61268%0.681SS**  trans-69.7109.5171.6-178.20000106.2P28 A34P28-V30 PolarHBondContact O-N 3.47Å; V30-A34 HydrophobicContact CG1-CB 3.86Å
31R70.6Confident63.3Low181 Ų181135.5 Ų135.568%0.68367%0.668SS**  trans-55.3138.8171.9-75.7-172.1175179.9-0.1108.6R29 E33 A34R29-R31 PolarHBondContact O-N 3.16Å; R29-R31 VanDerWaalsContact O-N 3.16Å; R31-E33 PolarHBondContact O-N 2.78Å; R31-A34 VanDerWaalsContact O-CB 3.3Å; R31-A34 WeakPolarHBondContact O-CB 3.28Å; R31-A34 PolarHBondContact O-N 2.97Å
32P70.5Confident63Low112 Ų112133.1 Ų133.173%0.72766%0.659SS**Hα-helixtrans-51.8-33.5178.9-25.532.4000113A34 R35P32-A34 VanDerWaalsContact C-N 3.31Å; P32-A34 PolarHBondContact O-N 3.15Å; P32-R35 PolarHBondContact O-N 2.77Å
33E72.4Confident62.6Low120 Ų120136.3 Ų136.356%0.56166%0.661SS**Hα-helixtrans-61.8-33175.9-62.5160.4-173.200113.4R31 R35 Q36 N37R31-E33 PolarHBondContact O-N 2.78Å; E33-R35 VanDerWaalsContact C-N 3.32Å; E33-R35 PolarHBondContact O-N 3.42Å; E33-Q36 PolarHBondContact O-N 3.39Å; E33-N37 PolarHBondContact O-N 2.85Å
34A63.9Low62.2Low44 Ų44132 Ų13236%0.36465%0.647SS.*Hα-helixtrans-68.6-32.3179.600000111.7V30 R31 P32 N37 Y38V30-A34 HydrophobicContact CG1-CB 3.86Å; R31-A34 VanDerWaalsContact O-CB 3.3Å; R31-A34 WeakPolarHBondContact O-CB 3.28Å; R31-A34 PolarHBondContact O-N 2.97Å; P32-A34 VanDerWaalsContact C-N 3.31Å; P32-A34 PolarHBondContact O-N 3.15Å; A34-N37 PolarHBondContact O-N 3.4Å; A34-Y38 WeakPolarHBondContact O-CB 3.14Å; A34-Y38 PolarHBondContact O-N 3.13Å
35R64Low61.5Low188 Ų188127.1 Ų127.171%0.70963%0.631SS**Hα-helixtrans-67.4-40.2175.4-159.5176.3-172.9-179.22.1111.4P32 E33 Q39P32-R35 PolarHBondContact O-N 2.77Å; E33-R35 VanDerWaalsContact C-N 3.32Å; E33-R35 PolarHBondContact O-N 3.42Å; R35-Q39 PolarHBondContact O-N 3.39Å; R35-Q39 VanDerWaalsContact O-N 3.13Å
36Q65.5Low60.8Low115 Ų115124 Ų12454%0.53762%0.62SS.*Hα-helixtrans-67.9-38.9172.9-84.7-174.8500112.6E33 Q39 K40E33-Q36 PolarHBondContact O-N 3.39Å; Q36-Q39 PolarHBondContact O-N 2.65Å; Q36-K40 WeakPolarHBondContact O-CB 3.42Å; Q36-K40 VanDerWaalsContact O-CG 3.28Å; Q36-K40 WeakPolarHBondContact O-CG 3.17Å; Q36-K40 PolarHBondContact O-N 2.86Å
37N62.8Low60.3Low90 Ų90118.2 Ų118.248%0.48161%0.608SS.*Hα-helixtrans-67.6-37.2176.8-75.7-20.8000112.1E33 A34 K40 N41E33-N37 PolarHBondContact O-N 2.85Å; A34-N37 PolarHBondContact O-N 3.4Å; N37-K40 PolarHBondContact O-N 3.08Å; N37-N41 VanDerWaalsContact O-CB 3.23Å; N37-N41 WeakPolarHBondContact O-CB 3.38Å; N37-N41 PolarHBondContact O-N 2.99Å; N37-N41 PolarHBondContact O-ND2 2.94Å
38Y60.1Low59.7Low179 Ų179115.6 Ų115.670%0.70259%0.594SS**Hα-helixtrans-63.2-47.3174.3-155.5-92.7000111A34 K40 N41 V42A34-Y38 WeakPolarHBondContact O-CB 3.14Å; A34-Y38 PolarHBondContact O-N 3.13Å; Y38-K40 PolarHBondContact O-N 3.4Å; Y38-N41 PolarHBondContact O-N 3.1Å; Y38-V42 HydrophobicContact CD1-CG2 4.05Å; Y38-V42 HydrophobicContact CE1-CG2 4.05Å; Y38-V42 VanDerWaalsContact O-CG2 3.25Å; Y38-V42 WeakPolarHBondContact O-CG2 3.34Å; Y38-V42 PolarHBondContact O-N 3.3Å
39Q62.2Low59.1Low125 Ų125117.7 Ų117.758%0.58459%0.591SS**Hα-helixtrans-63.4-39.4175.9-75.1-179.6-15.500113.1R35 Q36 N41R35-Q39 PolarHBondContact O-N 3.39Å; R35-Q39 VanDerWaalsContact O-N 3.13Å; Q36-Q39 PolarHBondContact O-N 2.65Å; Q39-N41 VanDerWaalsContact C-N 3.35Å
40K61.6Low58.5Low133 Ų133111.6 Ų111.658%0.57858%0.576SS**Hα-helixtrans-68.7-32.1176.4-76.4174.3-179.1171.80112.6Q36 N37 Y38 G44Q36-K40 WeakPolarHBondContact O-CB 3.42Å; Q36-K40 VanDerWaalsContact O-CG 3.28Å; Q36-K40 WeakPolarHBondContact O-CG 3.17Å; Q36-K40 PolarHBondContact O-N 2.86Å; N37-K40 PolarHBondContact O-N 3.08Å; Y38-K40 PolarHBondContact O-N 3.4Å; K40-G44 VanDerWaalsContact O-CA 3.26Å; K40-G44 WeakPolarHBondContact O-CA 3.48Å; K40-G44 PolarHBondContact O-N 2.89Å
41N58Low58Low104 Ų104113.3 Ų113.356%0.55658%0.582SS**Hα-helixtrans-85.3-26.7-178.4-73-12.6000113.5N37 Y38 Q39 F43 G44 C45N37-N41 VanDerWaalsContact O-CB 3.23Å; N37-N41 WeakPolarHBondContact O-CB 3.38Å; N37-N41 PolarHBondContact O-N 2.99Å; N37-N41 PolarHBondContact O-ND2 2.94Å; Y38-N41 PolarHBondContact O-N 3.1Å; Q39-N41 VanDerWaalsContact C-N 3.35Å; N41-F43 PolarHBondContact O-N 3.34Å; N41-G44 PolarHBondContact O-N 3.22Å; N41-C45 PolarHBondContact O-N 3.33Å
42V56.6Low57.1Low92 Ų92112.7 Ų112.756%0.55859%0.587SS**Hα-helixtrans-60.5-33.8171.8170.10000111.3Y38Y38-V42 HydrophobicContact CD1-CG2 4.05Å; Y38-V42 HydrophobicContact CE1-CG2 4.05Å; Y38-V42 VanDerWaalsContact O-CG2 3.25Å; Y38-V42 WeakPolarHBondContact O-CG2 3.34Å; Y38-V42 PolarHBondContact O-N 3.3Å
43F53Low55.9Low184 Ų184116.7 Ų116.781%0.80759%0.587SS**THydrogen-bonded Turntrans-101.4-5.6174.2-70.1-80.2000114.3N41N41-F43 PolarHBondContact O-N 3.34Å
44G49.2Very low54.8Low40 Ų40115.4 Ų115.441%0.41259%0.589SS.*THydrogen-bonded Turntrans-120.51-168.300000115.3K40 N41 G46K40-G44 VanDerWaalsContact O-CA 3.26Å; K40-G44 WeakPolarHBondContact O-CA 3.48Å; K40-G44 PolarHBondContact O-N 2.89Å; N41-G44 PolarHBondContact O-N 3.22Å; G44-G46 PolarHBondContact O-N 3.02Å; G44-G46 VanDerWaalsContact O-N 3.14Å
45C45.1Very low54.2Low71 Ų71119.4 Ų119.448%0.4861%0.614SS.*  trans-58.3119.1171.4-177.10000108.4N41 V47 A48N41-C45 PolarHBondContact O-N 3.33Å; C45-V47 PolarHBondContact O-N 3.34Å; C45-A48 PolarHBondContact O-N 3.27Å
46G46.9Very low53.5Low47 Ų47120.8 Ų120.849%0.48562%0.62SS.*Hα-helixtrans-54.3-15.6-174.200000114.8G44 L50G44-G46 PolarHBondContact O-N 3.02Å; G44-G46 VanDerWaalsContact O-N 3.14Å; G46-L50 PolarHBondContact O-N 2.91Å
47V49.6Very low52.6Low93 Ų93122.2 Ų122.256%0.56463%0.628SS**Hα-helixtrans-68.2-38.4172.8-173.60000112.1C45 K49 L50 L51C45-V47 PolarHBondContact O-N 3.34Å; V47-K49 VanDerWaalsContact C-N 3.34Å; V47-K49 PolarHBondContact O-N 2.9Å; V47-L50 PolarHBondContact O-N 3.33Å; V47-L51 HydrophobicContact CG1-CD1 4.44Å; V47-L51 WeakPolarHBondContact O-CG 3.48Å; V47-L51 PolarHBondContact O-N 3.4Å
48A47.4Very low51.6Low49 Ų49125.7 Ų125.741%0.40565%0.647SS.*Hα-helixtrans-71.1-29.4177.800000112.7C45 L51 Q52C45-A48 PolarHBondContact O-N 3.27Å; A48-L51 PolarHBondContact O-N 2.77Å; A48-Q52 PolarHBondContact O-N 3.24Å
49K49.9Very low51.2Low157 Ų157125.4 Ų125.468%0.68365%0.649SS**Hα-helixtrans-72-28172.5-94.4-173.6173.1-175.80113.4V47 L51V47-K49 VanDerWaalsContact C-N 3.34Å; V47-K49 PolarHBondContact O-N 2.9Å; K49-L51 VanDerWaalsContact C-N 3.35Å
50L53.7Low50.6Low118 Ų118124.1 Ų124.162%0.61865%0.652SS**Hα-helixtrans-73.1-28.6174.9-89.6152.9000112.4G46 V47 W53G46-L50 PolarHBondContact O-N 2.91Å; V47-L50 PolarHBondContact O-N 3.33Å; L50-W53 HydrophobicContact CD2-CE3 4.37Å; L50-W53 HydrophobicContact CD2-CZ3 4.13Å
51L54.5Low49.8Very low138 Ų138125.8 Ų125.872%0.72367%0.666SS**Hα-helixtrans-88.5-9-178.1-65.6169.4000114.1V47 A48 K49V47-L51 HydrophobicContact CG1-CD1 4.44Å; V47-L51 WeakPolarHBondContact O-CG 3.48Å; V47-L51 PolarHBondContact O-N 3.4Å; A48-L51 PolarHBondContact O-N 2.77Å; K49-L51 VanDerWaalsContact C-N 3.35Å
52Q53.2Low49.2Very low168 Ų168131 Ų13179%0.78568%0.68SS**THydrogen-bonded Turntrans-97.42.1177.7-100.7178.16.300114.2A48A48-Q52 PolarHBondContact O-N 3.24Å
53W43.3Very low48.4Very low196 Ų196138.8 Ų138.874%0.74270%0.699SS**SBendtrans-75.7126177.8-100.1-43.4000111.1L50 S55L50-W53 HydrophobicContact CD2-CE3 4.37Å; L50-W53 HydrophobicContact CD2-CZ3 4.13Å; W53-S55 PolarHBondContact O-N 2.9Å
54P49.6Very low47.8Very low93 Ų93133 Ų13360%0.60469%0.691SS**  trans-66134.7174.618.7-14.3000109R56P54-R56 PolarHBondContact O-N 3.42Å
55S52.1Low47.7Very low127 Ų127142 Ų14289%0.88871%0.712SS**SBendtrans-65.929.6-176.556.10000115.5W53W53-S55 PolarHBondContact O-N 2.9Å
56R49.2Very low47.6Very low218 Ų218145.5 Ų145.582%0.82373%0.732SS**  trans-137.175.6177.2-73.8-170.4177-167-0.5110.6P54P54-R56 PolarHBondContact O-N 3.42Å
57M47.1Very low47.8Very low144 Ų144147.6 Ų147.671%0.70975%0.745SS**  trans-132.499.9156.8-78.6-65.9161.100107.4F59M57-F59 HydrophobicContact CB-CD2 4.46Å; M57-F59 HydrophobicContact CB-CE2 4.09Å; M57-F59 WeakPolarHBondContact O-CD2 3.34Å; M57-F59 PolarHBondContact O-N 2.91Å
58D41.6Very low47.7Very low164 Ų164148 Ų14888%0.87775%0.752SS**  trans-63.798.2166-66.1-49.9000107.6P60D58-P60 WeakPolarHBondContact O-CD 3.22Å
59F51.2Low48Very low173 Ų173157.3 Ų157.376%0.75978%0.776SS**  trans-74.8119.7169.5-77-81.1000108.1M57 L61M57-F59 HydrophobicContact CB-CD2 4.46Å; M57-F59 HydrophobicContact CB-CE2 4.09Å; M57-F59 WeakPolarHBondContact O-CD2 3.34Å; M57-F59 PolarHBondContact O-N 2.91Å; F59-L61 PolarHBondContact O-N 3.05Å
60P50.1Low48.3Very low98 Ų98151.6 Ų151.664%0.63676%0.757SS**  trans-63112.3168.825.8-30000106.9D58 Y62D58-P60 WeakPolarHBondContact O-CD 3.22Å; P60-Y62 HydrophobicContact CB-CD2 4.23Å; P60-Y62 HydrophobicContact CB-CE2 4.43Å; P60-Y62 HydrophobicContact CG-CD2 4.31Å; P60-Y62 HydrophobicContact CG-CE2 4.45Å; P60-Y62 PolarHBondContact O-N 3.2Å
61L44.3Very low48.4Very low168 Ų168154.7 Ų154.788%0.8877%0.765SS**  trans-6484.2168.4-71.9173.3000107.7F59 R63F59-L61 PolarHBondContact O-N 3.05Å; L61-R63 PolarHBondContact O-N 2.79Å
62Y46.4Very low48.6Very low213 Ų213155.3 Ų155.384%0.83577%0.769SS**  trans-64.992.7166.4-99.4-85.8000107.7P60 G64P60-Y62 HydrophobicContact CB-CD2 4.23Å; P60-Y62 HydrophobicContact CB-CE2 4.43Å; P60-Y62 HydrophobicContact CG-CD2 4.31Å; P60-Y62 HydrophobicContact CG-CE2 4.45Å; P60-Y62 PolarHBondContact O-N 3.2Å; Y62-G64 PolarHBondContact O-N 3Å
63R39.2Very low49Very low256 Ų256154.8 Ų154.897%0.96676%0.764SS**  trans-7271.9169.6-147-176.3-148.5-141.27.2108L61L61-R63 PolarHBondContact O-N 2.79Å
64G41.2Very low49.9Very low62 Ų62150.1 Ų150.164%0.63975%0.753SS**  trans-101.391.9-17800000112.2Y62Y62-G64 PolarHBondContact O-N 3Å
65R45.4Very low50.8Low228 Ų228150.5 Ų150.586%0.8675%0.75SS**  trans23.1116151.3-56.7-175.7-162.8-145.33118.6A67R65-A67 PolarHBondContact O-N 3.4Å
66T42.9Very low51.8Low146 Ų146146.8 Ų146.890%0.89673%0.727SS**  trans4967.1145.159.20000117
67A51.9Low52.7Low91 Ų91138.6 Ų138.675%0.75271%0.706SS**  trans-100.1101.4167.800000110.9R65R65-A67 PolarHBondContact O-N 3.4Å
68S48.4Very low53.8Low102 Ų102138.9 Ų138.971%0.71370%0.7SS**  trans-32.2133.3169.1176.80000115.5S70S68-S70 PolarHBondContact O-N 3.34Å
69R53.3Low55.2Low243 Ų243135.3 Ų135.392%0.91768%0.684SS**SBendtrans-26.691.5163.9-69.2171.7169.8-177.6-3.8114.3
70S56.7Low56.2Low38 Ų38135.7 Ų135.727%0.26668%0.681SS.*  trans-167.977.8150.353.50000111.9S68 L72 K73 N74S68-S70 PolarHBondContact O-N 3.34Å; S70-L72 PolarHBondContact O-N 3.48Å; S70-L72 VanDerWaalsContact O-N 3.08Å; S70-K73 PolarHBondContact O-N 2.89Å; S70-K73 WeakPolarHBondContact OG-CB 3.41Å; S70-N74 PolarHBondContact O-N 3.11Å
71F54.7Low57.3Low183 Ų183135.5 Ų135.580%0.80368%0.675SS**Hα-helixtrans-51.9-31.1172-71.2-81.5000112.7N75F71-N75 WeakPolarHBondContact O-CB 3.13Å; F71-N75 PolarHBondContact O-N 3.25Å
72L58.8Low58.4Low151 Ų151131.2 Ų131.279%0.79165%0.652SS**Hα-helixtrans-68.9-37.7175.8-86.980.7000114S70 A76S70-L72 PolarHBondContact O-N 3.48Å; S70-L72 VanDerWaalsContact O-N 3.08Å; L72-A76 PolarHBondContact O-N 3.13Å
73K61.2Low59.7Low156 Ų156123.7 Ų123.768%0.67863%0.63SS**Hα-helixtrans-75.1-36.4-178.4-67-176.4-178.7179.10111.3S70 N75 A76 A77S70-K73 PolarHBondContact O-N 2.89Å; S70-K73 WeakPolarHBondContact OG-CB 3.41Å; K73-N75 VanDerWaalsContact C-N 3.33Å; K73-A76 PolarHBondContact O-N 3.38Å; K73-A77 PolarHBondContact O-N 3.24Å; K73-A77 VanDerWaalsContact O-N 3.14Å
74N63Low61Low99 Ų99115.3 Ų115.353%0.52961%0.605SS.*Hα-helixtrans-66.9-36.2175.2-69.4-9.8000111.6S70 A77 Y78S70-N74 PolarHBondContact O-N 3.11Å; N74-A77 PolarHBondContact O-N 3Å; N74-Y78 WeakPolarHBondContact O-CB 3.29Å; N74-Y78 PolarHBondContact O-N 2.92Å
75N69Low61.9Low100 Ų100116.5 Ų116.554%0.53560%0.597SS.*Hα-helixtrans-65.2-43174-113-34.6000112.5F71 K73 A77 Y78 V79F71-N75 WeakPolarHBondContact O-CB 3.13Å; F71-N75 PolarHBondContact O-N 3.25Å; K73-N75 VanDerWaalsContact C-N 3.33Å; N75-A77 VanDerWaalsContact C-N 3.33Å; N75-A77 PolarHBondContact O-N 3.46Å; N75-Y78 PolarHBondContact O-N 2.98Å; N75-V79 VanDerWaalsContact O-CG2 3.31Å; N75-V79 WeakPolarHBondContact O-CG2 3.34Å; N75-V79 PolarHBondContact O-N 3.11Å
76A71.7Confident62.6Low50 Ų50109.6 Ų109.641%0.41358%0.579SS.*Hα-helixtrans-63-38.8178.100000112.6L72 K73 R80L72-A76 PolarHBondContact O-N 3.13Å; K73-A76 PolarHBondContact O-N 3.38Å; A76-R80 PolarHBondContact O-N 3.35Å; A76-R80 VanDerWaalsContact O-N 3.14Å
77A68.4Low63.4Low46 Ų46110.6 Ų110.638%0.3857%0.567SS.*Hα-helixtrans-66.5-43.5174.100000111.8K73 N74 N75 R80 N81K73-A77 PolarHBondContact O-N 3.24Å; K73-A77 VanDerWaalsContact O-N 3.14Å; N74-A77 PolarHBondContact O-N 3Å; N75-A77 VanDerWaalsContact C-N 3.33Å; N75-A77 PolarHBondContact O-N 3.46Å; A77-R80 PolarHBondContact O-N 3.16Å; A77-N81 PolarHBondContact O-N 3.5Å
78Y71Confident63.6Low149 Ų149111.5 Ų111.558%0.58456%0.559SS**Hα-helixtrans-60.8-45.6177.4-173.6-108.4000112.2N74 N75 R80 N81 L82N74-Y78 WeakPolarHBondContact O-CB 3.29Å; N74-Y78 PolarHBondContact O-N 2.92Å; N75-Y78 PolarHBondContact O-N 2.98Å; Y78-R80 PolarHBondContact O-N 3.41Å; Y78-N81 PolarHBondContact O-N 2.83Å; Y78-L82 HydrophobicContact CD1-CD1 3.53Å; Y78-L82 HydrophobicContact CD2-CD1 4.42Å; Y78-L82 HydrophobicContact CE1-CD1 3.17Å; Y78-L82 HydrophobicContact CE2-CD1 4.12Å; Y78-L82 HydrophobicContact CG-CD1 4.14Å; Y78-L82 VanDerWaalsContact CZ-CD1 3.49Å; Y78-L82 PolarHBondContact O-N 3.49Å
79V70.9Confident63.9Low89 Ų89111.6 Ų111.654%0.53955%0.551SS.*Hα-helixtrans-65-37.8177.4174.10000112.2N75 S83N75-V79 VanDerWaalsContact O-CG2 3.31Å; N75-V79 WeakPolarHBondContact O-CG2 3.34Å; N75-V79 PolarHBondContact O-N 3.11Å; V79-S83 PolarHBondContact O-N 3.4Å
80R72.3Confident63.9Low181 Ų181106.4 Ų106.468%0.68354%0.535SS*.Hα-helixtrans-64.6-42.4173.7-83.2-171.5-165.7139.42.9112.4A76 A77 Y78 S83 N84A76-R80 PolarHBondContact O-N 3.35Å; A76-R80 VanDerWaalsContact O-N 3.14Å; A77-R80 PolarHBondContact O-N 3.16Å; Y78-R80 PolarHBondContact O-N 3.41Å; R80-S83 PolarHBondContact O-N 2.89Å; R80-N84 PolarHBondContact O-N 3.33Å; R80-N84 PolarHBondContact O-ND2 2.85Å
81N71.6Confident63.8Low95 Ų95109.1 Ų109.151%0.50855%0.55SS..Hα-helixtrans-64.7-45179-69.8-11.3000111.2A77 Y78 S83 N84 D85A77-N81 PolarHBondContact O-N 3.5Å; Y78-N81 PolarHBondContact O-N 2.83Å; N81-S83 VanDerWaalsContact C-N 3.3Å; N81-S83 PolarHBondContact O-N 3.07Å; N81-N84 PolarHBondContact O-N 2.99Å; N81-D85 PolarHBondContact O-N 2.95Å
82L68.4Low63.7Low78 Ų78105.4 Ų105.441%0.40854%0.538SS..Hα-helixtrans-57.3-40.7171.9-93.2141.3000112.8Y78 N84 D85 V86Y78-L82 HydrophobicContact CD1-CD1 3.53Å; Y78-L82 HydrophobicContact CD2-CD1 4.42Å; Y78-L82 HydrophobicContact CE1-CD1 3.17Å; Y78-L82 HydrophobicContact CE2-CD1 4.12Å; Y78-L82 HydrophobicContact CG-CD1 4.14Å; Y78-L82 VanDerWaalsContact CZ-CD1 3.49Å; Y78-L82 PolarHBondContact O-N 3.49Å; L82-N84 VanDerWaalsContact C-N 3.32Å; L82-N84 PolarHBondContact O-N 3.23Å; L82-D85 PolarHBondContact O-N 3.19Å; L82-V86 VanDerWaalsContact O-CG2 3.24Å; L82-V86 WeakPolarHBondContact O-CG2 3.31Å; L82-V86 PolarHBondContact O-N 3.09Å
83S72.6Confident63.3Low54 Ų54105.9 Ų105.938%0.37853%0.534SS..Hα-helixtrans-67.9-31.6176.3-1750000112.9V79 R80 N81 R87V79-S83 PolarHBondContact O-N 3.4Å; R80-S83 PolarHBondContact O-N 2.89Å; N81-S83 VanDerWaalsContact C-N 3.3Å; N81-S83 PolarHBondContact O-N 3.07Å; S83-R87 VanDerWaalsContact O-CG 3.28Å; S83-R87 WeakPolarHBondContact O-CG 3.43Å; S83-R87 PolarHBondContact O-N 2.78Å
84N67.8Low62.8Low80 Ų80105.3 Ų105.343%0.42853%0.534SS..Hα-helixtrans-74.5-40.5176-71.9-23.3000111.1R80 N81 L82 V86 R87 L88R80-N84 PolarHBondContact O-N 3.33Å; R80-N84 PolarHBondContact O-ND2 2.85Å; N81-N84 PolarHBondContact O-N 2.99Å; L82-N84 VanDerWaalsContact C-N 3.32Å; L82-N84 PolarHBondContact O-N 3.23Å; N84-V86 VanDerWaalsContact C-N 3.33Å; N84-V86 PolarHBondContact O-N 3.44Å; N84-R87 WeakPolarHBondContact O-CA 3.17Å; N84-R87 WeakPolarHBondContact O-CB 3.29Å; N84-R87 PolarHBondContact O-N 3.02Å; N84-L88 WeakPolarHBondContact O-CG 3.41Å; N84-L88 PolarHBondContact O-N 3Å
85D60.1Low62.2Low88 Ų88104.3 Ų104.347%0.47154%0.539SS..Hα-helixtrans-65.9-35.8176.6-67.4-20.7000112N81 L82 R87 N89N81-D85 PolarHBondContact O-N 2.95Å; L82-D85 PolarHBondContact O-N 3.19Å; D85-R87 VanDerWaalsContact C-N 3.28Å; D85-R87 PolarHBondContact O-N 3.47Å; D85-N89 WeakPolarHBondContact O-CB 3.38Å; D85-N89 PolarHBondContact O-N 2.88Å; D85-N89 PolarHBondContact O-ND2 2.83Å
86V59.7Low61.3Low82 Ų82109.8 Ų109.850%0.49755%0.552SS.*Hα-helixtrans-68.3-28.5172.9171.80000111.8L82 N84 K90L82-V86 VanDerWaalsContact O-CG2 3.24Å; L82-V86 WeakPolarHBondContact O-CG2 3.31Å; L82-V86 PolarHBondContact O-N 3.09Å; N84-V86 VanDerWaalsContact C-N 3.33Å; N84-V86 PolarHBondContact O-N 3.44Å; V86-K90 WeakPolarHBondContact O-CG 3.49Å
87R58.9Low60.3Low168 Ų168113.4 Ų113.463%0.63457%0.565SS**Hα-helixtrans-77.7-41.7174.9-75.4173.4174.1-170.9-3.2111.8S83 N84 D85 K90 V91S83-R87 VanDerWaalsContact O-CG 3.28Å; S83-R87 WeakPolarHBondContact O-CG 3.43Å; S83-R87 PolarHBondContact O-N 2.78Å; N84-R87 WeakPolarHBondContact O-CA 3.17Å; N84-R87 WeakPolarHBondContact O-CB 3.29Å; N84-R87 PolarHBondContact O-N 3.02Å; D85-R87 VanDerWaalsContact C-N 3.28Å; D85-R87 PolarHBondContact O-N 3.47Å; R87-K90 WeakPolarHBondContact O-CB 3.31Å; R87-K90 PolarHBondContact O-N 2.75Å; R87-K90 VanDerWaalsContact O-N 3.14Å; R87-V91 PolarHBondContact O-N 2.97Å
88L57.3Low59.3Low110 Ų110119.9 Ų119.958%0.57659%0.587SS**Hα-helixtrans-64.3-40.6176.5-71.2168.4000111.7N84 K90 V91 D92N84-L88 WeakPolarHBondContact O-CG 3.41Å; N84-L88 PolarHBondContact O-N 3Å; L88-K90 PolarHBondContact O-N 3.5Å; L88-V91 PolarHBondContact O-N 3.13Å; L88-D92 PolarHBondContact O-N 2.86Å
89N54.8Low58Low103 Ų103116.9 Ų116.955%0.55159%0.593SS**Hα-helixtrans-69.7-12.2174.9-75-55.4000114.7D85D85-N89 WeakPolarHBondContact O-CB 3.38Å; D85-N89 PolarHBondContact O-N 2.88Å; D85-N89 PolarHBondContact O-ND2 2.83Å
90K53.5Low56.6Low134 Ų134118.9 Ų118.958%0.58361%0.608SS**Hα-helixtrans-84.5-38.1170.4-79.5177.4178.8-173.10111.6V86 R87 L88 K93 E94V86-K90 WeakPolarHBondContact O-CG 3.49Å; R87-K90 WeakPolarHBondContact O-CB 3.31Å; R87-K90 PolarHBondContact O-N 2.75Å; R87-K90 VanDerWaalsContact O-N 3.14Å; L88-K90 PolarHBondContact O-N 3.5Å; K90-K93 PolarHBondContact O-N 3.21Å; K90-E94 PolarHBondContact O-N 3.44Å
91V53.6Low55.3Low95 Ų95116.1 Ų116.158%0.57662%0.616SS**Hα-helixtrans-65.9-39.2178.3179.70000111.1R87 L88 K93 E94 A95R87-V91 PolarHBondContact O-N 2.97Å; L88-V91 PolarHBondContact O-N 3.13Å; V91-K93 VanDerWaalsContact C-N 3.32Å; V91-K93 PolarHBondContact O-N 3.38Å; V91-E94 PolarHBondContact O-N 3.27Å; V91-A95 PolarHBondContact O-N 2.83Å
92D52.1Low53.7Low106 Ų106115.2 Ų115.257%0.56763%0.629SS**Hα-helixtrans-72-23.2176.9-80-24.3000114.2L88L88-D92 PolarHBondContact O-N 2.86Å
93K51.6Low52.4Low160 Ų160122.8 Ų122.870%0.69665%0.652SS**Hα-helixtrans-82-26.4175.5-87.7-178.1175.7-179.60113K90 V91 N97K90-K93 PolarHBondContact O-N 3.21Å; V91-K93 VanDerWaalsContact C-N 3.32Å; V91-K93 PolarHBondContact O-N 3.38Å; K93-N97 PolarHBondContact O-ND2 3.28Å
94E50.4Low51.1Low145 Ų145132 Ų13268%0.67868%0.678SS**Hα-helixtrans-78.6-27.9175.3-75.2173.5-177.400111.9K90 V91 R96K90-E94 PolarHBondContact O-N 3.44Å; V91-E94 PolarHBondContact O-N 3.27Å; E94-R96 VanDerWaalsContact C-N 3.31Å; E94-R96 PolarHBondContact O-N 3.05Å
95A51Low49.9Very low77 Ų77134.7 Ų134.764%0.63670%0.698SS**THydrogen-bonded Turntrans-72.7-15.7176.300000114.9V91V91-A95 PolarHBondContact O-N 2.83Å
96R49Very low49.5Very low215 Ų215136 Ų13681%0.81171%0.714SS**THydrogen-bonded Turntrans-102.94-173.9-70.7-172.7179.7-172.41.6115.5E94E94-R96 VanDerWaalsContact C-N 3.31Å; E94-R96 PolarHBondContact O-N 3.05Å
97N51.7Low48.7Very low127 Ų127141.4 Ų141.468%0.67973%0.734SS**  trans-9612.6-175.7-63.6-37.7000115K93K93-N97 PolarHBondContact O-ND2 3.28Å
98H46.8Very low48.2Very low182 Ų182140.1 Ų140.184%0.84374%0.744SS**  trans-105.678.4172.5-70.4-66.8000110.9
99A43.1Very low47.5Very low85 Ų85143.8 Ų143.870%0.70276%0.758SS**  trans-147.6129.5163.100000110.1
100P42.2Very low47Very low132 Ų132150.3 Ų150.386%0.85778%0.775SS**  trans-79.4132.1-170.230.4-31.6000112.6
101S44.2Very low46.5Very low123 Ų123149.6 Ų149.686%0.8678%0.784SS**  trans-2.2114.1152160.60000117.3
102G39.9Very low46.2Very low75 Ų75153.8 Ų153.877%0.77380%0.798SS**  trans-137.7113.6161.100000110.7
103R39.9Very low45.6Very low237 Ų237155.1 Ų155.189%0.89481%0.81SS**  trans-51.2141.8179.7-68.1176.7171.9-161.5-2.6113
104R46Very low45.3Very low248 Ų248153.4 Ų153.494%0.93681%0.813SS**  -169.8135.8127-101.7163.3-167.5-136.74.3111.9
105T43Very low45.4Very low136 Ų136154.3 Ų154.383%0.83482%0.817SS**  trans-76.3139.7-177.645.80000111.6
106S50.1Low45.2Very low115 Ų115156 Ų15680%0.80482%0.821SS**  trans-160.9133.7142.541.60000109.8
107E43Very low45.2Very low196 Ų196152.9 Ų152.992%0.91682%0.82SS**  trans-59.8133.7179.8-66.5162124.400111
108V49.3Very low44.6Very low142 Ų142152.4 Ų152.486%0.86183%0.825SS**  trans-136.9126.5161.7-178.70000108
109E42.8Very low44.7Very low186 Ų186149.5 Ų149.587%0.86982%0.815SS**PPolyproline II helixtrans-57.5147.4-168.3-64.5177.3133.200114.6
110R43.9Very low44.9Very low240 Ų240154 Ų15491%0.90682%0.822SS**PPolyproline II helixtrans-64.9133.1171.9-91.2-178.2169.5113.3-4110.6Q112R110-Q112 PolarHBondContact O-N 3.33Å
111P43.2Very low44.9Very low119 Ų119157.9 Ų157.977%0.77382%0.82SS**PPolyproline II helixtrans-70.3127.3166.727.2-30.6000110.4T113P111-T113 PolarHBondContact O-N 2.73Å
112Q47.6Very low45.2Very low183 Ų183160 Ų16086%0.85582%0.82SS**PPolyproline II helixtrans-58.2130.7171.9-76.4178.8-7.800110.2R110 V114R110-Q112 PolarHBondContact O-N 3.33Å; Q112-V114 PolarHBondContact O-N 3.08Å
113T38.6Very low45.4Very low134 Ų134163.8 Ų163.882%0.82282%0.823SS**  trans-80.5113.8174.5-51.20000107.8P111P111-T113 PolarHBondContact O-N 2.73Å
114V45.2Very low45.5Very low125 Ų125156.2 Ų156.276%0.75882%0.818SS**  trans-90.7115.5175-175.50000107.9Q112Q112-V114 PolarHBondContact O-N 3.08Å
115E52Low45.4Very low163 Ų163153 Ų15376%0.76281%0.814SS**  trans-71.5142.6175.1-75.5-109.9143.200111.1L117E115-L117 PolarHBondContact O-N 2.97Å
116P48.5Very low45.8Very low113 Ų113155.7 Ų155.773%0.73482%0.817SS**  trans-71.3125.4176.728.2-31.8000111.4C118P116-C118 PolarHBondContact O-N 2.97Å; P116-C118 VanDerWaalsContact O-N 3.15Å
117L47.8Very low45.5Very low149 Ų149154.6 Ų154.678%0.7881%0.814SS**  trans-53112.3174.2-85.6153.5000112E115 L119E115-L117 PolarHBondContact O-N 2.97Å; L117-L119 PolarHBondContact O-N 2.98Å
118C40.3Very low45.9Very low117 Ų117150.6 Ų150.679%0.79181%0.808SS**  trans-73.999.8162.1-90.30000109.1P116 Q120P116-C118 PolarHBondContact O-N 2.97Å; P116-C118 VanDerWaalsContact O-N 3.15Å; C118-Q120 PolarHBondContact O-N 3.42Å; C118-Q120 VanDerWaalsContact O-N 3.13Å
119L47.3Very low46Very low121 Ų121149 Ų14963%0.63480%0.803SS**  trans-67.9107.7163.3-72.1173.5000108.6L117 R121L117-L119 PolarHBondContact O-N 2.98Å; L119-R121 PolarHBondContact O-N 3.41Å
120Q47.4Very low46.2Very low181 Ų181151.5 Ų151.585%0.84681%0.805SS**  trans-59.3131.8170.5-72.5176.2600109.3C118 L122C118-Q120 PolarHBondContact O-N 3.42Å; C118-Q120 VanDerWaalsContact O-N 3.13Å; Q120-L122 PolarHBondContact O-N 3.14Å; Q120-L122 VanDerWaalsContact O-N 3.11Å
121R42.3Very low46.4Very low213 Ų213145.1 Ų145.180%0.80480%0.795SS**  trans-62.1109.7172.7-71.7177.8178.5161.30.9108.7L119 N123L119-R121 PolarHBondContact O-N 3.41Å; R121-N123 PolarHBondContact O-N 3.37Å
122L50.7Low46.7Very low168 Ų168147 Ų14788%0.8880%0.798SS**  trans-73108.8164-75.7170.6000108Q120 G124Q120-L122 PolarHBondContact O-N 3.14Å; Q120-L122 VanDerWaalsContact O-N 3.11Å; L122-G124 PolarHBondContact O-N 3.08Å; L122-G124 VanDerWaalsContact O-N 3.13Å
123N43.5Very low46.9Very low153 Ų153147.6 Ų147.682%0.81880%0.798SS**  trans-64.6104.7172.2-73.1-36.6000109.4R121 H125R121-N123 PolarHBondContact O-N 3.37Å; N123-H125 PolarHBondContact O-N 3.23Å
124G43.9Very low47.7Very low78 Ų78145.9 Ų145.980%0.80480%0.797SS**  trans-77.2103.3163.900000109.6L122 E126L122-G124 PolarHBondContact O-N 3.08Å; L122-G124 VanDerWaalsContact O-N 3.13Å; G124-E126 PolarHBondContact O-N 3.43Å
125H43.4Very low47.9Very low182 Ų182147.7 Ų147.784%0.84380%0.802SS**  trans-74.699.2174.6-146.3-74.7000108.4N123N123-H125 PolarHBondContact O-N 3.23Å
126E51.3Low48.6Very low192 Ų192145.1 Ų145.190%0.89780%0.802SS**  trans-116.6107.1162.7-77-132.7130.600109.5G124G124-E126 PolarHBondContact O-N 3.43Å
127A44.5Very low49Very low91 Ų91145.3 Ų145.375%0.75281%0.806SS**  trans-73.7124.3166.900000108.7
128S51.3Low49.6Very low112 Ų112145.3 Ų145.378%0.78381%0.807SS**  trans-164118.9148.5-1550000112.9
129S51.4Low50.2Low108 Ų108149.6 Ų149.676%0.75581%0.813SS**  trans53108.8152.364.40000120.5
130R46Very low50.8Low239 Ų239150.8 Ų150.890%0.90282%0.818SS**  trans-61.2156.1144.9-62.6178.7168.3175.1-2.9109.2
131P49.1Very low51Low107 Ų107147.9 Ų147.970%0.69582%0.818SS**  -148.9159.987.335.8-15.8000116.6
132D48.4Very low51.5Low158 Ų158141.1 Ų141.185%0.84581%0.814SS**  trans79.1134.1142.4-62.8-23.5000124.5
133K51.6Low51.7Low196 Ų196142.5 Ų142.585%0.85281%0.813SS**  trans-75.3141.8179.8-61.5-178.1171-1760110.3
134A55.8Low52.1Low98 Ų98141.5 Ų141.581%0.8181%0.812SS**  trans-140.4104.2153.300000109
135D50Low53.1Low162 Ų162142.8 Ų142.887%0.86681%0.809SS**  trans-74.8123.3158.8-71.5-49.3000107.9
136S65.3Low53.5Low109 Ų109141.4 Ų141.476%0.76281%0.808SS**  trans-149.5105.8157.666.90000110.1
137S58.3Low53.9Low117 Ų117138.8 Ų138.882%0.81880%0.804SS**  trans-51132.5162.6520000111.5
138N59.1Low54.5Low149 Ų149143.8 Ų143.880%0.79781%0.809SS**  trans-135.299.1154.7-128.1-7.2000110.1
139K53.9Low54.3Low207 Ų207144.9 Ų144.990%0.982%0.815SS**  trans-73.2118.4162-98.3175.2170.81750107
140I58.7Low54.2Low146 Ų146144.1 Ų144.175%0.74982%0.816SS**  trans-119106.3160.5-61.6177.4000107.5
141S53.7Low54.2Low121 Ų121145 Ų14585%0.84682%0.819SS**  trans-82.4125.3163168.70000107.2
142G51Low54.7Low70 Ų70144.5 Ų144.572%0.72282%0.818SS**  trans-154.379.1-173.300000111.8
143K55.5Low54.8Low198 Ų198142.4 Ų142.486%0.86182%0.816SS**  trans2.7131.7158.8-64.8178.1176.4179.10119.5
144V52.6Low54.8Low132 Ų132141.2 Ų141.280%0.881%0.811SS**  trans-46.5134.1158.6-173.70000112
145S65Low54.7Low104 Ų104143 Ų14373%0.72781%0.812SS**  trans-145.2120.6148.961.20000109.4
146D51.3Low54.9Low154 Ų154141.8 Ų141.882%0.82481%0.805SS**  trans-56.7127.5171-67.1-59.9000111.2
147V58.5Low53.9Low136 Ų136140.1 Ų140.182%0.82481%0.806SS**  trans-123.2102.2162.7-177.80000109.2
148K57.3Low53.8Low197 Ų197142.5 Ų142.586%0.85781%0.807SS**  trans-17.4124.9159.1-112.4164.9173.3172.70115.6A150K148-A150 PolarHBondContact O-N 2.96Å
149C47Very low53.6Low134 Ų134144.4 Ų144.491%0.90581%0.812SS**  trans-53.6122.6151.7-74.90000110.7
150A49.2Very low53.9Low93 Ų93138.6 Ų138.677%0.76980%0.802SS**  trans-124103.2159.200000108.6K148 S152K148-A150 PolarHBondContact O-N 2.96Å; A150-S152 PolarHBondContact O-N 3.35Å
151R46.6Very low54.2Low256 Ų256137.4 Ų137.497%0.96680%0.804SS**  trans-73.9108.2167.9-171.5178.3-174.2176.30.7106.5
152S59.3Low54.3Low98 Ų98143.5 Ų143.569%0.68581%0.808SS**  trans-126.8115.8165.957.30000109.2A150A150-S152 PolarHBondContact O-N 3.35Å
153S50.2Low54.8Low113 Ų113148.6 Ų148.679%0.7982%0.816SS**  trans-72.2120.5161.546.50000108.2
154F52.9Low54.9Low172 Ų172151 Ų15175%0.75482%0.819SS**  trans-138.2104.4159.2-99.8-87.1000108.2D156F154-D156 PolarHBondContact O-N 2.92Å
155T53Low54.8Low135 Ų135149 Ų14983%0.82882%0.817SS**  trans-69.7108.4155.646.50000106.4
156D54.7Low54.7Low136 Ų136150.3 Ų150.373%0.72782%0.821SS**  trans-152.4138.5163.5-94.2-39.3000111.3F154F154-D156 PolarHBondContact O-N 2.92Å
157G44.2Very low55Low75 Ų75151.6 Ų151.677%0.77382%0.822SS**  trans-67.8131.3-163.700000113.9Q159G157-Q159 PolarHBondContact O-N 3.01Å
158I56.1Low54.6Low166 Ų166150.4 Ų150.485%0.85182%0.819SS**  trans-95.296.9163-59.2-178.1000107.8A160I158-A160 PolarHBondContact O-N 3.33Å
159Q55.5Low54.6Low189 Ų189149 Ų14988%0.88382%0.82SS**  trans-59.9110.1165.1-151.6173.452.300108G157G157-Q159 PolarHBondContact O-N 3.01Å
160A58.8Low54.8Low85 Ų85150.4 Ų150.470%0.70282%0.819SS**  trans-72.514118000000111.2I158 R162I158-A160 PolarHBondContact O-N 3.33Å; A160-R162 PolarHBondContact O-N 3.18Å
161P66.6Low54.9Low121 Ų121153.3 Ų153.379%0.78682%0.821SS**  trans-68.2129.4-174-17.130.7000113.1M163P161-M163 PolarHBondContact O-N 3.48Å
162R54.5Low55.4Low249 Ų249149.6 Ų149.694%0.9482%0.82SS**  trans-62.5110.4163.5-96.3174.5150.3144.9-6.8109.5A160A160-R162 PolarHBondContact O-N 3.18Å
163M62.5Low54.9Low178 Ų178152.5 Ų152.588%0.87783%0.828SS**PPolyproline II helixtrans-103.1126.8163.3-75.7-65.8-72.100110P161P161-M163 PolarHBondContact O-N 3.48Å
164R56.9Low54.9Low247 Ų247151.5 Ų151.593%0.93283%0.827SS**PPolyproline II helixtrans-72.6155.7-173-75.4179.5-178158.40.1112.9
165A51.1Low54.6Low92 Ų92152.4 Ų152.476%0.7683%0.833SS**PPolyproline II helixtrans-64.6146.9176.700000114.9
166T61.9Low54.6Low130 Ų130154.1 Ų154.180%0.79883%0.831SS**  trans-131.2102.3153.251.90000105.8
167Q58.3Low54.1Low181 Ų181152.7 Ų152.785%0.84683%0.832SS**  54.994.9106.5-62.5-17720.900111.9
168S49.3Very low54.8Low111 Ų111155.7 Ų155.778%0.77683%0.83SS**  72.8107.990.4-174.60000112.7
169L57.9Low54.4Low168 Ų168156.1 Ų156.188%0.8883%0.828SS**  trans-165.662.7156.5-103.4171000108.9
170D50.7Low54Low163 Ų163151.4 Ų151.487%0.87282%0.822SS**  trans-127.281.9167.3-74.5-38.9000108.2
171N52.7Low53.7Low154 Ų154154.2 Ų154.282%0.82483%0.83SS**  trans-139.1104.6163.7-89.6-29.3000105.5
172L56.3Low52.4Low179 Ų179152 Ų15294%0.93783%0.83SS**  trans-166.997.5143.6-96.3171.4000108.3
173N49.6Very low52.1Low158 Ų158145.6 Ų145.685%0.84582%0.823SS**  trans-75.4174.2165.1-88.9-34.4000111.1
174A50.4Low51.6Low93 Ų93147.2 Ų147.277%0.76983%0.825SS**  trans90.996.2166.100000113.4
175H45Very low51.2Low190 Ų190144.4 Ų144.488%0.8882%0.82SS**  60.785.565.9-134.1-70000111.6
176E53.1Low50.9Low172 Ų172144.7 Ų144.780%0.80482%0.816SS**  trans-146.3100.8162.5-161165.6-17500109.7
177S45.7Very low50.1Low106 Ų106147.3 Ų147.374%0.74182%0.819SS**  trans-86.4116164.6-73.40000108.2
178L57.1Low49.4Very low138 Ų138148.4 Ų148.472%0.72382%0.815SS**  trans-147.3103.7155.1-78.4174.7000105.9
179E48.5Very low49.2Very low174 Ų174149 Ų14981%0.81381%0.809SS**  68.6123.189.8-75.8-79.6140.100113.1
180A48.1Very low48.7Very low91 Ų91148.9 Ų148.975%0.75281%0.809SS**  trans-43.6134.7-179.100000115.4
181T52.4Low48.4Very low144 Ų144145.7 Ų145.788%0.88380%0.797SS**  trans-157.3138.1133.742.30000109.7
182G39.5Very low47.9Very low75 Ų75145.9 Ų145.977%0.77379%0.793SS**  trans-67.2144.1-176.600000113.3
183S48.2Very low47.4Very low114 Ų114145.1 Ų145.180%0.79779%0.789SS**  trans-156.2113.6148.3-101.60000111.1K185S183-K185 PolarHBondContact O-N 3.43Å
184K52.1Low47Very low212 Ų212143.7 Ų143.792%0.92279%0.786SS**  trans-42.7104.2163.6-65.9161.6175.31720110.2
185K47.7Very low46.8Very low188 Ų188143.1 Ų143.182%0.81778%0.777SS**  trans-105.177.7156.3-77.4-175.2-179.8177.70108.5S183 H187S183-K185 PolarHBondContact O-N 3.43Å; K185-H187 PolarHBondContact O-N 2.98Å; K185-H187 VanDerWaalsContact O-N 3.13Å
186S43.8Very low46.9Very low98 Ų98142 Ų14269%0.68578%0.777SS**  trans-56.6106.6155-176.80000106.7R188S186-R188 PolarHBondContact O-N 3.34Å
187H46Very low47.2Very low184 Ų184136.3 Ų136.385%0.85276%0.76SS**  trans-6884.3163.8-89.2-74.2000107.7K185K185-H187 PolarHBondContact O-N 2.98Å; K185-H187 VanDerWaalsContact O-N 3.13Å
188R43Very low48.1Very low205 Ų205139.9 Ų139.977%0.77477%0.765SS**  trans-53.7127.6162.5-97.4-176.6173.3-177.9-2.7110S186S186-R188 PolarHBondContact O-N 3.34Å
189L46.4Very low48.6Very low124 Ų124136.1 Ų136.165%0.64975%0.747SS**  trans78.8101.9135.9-53.8169.4000118.4P191L189-P191 HydrophobicContact CD2-CG 3.9Å
190N45.9Very low49.8Very low164 Ų164131 Ų13188%0.87773%0.729SS**  -141.484.6125.6-102.9-36.8000109.4
191P45.1Very low50.8Low96 Ų96134.9 Ų134.962%0.62374%0.737SS**  trans-98.36.4166.121.6-1.7000113L189L189-P191 HydrophobicContact CD2-CG 3.9Å
192E41.6Very low52.1Low159 Ų159130.7 Ų130.774%0.74372%0.723SS**  trans-112.178.9-177.1-74-171.3155.600112.4
193L47.2Very low54.1Low163 Ų163128.8 Ų128.885%0.85370%0.697SS**  trans-130.854.8145.5-81.2175.6000107.9S195L193-S195 PolarHBondContact O-N 3.45Å
194T39.7Very low55.9Low128 Ų128129.9 Ų129.979%0.78569%0.69SS**  trans-79.279.6152.647.60000107.3
195S47.3Very low57.7Low81 Ų81123 Ų12357%0.56666%0.661SS**  trans-115120.8143.835.10000103.5L193 A197L193-S195 PolarHBondContact O-N 3.45Å; S195-A197 PolarHBondContact O-N 3.36Å
196D47Very low59.7Low165 Ų165115 Ų11588%0.88263%0.627SS**  trans-56.386164-69.3-49.1000106.5E198D196-E198 PolarHBondContact O-N 3.47Å
197A59.5Low62.1Low53 Ų53113.2 Ų113.244%0.43861%0.613SS.*  trans-679617300000104.6S195 V199S195-A197 PolarHBondContact O-N 3.36Å; A197-V199 PolarHBondContact O-N 3.48Å; A197-V199 VanDerWaalsContact O-N 3.1Å
198E64.7Low64.3Low181 Ų181109.3 Ų109.385%0.84660%0.595SS**  trans-40.8119.1176.3-72.4178.6160.400108.4D196 P200D196-E198 PolarHBondContact O-N 3.47Å; E198-P200 WeakPolarHBondContact O-CD 3.46Å; E198-P200 VanDerWaalsContact O-N 3.17Å
199V67.4Low66.6Low60 Ų60104.4 Ų104.436%0.36458%0.581SS.*PPolyproline II helixtrans-56.3123.3173-179.50000106.1A197 N201 C203 Y268A197-V199 PolarHBondContact O-N 3.48Å; A197-V199 VanDerWaalsContact O-N 3.1Å; V199-N201 PolarHBondContact O-N 3.5Å; V199-C203 HydrophobicContact CG1-CB 4.41Å; V199-C203 WeakPolarHBondContact CG1-O 3.31Å; V199-Y268 HydrophobicContact CB-CE1 4.44Å; V199-Y268 HydrophobicContact CG1-CD1 3.91Å; V199-Y268 HydrophobicContact CG1-CE1 4.15Å; V199-Y268 HydrophobicContact CG2-CE1 4.04Å
200P72.6Confident68.9Low67 Ų67103.3 Ų103.344%0.43557%0.573SS.*PPolyproline II helixtrans-53129.7-179.7-26.734.1000110.1E198 G202 C203E198-P200 WeakPolarHBondContact O-CD 3.46Å; E198-P200 VanDerWaalsContact O-N 3.17Å; P200-G202 PolarHBondContact O-N 3.15Å; P200-C203 HydrophobicContact CB-CB 4.35Å; P200-C203 VanDerWaalsContact O-CB 3.28Å; P200-C203 WeakPolarHBondContact O-CB 3.33Å; P200-C203 PolarHBondContact O-N 3.27Å
201N70.1Confident71.2Confident171 Ų17196.9 Ų96.991%0.91454%0.536SS*.THydrogen-bonded Turntrans-50.2127.1-177.1-76.4-20.3000111.4V199V199-N201 PolarHBondContact O-N 3.5Å
202G78.6Confident73.6Confident56 Ų5698.7 Ų98.758%0.57753%0.531SS*.THydrogen-bonded Turntrans84.43.8-177.100000115.1P200 G271P200-G202 PolarHBondContact O-N 3.15Å; G202-G271 PolarHBondContact O-N 3Å
203C82.8Confident76.2Confident36 Ų3699.9 Ų99.924%0.24353%0.528CS..EExtended strand (participates in β ladder)trans-106.1151171-61.30000111.7V199 P200 V269V199-C203 HydrophobicContact CG1-CB 4.41Å; V199-C203 WeakPolarHBondContact CG1-O 3.31Å; P200-C203 HydrophobicContact CB-CB 4.35Å; P200-C203 VanDerWaalsContact O-CB 3.28Å; P200-C203 WeakPolarHBondContact O-CB 3.33Å; P200-C203 PolarHBondContact O-N 3.27Å; C203-V269 CarbonylContact C-O 3.46Å; C203-V269 WeakPolarHBondContact CA-O 3.3Å
204E85.9Confident78.5Confident137 Ų13794 Ų9464%0.6450%0.497SS*.EExtended strand (participates in β ladder)trans-115.4137.7173.7-174.7171.5177.200109Y268 V269E204-Y268 CarbonylContact O-C 3.57Å; E204-Y268 WeakPolarHBondContact O-CA 3.49Å; E204-V269 PolarHBondContact N-O 2.99Å; E204-V269 PolarHBondContact O-N 3.03Å
205E89.1Confident81.2Confident66 Ų6689.2 Ų89.231%0.30847%0.468SS..EExtended strand (participates in β ladder)trans-77.8126.9173.8-175172.1-171.300109.5R266 Y268E205-R266 WeakPolarHBondContact OE1-CG 3.49Å; E205-R266 IonicContact OE1-CZ 3.55Å; E205-R266 IonicContact OE1-NE 2.76Å; E205-R266 PolarHBondContact OE1-NE 2.75Å; E205-R266 IonicContact OE1-NH2 3.47Å; E205-R266 PolarHBondContact OE1-NH2 3.16Å; E205-R266 IonicContact OE2-CZ 3.51Å; E205-R266 IonicContact OE2-NE 3.51Å; E205-R266 IonicContact OE2-NH2 2.77Å; E205-R266 PolarHBondContact OE2-NH2 2.98Å; E205-Y268 HydrophobicContact CB-CD1 3.89Å; E205-Y268 HydrophobicContact CB-CE1 3.84Å; E205-Y268 HydrophobicContact CG-CD1 4.31Å; E205-Y268 HydrophobicContact CG-CE1 4.03Å
206I90.5Very high83.5Confident20 Ų2087.9 Ų87.910%0.10346%0.461CS..PPolyproline II helixtrans-70.4128.8176.3-54.5179.3000109.2E210 R211 I214 F262 V267 V269I206-E210 HydrophobicContact CG2-CB 3.91Å; I206-E210 HydrophobicContact CG2-CG 3.99Å; I206-R211 HydrophobicContact CG2-CB 4.09Å; I206-I214 HydrophobicContact CD1-CD1 4.35Å; I206-I214 HydrophobicContact CG2-CD1 4.42Å; I206-F262 HydrophobicContact CD1-CD1 4.11Å; I206-F262 HydrophobicContact CD1-CE1 3.52Å; I206-V267 HydrophobicContact CD1-CB 4.16Å; I206-V267 HydrophobicContact CD1-CG1 3.83Å; I206-V267 PolarHBondContact N-O 2.93Å; I206-V269 HydrophobicContact CD1-CG2 3.4Å; I206-V269 HydrophobicContact CG1-CG2 3.53Å
207P92.9Very high85.9Confident62 Ų6283.2 Ų83.240%0.40344%0.442SS..PPolyproline II helixtrans-61146175.322.2-29.1000111.5E209 E210 R211P207-E209 VanDerWaalsContact C-N 3.26Å; P207-E209 PolarHBondContact O-N 3.05Å; P207-E210 HydrophobicContact CG-CB 3.8Å; P207-E210 WeakPolarHBondContact CG-OE2 3.3Å; P207-E210 PolarHBondContact O-N 3.08Å; P207-R211 PolarHBondContact O-N 3.43Å
208E92.3Very high87.7Confident102 Ų10281.4 Ų81.448%0.47742%0.424SS..Hα-helixtrans-60.3-34.3-172.8171.9157.5-134.700113R211 R212E208-R211 IonicContact OE1-CZ 3.91Å; E208-R211 IonicContact OE1-NH2 2.86Å; E208-R211 PolarHBondContact OE1-NH2 3.4Å; E208-R212 WeakPolarHBondContact O-CB 3.39Å; E208-R212 VanDerWaalsContact O-CG 3.31Å; E208-R212 WeakPolarHBondContact O-CG 3.37Å; E208-R212 PolarHBondContact O-N 3.43Å; E208-R212 PolarHBondContact O-NE 2.9Å
209E93.2Very high89.2Confident101 Ų10177 Ų7747%0.47240%0.404SS..Hα-helixtrans-62.1-47174.4-70.162.3-128.900111.6P207 R212 R213P207-E209 VanDerWaalsContact C-N 3.26Å; P207-E209 PolarHBondContact O-N 3.05Å; E209-R212 PolarHBondContact O-N 2.91Å; E209-R212 IonicContact OE1-NH2 2.89Å; E209-R212 PolarHBondContact OE1-NH2 2.65Å; E209-R213 WeakPolarHBondContact O-CG 3.48Å; E209-R213 PolarHBondContact O-N 3.16Å; E209-R213 VanDerWaalsContact O-N 3.09Å
210E93.4Very high90.6Very high101 Ų10179.9 Ų79.947%0.47242%0.417SS..Hα-helixtrans-68.5-43.8-179.6-175.7173.1-174.200110.9I206 P207 R212 R213 I214I206-E210 HydrophobicContact CG2-CB 3.91Å; I206-E210 HydrophobicContact CG2-CG 3.99Å; P207-E210 HydrophobicContact CG-CB 3.8Å; P207-E210 WeakPolarHBondContact CG-OE2 3.3Å; P207-E210 PolarHBondContact O-N 3.08Å; E210-R212 VanDerWaalsContact C-N 3.3Å; E210-R212 PolarHBondContact O-N 3.29Å; E210-R213 WeakPolarHBondContact O-CB 3.41Å; E210-R213 PolarHBondContact O-N 2.87Å; E210-I214 HydrophobicContact CG-CD1 4.06Å; E210-I214 WeakPolarHBondContact O-CG1 3.36Å; E210-I214 PolarHBondContact O-N 2.91Å
211R94.7Very high91.8Very high29 Ų2978.5 Ų78.511%0.10941%0.41CS..Hα-helixtrans-54.9-46.8173.7-171.8-160.469.3-153.6-10.3111.1I206 P207 E208 R213 I214 V215 F262 K264 R265 V267I206-R211 HydrophobicContact CG2-CB 4.09Å; P207-R211 PolarHBondContact O-N 3.43Å; E208-R211 IonicContact OE1-CZ 3.91Å; E208-R211 IonicContact OE1-NH2 2.86Å; E208-R211 PolarHBondContact OE1-NH2 3.4Å; R211-R213 VanDerWaalsContact C-N 3.32Å; R211-R213 PolarHBondContact O-N 3.07Å; R211-I214 PolarHBondContact O-N 3.09Å; R211-V215 VanDerWaalsContact O-CG2 3.31Å; R211-V215 WeakPolarHBondContact O-CG2 3.49Å; R211-V215 PolarHBondContact O-N 3.39Å; R211-F262 VanDerWaalsContact CD-O 3.29Å; R211-F262 WeakPolarHBondContact CD-O 3.39Å; R211-F262 WeakPolarHBondContact CG-O 3.38Å; R211-K264 WeakPolarHBondContact CD-O 3.44Å; R211-K264 PolarHBondContact NH1-O 2.8Å; R211-K264 VanDerWaalsContact NH1-O 3.1Å; R211-R265 VanDerWaalsContact NH1-CA 3.27Å; R211-R265 PolarHBondContact NH1-O 2.71Å; R211-V267 HydrophobicContact CG-CG2 4.37Å
212R94.6Very high93.1Very high135 Ų13571.2 Ų71.251%0.50937%0.372SS..Hα-helixtrans-61.5-38.7177.7-77.8-176.7-74168.1-6.4112.3E208 E209 E210 A216E208-R212 WeakPolarHBondContact O-CB 3.39Å; E208-R212 VanDerWaalsContact O-CG 3.31Å; E208-R212 WeakPolarHBondContact O-CG 3.37Å; E208-R212 PolarHBondContact O-N 3.43Å; E208-R212 PolarHBondContact O-NE 2.9Å; E209-R212 PolarHBondContact O-N 2.91Å; E209-R212 IonicContact OE1-NH2 2.89Å; E209-R212 PolarHBondContact OE1-NH2 2.65Å; E210-R212 VanDerWaalsContact C-N 3.3Å; E210-R212 PolarHBondContact O-N 3.29Å; R212-A216 WeakPolarHBondContact O-CB 3.4Å; R212-A216 PolarHBondContact O-N 3.31Å
213R96Very high93.9Very high183 Ų18372.5 Ų72.569%0.69137%0.365SS*.Hα-helixtrans-63-47.3173.8-69.1172.8-172.7179.43.1111.1E209 E210 R211 V215 A216 S217E209-R213 WeakPolarHBondContact O-CG 3.48Å; E209-R213 PolarHBondContact O-N 3.16Å; E209-R213 VanDerWaalsContact O-N 3.09Å; E210-R213 WeakPolarHBondContact O-CB 3.41Å; E210-R213 PolarHBondContact O-N 2.87Å; R211-R213 VanDerWaalsContact C-N 3.32Å; R211-R213 PolarHBondContact O-N 3.07Å; R213-V215 PolarHBondContact O-N 3.37Å; R213-A216 PolarHBondContact O-N 2.99Å; R213-S217 PolarHBondContact O-N 3.37Å; R213-S217 PolarHBondContact O-OG 2.97Å
214I95.5Very high94.6Very high40 Ų4074.6 Ų74.621%0.20537%0.373CS..Hα-helixtrans-59-48.2177.8-66.3166.8000110.7I206 E210 R211 A216 S217 I218 F262I206-I214 HydrophobicContact CD1-CD1 4.35Å; I206-I214 HydrophobicContact CG2-CD1 4.42Å; E210-I214 HydrophobicContact CG-CD1 4.06Å; E210-I214 WeakPolarHBondContact O-CG1 3.36Å; E210-I214 PolarHBondContact O-N 2.91Å; R211-I214 PolarHBondContact O-N 3.09Å; I214-A216 VanDerWaalsContact C-N 3.33Å; I214-A216 PolarHBondContact O-N 3.16Å; I214-S217 WeakPolarHBondContact O-CB 3.34Å; I214-S217 PolarHBondContact O-N 3.37Å; I214-I218 HydrophobicContact CG2-CD1 3.69Å; I214-I218 HydrophobicContact CG2-CG1 4.31Å; I214-I218 VanDerWaalsContact O-CG1 3.3Å; I214-I218 WeakPolarHBondContact O-CG1 3.44Å; I214-I218 PolarHBondContact O-N 2.85Å; I214-F262 HydrophobicContact CD1-CE1 4.17Å; I214-F262 HydrophobicContact CG2-CD1 3.92Å; I214-F262 HydrophobicContact CG2-CD2 3.85Å; I214-F262 HydrophobicContact CG2-CE1 4.04Å; I214-F262 HydrophobicContact CG2-CE2 3.99Å; I214-F262 HydrophobicContact CG2-CG 3.84Å; I214-F262 HydrophobicContact CG2-CZ 4.09Å
215V96.7Very high95.1Very high28 Ų2868.9 Ų68.917%0.1735%0.347CS..Hα-helixtrans-58.6-44.5177.3172.10000111.3R211 R213 I218 H219 Y259 F262R211-V215 VanDerWaalsContact O-CG2 3.31Å; R211-V215 WeakPolarHBondContact O-CG2 3.49Å; R211-V215 PolarHBondContact O-N 3.39Å; R213-V215 PolarHBondContact O-N 3.37Å; V215-I218 PolarHBondContact O-N 2.99Å; V215-H219 WeakPolarHBondContact O-CB 3.38Å; V215-H219 PolarHBondContact O-N 3.39Å; V215-Y259 HydrophobicContact CG1-CD2 4.1Å; V215-Y259 HydrophobicContact CG1-CE2 3.54Å; V215-F262 HydrophobicContact CG2-CB 3.64Å; V215-F262 VanDerWaalsContact CG2-O 3.29Å; V215-F262 WeakPolarHBondContact CG2-O 3.41Å
216A96.4Very high95.5Very high52 Ų5270.9 Ų70.943%0.4335%0.353SS..Hα-helixtrans-63.1-43.1176.700000111.9R212 R213 I214 H219 L220R212-A216 WeakPolarHBondContact O-CB 3.4Å; R212-A216 PolarHBondContact O-N 3.31Å; R213-A216 PolarHBondContact O-N 2.99Å; I214-A216 VanDerWaalsContact C-N 3.33Å; I214-A216 PolarHBondContact O-N 3.16Å; A216-H219 PolarHBondContact O-N 2.86Å; A216-L220 WeakPolarHBondContact O-CG 3.29Å; A216-L220 PolarHBondContact O-N 3.31Å
217S96.7Very high95.8Very high67 Ų6772.8 Ų72.847%0.46937%0.367SS..Hα-helixtrans-62.2-43.5175.9-660000112.4R213 I214 L220 A221R213-S217 PolarHBondContact O-N 3.37Å; R213-S217 PolarHBondContact O-OG 2.97Å; I214-S217 WeakPolarHBondContact O-CB 3.34Å; I214-S217 PolarHBondContact O-N 3.37Å; S217-L220 PolarHBondContact O-N 3.42Å; S217-A221 WeakPolarHBondContact O-CB 3.49Å; S217-A221 PolarHBondContact O-N 3.17Å
218I97.4Very high95.9Very high15 Ų1574.4 Ų74.48%0.07737%0.368CS..Hα-helixtrans-61.9-46175.9-68.8167.9000110.2I214 V215 L220 A221 I222 L255 A258 Y259 F262I214-I218 HydrophobicContact CG2-CD1 3.69Å; I214-I218 HydrophobicContact CG2-CG1 4.31Å; I214-I218 VanDerWaalsContact O-CG1 3.3Å; I214-I218 WeakPolarHBondContact O-CG1 3.44Å; I214-I218 PolarHBondContact O-N 2.85Å; V215-I218 PolarHBondContact O-N 2.99Å; I218-L220 PolarHBondContact O-N 3.27Å; I218-A221 PolarHBondContact O-N 3.48Å; I218-I222 HydrophobicContact CG2-CD1 3.83Å; I218-I222 HydrophobicContact CG2-CG1 4.4Å; I218-I222 WeakPolarHBondContact O-CG1 3.47Å; I218-I222 PolarHBondContact O-N 3.26Å; I218-L255 HydrophobicContact CG2-CB 4.22Å; I218-L255 HydrophobicContact CG2-CD2 4.33Å; I218-L255 WeakPolarHBondContact CG2-O 3.25Å; I218-A258 HydrophobicContact CD1-CB 4.01Å; I218-Y259 HydrophobicContact CG2-CD2 4.15Å; I218-F262 HydrophobicContact CD1-CB 4.46Å; I218-F262 HydrophobicContact CD1-CD2 3.5Å; I218-F262 VanDerWaalsContact CD1-CD2 3.5Å; I218-F262 HydrophobicContact CD1-CE2 4.11Å; I218-F262 HydrophobicContact CD1-CG 4.27Å
219H96.6Very high95.9Very high90 Ų9071.5 Ų71.542%0.41736%0.356SS..Hα-helixtrans-60.6-44.5179.2-167.9103.2000112V215 A216 A221 I222 L223 Y259V215-H219 WeakPolarHBondContact O-CB 3.38Å; V215-H219 PolarHBondContact O-N 3.39Å; A216-H219 PolarHBondContact O-N 2.86Å; H219-A221 VanDerWaalsContact C-N 3.34Å; H219-A221 PolarHBondContact O-N 3.08Å; H219-I222 PolarHBondContact O-N 3Å; H219-L223 WeakPolarHBondContact O-CG 3.44Å; H219-L223 PolarHBondContact O-N 3.47Å; H219-L223 VanDerWaalsContact O-N 3.08Å; H219-Y259 HydrophobicContact CB-CE2 4.42Å
220L97.2Very high95.9Very high120 Ų12069.7 Ų69.763%0.62836%0.364SS*.Hα-helixtrans-62.3-40.6175.4-71.5173.4000112.1A216 S217 I218 L223 D224A216-L220 WeakPolarHBondContact O-CG 3.29Å; A216-L220 PolarHBondContact O-N 3.31Å; S217-L220 PolarHBondContact O-N 3.42Å; I218-L220 PolarHBondContact O-N 3.27Å; L220-L223 PolarHBondContact O-N 3.46Å; L220-D224 PolarHBondContact O-N 3.12Å
221A97Very high95.9Very high37 Ų3772.2 Ų72.231%0.30638%0.376SS..Hα-helixtrans-64.5-41177.100000112.2S217 I218 H219 D224 L225 L255S217-A221 WeakPolarHBondContact O-CB 3.49Å; S217-A221 PolarHBondContact O-N 3.17Å; I218-A221 PolarHBondContact O-N 3.48Å; H219-A221 VanDerWaalsContact C-N 3.34Å; H219-A221 PolarHBondContact O-N 3.08Å; A221-D224 PolarHBondContact O-N 3.18Å; A221-L225 WeakPolarHBondContact O-CG 3.39Å; A221-L225 PolarHBondContact O-N 2.93Å; A221-L255 HydrophobicContact CB-CD1 3.76Å
222I96.9Very high95.8Very high19 Ų1972 Ų7210%0.09738%0.376CS..Hα-helixtrans-60.3-47.2174.9-69.7168.3000110.5I218 H219 D224 L225 Y226 L255 E256I218-I222 HydrophobicContact CG2-CD1 3.83Å; I218-I222 HydrophobicContact CG2-CG1 4.4Å; I218-I222 WeakPolarHBondContact O-CG1 3.47Å; I218-I222 PolarHBondContact O-N 3.26Å; H219-I222 PolarHBondContact O-N 3Å; I222-D224 VanDerWaalsContact C-N 3.34Å; I222-D224 PolarHBondContact O-N 3.06Å; I222-L225 PolarHBondContact O-N 2.95Å; I222-Y226 HydrophobicContact CG2-CD2 3.59Å; I222-Y226 HydrophobicContact CG2-CE2 3.39Å; I222-Y226 VanDerWaalsContact O-CD2 3.29Å; I222-Y226 WeakPolarHBondContact O-CD2 3.44Å; I222-Y226 PolarHBondContact O-N 3.1Å; I222-L255 HydrophobicContact CD1-CB 4.03Å; I222-L255 HydrophobicContact CG1-CB 3.6Å; I222-L255 HydrophobicContact CG1-CD1 4.12Å; I222-E256 HydrophobicContact CD1-CG 4.12Å
223L96.9Very high95.7Very high83 Ų8368.7 Ų68.744%0.43537%0.373SS..Hα-helixtrans-61.7-40.5177.7-68.4177.3000112.6H219 L220 L225 Y226 S227H219-L223 WeakPolarHBondContact O-CG 3.44Å; H219-L223 PolarHBondContact O-N 3.47Å; H219-L223 VanDerWaalsContact O-N 3.08Å; L220-L223 PolarHBondContact O-N 3.46Å; L223-L225 VanDerWaalsContact C-N 3.35Å; L223-Y226 PolarHBondContact O-N 3.01Å; L223-S227 PolarHBondContact O-N 3.43Å
224D97Very high95.4Very high79 Ų7967.3 Ų67.342%0.42238%0.384SS..Hα-helixtrans-62.7-40.5175.6-18060.5000112L220 A221 I222 S227 K228L220-D224 PolarHBondContact O-N 3.12Å; A221-D224 PolarHBondContact O-N 3.18Å; I222-D224 VanDerWaalsContact C-N 3.34Å; I222-D224 PolarHBondContact O-N 3.06Å; D224-S227 WeakPolarHBondContact O-CB 3.3Å; D224-S227 PolarHBondContact O-N 2.85Å; D224-K228 WeakPolarHBondContact O-CG 3.34Å; D224-K228 PolarHBondContact O-N 3.48Å; D224-K228 WeakPolarHBondContact OD2-CE 3.44Å; D224-K228 IonicContact OD2-NZ 2.65Å; D224-K228 PolarHBondContact OD2-NZ 3.09Å
225L96.9Very high95.2Very high17 Ų1774.5 Ų74.59%0.08941%0.409CS..Hα-helixtrans-67.9-41.6176.1-68170.8000112.6A221 I222 L223 S227 K228 L229 L248 R251 I252 L255A221-L225 WeakPolarHBondContact O-CG 3.39Å; A221-L225 PolarHBondContact O-N 2.93Å; I222-L225 PolarHBondContact O-N 2.95Å; L223-L225 VanDerWaalsContact C-N 3.35Å; L225-S227 VanDerWaalsContact C-N 3.26Å; L225-S227 PolarHBondContact O-N 2.99Å; L225-K228 HydrophobicContact CD2-CD 4.26Å; L225-K228 WeakPolarHBondContact O-CB 3.29Å; L225-K228 PolarHBondContact O-N 3.32Å; L225-L229 WeakPolarHBondContact O-CB 3.41Å; L225-L229 PolarHBondContact O-N 3.21Å; L225-L248 HydrophobicContact CD2-CD2 3.68Å; L225-R251 HydrophobicContact CD1-CB 4.03Å; L225-R251 HydrophobicContact CD1-CG 3.63Å; L225-R251 HydrophobicContact CD2-CG 4.39Å; L225-I252 HydrophobicContact CB-CD1 3.93Å; L225-I252 HydrophobicContact CB-CG1 3.55Å; L225-I252 HydrophobicContact CD1-CG1 3.85Å; L225-I252 HydrophobicContact CG-CG1 4.36Å; L225-L255 HydrophobicContact CD1-CD1 3.54Å
226Y97Very high94.7Very high109 Ų10974.6 Ų74.643%0.42741%0.41SS..Hα-helixtrans-61.2-36.7173-82-61.4000111.9I222 L223 L229 G230 I252 E256I222-Y226 HydrophobicContact CG2-CD2 3.59Å; I222-Y226 HydrophobicContact CG2-CE2 3.39Å; I222-Y226 VanDerWaalsContact O-CD2 3.29Å; I222-Y226 WeakPolarHBondContact O-CD2 3.44Å; I222-Y226 PolarHBondContact O-N 3.1Å; L223-Y226 PolarHBondContact O-N 3.01Å; Y226-L229 HydrophobicContact CD1-CD2 4.38Å; Y226-L229 PolarHBondContact O-N 2.98Å; Y226-G230 PolarHBondContact O-N 2.91Å; Y226-I252 HydrophobicContact CD1-CD1 3.99Å; Y226-I252 HydrophobicContact CE1-CD1 3.99Å; Y226-I252 HydrophobicContact CE1-CG2 4.46Å; Y226-I252 HydrophobicContact CE2-CG2 4.07Å; Y226-I252 HydrophobicContact CG-CD1 4.3Å; Y226-E256 PolarHBondContact OH-OE1 3.28Å
227S95.8Very high94.4Very high59 Ų5977.9 Ų77.941%0.41342%0.42SS..Hα-helixtrans-61.8-48172.3-175.20000111.6L223 D224 L225 L229 G230 H231L223-S227 PolarHBondContact O-N 3.43Å; D224-S227 WeakPolarHBondContact O-CB 3.3Å; D224-S227 PolarHBondContact O-N 2.85Å; L225-S227 VanDerWaalsContact C-N 3.26Å; L225-S227 PolarHBondContact O-N 2.99Å; S227-L229 VanDerWaalsContact C-N 3.3Å; S227-L229 PolarHBondContact O-N 3.45Å; S227-G230 PolarHBondContact O-N 3.36Å; S227-G230 VanDerWaalsContact O-N 3.16Å; S227-H231 PolarHBondContact O-CD2 3Å; S227-H231 PolarHBondContact O-N 3.26Å
228K94.9Very high94.2Very high96 Ų9678.3 Ų78.342%0.41742%0.42SS..Hα-helixtrans-59.6-39.4175.4-73.4164.8175.9162.90112.4D224 L225 H231 L232 L248D224-K228 WeakPolarHBondContact O-CG 3.34Å; D224-K228 PolarHBondContact O-N 3.48Å; D224-K228 WeakPolarHBondContact OD2-CE 3.44Å; D224-K228 IonicContact OD2-NZ 2.65Å; D224-K228 PolarHBondContact OD2-NZ 3.09Å; L225-K228 HydrophobicContact CD2-CD 4.26Å; L225-K228 WeakPolarHBondContact O-CB 3.29Å; L225-K228 PolarHBondContact O-N 3.32Å; K228-H231 PolarHBondContact O-N 3.42Å; K228-L232 PolarHBondContact O-N 3.48Å; K228-L248 HydrophobicContact CB-CD1 4.05Å; K228-L248 HydrophobicContact CB-CD2 4.12Å; K228-L248 HydrophobicContact CD-CD2 4.29Å
229L94.1Very high94.1Very high41 Ų4182 Ų8222%0.21544%0.444CS..Hα-helixtrans-65.2-42.5176.2-168.371.4000110.9L225 Y226 S227 H231 L232 K245 L248 N249 I252L225-L229 WeakPolarHBondContact O-CB 3.41Å; L225-L229 PolarHBondContact O-N 3.21Å; Y226-L229 HydrophobicContact CD1-CD2 4.38Å; Y226-L229 PolarHBondContact O-N 2.98Å; S227-L229 VanDerWaalsContact C-N 3.3Å; S227-L229 PolarHBondContact O-N 3.45Å; L229-H231 VanDerWaalsContact C-N 3.26Å; L229-H231 PolarHBondContact O-N 3.14Å; L229-L232 HydrophobicContact CD1-CD1 4.08Å; L229-L232 WeakPolarHBondContact O-CB 3.37Å; L229-L232 PolarHBondContact O-N 3.17Å; L229-L232 VanDerWaalsContact O-N 3.16Å; L229-K245 HydrophobicContact CD1-CG 3.86Å; L229-L248 HydrophobicContact CB-CD1 4.5Å; L229-L248 HydrophobicContact CD1-CB 4.21Å; L229-L248 HydrophobicContact CD1-CD1 4.3Å; L229-N249 WeakPolarHBondContact CD2-OD1 3.41Å; L229-I252 HydrophobicContact CD2-CD1 4.47Å
230G92.7Very high94Very high63 Ų6380 Ų8065%0.64945%0.449SS*.Hα-helixtrans-67-22.2175.500000114.5Y226 S227Y226-G230 PolarHBondContact O-N 2.91Å; S227-G230 PolarHBondContact O-N 3.36Å; S227-G230 VanDerWaalsContact O-N 3.16Å
231H92.7Very high93.8Very high155 Ų15576.3 Ų76.372%0.71843%0.43SS*.THydrogen-bonded Turntrans-82.8-8.8173.5-76-57000114.1S227 K228 L229S227-H231 PolarHBondContact O-CD2 3Å; S227-H231 PolarHBondContact O-N 3.26Å; K228-H231 PolarHBondContact O-N 3.42Å; L229-H231 VanDerWaalsContact C-N 3.26Å; L229-H231 PolarHBondContact O-N 3.14Å
232L92.4Very high93.7Very high23 Ų2377.8 Ų77.812%0.1243%0.432CS..SBendtrans-67.9146.4172.1-65.5-177.7000110.3K228 L229 L241 K244 K245 L248K228-L232 PolarHBondContact O-N 3.48Å; L229-L232 HydrophobicContact CD1-CD1 4.08Å; L229-L232 WeakPolarHBondContact O-CB 3.37Å; L229-L232 PolarHBondContact O-N 3.17Å; L229-L232 VanDerWaalsContact O-N 3.16Å; L232-L241 HydrophobicContact CD2-CD2 4.42Å; L232-K244 HydrophobicContact CD2-CD 3.91Å; L232-K244 HydrophobicContact CD2-CG 4.33Å; L232-K245 HydrophobicContact CD1-CB 3.87Å; L232-K245 HydrophobicContact CD1-CG 4.24Å; L232-L248 HydrophobicContact CD1-CD1 4.16Å
233P92.5Very high93.7Very high67 Ų6785.6 Ų85.644%0.43546%0.46SS..  trans-58.6143.817426.8-35.2000110.2R235 L241P233-R235 CarbonylContact O-C 3.6Å; P233-R235 PolarHBondContact O-N 3.29Å; P233-R235 VanDerWaalsContact O-N 3.12Å; P233-L241 HydrophobicContact CG-CD1 3.52Å; P233-L241 HydrophobicContact CG-CD2 4.02Å; P233-L241 HydrophobicContact CG-CG 4.4Å
234V90.1Very high93.6Very high154 Ų15486.9 Ų86.993%0.93346%0.462SS*.SBendtrans-54.6-35-179.3179.70000111.6
235R90.5Very high93.5Very high190 Ų19087.2 Ų87.272%0.71746%0.46SS*.  trans-94.9122.5172.3-69.8-172.5179.1171-1.3110.1P233P233-R235 CarbonylContact O-C 3.6Å; P233-R235 PolarHBondContact O-N 3.29Å; P233-R235 VanDerWaalsContact O-N 3.12Å
236T87.6Confident93.5Very high31 Ų3191.4 Ų91.419%0.1948%0.479CS..  trans-112.655.4178.844.20000109L241 I242 K245T236-L241 HydrophobicContact CG2-CB 4.25Å; T236-I242 WeakPolarHBondContact O-CG1 3.32Å; T236-K245 HydrophobicContact CG2-CD 4.28Å
237D89.1Confident93.5Very high121 Ų12192.1 Ų92.165%0.64749%0.486SS*.  trans-86.1-18.3-170.6-53.2-22.4000112.1
238T94Very high93.5Very high75 Ų7590.1 Ų90.146%0.4647%0.471SS..SBendtrans-88140179.168.10000110.7G240 L241 I242T238-G240 PolarHBondContact O-N 3.14Å; T238-G240 VanDerWaalsContact O-N 3.1Å; T238-L241 PolarHBondContact O-N 2.98Å; T238-L241 WeakPolarHBondContact OG1-CB 3.49Å; T238-L241 VanDerWaalsContact OG1-CD1 3.3Å; T238-L241 WeakPolarHBondContact OG1-CD1 3.06Å; T238-L241 WeakPolarHBondContact OG1-CG 3.28Å; T238-I242 WeakPolarHBondContact O-CG1 3.32Å; T238-I242 PolarHBondContact O-N 3.02Å
239P94.3Very high93.6Very high92 Ų9288.1 Ų88.160%0.59746%0.464SS*.Hα-helixtrans-58.6-29.8-177.722-33.6000113.1R243P239-R243 WeakPolarHBondContact O-CB 3.38Å; P239-R243 VanDerWaalsContact O-CG 3.28Å; P239-R243 WeakPolarHBondContact O-CG 3.34Å; P239-R243 PolarHBondContact O-N 3.45Å
240G94Very high93.7Very high50 Ų5090.3 Ų90.352%0.51548%0.476SS..Hα-helixtrans-67.1-38.6174.500000113.3T238 K244T238-G240 PolarHBondContact O-N 3.14Å; T238-G240 VanDerWaalsContact O-N 3.1Å; G240-K244 WeakPolarHBondContact O-CB 3.49Å; G240-K244 PolarHBondContact O-N 3.27Å; G240-K244 VanDerWaalsContact O-N 3.09Å
241L94.4Very high94Very high42 Ų4291 Ų9122%0.2246%0.459CS..Hα-helixtrans-72.5-37.1176.5-71.8173.2000112L232 P233 T236 T238 K244 K245L232-L241 HydrophobicContact CD2-CD2 4.42Å; P233-L241 HydrophobicContact CG-CD1 3.52Å; P233-L241 HydrophobicContact CG-CD2 4.02Å; P233-L241 HydrophobicContact CG-CG 4.4Å; T236-L241 HydrophobicContact CG2-CB 4.25Å; T238-L241 PolarHBondContact O-N 2.98Å; T238-L241 WeakPolarHBondContact OG1-CB 3.49Å; T238-L241 VanDerWaalsContact OG1-CD1 3.3Å; T238-L241 WeakPolarHBondContact OG1-CD1 3.06Å; T238-L241 WeakPolarHBondContact OG1-CG 3.28Å; L241-K244 PolarHBondContact O-N 3.42Å; L241-K245 WeakPolarHBondContact O-CB 3.5Å; L241-K245 PolarHBondContact O-N 3.47Å
242I94.6Very high94.2Very high68 Ų6883.9 Ų83.935%0.34943%0.427SS..Hα-helixtrans-59.6-53.6174.4-63.6171.9000109.7T236 T238 K244 K245 E246T236-I242 WeakPolarHBondContact O-CG1 3.32Å; T238-I242 WeakPolarHBondContact O-CG1 3.32Å; T238-I242 PolarHBondContact O-N 3.02Å; I242-K244 VanDerWaalsContact C-N 3.29Å; I242-K244 PolarHBondContact O-N 3.38Å; I242-K245 WeakPolarHBondContact O-CB 3.44Å; I242-K245 PolarHBondContact O-N 3.4Å; I242-K245 VanDerWaalsContact O-N 3.08Å; I242-E246 HydrophobicContact CG2-CG 4.45Å; I242-E246 WeakPolarHBondContact CG2-OE1 3.36Å; I242-E246 WeakPolarHBondContact O-CG 3.43Å; I242-E246 PolarHBondContact O-N 2.98Å
243R95.9Very high94.4Very high182 Ų18287.4 Ų87.469%0.68744%0.443SS*.Hα-helixtrans-56.2-43.1177.7-72.8175-176-173.21.1112.4P239 E246 E247P239-R243 WeakPolarHBondContact O-CB 3.38Å; P239-R243 VanDerWaalsContact O-CG 3.28Å; P239-R243 WeakPolarHBondContact O-CG 3.34Å; P239-R243 PolarHBondContact O-N 3.45Å; R243-E246 PolarHBondContact O-N 2.9Å; R243-E247 VanDerWaalsContact O-CB 3.32Å; R243-E247 WeakPolarHBondContact O-CB 3.49Å; R243-E247 PolarHBondContact O-N 3.33Å
244K95.7Very high94.7Very high110 Ų11088.8 Ų88.848%0.47844%0.443SS..Hα-helixtrans-65.5-38.9178-173.8174-179.8179.90112.3L232 G240 L241 I242 L248L232-K244 HydrophobicContact CD2-CD 3.91Å; L232-K244 HydrophobicContact CD2-CG 4.33Å; G240-K244 WeakPolarHBondContact O-CB 3.49Å; G240-K244 PolarHBondContact O-N 3.27Å; G240-K244 VanDerWaalsContact O-N 3.09Å; L241-K244 PolarHBondContact O-N 3.42Å; I242-K244 VanDerWaalsContact C-N 3.29Å; I242-K244 PolarHBondContact O-N 3.38Å; K244-L248 VanDerWaalsContact O-CG 3.32Å; K244-L248 WeakPolarHBondContact O-CG 3.18Å; K244-L248 PolarHBondContact O-N 3.34Å
245K95.3Very high95Very high87 Ų8782.3 Ų82.338%0.37840%0.403SS..Hα-helixtrans-65.3-46176.1-174.8-175.7176.7-178.40111L229 L232 T236 L241 I242 L248 N249L229-K245 HydrophobicContact CD1-CG 3.86Å; L232-K245 HydrophobicContact CD1-CB 3.87Å; L232-K245 HydrophobicContact CD1-CG 4.24Å; T236-K245 HydrophobicContact CG2-CD 4.28Å; L241-K245 WeakPolarHBondContact O-CB 3.5Å; L241-K245 PolarHBondContact O-N 3.47Å; I242-K245 WeakPolarHBondContact O-CB 3.44Å; I242-K245 PolarHBondContact O-N 3.4Å; I242-K245 VanDerWaalsContact O-N 3.08Å; K245-L248 PolarHBondContact O-N 3.32Å; K245-N249 WeakPolarHBondContact O-CB 3.49Å; K245-N249 PolarHBondContact O-N 3.04Å
246E95.9Very high95.3Very high105 Ų10577.1 Ų77.149%0.49139%0.387SS..Hα-helixtrans-61.1-45175.6-71.7170.4178.300111.5I242 R243 L248 N249 N250I242-E246 HydrophobicContact CG2-CG 4.45Å; I242-E246 WeakPolarHBondContact CG2-OE1 3.36Å; I242-E246 WeakPolarHBondContact O-CG 3.43Å; I242-E246 PolarHBondContact O-N 2.98Å; R243-E246 PolarHBondContact O-N 2.9Å; E246-L248 PolarHBondContact O-N 3.14Å; E246-N249 PolarHBondContact O-N 3.01Å; E246-N250 WeakPolarHBondContact O-CB 3.38Å; E246-N250 PolarHBondContact O-N 3.24Å; E246-N250 PolarHBondContact O-ND2 3.49Å; E246-N250 PolarHBondContact O-OD1 3.06Å
247E96.8Very high95.8Very high123 Ų12381.9 Ų81.958%0.57541%0.405SS*.Hα-helixtrans-58.5-45.8176.4-177.9-179.4-171.500112.2R243 R251R243-E247 VanDerWaalsContact O-CB 3.32Å; R243-E247 WeakPolarHBondContact O-CB 3.49Å; R243-E247 PolarHBondContact O-N 3.33Å; E247-R251 WeakPolarHBondContact O-CB 3.22Å; E247-R251 PolarHBondContact O-N 2.96Å
248L96.8Very high96.1Very high18 Ų1877 Ų779%0.09438%0.381CS..Hα-helixtrans-64.1-43.9176.7-71.5174.4000111.8L225 K228 L229 L232 K244 K245 E246 R251 I252L225-L248 HydrophobicContact CD2-CD2 3.68Å; K228-L248 HydrophobicContact CB-CD1 4.05Å; K228-L248 HydrophobicContact CB-CD2 4.12Å; K228-L248 HydrophobicContact CD-CD2 4.29Å; L229-L248 HydrophobicContact CB-CD1 4.5Å; L229-L248 HydrophobicContact CD1-CB 4.21Å; L229-L248 HydrophobicContact CD1-CD1 4.3Å; L232-L248 HydrophobicContact CD1-CD1 4.16Å; K244-L248 VanDerWaalsContact O-CG 3.32Å; K244-L248 WeakPolarHBondContact O-CG 3.18Å; K244-L248 PolarHBondContact O-N 3.34Å; K245-L248 PolarHBondContact O-N 3.32Å; E246-L248 PolarHBondContact O-N 3.14Å; L248-R251 PolarHBondContact O-N 3.48Å; L248-I252 VanDerWaalsContact O-CG1 3.3Å; L248-I252 WeakPolarHBondContact O-CG1 3.44Å; L248-I252 PolarHBondContact O-N 3.03Å
249N96.4Very high96.2Very high53 Ų5377.6 Ų77.628%0.28338%0.376SS..Hα-helixtrans-63-47.5177.6-76.2-12.5000111.8L229 K245 E246 R251 I252 E253L229-N249 WeakPolarHBondContact CD2-OD1 3.41Å; K245-N249 WeakPolarHBondContact O-CB 3.49Å; K245-N249 PolarHBondContact O-N 3.04Å; E246-N249 PolarHBondContact O-N 3.01Å; N249-R251 PolarHBondContact O-N 2.84Å; N249-I252 WeakPolarHBondContact O-CB 3.49Å; N249-I252 PolarHBondContact O-N 3.46Å; N249-I252 VanDerWaalsContact O-N 3.08Å; N249-E253 WeakPolarHBondContact O-CG 3.31Å; N249-E253 PolarHBondContact O-N 3.44Å
250N97.4Very high96.2Very high87 Ų8779.4 Ų79.447%0.46538%0.376SS..Hα-helixtrans-57.1-41.1176.6-69.2-15000111E246 E253 E254E246-N250 WeakPolarHBondContact O-CB 3.38Å; E246-N250 PolarHBondContact O-N 3.24Å; E246-N250 PolarHBondContact O-ND2 3.49Å; E246-N250 PolarHBondContact O-OD1 3.06Å; N250-E253 PolarHBondContact O-N 3.44Å; N250-E254 WeakPolarHBondContact O-CG 3.3Å; N250-E254 PolarHBondContact O-N 2.9Å
251R97Very high96.2Very high77 Ų7781.4 Ų81.429%0.29137%0.374SS..Hα-helixtrans-69.2-35178.3-169.757.9175.8-177.10112.9L225 E247 L248 N249 E254 L255L225-R251 HydrophobicContact CD1-CB 4.03Å; L225-R251 HydrophobicContact CD1-CG 3.63Å; L225-R251 HydrophobicContact CD2-CG 4.39Å; E247-R251 WeakPolarHBondContact O-CB 3.22Å; E247-R251 PolarHBondContact O-N 2.96Å; L248-R251 PolarHBondContact O-N 3.48Å; N249-R251 PolarHBondContact O-N 2.84Å; R251-E254 VanDerWaalsContact CD-OE2 3.29Å; R251-E254 WeakPolarHBondContact CD-OE2 3.36Å; R251-E254 IonicContact CZ-OE2 3.68Å; R251-E254 IonicContact NE-OE2 3.9Å; R251-E254 IonicContact NH1-OE2 2.73Å; R251-E254 PolarHBondContact NH1-OE2 3.46Å; R251-L255 WeakPolarHBondContact O-CG 3.26Å; R251-L255 PolarHBondContact O-N 3.42Å; R251-L255 VanDerWaalsContact O-N 3.16Å
252I97.4Very high96.2Very high6 Ų681.5 Ų81.53%0.03137%0.373CS..Hα-helixtrans-62.8-48.5172.2-70.9164.8000109.5L225 Y226 L229 L248 N249 E254 L255 E256L225-I252 HydrophobicContact CB-CD1 3.93Å; L225-I252 HydrophobicContact CB-CG1 3.55Å; L225-I252 HydrophobicContact CD1-CG1 3.85Å; L225-I252 HydrophobicContact CG-CG1 4.36Å; Y226-I252 HydrophobicContact CD1-CD1 3.99Å; Y226-I252 HydrophobicContact CE1-CD1 3.99Å; Y226-I252 HydrophobicContact CE1-CG2 4.46Å; Y226-I252 HydrophobicContact CE2-CG2 4.07Å; Y226-I252 HydrophobicContact CG-CD1 4.3Å; L229-I252 HydrophobicContact CD2-CD1 4.47Å; L248-I252 VanDerWaalsContact O-CG1 3.3Å; L248-I252 WeakPolarHBondContact O-CG1 3.44Å; L248-I252 PolarHBondContact O-N 3.03Å; N249-I252 WeakPolarHBondContact O-CB 3.49Å; N249-I252 PolarHBondContact O-N 3.46Å; N249-I252 VanDerWaalsContact O-N 3.08Å; I252-E254 VanDerWaalsContact C-N 3.35Å; I252-E254 PolarHBondContact O-N 3.37Å; I252-L255 PolarHBondContact O-N 2.88Å; I252-L255 VanDerWaalsContact O-N 3.11Å; I252-E256 HydrophobicContact CG2-CG 4.19Å; I252-E256 WeakPolarHBondContact CG2-OE1 3.38Å; I252-E256 WeakPolarHBondContact O-CG 3.46Å; I252-E256 PolarHBondContact O-N 3.06Å
253E97.6Very high96Very high98 Ų9881.4 Ų81.446%0.45838%0.379SS..Hα-helixtrans-59.9-41.3178.9-70.1177.2-162.700112.7N249 N250 L255 E256 K257N249-E253 WeakPolarHBondContact O-CG 3.31Å; N249-E253 PolarHBondContact O-N 3.44Å; N250-E253 PolarHBondContact O-N 3.44Å; E253-L255 VanDerWaalsContact C-N 3.34Å; E253-L255 PolarHBondContact O-N 3.29Å; E253-E256 PolarHBondContact O-N 3.14Å; E253-K257 WeakPolarHBondContact O-CG 3.43Å; E253-K257 PolarHBondContact O-N 3.41Å
254E97.3Very high95.9Very high96 Ų9678.6 Ų78.645%0.44937%0.371SS..Hα-helixtrans-59.4-44.5173.9-75.6173.6-173.500112N250 R251 I252 K257 A258N250-E254 WeakPolarHBondContact O-CG 3.3Å; N250-E254 PolarHBondContact O-N 2.9Å; R251-E254 VanDerWaalsContact CD-OE2 3.29Å; R251-E254 WeakPolarHBondContact CD-OE2 3.36Å; R251-E254 IonicContact CZ-OE2 3.68Å; R251-E254 IonicContact NE-OE2 3.9Å; R251-E254 IonicContact NH1-OE2 2.73Å; R251-E254 PolarHBondContact NH1-OE2 3.46Å; I252-E254 VanDerWaalsContact C-N 3.35Å; I252-E254 PolarHBondContact O-N 3.37Å; E254-K257 PolarHBondContact O-N 2.9Å; E254-A258 PolarHBondContact O-N 3.13Å
255L97.5Very high95.6Very high17 Ų1783.8 Ų83.89%0.08939%0.388CS..Hα-helixtrans-72.1-33.8179.5-72.7174.5000112.5I218 A221 I222 L225 R251 I252 E253 A258 Y259I218-L255 HydrophobicContact CG2-CB 4.22Å; I218-L255 HydrophobicContact CG2-CD2 4.33Å; I218-L255 WeakPolarHBondContact CG2-O 3.25Å; A221-L255 HydrophobicContact CB-CD1 3.76Å; I222-L255 HydrophobicContact CD1-CB 4.03Å; I222-L255 HydrophobicContact CG1-CB 3.6Å; I222-L255 HydrophobicContact CG1-CD1 4.12Å; L225-L255 HydrophobicContact CD1-CD1 3.54Å; R251-L255 WeakPolarHBondContact O-CG 3.26Å; R251-L255 PolarHBondContact O-N 3.42Å; R251-L255 VanDerWaalsContact O-N 3.16Å; I252-L255 PolarHBondContact O-N 2.88Å; I252-L255 VanDerWaalsContact O-N 3.11Å; E253-L255 VanDerWaalsContact C-N 3.34Å; E253-L255 PolarHBondContact O-N 3.29Å; L255-A258 PolarHBondContact O-N 3.22Å; L255-Y259 VanDerWaalsContact O-CB 3.31Å; L255-Y259 WeakPolarHBondContact O-CB 3.23Å; L255-Y259 PolarHBondContact O-N 2.83Å
256E97.2Very high95.3Very high82 Ų8285.3 Ų85.338%0.38339%0.391SS..Hα-helixtrans-65.7-41.3174.2-74.7176.5169.400111.1I222 Y226 I252 E253 Y259 E260I222-E256 HydrophobicContact CD1-CG 4.12Å; Y226-E256 PolarHBondContact OH-OE1 3.28Å; I252-E256 HydrophobicContact CG2-CG 4.19Å; I252-E256 WeakPolarHBondContact CG2-OE1 3.38Å; I252-E256 WeakPolarHBondContact O-CG 3.46Å; I252-E256 PolarHBondContact O-N 3.06Å; E253-E256 PolarHBondContact O-N 3.14Å; E256-Y259 WeakPolarHBondContact O-CB 3.24Å; E256-Y259 PolarHBondContact O-N 3.22Å; E256-E260 PolarHBondContact O-N 3.27Å
257K96.9Very high95Very high130 Ų13080.8 Ų80.857%0.56537%0.371SS*.Hα-helixtrans-61.6-44.1171.2-71.2172-173.8171.20111.7E253 E254 Y259 E260 I261E253-K257 WeakPolarHBondContact O-CG 3.43Å; E253-K257 PolarHBondContact O-N 3.41Å; E254-K257 PolarHBondContact O-N 2.9Å; K257-Y259 VanDerWaalsContact C-N 3.34Å; K257-E260 PolarHBondContact O-N 2.87Å; K257-I261 WeakPolarHBondContact O-CG1 3.33Å; K257-I261 PolarHBondContact O-N 3.46Å; K257-I261 VanDerWaalsContact O-N 3.13Å
258A95.4Very high94.6Very high18 Ų1878.4 Ų78.415%0.14936%0.357CS..Hα-helixtrans-62.1-43.7175.300000111.1I218 E254 L255 E260 I261 F262I218-A258 HydrophobicContact CD1-CB 4.01Å; E254-A258 PolarHBondContact O-N 3.13Å; L255-A258 PolarHBondContact O-N 3.22Å; A258-E260 VanDerWaalsContact C-N 3.32Å; A258-E260 PolarHBondContact O-N 3.03Å; A258-I261 PolarHBondContact O-N 3.28Å; A258-I261 VanDerWaalsContact O-N 3.15Å; A258-F262 HydrophobicContact CB-CD2 4.38Å; A258-F262 HydrophobicContact CB-CE2 4.46Å; A258-F262 WeakPolarHBondContact O-CD2 3.28Å; A258-F262 PolarHBondContact O-N 3.31Å
259Y95.9Very high94.2Very high89 Ų8980.9 Ų80.935%0.34937%0.373SS..Hα-helixtrans-57.7-45176.4-175.4-91.9000111.2V215 I218 H219 L255 E256 K257 I261 F262 S263V215-Y259 HydrophobicContact CG1-CD2 4.1Å; V215-Y259 HydrophobicContact CG1-CE2 3.54Å; I218-Y259 HydrophobicContact CG2-CD2 4.15Å; H219-Y259 HydrophobicContact CB-CE2 4.42Å; L255-Y259 VanDerWaalsContact O-CB 3.31Å; L255-Y259 WeakPolarHBondContact O-CB 3.23Å; L255-Y259 PolarHBondContact O-N 2.83Å; E256-Y259 WeakPolarHBondContact O-CB 3.24Å; E256-Y259 PolarHBondContact O-N 3.22Å; K257-Y259 VanDerWaalsContact C-N 3.34Å; Y259-I261 VanDerWaalsContact C-N 3.32Å; Y259-I261 PolarHBondContact O-N 2.94Å; Y259-F262 PolarHBondContact O-N 3.18Å; Y259-S263 WeakPolarHBondContact O-CB 3.28Å; Y259-S263 PolarHBondContact O-N 3.4Å; Y259-S263 PolarHBondContact O-OG 3.38Å
260E95.6Very high93.7Very high129 Ų12988.1 Ų88.160%0.60340%0.396SS*.Hα-helixtrans-58.7-43.2176.4-170.5-178.817700111.7E256 K257 A258 S263E256-E260 PolarHBondContact O-N 3.27Å; K257-E260 PolarHBondContact O-N 2.87Å; A258-E260 VanDerWaalsContact C-N 3.32Å; A258-E260 PolarHBondContact O-N 3.03Å; E260-S263 PolarHBondContact O-OG 3.33Å
261I93.9Very high92.8Very high92 Ų9285.8 Ų85.847%0.47239%0.392SS..Hα-helixtrans-64-51176.7-64.6165000110.9K257 A258 Y259 S263 K264 V267K257-I261 WeakPolarHBondContact O-CG1 3.33Å; K257-I261 PolarHBondContact O-N 3.46Å; K257-I261 VanDerWaalsContact O-N 3.13Å; A258-I261 PolarHBondContact O-N 3.28Å; A258-I261 VanDerWaalsContact O-N 3.15Å; Y259-I261 VanDerWaalsContact C-N 3.32Å; Y259-I261 PolarHBondContact O-N 2.94Å; I261-S263 VanDerWaalsContact C-N 3.3Å; I261-S263 PolarHBondContact O-N 2.91Å; I261-K264 WeakPolarHBondContact O-CB 3.44Å; I261-K264 PolarHBondContact O-N 3.19Å; I261-V267 HydrophobicContact CG2-CG1 4.32Å; I261-V267 WeakPolarHBondContact O-CG2 3.47Å
262F93.8Very high91.4Very high44 Ų4490.8 Ų90.819%0.19342%0.419CS..Hα-helixtrans-76.7-14.6-175.7-70.3-72.5000114I206 R211 I214 V215 I218 A258 Y259 K264 V267I206-F262 HydrophobicContact CD1-CD1 4.11Å; I206-F262 HydrophobicContact CD1-CE1 3.52Å; R211-F262 VanDerWaalsContact CD-O 3.29Å; R211-F262 WeakPolarHBondContact CD-O 3.39Å; R211-F262 WeakPolarHBondContact CG-O 3.38Å; I214-F262 HydrophobicContact CD1-CE1 4.17Å; I214-F262 HydrophobicContact CG2-CD1 3.92Å; I214-F262 HydrophobicContact CG2-CD2 3.85Å; I214-F262 HydrophobicContact CG2-CE1 4.04Å; I214-F262 HydrophobicContact CG2-CE2 3.99Å; I214-F262 HydrophobicContact CG2-CG 3.84Å; I214-F262 HydrophobicContact CG2-CZ 4.09Å; V215-F262 HydrophobicContact CG2-CB 3.64Å; V215-F262 VanDerWaalsContact CG2-O 3.29Å; V215-F262 WeakPolarHBondContact CG2-O 3.41Å; I218-F262 HydrophobicContact CD1-CB 4.46Å; I218-F262 HydrophobicContact CD1-CD2 3.5Å; I218-F262 VanDerWaalsContact CD1-CD2 3.5Å; I218-F262 HydrophobicContact CD1-CE2 4.11Å; I218-F262 HydrophobicContact CD1-CG 4.27Å; A258-F262 HydrophobicContact CB-CD2 4.38Å; A258-F262 HydrophobicContact CB-CE2 4.46Å; A258-F262 WeakPolarHBondContact O-CD2 3.28Å; A258-F262 PolarHBondContact O-N 3.31Å; Y259-F262 PolarHBondContact O-N 3.18Å; F262-K264 PolarHBondContact O-N 3.38Å; F262-V267 HydrophobicContact CD1-CG1 3.98Å; F262-V267 HydrophobicContact CD1-CG2 4.43Å; F262-V267 HydrophobicContact CE1-CG1 4Å
263S91.4Very high89.5Confident67 Ų67101.4 Ų101.447%0.46946%0.459SS..THydrogen-bonded Turntrans-70.3-17.2173.872.70000113.1Y259 E260 I261Y259-S263 WeakPolarHBondContact O-CB 3.28Å; Y259-S263 PolarHBondContact O-N 3.4Å; Y259-S263 PolarHBondContact O-OG 3.38Å; E260-S263 PolarHBondContact O-OG 3.33Å; I261-S263 VanDerWaalsContact C-N 3.3Å; I261-S263 PolarHBondContact O-N 2.91Å
264K92.5Very high87.6Confident122 Ų122102.4 Ų102.453%0.5347%0.474SS..SBendtrans-68.8151.7179.8-63.7179.4-178177.90111.9R211 I261 F262 R266 V267R211-K264 WeakPolarHBondContact CD-O 3.44Å; R211-K264 PolarHBondContact NH1-O 2.8Å; R211-K264 VanDerWaalsContact NH1-O 3.1Å; I261-K264 WeakPolarHBondContact O-CB 3.44Å; I261-K264 PolarHBondContact O-N 3.19Å; F262-K264 PolarHBondContact O-N 3.38Å; K264-R266 VanDerWaalsContact C-N 3.29Å; K264-R266 PolarHBondContact O-N 2.99Å; K264-V267 HydrophobicContact CB-CG2 4.46Å
265R90Very high85.4Confident219 Ų219102.8 Ų102.883%0.82649%0.487SS*.SBendtrans-63.9-29.4-177.9-171.9176.3178.6-167.4-1.2113.7R211R211-R265 VanDerWaalsContact NH1-CA 3.27Å; R211-R265 PolarHBondContact NH1-O 2.71Å
266R88.5Confident82.9Confident119 Ų119111.6 Ų111.645%0.44953%0.528SS..  trans-135.5131.3177.1-54.9-175.890.5177.92.2108.1E205 K264 Y268E205-R266 WeakPolarHBondContact OE1-CG 3.49Å; E205-R266 IonicContact OE1-CZ 3.55Å; E205-R266 IonicContact OE1-NE 2.76Å; E205-R266 PolarHBondContact OE1-NE 2.75Å; E205-R266 IonicContact OE1-NH2 3.47Å; E205-R266 PolarHBondContact OE1-NH2 3.16Å; E205-R266 IonicContact OE2-CZ 3.51Å; E205-R266 IonicContact OE2-NE 3.51Å; E205-R266 IonicContact OE2-NH2 2.77Å; E205-R266 PolarHBondContact OE2-NH2 2.98Å; K264-R266 VanDerWaalsContact C-N 3.29Å; K264-R266 PolarHBondContact O-N 2.99Å; R266-Y268 HydrophobicContact CB-CE2 4.28Å
267V89.2Confident80.2Confident11 Ų11115.7 Ų115.77%0.06758%0.576CS.*  trans-131.8129.2-178.1-1770000107.4I206 R211 I261 F262 K264I206-V267 HydrophobicContact CD1-CB 4.16Å; I206-V267 HydrophobicContact CD1-CG1 3.83Å; I206-V267 PolarHBondContact N-O 2.93Å; R211-V267 HydrophobicContact CG-CG2 4.37Å; I261-V267 HydrophobicContact CG2-CG1 4.32Å; I261-V267 WeakPolarHBondContact O-CG2 3.47Å; F262-V267 HydrophobicContact CD1-CG1 3.98Å; F262-V267 HydrophobicContact CD1-CG2 4.43Å; F262-V267 HydrophobicContact CE1-CG1 4Å; K264-V267 HydrophobicContact CB-CG2 4.46Å
268Y89.1Confident79.3Confident72 Ų72115 Ų11528%0.28258%0.576SS.*EExtended strand (participates in β ladder)trans-112.1131.8-178.4-55.7-79.3000109.4V199 E204 E205 R266V199-Y268 HydrophobicContact CB-CE1 4.44Å; V199-Y268 HydrophobicContact CG1-CD1 3.91Å; V199-Y268 HydrophobicContact CG1-CE1 4.15Å; V199-Y268 HydrophobicContact CG2-CE1 4.04Å; E204-Y268 CarbonylContact O-C 3.57Å; E204-Y268 WeakPolarHBondContact O-CA 3.49Å; E205-Y268 HydrophobicContact CB-CD1 3.89Å; E205-Y268 HydrophobicContact CB-CE1 3.84Å; E205-Y268 HydrophobicContact CG-CD1 4.31Å; E205-Y268 HydrophobicContact CG-CE1 4.03Å; R266-Y268 HydrophobicContact CB-CE2 4.28Å
269V87.8Confident78.5Confident70 Ų70120.1 Ų120.142%0.42460%0.599SS.*EExtended strand (participates in β ladder)trans-112.9135.5177.8179.40000108.3C203 E204 I206 G271C203-V269 CarbonylContact C-O 3.46Å; C203-V269 WeakPolarHBondContact CA-O 3.3Å; E204-V269 PolarHBondContact N-O 2.99Å; E204-V269 PolarHBondContact O-N 3.03Å; I206-V269 HydrophobicContact CD1-CG2 3.4Å; I206-V269 HydrophobicContact CG1-CG2 3.53Å; V269-G271 PolarHBondContact O-N 2.85Å; V269-G271 VanDerWaalsContact O-N 3.16Å
270R86.6Confident77.5Confident206 Ų206121.8 Ų121.878%0.77761%0.613SS**EExtended strand (participates in β ladder)trans-67.7114.3172.9-175.7178.2-68.9-180-1.5108.4E272R270-E272 PolarHBondContact O-N 3.01Å
271G77.5Confident76.5Confident37 Ų37121.4 Ų121.438%0.38161%0.613SS.*  trans-70.7112.617500000108.8G202 V269 R273G202-G271 PolarHBondContact O-N 3Å; V269-G271 PolarHBondContact O-N 2.85Å; V269-G271 VanDerWaalsContact O-N 3.16Å; G271-R273 PolarHBondContact O-N 3.09Å
272E68.5Low75.4Confident183 Ų183123.3 Ų123.386%0.85562%0.622SS**  trans-70.981.5163.9-67.3-176.1-178.600107.4R270 P274R270-E272 PolarHBondContact O-N 3.01Å; E272-P274 WeakPolarHBondContact O-CD 3.5Å
273R57.7Low74.1Confident228 Ų228128.5 Ų128.586%0.8665%0.651SS**  trans-67.7119159.5-73.3-167-171.1-179.64.2106G271 S275G271-R273 PolarHBondContact O-N 3.09Å; R273-S275 VanDerWaalsContact C-N 3.35Å; R273-S275 PolarHBondContact O-N 3.36Å
274P57Low72.9Confident119 Ų119132.9 Ų132.977%0.77366%0.664SS**  trans-62.4107.7162.227.5-29.8000105.2E272 E276E272-P274 WeakPolarHBondContact O-CD 3.5Å; P274-E276 PolarHBondContact O-N 3.2Å
275S51.7Low71.4Confident105 Ų105133.8 Ų133.873%0.73467%0.674SS**  trans-59.4109.6165.654.80000106.2R273 A277R273-S275 VanDerWaalsContact C-N 3.35Å; R273-S275 PolarHBondContact O-N 3.36Å; S275-A277 PolarHBondContact O-N 3.48Å; S275-A277 VanDerWaalsContact O-N 3.08Å
276E44.8Very low69.9Low202 Ų202126.7 Ų126.794%0.94466%0.661SS**  trans-52.7113.2164.1-66.3-179.3156.500107.9P274P274-E276 PolarHBondContact O-N 3.2Å
277A39.9Very low68.2Low168 Ų168127.4 Ų127.4100%1.38868%0.681SS**  trans-1450164.100000107.6S275S275-A277 PolarHBondContact O-N 3.48Å; S275-A277 VanDerWaalsContact O-N 3.08Å

Retrieved 277 of 277 residues in 90.2 ms (Link to these results)