A0A087WUW6_HUMAN Loading...

NF-kappa-B essential modulator

AlphaFold DB , UniProt , Accession A0A087WUW6, Species HUMAN (Homo sapiens, Human), Gene IKBKG, Length 412 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
1M37.3Very low37.1Very low242 Ų242171.8 Ų171.8100%1.19284%0.837SS**  083.80-66.7173.8174.800106.5
2N39.9Very low37Very low136 Ų136171.3 Ų171.373%0.72783%0.831SS**  51.693.569-146.2-6.1000112.5
3R37.2Very low36.8Very low225 Ų225173 Ų17385%0.84984%0.841SS**  trans-177.1100.4151.8-100.5168.3-172.2-131.32.5105.8
4H38.3Very low36.9Very low153 Ų153167.6 Ų167.671%0.70882%0.823SS**  61.8142.182.2-74.3-68.1000113.4
5L35.9Very low36.9Very low125 Ų125167.9 Ų167.965%0.65482%0.822SS**  trans90.9126.4165.4-55.3131.7000113.5
6W35.2Very low37.1Very low232 Ų232164.3 Ų164.388%0.87982%0.815SS**  cis-153.9135.410.4-113.7-52000108.7
7K39Very low37.1Very low196 Ų196162.5 Ų162.585%0.85282%0.822SS**  trans-58.3130.9154.8-79170.91711780108.3
8S37.7Very low36.7Very low116 Ų116157.8 Ų157.881%0.81182%0.821SS**  trans-136.474.4156.4-165.50000104.4
9Q36.5Very low36.7Very low173 Ų173153.5 Ų153.581%0.80882%0.819SS**  4981.793.2-145.5164.215.800109.3C11Q9-C11 PolarHBondContact O-N 3.45Å; Q9-C11 VanDerWaalsContact O-N 3.13Å
10L36.3Very low37.1Very low166 Ų166152 Ų15287%0.86982%0.818SS**  trans-51.6115.1161.8-86.7150.5000106.8E12L10-E12 VanDerWaalsContact C-N 3.33Å; L10-E12 PolarHBondContact O-N 2.77Å
11C34.5Very low36.8Very low126 Ų126149.3 Ų149.385%0.85182%0.817SS**  trans-62.8100.8166.9-970000107.9Q9 M13Q9-C11 PolarHBondContact O-N 3.45Å; Q9-C11 VanDerWaalsContact O-N 3.13Å; C11-M13 PolarHBondContact O-N 3.48Å
12E36.1Very low36.7Very low166 Ų166142 Ų14278%0.77680%0.795SS**  trans-38.5117.7146.2-86.7172.9140.100110L10 V14L10-E12 VanDerWaalsContact C-N 3.33Å; L10-E12 PolarHBondContact O-N 2.77Å; E12-V14 HydrophobicContact CB-CG2 4.07Å; E12-V14 HydrophobicContact CG-CG2 4.15Å
13M34.2Very low36.3Very low193 Ų193142.6 Ų142.695%0.95180%0.798SS**  trans-96.883.8147.7-68.9-132-56.500106.9C11C11-M13 PolarHBondContact O-N 3.48Å
14V38.8Very low36.3Very low98 Ų98140.9 Ų140.959%0.59480%0.8SS**  trans-81.1135.1157.8175.80000106.9E12E12-V14 HydrophobicContact CB-CG2 4.07Å; E12-V14 HydrophobicContact CG-CG2 4.15Å
15Q36.8Very low35.9Very low172 Ų172140.6 Ų140.680%0.80480%0.803SS**  trans144.9145.5142.5-72.3-101.3-37.600111.5
16P39.9Very low35.8Very low110 Ų110140.5 Ų140.571%0.71481%0.808SS**  cis-127.7140.6-17.632.3-13.5000113.9
17S37.5Very low35.8Very low133 Ų133137.4 Ų137.493%0.9381%0.808SS**  trans-98.2145.6152-67.70000108.8
18G30.3Very low35.3Very low78 Ų78131.4 Ų131.480%0.80480%0.801SS**  trans115.3103.8174.900000110.2
19G36.1Very low35Very low77 Ų77134.4 Ų134.479%0.79480%0.802SS**  97.7166.165.500000108.6
20P44.4Very low34.7Very low123 Ų123135.1 Ų135.180%0.79981%0.805SS**  cis-137.3-177.310.341.3-23.1000114.6
21A30.7Very low35.1Very low96 Ų96132 Ų13279%0.79380%0.797SS**  trans60.8139.5139.200000118.8
22A35.1Very low35.2Very low87 Ų87131.3 Ų131.372%0.71979%0.792SS**  cis-151.4143.520.700000107.2
23D32.2Very low35.2Very low150 Ų150130.8 Ų130.880%0.80279%0.794SS**  35.997.382.7-89.1-6.9000113.4
24Q36.6Very low35.1Very low189 Ų189125.5 Ų125.588%0.88379%0.788SS**  -164.2119.8112-107.7165.143.900111.2
25D31.3Very low34.7Very low146 Ų146129.5 Ų129.578%0.78180%0.798SS**  trans-36148143.9-80.1-51.1000111.5
26V33.1Very low35.1Very low123 Ų123127.3 Ų127.375%0.74580%0.798SS**  172.2114.3111.3156.70000107.8
27L33.8Very low34.7Very low168 Ų168126.3 Ų126.388%0.8880%0.8SS**  trans12.2138.1133.8-61.2153.1000116.6
28G30.3Very low34.5Very low69 Ų69127.4 Ų127.471%0.71179%0.792SS**  trans152.4104.1144.400000115.4
29E31.6Very low34.6Very low180 Ų180131.8 Ų131.884%0.84180%0.796SS**  trans70.991.2136.5-57.6-157.1120.100118.2S31E29-S31 PolarHBondContact O-N 3.3Å
30E29.8Very low34.4Very low187 Ų187135.7 Ų135.787%0.87479%0.793SS**SBend-43.3125.5128.7-66.6-93.8131.700111.1
31S43.6Very low34.2Very low100 Ų100137.3 Ų137.370%0.69979%0.794SS**  trans65.5130.8163.5-79.80000119E29E29-S31 PolarHBondContact O-N 3.3Å
32P36.8Very low34.5Very low113 Ų113138.1 Ų138.173%0.73479%0.792SS**  -137.1132.895.224-5.3000114.5G34P32-G34 PolarHBondContact O-N 3.46Å
33L36.5Very low34.7Very low155 Ų155138.6 Ų138.681%0.81279%0.79SS**  38.984.1126.3-76.8147.2000117
34G31.5Very low35.4Very low82 Ų82138.8 Ų138.885%0.84579%0.786SS**  trans-103.3101.6153.400000109.9P32P32-G34 PolarHBondContact O-N 3.46Å
35K31.8Very low35.9Very low181 Ų181138.5 Ų138.579%0.78778%0.784SS**  trans-58157.5-169.4-70.8165.7177.4172.90115.5
36P44.1Very low36.7Very low126 Ų126135.3 Ų135.382%0.81879%0.786SS**  trans-76.3131.416932.4-31.4000110.6
37A31.6Very low37.6Very low90 Ų90133.6 Ų133.674%0.74479%0.785SS**  trans-138.795.6163.500000106.9
38M32.9Very low38.8Very low156 Ų156130 Ų13077%0.76877%0.772SS**  55.487.594-83.1-78.6-72.800112.6
39L32.3Very low40.2Very low170 Ų170134.5 Ų134.589%0.8977%0.774SS**  trans-146.388.1147-70.6179.7000106.3
40H33.2Very low41.8Very low158 Ų158131.1 Ų131.173%0.73177%0.766SS**  47.3111.7100.3-114.7122.4000112.9P42H40-P42 VanDerWaalsContact O-CD 3.29Å; H40-P42 WeakPolarHBondContact O-CD 3.42Å
41L38.9Very low43.6Very low157 Ų157128.1 Ų128.182%0.82276%0.755SS**  trans-56133.8151.8-94.675.7000108.6
42P37.7Very low45.1Very low114 Ų114129 Ų12974%0.7475%0.749SS**  -108.7118122.13.715.3000106H40H40-P42 VanDerWaalsContact O-CD 3.29Å; H40-P42 WeakPolarHBondContact O-CD 3.42Å
43S38.4Very low47Very low97 Ų97131.1 Ų131.168%0.67874%0.742SS**  56.510393.6-165.80000110.7
44E47.8Very low49Very low153 Ų153127.3 Ų127.372%0.71573%0.727SS**SBendtrans35.6116.9136.3-73.1-94.3131.600116.7
45Q47.6Very low51.3Low183 Ų183128.9 Ų128.986%0.85572%0.716SS**  trans90.788.3154.3-57.6153.719.300116.2
46G48.2Very low53.7Low79 Ų79125 Ų12581%0.81470%0.7SS**  trans157.685.2167.700000113.8
47A50.4Low55.5Low87 Ų87123.9 Ų123.972%0.71968%0.684SS**  trans-151.186.7-179.200000114
48P59.1Low57.9Low94 Ų94122.9 Ų122.961%0.6167%0.667SS**SBendtrans-128.7-26.9150.37.814.3000115.6
49E59.7Low60.4Low162 Ų162119.7 Ų119.776%0.75765%0.65SS**Hα-helixtrans-89-30.1-163.9-67169.8175.100115.1R53E49-R53 PolarHBondContact O-N 3.01Å
50T65Low62.9Low109 Ų109117.9 Ų117.967%0.66964%0.637SS**Hα-helixtrans-76.9-31.3177.345.80000112.9Q52 C54T50-Q52 VanDerWaalsContact C-N 3.34Å; T50-C54 PolarHBondContact O-N 3.24Å
51L69.3Low65.4Low124 Ų124115.4 Ų115.465%0.64963%0.628SS**Hα-helixtrans-67.7-37.5174.6-158.484.8000111C54 L55L51-C54 PolarHBondContact O-N 3.47Å; L51-L55 WeakPolarHBondContact O-CG 3.47Å; L51-L55 PolarHBondContact O-N 3.41Å
52Q75.2Confident67.7Low120 Ų120115 Ų11556%0.56162%0.616SS**Hα-helixtrans-67.4-42179.8-171.9142.7-15.800112.6T50 C54 L55 E56T50-Q52 VanDerWaalsContact C-N 3.34Å; Q52-C54 PolarHBondContact O-N 3.3Å; Q52-L55 PolarHBondContact O-N 3.18Å; Q52-E56 WeakPolarHBondContact O-CG 3.44Å; Q52-E56 PolarHBondContact O-N 3.4Å
53R76.3Confident70.1Confident156 Ų156112.1 Ų112.159%0.58959%0.594SS**Hα-helixtrans-63-39.9174.4-163.8-177.6-53.7-179.94.4112.7E49 L55 E56 E57E49-R53 PolarHBondContact O-N 3.01Å; R53-L55 VanDerWaalsContact C-N 3.32Å; R53-L55 PolarHBondContact O-N 3.25Å; R53-E56 PolarHBondContact O-N 3.39Å; R53-E57 WeakPolarHBondContact O-CB 3.38Å; R53-E57 WeakPolarHBondContact O-CG 3.47Å; R53-E57 PolarHBondContact O-N 2.93Å
54C78.3Confident72.5Confident76 Ų76109.9 Ų109.951%0.51458%0.581SS.*Hα-helixtrans-65.5-35.7176-174.30000112.1T50 L51 Q52 N58T50-C54 PolarHBondContact O-N 3.24Å; L51-C54 PolarHBondContact O-N 3.47Å; Q52-C54 PolarHBondContact O-N 3.3Å; C54-N58 VanDerWaalsContact O-CB 3.26Å; C54-N58 WeakPolarHBondContact O-CB 3.45Å; C54-N58 PolarHBondContact O-N 2.97Å
55L80.6Confident74.3Confident114 Ų114107.3 Ų107.360%0.59757%0.571SS**Hα-helixtrans-69.3-39.8174.3-71.8169.9000112.1L51 Q52 R53 N58 Q59L51-L55 WeakPolarHBondContact O-CG 3.47Å; L51-L55 PolarHBondContact O-N 3.41Å; Q52-L55 PolarHBondContact O-N 3.18Å; R53-L55 VanDerWaalsContact C-N 3.32Å; R53-L55 PolarHBondContact O-N 3.25Å; L55-N58 PolarHBondContact O-N 3.15Å; L55-Q59 VanDerWaalsContact O-CB 3.3Å; L55-Q59 WeakPolarHBondContact O-CB 3.47Å; L55-Q59 PolarHBondContact O-N 3.02Å
56E81.4Confident76.2Confident100 Ų100105.4 Ų105.447%0.46756%0.557SS.*Hα-helixtrans-63.6-48.3174.4-74.4166.9-175.400111.2Q52 R53 N58 Q59 E60Q52-E56 WeakPolarHBondContact O-CG 3.44Å; Q52-E56 PolarHBondContact O-N 3.4Å; R53-E56 PolarHBondContact O-N 3.39Å; E56-N58 VanDerWaalsContact C-N 3.32Å; E56-N58 PolarHBondContact O-N 3.07Å; E56-Q59 CarbonylContact O-C 3.58Å; E56-Q59 WeakPolarHBondContact O-CA 3.3Å; E56-Q59 WeakPolarHBondContact O-CB 3.45Å; E56-Q59 PolarHBondContact O-N 3.39Å; E56-Q59 VanDerWaalsContact O-N 3.09Å; E56-E60 WeakPolarHBondContact O-CB 3.5Å; E56-E60 WeakPolarHBondContact O-CG 3.44Å; E56-E60 PolarHBondContact O-N 3.47Å
57E81.3Confident78.2Confident103 Ų103107.8 Ų107.848%0.48155%0.546SS..Hα-helixtrans-62.2-37174.4-72.3171-171.200112R53 Q59 L61R53-E57 WeakPolarHBondContact O-CB 3.38Å; R53-E57 WeakPolarHBondContact O-CG 3.47Å; R53-E57 PolarHBondContact O-N 2.93Å; E57-Q59 VanDerWaalsContact C-N 3.34Å; E57-L61 VanDerWaalsContact O-CB 3.27Å; E57-L61 WeakPolarHBondContact O-CB 3.48Å; E57-L61 VanDerWaalsContact O-CG 3.24Å; E57-L61 WeakPolarHBondContact O-CG 3.41Å; E57-L61 PolarHBondContact O-N 3.49Å
58N82.5Confident80.1Confident69 Ų69107.1 Ų107.137%0.36954%0.536SS..Hα-helixtrans-68.2-35.7174.3-155.1-94.5000111.7C54 L55 E56 R62C54-N58 VanDerWaalsContact O-CB 3.26Å; C54-N58 WeakPolarHBondContact O-CB 3.45Å; C54-N58 PolarHBondContact O-N 2.97Å; L55-N58 PolarHBondContact O-N 3.15Å; E56-N58 VanDerWaalsContact C-N 3.32Å; E56-N58 PolarHBondContact O-N 3.07Å; N58-R62 WeakPolarHBondContact O-CB 3.4Å; N58-R62 WeakPolarHBondContact O-CG 3.49Å; N58-R62 PolarHBondContact O-N 2.97Å; N58-R62 PolarHBondContact OD1-NE 3.35Å; N58-R62 PolarHBondContact OD1-NH2 3.47Å
59Q85.1Confident81.6Confident89 Ų89106.4 Ų106.442%0.41653%0.527SS..Hα-helixtrans-68.6-45.2175.5-175.657.543.700110.8L55 E56 E57 L61 R62 D63L55-Q59 VanDerWaalsContact O-CB 3.3Å; L55-Q59 WeakPolarHBondContact O-CB 3.47Å; L55-Q59 PolarHBondContact O-N 3.02Å; E56-Q59 CarbonylContact O-C 3.58Å; E56-Q59 WeakPolarHBondContact O-CA 3.3Å; E56-Q59 WeakPolarHBondContact O-CB 3.45Å; E56-Q59 PolarHBondContact O-N 3.39Å; E56-Q59 VanDerWaalsContact O-N 3.09Å; E57-Q59 VanDerWaalsContact C-N 3.34Å; Q59-L61 PolarHBondContact O-N 3.42Å; Q59-R62 WeakPolarHBondContact O-CB 3.48Å; Q59-R62 PolarHBondContact O-N 3.38Å; Q59-D63 PolarHBondContact NE2-OD1 3.04Å; Q59-D63 PolarHBondContact NE2-OD2 3.42Å; Q59-D63 VanDerWaalsContact NE2-OD2 3.09Å; Q59-D63 WeakPolarHBondContact O-CB 3.48Å; Q59-D63 VanDerWaalsContact O-CG 3.22Å; Q59-D63 PolarHBondContact O-N 2.88Å
60E85.3Confident83.2Confident132 Ų132102.4 Ų102.462%0.61751%0.509SS*.Hα-helixtrans-61.3-42173.5-73.2178.2-179.300111.8E56 D63 A64E56-E60 WeakPolarHBondContact O-CB 3.5Å; E56-E60 WeakPolarHBondContact O-CG 3.44Å; E56-E60 PolarHBondContact O-N 3.47Å; E60-D63 CarbonylContact O-C 3.6Å; E60-D63 PolarHBondContact O-N 3.2Å; E60-A64 VanDerWaalsContact O-CB 3.24Å; E60-A64 WeakPolarHBondContact O-CB 3.49Å; E60-A64 PolarHBondContact O-N 3.13Å
61L86.3Confident84.4Confident105 Ų105101.6 Ų101.655%0.5550%0.499SS..Hα-helixtrans-63.6-42.5173.6-80.5166.3000111.6E57 Q59 D63 A64 I65E57-L61 VanDerWaalsContact O-CB 3.27Å; E57-L61 WeakPolarHBondContact O-CB 3.48Å; E57-L61 VanDerWaalsContact O-CG 3.24Å; E57-L61 WeakPolarHBondContact O-CG 3.41Å; E57-L61 PolarHBondContact O-N 3.49Å; Q59-L61 PolarHBondContact O-N 3.42Å; L61-D63 VanDerWaalsContact C-N 3.29Å; L61-D63 PolarHBondContact O-N 3.04Å; L61-A64 PolarHBondContact O-N 3.44Å; L61-I65 VanDerWaalsContact O-CB 3.26Å; L61-I65 WeakPolarHBondContact O-CB 3.48Å; L61-I65 WeakPolarHBondContact O-CD1 3.41Å; L61-I65 WeakPolarHBondContact O-CG1 3.49Å; L61-I65 PolarHBondContact O-N 3.04Å
62R86.6Confident85.5Confident150 Ų150100.5 Ų100.557%0.56649%0.493SS*.Hα-helixtrans-63.6-36.5174.6-76171.6-171.1-131.32.2111.8N58 Q59 R66N58-R62 WeakPolarHBondContact O-CB 3.4Å; N58-R62 WeakPolarHBondContact O-CG 3.49Å; N58-R62 PolarHBondContact O-N 2.97Å; N58-R62 PolarHBondContact OD1-NE 3.35Å; N58-R62 PolarHBondContact OD1-NH2 3.47Å; Q59-R62 WeakPolarHBondContact O-CB 3.48Å; Q59-R62 PolarHBondContact O-N 3.38Å; R62-R66 WeakPolarHBondContact O-CB 3.45Å; R62-R66 WeakPolarHBondContact O-CG 3.44Å; R62-R66 PolarHBondContact O-N 2.96Å
63D88.1Confident86.4Confident53 Ų53101.3 Ų101.328%0.28349%0.492SS..Hα-helixtrans-73.5-41.2177.8-69.6-23.4000111.5Q59 E60 L61 R66 Q67Q59-D63 PolarHBondContact NE2-OD1 3.04Å; Q59-D63 PolarHBondContact NE2-OD2 3.42Å; Q59-D63 VanDerWaalsContact NE2-OD2 3.09Å; Q59-D63 WeakPolarHBondContact O-CB 3.48Å; Q59-D63 VanDerWaalsContact O-CG 3.22Å; Q59-D63 PolarHBondContact O-N 2.88Å; E60-D63 CarbonylContact O-C 3.6Å; E60-D63 PolarHBondContact O-N 3.2Å; L61-D63 VanDerWaalsContact C-N 3.29Å; L61-D63 PolarHBondContact O-N 3.04Å; D63-R66 PolarHBondContact O-N 3.46Å; D63-R66 IonicContact OD1-CZ 3.47Å; D63-R66 IonicContact OD1-NE 3.33Å; D63-R66 PolarHBondContact OD1-NE 2.98Å; D63-R66 IonicContact OD1-NH1 3.32Å; D63-R66 IonicContact OD1-NH2 3.54Å; D63-R66 PolarHBondContact OD1-NH2 2.91Å; D63-Q67 WeakPolarHBondContact O-CB 3.38Å; D63-Q67 VanDerWaalsContact O-CG 3.23Å; D63-Q67 WeakPolarHBondContact O-CG 3.3Å; D63-Q67 PolarHBondContact O-N 3.48Å
64A87.6Confident87.2Confident50 Ų5097.8 Ų97.841%0.41348%0.482SS..Hα-helixtrans-64.3-40.4172.800000111.7E60 L61 Q67 S68E60-A64 VanDerWaalsContact O-CB 3.24Å; E60-A64 WeakPolarHBondContact O-CB 3.49Å; E60-A64 PolarHBondContact O-N 3.13Å; L61-A64 PolarHBondContact O-N 3.44Å; A64-Q67 PolarHBondContact O-N 3.12Å; A64-S68 WeakPolarHBondContact O-CB 3.33Å; A64-S68 PolarHBondContact O-N 3.48Å
65I85.6Confident87.8Confident98 Ų98101.2 Ų101.250%0.50348%0.484SS..Hα-helixtrans-67.6-39.5173.8-71.7167.8000110.4L61 N69L61-I65 VanDerWaalsContact O-CB 3.26Å; L61-I65 WeakPolarHBondContact O-CB 3.48Å; L61-I65 WeakPolarHBondContact O-CD1 3.41Å; L61-I65 WeakPolarHBondContact O-CG1 3.49Å; L61-I65 PolarHBondContact O-N 3.04Å; I65-N69 VanDerWaalsContact CG2-ND2 3.29Å; I65-N69 WeakPolarHBondContact CG2-ND2 3.46Å; I65-N69 VanDerWaalsContact O-CB 3.29Å; I65-N69 WeakPolarHBondContact O-CB 3.48Å; I65-N69 PolarHBondContact O-N 3.4Å; I65-N69 PolarHBondContact O-ND2 3.06Å
66R89.4Confident88.4Confident144 Ų14498.8 Ų98.854%0.54348%0.476SS..Hα-helixtrans-62.6-45.9173.2-86.9-172.8-81.7176-10.6111.5R62 D63 N69 Q70R62-R66 WeakPolarHBondContact O-CB 3.45Å; R62-R66 WeakPolarHBondContact O-CG 3.44Å; R62-R66 PolarHBondContact O-N 2.96Å; D63-R66 PolarHBondContact O-N 3.46Å; D63-R66 IonicContact OD1-CZ 3.47Å; D63-R66 IonicContact OD1-NE 3.33Å; D63-R66 PolarHBondContact OD1-NE 2.98Å; D63-R66 IonicContact OD1-NH1 3.32Å; D63-R66 IonicContact OD1-NH2 3.54Å; D63-R66 PolarHBondContact OD1-NH2 2.91Å; R66-N69 PolarHBondContact O-N 3.4Å; R66-Q70 VanDerWaalsContact O-CB 3.28Å; R66-Q70 WeakPolarHBondContact O-CB 3.3Å; R66-Q70 PolarHBondContact O-N 3.48Å
67Q90.1Very high88.9Confident129 Ų12999.3 Ų99.360%0.60348%0.478SS*.Hα-helixtrans-64.5-43.4176.8-72.8174.322.800111.5D63 A64 Q70 I71D63-Q67 WeakPolarHBondContact O-CB 3.38Å; D63-Q67 VanDerWaalsContact O-CG 3.23Å; D63-Q67 WeakPolarHBondContact O-CG 3.3Å; D63-Q67 PolarHBondContact O-N 3.48Å; A64-Q67 PolarHBondContact O-N 3.12Å; Q67-Q70 WeakPolarHBondContact O-CB 3.42Å; Q67-Q70 PolarHBondContact O-N 3.04Å; Q67-I71 VanDerWaalsContact O-CG1 3.27Å; Q67-I71 WeakPolarHBondContact O-CG1 3.43Å; Q67-I71 PolarHBondContact O-N 2.93Å
68S88.8Confident89.5Confident72 Ų7299.1 Ų99.150%0.50348%0.477SS..Hα-helixtrans-63.7-44.3176.7179.50000111.6A64 Q70 I71 L72A64-S68 WeakPolarHBondContact O-CB 3.33Å; A64-S68 PolarHBondContact O-N 3.48Å; S68-Q70 VanDerWaalsContact C-N 3.28Å; S68-Q70 PolarHBondContact O-N 3.46Å; S68-I71 PolarHBondContact O-N 2.81Å; S68-L72 VanDerWaalsContact O-CB 3.31Å; S68-L72 WeakPolarHBondContact O-CB 3.49Å; S68-L72 PolarHBondContact O-N 3.35Å
69N91.4Very high90Very high79 Ų79101.3 Ų101.342%0.42249%0.488SS..Hα-helixtrans-67.4-28.6173.7-79.5-58.8000112.9I65 R66 R73I65-N69 VanDerWaalsContact CG2-ND2 3.29Å; I65-N69 WeakPolarHBondContact CG2-ND2 3.46Å; I65-N69 VanDerWaalsContact O-CB 3.29Å; I65-N69 WeakPolarHBondContact O-CB 3.48Å; I65-N69 PolarHBondContact O-N 3.4Å; I65-N69 PolarHBondContact O-ND2 3.06Å; R66-N69 PolarHBondContact O-N 3.4Å; N69-R73 WeakPolarHBondContact O-CB 3.39Å; N69-R73 WeakPolarHBondContact O-CG 3.45Å; N69-R73 PolarHBondContact O-N 3.34Å; N69-R73 VanDerWaalsContact O-N 3.1Å; N69-R73 PolarHBondContact O-NE 3.12Å; N69-R73 VanDerWaalsContact O-NE 3.12Å
70Q92.8Very high90.4Very high79 Ų79102.3 Ų102.337%0.36950%0.496SS..Hα-helixtrans-70.7-49.5173.8-17758.629.100110.5R66 Q67 S68 L72 R73 E74R66-Q70 VanDerWaalsContact O-CB 3.28Å; R66-Q70 WeakPolarHBondContact O-CB 3.3Å; R66-Q70 PolarHBondContact O-N 3.48Å; Q67-Q70 WeakPolarHBondContact O-CB 3.42Å; Q67-Q70 PolarHBondContact O-N 3.04Å; S68-Q70 VanDerWaalsContact C-N 3.28Å; S68-Q70 PolarHBondContact O-N 3.46Å; Q70-L72 VanDerWaalsContact C-N 3.31Å; Q70-L72 PolarHBondContact O-N 3.07Å; Q70-R73 WeakPolarHBondContact O-CB 3.42Å; Q70-R73 PolarHBondContact O-N 3.12Å; Q70-R73 VanDerWaalsContact O-N 3.16Å; Q70-E74 WeakPolarHBondContact CG-OE1 3.33Å; Q70-E74 PolarHBondContact NE2-OE1 2.96Å; Q70-E74 WeakPolarHBondContact O-CG 3.42Å; Q70-E74 PolarHBondContact O-N 3.21Å
71I91.5Very high90.8Very high91 Ų91102.5 Ų102.547%0.46750%0.497SS..Hα-helixtrans-59.4-42.8174.7-67.1164.4000110.4Q67 S68 R73 E74 R75Q67-I71 VanDerWaalsContact O-CG1 3.27Å; Q67-I71 WeakPolarHBondContact O-CG1 3.43Å; Q67-I71 PolarHBondContact O-N 2.93Å; S68-I71 PolarHBondContact O-N 2.81Å; I71-R73 VanDerWaalsContact C-N 3.33Å; I71-R73 PolarHBondContact O-N 3.19Å; I71-E74 PolarHBondContact O-N 3.01Å; I71-R75 HydrophobicContact CG2-CG 4.17Å; I71-R75 WeakPolarHBondContact O-CB 3.48Å; I71-R75 VanDerWaalsContact O-CG 3.26Å; I71-R75 WeakPolarHBondContact O-CG 3.48Å; I71-R75 PolarHBondContact O-N 2.87Å
72L92.1Very high91.2Very high101 Ų101103.3 Ų103.353%0.52950%0.496SS..Hα-helixtrans-63.5-40.3178.2-174.963.2000111.4S68 Q70 R75 C76S68-L72 VanDerWaalsContact O-CB 3.31Å; S68-L72 WeakPolarHBondContact O-CB 3.49Å; S68-L72 PolarHBondContact O-N 3.35Å; Q70-L72 VanDerWaalsContact C-N 3.31Å; Q70-L72 PolarHBondContact O-N 3.07Å; L72-R75 PolarHBondContact O-N 3.41Å; L72-C76 WeakPolarHBondContact O-CB 3.33Å; L72-C76 PolarHBondContact O-N 2.93Å; L72-C76 PolarHBondContact O-SG 3.43Å
73R92.6Very high91.5Very high138 Ų138100.8 Ų100.852%0.52149%0.49SS..Hα-helixtrans-62.4-47.3173.5-81.4-179-79178.50.4111.6N69 Q70 I71 R75 C76 E77N69-R73 WeakPolarHBondContact O-CB 3.39Å; N69-R73 WeakPolarHBondContact O-CG 3.45Å; N69-R73 PolarHBondContact O-N 3.34Å; N69-R73 VanDerWaalsContact O-N 3.1Å; N69-R73 PolarHBondContact O-NE 3.12Å; N69-R73 VanDerWaalsContact O-NE 3.12Å; Q70-R73 WeakPolarHBondContact O-CB 3.42Å; Q70-R73 PolarHBondContact O-N 3.12Å; Q70-R73 VanDerWaalsContact O-N 3.16Å; I71-R73 VanDerWaalsContact C-N 3.33Å; I71-R73 PolarHBondContact O-N 3.19Å; R73-R75 VanDerWaalsContact C-N 3.34Å; R73-R75 PolarHBondContact O-N 2.89Å; R73-C76 PolarHBondContact O-N 3.36Å; R73-E77 WeakPolarHBondContact O-CB 3.46Å; R73-E77 VanDerWaalsContact O-CG 3.3Å; R73-E77 WeakPolarHBondContact O-CG 3.46Å; R73-E77 PolarHBondContact O-N 2.95Å
74E92.9Very high91.8Very high82 Ų8299.7 Ų99.738%0.38349%0.489SS..Hα-helixtrans-59.4-42.9175.5-71.5165.3-169.300111.6Q70 I71 E77 E78Q70-E74 WeakPolarHBondContact CG-OE1 3.33Å; Q70-E74 PolarHBondContact NE2-OE1 2.96Å; Q70-E74 WeakPolarHBondContact O-CG 3.42Å; Q70-E74 PolarHBondContact O-N 3.21Å; I71-E74 PolarHBondContact O-N 3.01Å; E74-E77 PolarHBondContact O-N 3.18Å; E74-E78 WeakPolarHBondContact O-CB 3.43Å; E74-E78 VanDerWaalsContact O-CG 3.32Å; E74-E78 WeakPolarHBondContact O-CG 3.41Å; E74-E78 PolarHBondContact O-N 3.47Å
75R92.6Very high92.1Very high148 Ų148100.3 Ų100.356%0.55849%0.49SS*.Hα-helixtrans-66.6-38.4175.2-69-55.7-175.8-167.7-2.8112.7I71 L72 R73 E78 L79I71-R75 HydrophobicContact CG2-CG 4.17Å; I71-R75 WeakPolarHBondContact O-CB 3.48Å; I71-R75 VanDerWaalsContact O-CG 3.26Å; I71-R75 WeakPolarHBondContact O-CG 3.48Å; I71-R75 PolarHBondContact O-N 2.87Å; L72-R75 PolarHBondContact O-N 3.41Å; R73-R75 VanDerWaalsContact C-N 3.34Å; R73-R75 PolarHBondContact O-N 2.89Å; R75-E78 VanDerWaalsContact CD-OE2 3.3Å; R75-E78 WeakPolarHBondContact CD-OE2 3.42Å; R75-E78 IonicContact CZ-OE2 2.77Å; R75-E78 IonicContact NE-OE2 3.91Å; R75-E78 IonicContact NH1-OE1 2.58Å; R75-E78 IonicContact NH1-OE2 3.55Å; R75-E78 PolarHBondContact NH1-OE2 3.16Å; R75-L79 VanDerWaalsContact O-CB 3.32Å; R75-L79 WeakPolarHBondContact O-CB 3.49Å; R75-L79 PolarHBondContact O-N 3.3Å
76C91.7Very high92.5Very high63 Ų6399.9 Ų99.943%0.42649%0.486SS..Hα-helixtrans-65-41.3173.1-75.10000111.1L72 R73 L79 L80L72-C76 WeakPolarHBondContact O-CB 3.33Å; L72-C76 PolarHBondContact O-N 2.93Å; L72-C76 PolarHBondContact O-SG 3.43Å; R73-C76 PolarHBondContact O-N 3.36Å; C76-L79 PolarHBondContact O-N 2.97Å; C76-L80 WeakPolarHBondContact O-CB 3.37Å; C76-L80 VanDerWaalsContact O-CG 3.24Å; C76-L80 WeakPolarHBondContact O-CG 3.49Å; C76-L80 PolarHBondContact O-N 3.06Å
77E93.6Very high92.7Very high110 Ų11099.3 Ų99.351%0.51448%0.484SS..Hα-helixtrans-64.8-45.7175.4-74170.2-168.500111.5R73 E74 L79 L80 H81R73-E77 WeakPolarHBondContact O-CB 3.46Å; R73-E77 VanDerWaalsContact O-CG 3.3Å; R73-E77 WeakPolarHBondContact O-CG 3.46Å; R73-E77 PolarHBondContact O-N 2.95Å; E74-E77 PolarHBondContact O-N 3.18Å; E77-L79 VanDerWaalsContact C-N 3.34Å; E77-L79 PolarHBondContact O-N 3.4Å; E77-L80 PolarHBondContact O-N 3.1Å; E77-H81 WeakPolarHBondContact O-CB 3.37Å; E77-H81 PolarHBondContact O-CD2 3.03Å; E77-H81 VanDerWaalsContact O-CD2 3.3Å; E77-H81 PolarHBondContact O-N 2.99Å
78E93.2Very high92.9Very high100 Ų10099.2 Ų99.247%0.46748%0.483SS..Hα-helixtrans-59.3-42.5173.4-76.6175.1-179.500111.9E74 R75 H81 F82E74-E78 WeakPolarHBondContact O-CB 3.43Å; E74-E78 VanDerWaalsContact O-CG 3.32Å; E74-E78 WeakPolarHBondContact O-CG 3.41Å; E74-E78 PolarHBondContact O-N 3.47Å; R75-E78 VanDerWaalsContact CD-OE2 3.3Å; R75-E78 WeakPolarHBondContact CD-OE2 3.42Å; R75-E78 IonicContact CZ-OE2 2.77Å; R75-E78 IonicContact NE-OE2 3.91Å; R75-E78 IonicContact NH1-OE1 2.58Å; R75-E78 IonicContact NH1-OE2 3.55Å; R75-E78 PolarHBondContact NH1-OE2 3.16Å; E78-H81 PolarHBondContact O-N 2.9Å; E78-F82 VanDerWaalsContact O-CB 3.26Å; E78-F82 WeakPolarHBondContact O-CB 3.38Å; E78-F82 PolarHBondContact O-N 3.49Å
79L93.3Very high93.2Very high114 Ų114101.7 Ų101.760%0.59749%0.487SS*.Hα-helixtrans-67-39.8177.7-175.864.6000111.5R75 C76 E77 F82 Q83R75-L79 VanDerWaalsContact O-CB 3.32Å; R75-L79 WeakPolarHBondContact O-CB 3.49Å; R75-L79 PolarHBondContact O-N 3.3Å; C76-L79 PolarHBondContact O-N 2.97Å; E77-L79 VanDerWaalsContact C-N 3.34Å; E77-L79 PolarHBondContact O-N 3.4Å; L79-F82 PolarHBondContact O-N 3.06Å; L79-Q83 VanDerWaalsContact O-CB 3.25Å; L79-Q83 WeakPolarHBondContact O-CB 3.34Å; L79-Q83 PolarHBondContact O-N 3.46Å
80L93.6Very high93.4Very high110 Ų110105.6 Ų105.658%0.57650%0.5SS*.Hα-helixtrans-64.8-43.4174.7-74.4171.6000111.2C76 E77 Q83 A84C76-L80 WeakPolarHBondContact O-CB 3.37Å; C76-L80 VanDerWaalsContact O-CG 3.24Å; C76-L80 WeakPolarHBondContact O-CG 3.49Å; C76-L80 PolarHBondContact O-N 3.06Å; E77-L80 PolarHBondContact O-N 3.1Å; L80-Q83 PolarHBondContact O-N 3.41Å; L80-A84 WeakPolarHBondContact O-CB 3.41Å; L80-A84 PolarHBondContact O-N 3.37Å
81H93.2Very high93.5Very high137 Ų137107.2 Ų107.263%0.63451%0.508SS*.Hα-helixtrans-62.6-47.1173.5-86.7-63.4000111.9E77 E78 Q83 A84 S85E77-H81 WeakPolarHBondContact O-CB 3.37Å; E77-H81 PolarHBondContact O-CD2 3.03Å; E77-H81 VanDerWaalsContact O-CD2 3.3Å; E77-H81 PolarHBondContact O-N 2.99Å; E78-H81 PolarHBondContact O-N 2.9Å; H81-Q83 VanDerWaalsContact C-N 3.33Å; H81-Q83 PolarHBondContact O-N 2.93Å; H81-A84 WeakPolarHBondContact O-CB 3.42Å; H81-A84 PolarHBondContact O-N 3.17Å; H81-S85 PolarHBondContact O-N 3.2Å; H81-S85 PolarHBondContact O-OG 3.25Å; H81-S85 VanDerWaalsContact O-OG 3.1Å
82F93.8Very high93.7Very high121 Ų121109 Ų10953%0.53151%0.512SS..Hα-helixtrans-59.7-44.2175.9178.3-104.3000111.2E78 L79 A84 S85 Q86E78-F82 VanDerWaalsContact O-CB 3.26Å; E78-F82 WeakPolarHBondContact O-CB 3.38Å; E78-F82 PolarHBondContact O-N 3.49Å; L79-F82 PolarHBondContact O-N 3.06Å; F82-A84 VanDerWaalsContact C-N 3.32Å; F82-A84 PolarHBondContact O-N 3.01Å; F82-S85 PolarHBondContact O-N 3.23Å; F82-Q86 HydrophobicContact CD1-CG 4.07Å; F82-Q86 HydrophobicContact CD2-CG 4.22Å; F82-Q86 HydrophobicContact CE1-CG 3.7Å; F82-Q86 HydrophobicContact CE2-CG 3.85Å; F82-Q86 HydrophobicContact CG-CG 4.32Å; F82-Q86 HydrophobicContact CZ-CG 3.58Å; F82-Q86 VanDerWaalsContact O-CB 3.32Å; F82-Q86 WeakPolarHBondContact O-CB 3.24Å; F82-Q86 WeakPolarHBondContact O-CG 3.47Å; F82-Q86 PolarHBondContact O-N 3.41Å
83Q93.8Very high93.9Very high97 Ų97108.3 Ų108.345%0.45351%0.509SS..Hα-helixtrans-65.3-36.5177.2-162.3-172.137.100111.9L79 L80 H81 R87L79-Q83 VanDerWaalsContact O-CB 3.25Å; L79-Q83 WeakPolarHBondContact O-CB 3.34Å; L79-Q83 PolarHBondContact O-N 3.46Å; L80-Q83 PolarHBondContact O-N 3.41Å; H81-Q83 VanDerWaalsContact C-N 3.33Å; H81-Q83 PolarHBondContact O-N 2.93Å; Q83-R87 VanDerWaalsContact CD-NH2 3.3Å; Q83-R87 WeakPolarHBondContact O-CG 3.45Å; Q83-R87 PolarHBondContact O-N 3Å
84A94Very high94Very high31 Ų31106.5 Ų106.526%0.25651%0.507SS..Hα-helixtrans-65.1-51.3173.400000111.2L80 H81 F82 Q86 R87 E88L80-A84 WeakPolarHBondContact O-CB 3.41Å; L80-A84 PolarHBondContact O-N 3.37Å; H81-A84 WeakPolarHBondContact O-CB 3.42Å; H81-A84 PolarHBondContact O-N 3.17Å; F82-A84 VanDerWaalsContact C-N 3.32Å; F82-A84 PolarHBondContact O-N 3.01Å; A84-Q86 VanDerWaalsContact C-N 3.32Å; A84-Q86 PolarHBondContact O-N 2.98Å; A84-R87 WeakPolarHBondContact O-CA 3.44Å; A84-R87 WeakPolarHBondContact O-CB 3.49Å; A84-R87 PolarHBondContact O-N 3.42Å; A84-E88 WeakPolarHBondContact O-CG 3.39Å; A84-E88 PolarHBondContact O-N 3.45Å
85S93.9Very high94.2Very high62 Ų62105.5 Ų105.543%0.43451%0.509SS..Hα-helixtrans-58.9-40.5176.5-58.10000112.5H81 F82 R87 E88 E89H81-S85 PolarHBondContact O-N 3.2Å; H81-S85 PolarHBondContact O-OG 3.25Å; H81-S85 VanDerWaalsContact O-OG 3.1Å; F82-S85 PolarHBondContact O-N 3.23Å; S85-R87 VanDerWaalsContact C-N 3.33Å; S85-R87 PolarHBondContact O-N 2.91Å; S85-E88 PolarHBondContact O-N 3.29Å; S85-E89 WeakPolarHBondContact O-CB 3.48Å; S85-E89 PolarHBondContact O-N 2.85Å
86Q93.8Very high94.4Very high89 Ų89102.7 Ų102.742%0.41650%0.501SS..Hα-helixtrans-65.8-34175.4-72.7-68.97600112.6F82 A84 E89 K90F82-Q86 HydrophobicContact CD1-CG 4.07Å; F82-Q86 HydrophobicContact CD2-CG 4.22Å; F82-Q86 HydrophobicContact CE1-CG 3.7Å; F82-Q86 HydrophobicContact CE2-CG 3.85Å; F82-Q86 HydrophobicContact CG-CG 4.32Å; F82-Q86 HydrophobicContact CZ-CG 3.58Å; F82-Q86 VanDerWaalsContact O-CB 3.32Å; F82-Q86 WeakPolarHBondContact O-CB 3.24Å; F82-Q86 WeakPolarHBondContact O-CG 3.47Å; F82-Q86 PolarHBondContact O-N 3.41Å; A84-Q86 VanDerWaalsContact C-N 3.32Å; A84-Q86 PolarHBondContact O-N 2.98Å; Q86-E89 PolarHBondContact OE1-OE2 2.78Å; Q86-K90 VanDerWaalsContact O-CB 3.27Å; Q86-K90 WeakPolarHBondContact O-CB 3.48Å; Q86-K90 PolarHBondContact O-N 2.73Å; Q86-K90 VanDerWaalsContact O-N 3.07Å
87R94.4Very high94.6Very high132 Ų132106.2 Ų106.250%0.49851%0.509SS..Hα-helixtrans-68-46.1172.4-75.9-177.2-128.8142.8-0.8110.6Q83 A84 S85 K90 E91Q83-R87 VanDerWaalsContact CD-NH2 3.3Å; Q83-R87 WeakPolarHBondContact O-CG 3.45Å; Q83-R87 PolarHBondContact O-N 3Å; A84-R87 WeakPolarHBondContact O-CA 3.44Å; A84-R87 WeakPolarHBondContact O-CB 3.49Å; A84-R87 PolarHBondContact O-N 3.42Å; S85-R87 VanDerWaalsContact C-N 3.33Å; S85-R87 PolarHBondContact O-N 2.91Å; R87-K90 PolarHBondContact O-N 3.06Å; R87-E91 WeakPolarHBondContact O-CB 3.29Å; R87-E91 VanDerWaalsContact O-CG 3.3Å; R87-E91 WeakPolarHBondContact O-CG 3.37Å; R87-E91 PolarHBondContact O-N 3.42Å
88E94.8Very high94.7Very high128 Ų128105.3 Ų105.360%0.59851%0.505SS*.Hα-helixtrans-60.6-44.1177-70.2175.9-178.100112.1A84 S85 E91 F92A84-E88 WeakPolarHBondContact O-CG 3.39Å; A84-E88 PolarHBondContact O-N 3.45Å; S85-E88 PolarHBondContact O-N 3.29Å; E88-E91 PolarHBondContact O-N 3.02Å; E88-F92 WeakPolarHBondContact O-CB 3.47Å; E88-F92 PolarHBondContact O-N 3.4Å
89E94.4Very high94.9Very high123 Ų123105.4 Ų105.458%0.57551%0.505SS*.Hα-helixtrans-64.4-43176.8-174.8177.1-178.700111.5S85 Q86 E91 F92 L93S85-E89 WeakPolarHBondContact O-CB 3.48Å; S85-E89 PolarHBondContact O-N 2.85Å; Q86-E89 PolarHBondContact OE1-OE2 2.78Å; E89-E91 VanDerWaalsContact C-N 3.35Å; E89-E91 PolarHBondContact O-N 2.92Å; E89-F92 PolarHBondContact O-N 2.9Å; E89-L93 VanDerWaalsContact O-CB 3.31Å; E89-L93 WeakPolarHBondContact O-CB 3.47Å; E89-L93 PolarHBondContact O-N 3.38Å
90K94.6Very high95Very high161 Ų161102.4 Ų102.470%0.750%0.497SS*.Hα-helixtrans-63.1-42175.6-176.4-178.6177.6-177.30111.5Q86 R87 M94Q86-K90 VanDerWaalsContact O-CB 3.27Å; Q86-K90 WeakPolarHBondContact O-CB 3.48Å; Q86-K90 PolarHBondContact O-N 2.73Å; Q86-K90 VanDerWaalsContact O-N 3.07Å; R87-K90 PolarHBondContact O-N 3.06Å; K90-M94 VanDerWaalsContact O-CB 3.22Å; K90-M94 WeakPolarHBondContact O-CB 3.38Å; K90-M94 PolarHBondContact O-N 2.96Å
91E95Very high95.1Very high113 Ų113105.4 Ų105.453%0.52850%0.5SS..Hα-helixtrans-64.1-45.2175.8-76.4173.3-167.800111.2R87 E88 E89 L93 M94 C95R87-E91 WeakPolarHBondContact O-CB 3.29Å; R87-E91 VanDerWaalsContact O-CG 3.3Å; R87-E91 WeakPolarHBondContact O-CG 3.37Å; R87-E91 PolarHBondContact O-N 3.42Å; E88-E91 PolarHBondContact O-N 3.02Å; E89-E91 VanDerWaalsContact C-N 3.35Å; E89-E91 PolarHBondContact O-N 2.92Å; E91-L93 PolarHBondContact O-N 3.38Å; E91-M94 PolarHBondContact O-N 3.35Å; E91-C95 WeakPolarHBondContact O-CB 3.37Å; E91-C95 PolarHBondContact O-N 2.92Å; E91-C95 PolarHBondContact O-SG 2.89Å; E91-C95 VanDerWaalsContact O-SG 3.38Å
92F96Very high95.3Very high128 Ų128104.4 Ų104.456%0.56149%0.494SS*.Hα-helixtrans-58.8-49.1174.7175.3-98.7000111.7E88 E89 M94 C95 K96E88-F92 WeakPolarHBondContact O-CB 3.47Å; E88-F92 PolarHBondContact O-N 3.4Å; E89-F92 PolarHBondContact O-N 2.9Å; F92-M94 VanDerWaalsContact C-N 3.33Å; F92-M94 PolarHBondContact O-N 3.18Å; F92-C95 WeakPolarHBondContact O-CB 3.45Å; F92-C95 PolarHBondContact O-N 3.5Å; F92-K96 HydrophobicContact CD1-CG 4.23Å; F92-K96 HydrophobicContact CE1-CG 3.81Å; F92-K96 HydrophobicContact CE2-CD 4.44Å; F92-K96 HydrophobicContact CE2-CG 4.16Å; F92-K96 HydrophobicContact CZ-CD 4.1Å; F92-K96 VanDerWaalsContact CZ-CE 3.48Å; F92-K96 HydrophobicContact CZ-CG 3.78Å; F92-K96 WeakPolarHBondContact O-CG 3.5Å; F92-K96 PolarHBondContact O-N 3.24Å
93L96.4Very high95.5Very high88 Ų88102.6 Ų102.646%0.46149%0.49SS..Hα-helixtrans-64-40.3179.4-173.560.8000111.1E89 E91 K96 F97E89-L93 VanDerWaalsContact O-CB 3.31Å; E89-L93 WeakPolarHBondContact O-CB 3.47Å; E89-L93 PolarHBondContact O-N 3.38Å; E91-L93 PolarHBondContact O-N 3.38Å; L93-K96 PolarHBondContact O-N 3.21Å; L93-F97 HydrophobicContact CD1-CD2 3.98Å; L93-F97 HydrophobicContact CD1-CE2 3.61Å; L93-F97 HydrophobicContact CD1-CZ 4.39Å; L93-F97 HydrophobicContact CD2-CE2 3.96Å; L93-F97 HydrophobicContact CG-CD2 3.76Å; L93-F97 HydrophobicContact CG-CE2 3.53Å; L93-F97 WeakPolarHBondContact O-CD2 3.4Å; L93-F97 PolarHBondContact O-N 3.47Å
94M95.4Very high95.6Very high99 Ų99102.8 Ų102.849%0.48850%0.497SS..Hα-helixtrans-60.8-45.4173.3-178.2-178.163.200111.4K90 E91 F92 K96 F97 Q98K90-M94 VanDerWaalsContact O-CB 3.22Å; K90-M94 WeakPolarHBondContact O-CB 3.38Å; K90-M94 PolarHBondContact O-N 2.96Å; E91-M94 PolarHBondContact O-N 3.35Å; F92-M94 VanDerWaalsContact C-N 3.33Å; F92-M94 PolarHBondContact O-N 3.18Å; M94-K96 PolarHBondContact O-N 3.14Å; M94-F97 PolarHBondContact O-N 2.62Å; M94-Q98 WeakPolarHBondContact O-CB 3.33Å; M94-Q98 VanDerWaalsContact O-CG 3.28Å; M94-Q98 WeakPolarHBondContact O-CG 3.43Å; M94-Q98 PolarHBondContact O-N 3.07Å
95C96.2Very high95.7Very high61 Ų61106 Ų10641%0.41251%0.507SS..Hα-helixtrans-59.8-44.2174.2-74.80000111.5E91 F92 Q98 E99E91-C95 WeakPolarHBondContact O-CB 3.37Å; E91-C95 PolarHBondContact O-N 2.92Å; E91-C95 PolarHBondContact O-SG 2.89Å; E91-C95 VanDerWaalsContact O-SG 3.38Å; F92-C95 WeakPolarHBondContact O-CB 3.45Å; F92-C95 PolarHBondContact O-N 3.5Å; C95-Q98 PolarHBondContact O-N 3.35Å; C95-E99 WeakPolarHBondContact O-CG 3.48Å; C95-E99 PolarHBondContact O-N 3.16Å
96K96.8Very high95.8Very high90 Ų90109.3 Ų109.339%0.39151%0.51SS..Hα-helixtrans-64.3-41.1177.5-70.4-70.6159.5-1510112.7F92 L93 M94 Q98 E99 A100F92-K96 HydrophobicContact CD1-CG 4.23Å; F92-K96 HydrophobicContact CE1-CG 3.81Å; F92-K96 HydrophobicContact CE2-CD 4.44Å; F92-K96 HydrophobicContact CE2-CG 4.16Å; F92-K96 HydrophobicContact CZ-CD 4.1Å; F92-K96 VanDerWaalsContact CZ-CE 3.48Å; F92-K96 HydrophobicContact CZ-CG 3.78Å; F92-K96 WeakPolarHBondContact O-CG 3.5Å; F92-K96 PolarHBondContact O-N 3.24Å; L93-K96 PolarHBondContact O-N 3.21Å; M94-K96 PolarHBondContact O-N 3.14Å; K96-Q98 VanDerWaalsContact C-N 3.35Å; K96-E99 IonicContact NZ-OE1 3.57Å; K96-E99 IonicContact NZ-OE2 3.05Å; K96-E99 PolarHBondContact NZ-OE2 3.41Å; K96-E99 PolarHBondContact O-N 2.94Å; K96-A100 WeakPolarHBondContact O-CB 3.39Å; K96-A100 PolarHBondContact O-N 2.86Å
97F96.3Very high96Very high136 Ų136109.3 Ų109.360%0.59651%0.513SS*.Hα-helixtrans-64-40.1173.1-84.6-62000112.1L93 M94 A100 R101L93-F97 HydrophobicContact CD1-CD2 3.98Å; L93-F97 HydrophobicContact CD1-CE2 3.61Å; L93-F97 HydrophobicContact CD1-CZ 4.39Å; L93-F97 HydrophobicContact CD2-CE2 3.96Å; L93-F97 HydrophobicContact CG-CD2 3.76Å; L93-F97 HydrophobicContact CG-CE2 3.53Å; L93-F97 WeakPolarHBondContact O-CD2 3.4Å; L93-F97 PolarHBondContact O-N 3.47Å; M94-F97 PolarHBondContact O-N 2.62Å; F97-A100 PolarHBondContact O-N 3.49Å; F97-R101 VanDerWaalsContact O-CB 3.3Å; F97-R101 WeakPolarHBondContact O-CB 3.41Å; F97-R101 PolarHBondContact O-N 2.92Å
98Q96.3Very high96.1Very high92 Ų92104.6 Ų104.643%0.4351%0.505SS..Hα-helixtrans-64.5-41.4175-72.4175.921.900111.9M94 C95 K96 R101 K102M94-Q98 WeakPolarHBondContact O-CB 3.33Å; M94-Q98 VanDerWaalsContact O-CG 3.28Å; M94-Q98 WeakPolarHBondContact O-CG 3.43Å; M94-Q98 PolarHBondContact O-N 3.07Å; C95-Q98 PolarHBondContact O-N 3.35Å; K96-Q98 VanDerWaalsContact C-N 3.35Å; Q98-R101 PolarHBondContact O-N 3.35Å; Q98-K102 WeakPolarHBondContact O-CB 3.49Å; Q98-K102 VanDerWaalsContact O-CG 3.32Å; Q98-K102 WeakPolarHBondContact O-CG 3.38Å; Q98-K102 PolarHBondContact O-N 3.38Å
99E96.3Very high96.2Very high102 Ų102103.8 Ų103.848%0.47750%0.504SS..Hα-helixtrans-61-48.5173.7-75.1173.4-17600111.7C95 K96 R101 K102 L103C95-E99 WeakPolarHBondContact O-CG 3.48Å; C95-E99 PolarHBondContact O-N 3.16Å; K96-E99 IonicContact NZ-OE1 3.57Å; K96-E99 IonicContact NZ-OE2 3.05Å; K96-E99 PolarHBondContact NZ-OE2 3.41Å; K96-E99 PolarHBondContact O-N 2.94Å; E99-R101 VanDerWaalsContact C-N 3.34Å; E99-R101 PolarHBondContact O-N 3.28Å; E99-K102 PolarHBondContact O-N 3.22Å; E99-L103 PolarHBondContact O-N 2.94Å
100A96.2Very high96.3Very high51 Ų51103 Ų10342%0.42150%0.5SS..Hα-helixtrans-60.9-42.8177.500000111.6K96 F97 L103 V104K96-A100 WeakPolarHBondContact O-CB 3.39Å; K96-A100 PolarHBondContact O-N 2.86Å; F97-A100 PolarHBondContact O-N 3.49Å; A100-L103 WeakPolarHBondContact O-CB 3.47Å; A100-L103 PolarHBondContact O-N 3.41Å; A100-V104 WeakPolarHBondContact O-CG2 3.31Å; A100-V104 PolarHBondContact O-N 3.4Å
101R96.1Very high96.3Very high172 Ų172101.5 Ų101.565%0.64949%0.494SS*.Hα-helixtrans-61.5-48.1175.8-177.4179.2169.6176.22.6111.7F97 Q98 E99 L103 V104 E105F97-R101 VanDerWaalsContact O-CB 3.3Å; F97-R101 WeakPolarHBondContact O-CB 3.41Å; F97-R101 PolarHBondContact O-N 2.92Å; Q98-R101 PolarHBondContact O-N 3.35Å; E99-R101 VanDerWaalsContact C-N 3.34Å; E99-R101 PolarHBondContact O-N 3.28Å; R101-L103 VanDerWaalsContact C-N 3.26Å; R101-L103 PolarHBondContact O-N 3.49Å; R101-V104 PolarHBondContact O-N 2.88Å; R101-E105 IonicContact CZ-OE1 3.64Å; R101-E105 IonicContact NE-OE1 3.88Å; R101-E105 PolarHBondContact NE-OE1 3.45Å; R101-E105 IonicContact NH2-OE1 2.69Å; R101-E105 WeakPolarHBondContact O-CG 3.45Å; R101-E105 PolarHBondContact O-N 3Å
102K97.1Very high96.4Very high117 Ų117101.3 Ų101.351%0.50950%0.496SS..Hα-helixtrans-59.2-38175.8-73.8174.3-177.3175.50111.6Q98 E99 R106Q98-K102 WeakPolarHBondContact O-CB 3.49Å; Q98-K102 VanDerWaalsContact O-CG 3.32Å; Q98-K102 WeakPolarHBondContact O-CG 3.38Å; Q98-K102 PolarHBondContact O-N 3.38Å; E99-K102 PolarHBondContact O-N 3.22Å; K102-R106 WeakPolarHBondContact O-CG 3.46Å; K102-R106 PolarHBondContact O-N 3.27Å
103L96.9Very high96.5Very high83 Ų8399.4 Ų99.444%0.43549%0.492SS..Hα-helixtrans-65.7-45.1176179.463000111.9E99 A100 R101 E105 R106 L107E99-L103 PolarHBondContact O-N 2.94Å; A100-L103 WeakPolarHBondContact O-CB 3.47Å; A100-L103 PolarHBondContact O-N 3.41Å; R101-L103 VanDerWaalsContact C-N 3.26Å; R101-L103 PolarHBondContact O-N 3.49Å; L103-E105 VanDerWaalsContact C-N 3.34Å; L103-E105 PolarHBondContact O-N 3.18Å; L103-R106 PolarHBondContact O-N 3.17Å; L103-L107 HydrophobicContact CD1-CD1 4.28Å; L103-L107 HydrophobicContact CD1-CG 4.3Å; L103-L107 HydrophobicContact CG-CD1 4.09Å; L103-L107 WeakPolarHBondContact O-CB 3.43Å; L103-L107 WeakPolarHBondContact O-CG 3.46Å; L103-L107 PolarHBondContact O-N 3.03Å
104V96.6Very high96.5Very high101 Ų101100.5 Ų100.561%0.61250%0.497SS*.Hα-helixtrans-62.8-41.6176.6171.60000111.3A100 R101 L107 G108A100-V104 WeakPolarHBondContact O-CG2 3.31Å; A100-V104 PolarHBondContact O-N 3.4Å; R101-V104 PolarHBondContact O-N 2.88Å; V104-L107 PolarHBondContact O-N 3.27Å; V104-G108 PolarHBondContact O-N 3.09Å
105E95.9Very high96.5Very high99 Ų99100.9 Ų100.946%0.46350%0.496SS..Hα-helixtrans-61.1-45.2175.3-73.5171.4-175.500111.2R101 L103 G108 L109R101-E105 IonicContact CZ-OE1 3.64Å; R101-E105 IonicContact NE-OE1 3.88Å; R101-E105 PolarHBondContact NE-OE1 3.45Å; R101-E105 IonicContact NH2-OE1 2.69Å; R101-E105 WeakPolarHBondContact O-CG 3.45Å; R101-E105 PolarHBondContact O-N 3Å; L103-E105 VanDerWaalsContact C-N 3.34Å; L103-E105 PolarHBondContact O-N 3.18Å; E105-G108 PolarHBondContact O-N 3.38Å; E105-L109 WeakPolarHBondContact O-CG 3.43Å; E105-L109 PolarHBondContact O-N 2.92Å
106R97.2Very high96.6Very high130 Ų130106.8 Ų106.849%0.49151%0.51SS..Hα-helixtrans-61-49.8174.5-74.4-168.2-56.6-93.72.1112.7K102 L103 G108 L109 E110K102-R106 WeakPolarHBondContact O-CG 3.46Å; K102-R106 PolarHBondContact O-N 3.27Å; L103-R106 PolarHBondContact O-N 3.17Å; R106-G108 PolarHBondContact O-N 3.31Å; R106-L109 PolarHBondContact O-N 2.96Å; R106-L109 VanDerWaalsContact O-N 3.13Å; R106-E110 WeakPolarHBondContact O-CG 3.43Å; R106-E110 PolarHBondContact O-N 3.35Å
107L96.3Very high96.6Very high90 Ų90108.3 Ų108.347%0.47152%0.518SS..Hα-helixtrans-61.4-32.6176.9-71172.9000111.9L103 V104 K111L103-L107 HydrophobicContact CD1-CD1 4.28Å; L103-L107 HydrophobicContact CD1-CG 4.3Å; L103-L107 HydrophobicContact CG-CD1 4.09Å; L103-L107 WeakPolarHBondContact O-CB 3.43Å; L103-L107 WeakPolarHBondContact O-CG 3.46Å; L103-L107 PolarHBondContact O-N 3.03Å; V104-L107 PolarHBondContact O-N 3.27Å; L107-K111 WeakPolarHBondContact O-CB 3.43Å; L107-K111 PolarHBondContact O-N 2.99Å
108G96.3Very high96.6Very high33 Ų33108.6 Ų108.634%0.3452%0.519SS..Hα-helixtrans-62.8-46.3173.500000112.3V104 E105 R106 K111 L112V104-G108 PolarHBondContact O-N 3.09Å; E105-G108 PolarHBondContact O-N 3.38Å; R106-G108 PolarHBondContact O-N 3.31Å; G108-K111 PolarHBondContact O-N 3.12Å; G108-L112 WeakPolarHBondContact O-CG 3.45Å; G108-L112 PolarHBondContact O-N 2.88Å; G108-L112 VanDerWaalsContact O-N 3.08Å
109L97.1Very high96.6Very high111 Ų111109.1 Ų109.158%0.58152%0.522SS*.Hα-helixtrans-64.2-48.6174.9-66.8173.9000111.4E105 R106 K111 L112 D113E105-L109 WeakPolarHBondContact O-CG 3.43Å; E105-L109 PolarHBondContact O-N 2.92Å; R106-L109 PolarHBondContact O-N 2.96Å; R106-L109 VanDerWaalsContact O-N 3.13Å; L109-K111 VanDerWaalsContact C-N 3.28Å; L109-K111 PolarHBondContact O-N 3.16Å; L109-L112 WeakPolarHBondContact O-CB 3.24Å; L109-L112 PolarHBondContact O-N 2.95Å; L109-D113 PolarHBondContact O-N 3.28Å
110E96.6Very high96.6Very high105 Ų105109.3 Ų109.349%0.49152%0.523SS..Hα-helixtrans-57.8-40.7176.7-72.1173.3-16700111.9R106 L112 D113 L114R106-E110 WeakPolarHBondContact O-CG 3.43Å; R106-E110 PolarHBondContact O-N 3.35Å; E110-L112 VanDerWaalsContact C-N 3.34Å; E110-L112 PolarHBondContact O-N 3.36Å; E110-D113 PolarHBondContact O-N 2.8Å; E110-L114 WeakPolarHBondContact O-CB 3.37Å; E110-L114 VanDerWaalsContact O-CG 3.28Å; E110-L114 WeakPolarHBondContact O-CG 3.46Å; E110-L114 PolarHBondContact O-N 2.96Å
111K96.3Very high96.5Very high131 Ų131109.1 Ų109.157%0.5752%0.521SS*.Hα-helixtrans-64.4-37.9175.6-178.7179.7179.51790112.1L107 G108 L109 K115L107-K111 WeakPolarHBondContact O-CB 3.43Å; L107-K111 PolarHBondContact O-N 2.99Å; G108-K111 PolarHBondContact O-N 3.12Å; L109-K111 VanDerWaalsContact C-N 3.28Å; L109-K111 PolarHBondContact O-N 3.16Å; K111-K115 WeakPolarHBondContact O-CB 3.38Å; K111-K115 VanDerWaalsContact O-CG 3.24Å; K111-K115 WeakPolarHBondContact O-CG 3.37Å; K111-K115 PolarHBondContact O-N 3.29Å
112L97.1Very high96.6Very high108 Ų108105.2 Ų105.257%0.56551%0.513SS*.Hα-helixtrans-68.1-42.7175.7-73169.2000110.9G108 L109 E110 K115 R116G108-L112 WeakPolarHBondContact O-CG 3.45Å; G108-L112 PolarHBondContact O-N 2.88Å; G108-L112 VanDerWaalsContact O-N 3.08Å; L109-L112 WeakPolarHBondContact O-CB 3.24Å; L109-L112 PolarHBondContact O-N 2.95Å; E110-L112 VanDerWaalsContact C-N 3.34Å; E110-L112 PolarHBondContact O-N 3.36Å; L112-K115 WeakPolarHBondContact O-CB 3.22Å; L112-K115 PolarHBondContact O-N 3.32Å; L112-R116 PolarHBondContact O-N 3.47Å
113D96.7Very high96.5Very high89 Ų89107.7 Ų107.748%0.47652%0.519SS..Hα-helixtrans-64.2-45.9177.1-72.4-23.7000111.6L109 E110 K115 R116 Q117L109-D113 PolarHBondContact O-N 3.28Å; E110-D113 PolarHBondContact O-N 2.8Å; D113-K115 VanDerWaalsContact C-N 3.31Å; D113-K115 PolarHBondContact O-N 2.97Å; D113-R116 WeakPolarHBondContact O-CB 3.23Å; D113-R116 PolarHBondContact O-N 3.41Å; D113-R116 VanDerWaalsContact O-N 3.15Å; D113-Q117 WeakPolarHBondContact O-CB 3.32Å; D113-Q117 WeakPolarHBondContact O-CG 3.46Å; D113-Q117 PolarHBondContact O-N 3.33Å
114L96.9Very high96.5Very high110 Ų110108.5 Ų108.558%0.57652%0.52SS*.Hα-helixtrans-61.4-38.6174.8-74.8171.7000112.2E110 K118E110-L114 WeakPolarHBondContact O-CB 3.37Å; E110-L114 VanDerWaalsContact O-CG 3.28Å; E110-L114 WeakPolarHBondContact O-CG 3.46Å; E110-L114 PolarHBondContact O-N 2.96Å; L114-K118 WeakPolarHBondContact O-CB 3.18Å; L114-K118 PolarHBondContact O-N 3.03Å
115K96.2Very high96.5Very high108 Ų108107 Ų10747%0.4751%0.512SS..Hα-helixtrans-62.3-46.1173.4-81.6176.9175.6-169.40111.2K111 L112 D113 K118 E119K111-K115 WeakPolarHBondContact O-CB 3.38Å; K111-K115 VanDerWaalsContact O-CG 3.24Å; K111-K115 WeakPolarHBondContact O-CG 3.37Å; K111-K115 PolarHBondContact O-N 3.29Å; L112-K115 WeakPolarHBondContact O-CB 3.22Å; L112-K115 PolarHBondContact O-N 3.32Å; D113-K115 VanDerWaalsContact C-N 3.31Å; D113-K115 PolarHBondContact O-N 2.97Å; K115-K118 PolarHBondContact O-N 3.42Å; K115-E119 WeakPolarHBondContact O-CG 3.34Å; K115-E119 PolarHBondContact O-N 3.19Å
116R97.1Very high96.5Very high184 Ų184107.1 Ų107.169%0.69451%0.512SS*.Hα-helixtrans-62.3-44.5178.2-166.3-179.2-158.3147.54.8111.7L112 D113 E119 Q120L112-R116 PolarHBondContact O-N 3.47Å; D113-R116 WeakPolarHBondContact O-CB 3.23Å; D113-R116 PolarHBondContact O-N 3.41Å; D113-R116 VanDerWaalsContact O-N 3.15Å; R116-E119 PolarHBondContact O-N 3.47Å; R116-Q120 WeakPolarHBondContact O-CB 3.32Å; R116-Q120 PolarHBondContact O-N 2.96Å
117Q96.3Very high96.5Very high122 Ų122106.6 Ų106.657%0.5752%0.515SS*.Hα-helixtrans-61.3-43.9175.4-72.9176.65.700111.5D113 Q120 A121D113-Q117 WeakPolarHBondContact O-CB 3.32Å; D113-Q117 WeakPolarHBondContact O-CG 3.46Å; D113-Q117 PolarHBondContact O-N 3.33Å; Q117-Q120 PolarHBondContact O-N 3.04Å; Q117-A121 WeakPolarHBondContact O-CB 3.43Å; Q117-A121 PolarHBondContact O-N 3.36Å
118K96.5Very high96.5Very high142 Ų142107.9 Ų107.962%0.61752%0.521SS*.Hα-helixtrans-61.3-45.2175.6-178.5-175.1175.2-177.40111.8L114 K115 Q120 A121 L122L114-K118 WeakPolarHBondContact O-CB 3.18Å; L114-K118 PolarHBondContact O-N 3.03Å; K115-K118 PolarHBondContact O-N 3.42Å; K118-Q120 VanDerWaalsContact C-N 3.34Å; K118-A121 PolarHBondContact O-N 2.99Å; K118-L122 HydrophobicContact CG-CD1 4.29Å; K118-L122 WeakPolarHBondContact O-CB 3.31Å; K118-L122 VanDerWaalsContact O-CG 3.3Å; K118-L122 WeakPolarHBondContact O-CG 3.34Å; K118-L122 PolarHBondContact O-N 3.37Å
119E96.2Very high96.5Very high104 Ų104112 Ų11249%0.48653%0.53SS..Hα-helixtrans-62.9-41177.2-74.6173.8-167.900111.8K115 R116 L122 R123K115-E119 WeakPolarHBondContact O-CG 3.34Å; K115-E119 PolarHBondContact O-N 3.19Å; R116-E119 PolarHBondContact O-N 3.47Å; E119-L122 PolarHBondContact O-N 2.88Å; E119-R123 WeakPolarHBondContact O-CG 3.37Å; E119-R123 PolarHBondContact O-N 2.89Å
120Q96.1Very high96.5Very high106 Ų106114.8 Ų114.850%0.49553%0.533SS..Hα-helixtrans-64.1-48.1175-178.7173.7-12.100111.6R116 Q117 K118 L122 R123 E124R116-Q120 WeakPolarHBondContact O-CB 3.32Å; R116-Q120 PolarHBondContact O-N 2.96Å; Q117-Q120 PolarHBondContact O-N 3.04Å; K118-Q120 VanDerWaalsContact C-N 3.34Å; Q120-L122 VanDerWaalsContact C-N 3.28Å; Q120-L122 PolarHBondContact O-N 3.3Å; Q120-R123 WeakPolarHBondContact O-CB 3.42Å; Q120-R123 PolarHBondContact O-N 2.85Å; Q120-R123 VanDerWaalsContact O-N 3.1Å; Q120-E124 WeakPolarHBondContact CG-OE1 3.14Å; Q120-E124 PolarHBondContact NE2-OE1 2.96Å; Q120-E124 WeakPolarHBondContact O-CG 3.42Å; Q120-E124 PolarHBondContact O-N 3.34Å
121A96Very high96.5Very high46 Ų46112.4 Ų112.438%0.3853%0.527SS..Hα-helixtrans-60.1-37.7177.100000112Q117 K118 E124 V125Q117-A121 WeakPolarHBondContact O-CB 3.43Å; Q117-A121 PolarHBondContact O-N 3.36Å; K118-A121 PolarHBondContact O-N 2.99Å; A121-E124 PolarHBondContact O-N 3.46Å; A121-V125 WeakPolarHBondContact O-CB 3.33Å; A121-V125 VanDerWaalsContact O-CG2 3.28Å; A121-V125 WeakPolarHBondContact O-CG2 3.24Å; A121-V125 PolarHBondContact O-N 3.44Å
122L96.6Very high96.5Very high91 Ų91113 Ų11348%0.47653%0.532SS..Hα-helixtrans-63.4-44.5173.9-76.1170.8000111.9K118 E119 Q120 E124 V125 E126K118-L122 HydrophobicContact CG-CD1 4.29Å; K118-L122 WeakPolarHBondContact O-CB 3.31Å; K118-L122 VanDerWaalsContact O-CG 3.3Å; K118-L122 WeakPolarHBondContact O-CG 3.34Å; K118-L122 PolarHBondContact O-N 3.37Å; E119-L122 PolarHBondContact O-N 2.88Å; Q120-L122 VanDerWaalsContact C-N 3.28Å; Q120-L122 PolarHBondContact O-N 3.3Å; L122-E124 VanDerWaalsContact C-N 3.33Å; L122-E124 PolarHBondContact O-N 3.05Å; L122-V125 PolarHBondContact O-N 3.34Å; L122-E126 WeakPolarHBondContact O-CG 3.44Å; L122-E126 PolarHBondContact O-N 3.08Å
123R96.3Very high96.4Very high168 Ų168113.8 Ų113.863%0.63453%0.533SS*.Hα-helixtrans-62.4-40.6175.8-69.4172.5-169.9168.47111.9E119 Q120 E126 H127E119-R123 WeakPolarHBondContact O-CG 3.37Å; E119-R123 PolarHBondContact O-N 2.89Å; Q120-R123 WeakPolarHBondContact O-CB 3.42Å; Q120-R123 PolarHBondContact O-N 2.85Å; Q120-R123 VanDerWaalsContact O-N 3.1Å; R123-E126 PolarHBondContact O-N 2.98Å; R123-H127 WeakPolarHBondContact O-CB 3.29Å; R123-H127 PolarHBondContact O-N 3.13Å
124E96.3Very high96.4Very high100 Ų100114.1 Ų114.147%0.46753%0.531SS..Hα-helixtrans-63.9-43.7175.9-72.7171.3-16800111.5Q120 A121 L122 E126 H127 L128Q120-E124 WeakPolarHBondContact CG-OE1 3.14Å; Q120-E124 PolarHBondContact NE2-OE1 2.96Å; Q120-E124 WeakPolarHBondContact O-CG 3.42Å; Q120-E124 PolarHBondContact O-N 3.34Å; A121-E124 PolarHBondContact O-N 3.46Å; L122-E124 VanDerWaalsContact C-N 3.33Å; L122-E124 PolarHBondContact O-N 3.05Å; E124-E126 PolarHBondContact O-N 3.11Å; E124-H127 PolarHBondContact O-N 3.43Å; E124-L128 WeakPolarHBondContact O-CB 3.45Å; E124-L128 VanDerWaalsContact O-CG 3.31Å; E124-L128 WeakPolarHBondContact O-CG 3.24Å; E124-L128 PolarHBondContact O-N 2.61Å
125V96.4Very high96.4Very high71 Ų71114.9 Ų114.943%0.4353%0.534SS..Hα-helixtrans-63.1-42174.9168.90000111.5A121 L122 L128 K129A121-V125 WeakPolarHBondContact O-CB 3.33Å; A121-V125 VanDerWaalsContact O-CG2 3.28Å; A121-V125 WeakPolarHBondContact O-CG2 3.24Å; A121-V125 PolarHBondContact O-N 3.44Å; L122-V125 PolarHBondContact O-N 3.34Å; V125-L128 PolarHBondContact O-N 3.3Å; V125-K129 HydrophobicContact CG1-CD 4.3Å; V125-K129 WeakPolarHBondContact O-CB 3.22Å; V125-K129 VanDerWaalsContact O-CG 3.32Å; V125-K129 WeakPolarHBondContact O-CG 3.46Å; V125-K129 PolarHBondContact O-N 3.46Å
126E95.9Very high96.5Very high100 Ų100112.6 Ų112.647%0.46754%0.535SS..Hα-helixtrans-62.8-42.5175.1-75.3176.2-174.300112L122 R123 E124 K129 R130L122-E126 WeakPolarHBondContact O-CG 3.44Å; L122-E126 PolarHBondContact O-N 3.08Å; R123-E126 PolarHBondContact O-N 2.98Å; E124-E126 PolarHBondContact O-N 3.11Å; E126-K129 PolarHBondContact O-N 3.4Å; E126-R130 WeakPolarHBondContact O-CG 3.12Å; E126-R130 PolarHBondContact O-N 3.43Å
127H96.4Very high96.5Very high119 Ų119109.5 Ų109.555%0.55153%0.528SS*.Hα-helixtrans-61.5-48.8175.1-179.4-87.1000111.3R123 E124 K129 R130 C131R123-H127 WeakPolarHBondContact O-CB 3.29Å; R123-H127 PolarHBondContact O-N 3.13Å; E124-H127 PolarHBondContact O-N 3.43Å; H127-K129 VanDerWaalsContact C-N 3.3Å; H127-K129 PolarHBondContact O-N 2.88Å; H127-R130 PolarHBondContact O-N 2.89Å; H127-R130 VanDerWaalsContact O-N 3.14Å; H127-C131 PolarHBondContact CE1-SG 3.44Å; H127-C131 PolarHBondContact O-N 3.49Å; H127-C131 PolarHBondContact O-SG 2.96Å
128L96.9Very high96.5Very high117 Ų117107 Ų10761%0.61352%0.519SS*.Hα-helixtrans-60.6-37.8177.1-72.3173.5000112.3E124 V125 C131 Q132E124-L128 WeakPolarHBondContact O-CB 3.45Å; E124-L128 VanDerWaalsContact O-CG 3.31Å; E124-L128 WeakPolarHBondContact O-CG 3.24Å; E124-L128 PolarHBondContact O-N 2.61Å; V125-L128 PolarHBondContact O-N 3.3Å; L128-C131 PolarHBondContact O-N 3.04Å; L128-Q132 WeakPolarHBondContact O-CB 3.2Å; L128-Q132 PolarHBondContact O-N 2.97Å
129K96.6Very high96.5Very high121 Ų121108 Ų10853%0.52652%0.523SS..Hα-helixtrans-62.5-44173.6-78.3176.8179.9-179.50112.1V125 E126 H127 Q132 Q133V125-K129 HydrophobicContact CG1-CD 4.3Å; V125-K129 WeakPolarHBondContact O-CB 3.22Å; V125-K129 VanDerWaalsContact O-CG 3.32Å; V125-K129 WeakPolarHBondContact O-CG 3.46Å; V125-K129 PolarHBondContact O-N 3.46Å; E126-K129 PolarHBondContact O-N 3.4Å; H127-K129 VanDerWaalsContact C-N 3.3Å; H127-K129 PolarHBondContact O-N 2.88Å; K129-Q132 PolarHBondContact O-N 3.29Å; K129-Q133 WeakPolarHBondContact O-CG 3.28Å; K129-Q133 PolarHBondContact O-N 2.98Å
130R96.7Very high96.6Very high168 Ų168106 Ų10663%0.63452%0.524SS*.Hα-helixtrans-63.4-44.8175.6-68179.7-159.6-179.86.7111.3E126 H127 Q132 Q133 Q134E126-R130 WeakPolarHBondContact O-CG 3.12Å; E126-R130 PolarHBondContact O-N 3.43Å; H127-R130 PolarHBondContact O-N 2.89Å; H127-R130 VanDerWaalsContact O-N 3.14Å; R130-Q132 VanDerWaalsContact C-N 3.33Å; R130-Q132 PolarHBondContact O-N 2.91Å; R130-Q133 PolarHBondContact O-N 3.45Å; R130-Q134 PolarHBondContact O-N 3.16Å
131C96.4Very high96.7Very high55 Ų55103.7 Ų103.737%0.37252%0.52SS..Hα-helixtrans-59.4-43.8174.2-69.30000111.6H127 L128 Q133 Q134 M135H127-C131 PolarHBondContact CE1-SG 3.44Å; H127-C131 PolarHBondContact O-N 3.49Å; H127-C131 PolarHBondContact O-SG 2.96Å; L128-C131 PolarHBondContact O-N 3.04Å; C131-Q133 PolarHBondContact O-N 3.28Å; C131-Q134 PolarHBondContact O-N 3.49Å; C131-M135 WeakPolarHBondContact O-CB 3.34Å; C131-M135 VanDerWaalsContact O-CG 3.24Å; C131-M135 WeakPolarHBondContact O-CG 3.49Å; C131-M135 PolarHBondContact O-N 3.09Å
132Q96.3Very high96.8Very high144 Ų144105.4 Ų105.467%0.67353%0.525SS*.Hα-helixtrans-62.9-40.8177.7-174.2-178.346.900112.2L128 K129 R130 M135 A136L128-Q132 WeakPolarHBondContact O-CB 3.2Å; L128-Q132 PolarHBondContact O-N 2.97Å; K129-Q132 PolarHBondContact O-N 3.29Å; R130-Q132 VanDerWaalsContact C-N 3.33Å; R130-Q132 PolarHBondContact O-N 2.91Å; Q132-M135 PolarHBondContact O-N 2.87Å; Q132-A136 WeakPolarHBondContact O-CB 3.23Å; Q132-A136 PolarHBondContact O-N 2.95Å
133Q96.6Very high96.8Very high124 Ų124108.3 Ų108.358%0.57953%0.534SS*.Hα-helixtrans-62.6-48.6175-74.7171.5-17.100111.2K129 R130 C131 M135 A136 E137K129-Q133 WeakPolarHBondContact O-CG 3.28Å; K129-Q133 PolarHBondContact O-N 2.98Å; R130-Q133 PolarHBondContact O-N 3.45Å; C131-Q133 PolarHBondContact O-N 3.28Å; Q133-M135 VanDerWaalsContact C-N 3.33Å; Q133-M135 PolarHBondContact O-N 2.84Å; Q133-A136 WeakPolarHBondContact O-CB 3.36Å; Q133-A136 PolarHBondContact O-N 3.31Å; Q133-E137 WeakPolarHBondContact O-CG 3.16Å; Q133-E137 PolarHBondContact O-N 3.26Å
134Q96.6Very high96.9Very high96 Ų96103.2 Ų103.245%0.44953%0.528SS..Hα-helixtrans-57.7-46.1176-1736356.100111.6R130 C131 A136 E137 D138R130-Q134 PolarHBondContact O-N 3.16Å; C131-Q134 PolarHBondContact O-N 3.49Å; Q134-A136 VanDerWaalsContact C-N 3.25Å; Q134-A136 PolarHBondContact O-N 3.43Å; Q134-E137 PolarHBondContact O-N 3.06Å; Q134-D138 PolarHBondContact NE2-OD1 3.46Å; Q134-D138 WeakPolarHBondContact O-CB 3.4Å; Q134-D138 PolarHBondContact O-N 2.97Å
135M96.9Very high97Very high127 Ų127103.9 Ų103.963%0.62653%0.531SS*.Hα-helixtrans-62.4-32.6177.2-69.6-58.3-58.500112.6C131 Q132 Q133 K139C131-M135 WeakPolarHBondContact O-CB 3.34Å; C131-M135 VanDerWaalsContact O-CG 3.24Å; C131-M135 WeakPolarHBondContact O-CG 3.49Å; C131-M135 PolarHBondContact O-N 3.09Å; Q132-M135 PolarHBondContact O-N 2.87Å; Q133-M135 VanDerWaalsContact C-N 3.33Å; Q133-M135 PolarHBondContact O-N 2.84Å; M135-K139 VanDerWaalsContact O-CB 3.23Å; M135-K139 WeakPolarHBondContact O-CB 3.32Å; M135-K139 PolarHBondContact O-N 3.08Å
136A96.4Very high97.1Very high60 Ų60104 Ų10450%0.49653%0.532SS..Hα-helixtrans-71.7-40175.400000111.9Q132 Q133 Q134 K139 A140Q132-A136 WeakPolarHBondContact O-CB 3.23Å; Q132-A136 PolarHBondContact O-N 2.95Å; Q133-A136 WeakPolarHBondContact O-CB 3.36Å; Q133-A136 PolarHBondContact O-N 3.31Å; Q134-A136 VanDerWaalsContact C-N 3.25Å; Q134-A136 PolarHBondContact O-N 3.43Å; A136-K139 PolarHBondContact O-N 2.97Å; A136-A140 WeakPolarHBondContact O-CB 3.27Å; A136-A140 PolarHBondContact O-N 3.45Å
137E97.2Very high97.2Very high118 Ų118103.3 Ų103.355%0.55153%0.534SS*.Hα-helixtrans-64-47173.8-71.2174.3-169.800111.3Q133 Q134 K139 A140 S141Q133-E137 WeakPolarHBondContact O-CG 3.16Å; Q133-E137 PolarHBondContact O-N 3.26Å; Q134-E137 PolarHBondContact O-N 3.06Å; E137-K139 VanDerWaalsContact C-N 3.34Å; E137-K139 PolarHBondContact O-N 3.49Å; E137-A140 PolarHBondContact O-N 3.43Å; E137-A140 VanDerWaalsContact O-N 3.13Å; E137-S141 WeakPolarHBondContact O-CB 3.46Å; E137-S141 PolarHBondContact O-N 2.96Å
138D97.1Very high97.3Very high70 Ų70100.7 Ų100.737%0.37453%0.529SS..Hα-helixtrans-61.2-43.6176.8-66.2-16.3000110.8Q134 A140 S141 V142Q134-D138 PolarHBondContact NE2-OD1 3.46Å; Q134-D138 WeakPolarHBondContact O-CB 3.4Å; Q134-D138 PolarHBondContact O-N 2.97Å; D138-A140 VanDerWaalsContact C-N 3.33Å; D138-A140 PolarHBondContact O-N 2.83Å; D138-S141 PolarHBondContact O-N 3.3Å; D138-V142 WeakPolarHBondContact O-CB 3.36Å; D138-V142 VanDerWaalsContact O-CG2 3.31Å; D138-V142 WeakPolarHBondContact O-CG2 3.39Å; D138-V142 PolarHBondContact O-N 2.73Å
139K97.4Very high97.3Very high164 Ų164100.1 Ų100.171%0.71353%0.527SS*.Hα-helixtrans-60.1-42.7174.3-179.7-178.3178.6-179.70111.8M135 A136 E137 K143M135-K139 VanDerWaalsContact O-CB 3.23Å; M135-K139 WeakPolarHBondContact O-CB 3.32Å; M135-K139 PolarHBondContact O-N 3.08Å; A136-K139 PolarHBondContact O-N 2.97Å; E137-K139 VanDerWaalsContact C-N 3.34Å; E137-K139 PolarHBondContact O-N 3.49Å; K139-K143 VanDerWaalsContact O-CB 3.29Å; K139-K143 WeakPolarHBondContact O-CB 3.39Å; K139-K143 PolarHBondContact O-N 3.07Å
140A97.3Very high97.4Very high60 Ų6099.3 Ų99.350%0.49653%0.527SS..Hα-helixtrans-67-42.417800000111.5A136 E137 D138 K143 A144A136-A140 WeakPolarHBondContact O-CB 3.27Å; A136-A140 PolarHBondContact O-N 3.45Å; E137-A140 PolarHBondContact O-N 3.43Å; E137-A140 VanDerWaalsContact O-N 3.13Å; D138-A140 VanDerWaalsContact C-N 3.33Å; D138-A140 PolarHBondContact O-N 2.83Å; A140-K143 PolarHBondContact O-N 3.33Å; A140-A144 WeakPolarHBondContact O-CB 3.42Å; A140-A144 PolarHBondContact O-N 3.47Å
141S98.1Very high97.5Very high58 Ų5892.9 Ų92.941%0.40651%0.514SS..Hα-helixtrans-61.1-49.9176.1179.80000111.6E137 D138 K143 A144 Q145E137-S141 WeakPolarHBondContact O-CB 3.46Å; E137-S141 PolarHBondContact O-N 2.96Å; D138-S141 PolarHBondContact O-N 3.3Å; S141-K143 VanDerWaalsContact C-N 3.32Å; S141-K143 PolarHBondContact O-N 2.95Å; S141-A144 WeakPolarHBondContact O-CB 3.5Å; S141-A144 PolarHBondContact O-N 2.82Å; S141-A144 VanDerWaalsContact O-N 3.16Å; S141-Q145 WeakPolarHBondContact O-CG 3.48Å; S141-Q145 PolarHBondContact O-N 3.3Å; S141-Q145 PolarHBondContact OG-NE2 3.18Å
142V98.1Very high97.6Very high82 Ų8295.5 Ų95.550%0.49752%0.52SS..Hα-helixtrans-61.4-42176.6171.80000110.8D138 A144 Q145 V146D138-V142 WeakPolarHBondContact O-CB 3.36Å; D138-V142 VanDerWaalsContact O-CG2 3.31Å; D138-V142 WeakPolarHBondContact O-CG2 3.39Å; D138-V142 PolarHBondContact O-N 2.73Å; V142-A144 VanDerWaalsContact C-N 3.33Å; V142-A144 PolarHBondContact O-N 2.93Å; V142-Q145 PolarHBondContact O-N 2.74Å; V142-V146 HydrophobicContact CG1-CG2 4.28Å; V142-V146 WeakPolarHBondContact O-CB 3.41Å; V142-V146 VanDerWaalsContact O-CG2 3.31Å; V142-V146 WeakPolarHBondContact O-CG2 3.36Å; V142-V146 PolarHBondContact O-N 3.45Å
143K98.1Very high97.7Very high152 Ų15293.9 Ų93.966%0.66152%0.516SS*.Hα-helixtrans-61.9-41.1176.2-171.5-177.3178.8-173.10111.8K139 A140 S141 T147K139-K143 VanDerWaalsContact O-CB 3.29Å; K139-K143 WeakPolarHBondContact O-CB 3.39Å; K139-K143 PolarHBondContact O-N 3.07Å; A140-K143 PolarHBondContact O-N 3.33Å; S141-K143 VanDerWaalsContact C-N 3.32Å; S141-K143 PolarHBondContact O-N 2.95Å; K143-T147 WeakPolarHBondContact O-CB 3.38Å; K143-T147 PolarHBondContact O-N 3.45Å; K143-T147 PolarHBondContact O-OG1 3.17Å
144A97.7Very high97.7Very high61 Ų6194.4 Ų94.450%0.50452%0.519SS..Hα-helixtrans-64.3-44.817600000111.4A140 S141 V142 T147 S148A140-A144 WeakPolarHBondContact O-CB 3.42Å; A140-A144 PolarHBondContact O-N 3.47Å; S141-A144 WeakPolarHBondContact O-CB 3.5Å; S141-A144 PolarHBondContact O-N 2.82Å; S141-A144 VanDerWaalsContact O-N 3.16Å; V142-A144 VanDerWaalsContact C-N 3.33Å; V142-A144 PolarHBondContact O-N 2.93Å; A144-T147 PolarHBondContact O-N 3.41Å; A144-S148 PolarHBondContact O-N 3.36Å
145Q98.3Very high97.8Very high114 Ų11494.6 Ų94.653%0.53352%0.519SS..Hα-helixtrans-61.1-47176.4-70.7175.340.500112.1S141 V142 T147 S148 L149S141-Q145 WeakPolarHBondContact O-CG 3.48Å; S141-Q145 PolarHBondContact O-N 3.3Å; S141-Q145 PolarHBondContact OG-NE2 3.18Å; V142-Q145 PolarHBondContact O-N 2.74Å; Q145-T147 VanDerWaalsContact C-N 3.29Å; Q145-T147 PolarHBondContact O-N 3.13Å; Q145-S148 PolarHBondContact O-N 2.84Å; Q145-L149 WeakPolarHBondContact O-CG 3.46Å; Q145-L149 PolarHBondContact O-N 3.42Å
146V98.3Very high97.9Very high74 Ų7492 Ų9245%0.44851%0.514SS..Hα-helixtrans-60.7-40.9176.2170.70000110.9V142 L149 L150V142-V146 HydrophobicContact CG1-CG2 4.28Å; V142-V146 WeakPolarHBondContact O-CB 3.41Å; V142-V146 VanDerWaalsContact O-CG2 3.31Å; V142-V146 WeakPolarHBondContact O-CG2 3.36Å; V142-V146 PolarHBondContact O-N 3.45Å; V146-L149 PolarHBondContact O-N 3.49Å; V146-L150 HydrophobicContact CG1-CD1 3.94Å; V146-L150 HydrophobicContact CG1-CG 4.39Å; V146-L150 WeakPolarHBondContact O-CB 3.42Å; V146-L150 VanDerWaalsContact O-CG 3.25Å; V146-L150 WeakPolarHBondContact O-CG 3.48Å; V146-L150 PolarHBondContact O-N 3.48Å
147T97.6Very high98Very high85 Ų8594.2 Ų94.252%0.52151%0.514SS..Hα-helixtrans-65.3-41177.5-52.70000111.4K143 A144 Q145 L150 G151K143-T147 WeakPolarHBondContact O-CB 3.38Å; K143-T147 PolarHBondContact O-N 3.45Å; K143-T147 PolarHBondContact O-OG1 3.17Å; A144-T147 PolarHBondContact O-N 3.41Å; Q145-T147 VanDerWaalsContact C-N 3.29Å; Q145-T147 PolarHBondContact O-N 3.13Å; T147-L150 PolarHBondContact O-N 3.49Å; T147-G151 PolarHBondContact O-N 2.85Å
148S98.3Very high98Very high64 Ų6491.6 Ų91.645%0.44851%0.509SS..Hα-helixtrans-62-50.5175.3-165.60000111.4A144 Q145 L150 G151 E152A144-S148 PolarHBondContact O-N 3.36Å; Q145-S148 PolarHBondContact O-N 2.84Å; S148-L150 VanDerWaalsContact C-N 3.31Å; S148-L150 PolarHBondContact O-N 3.49Å; S148-G151 WeakPolarHBondContact O-CA 3.44Å; S148-G151 PolarHBondContact O-N 3.33Å; S148-E152 WeakPolarHBondContact O-CG 3.33Å; S148-E152 PolarHBondContact O-N 2.88Å; S148-E152 PolarHBondContact OG-OE1 3.12Å; S148-E152 VanDerWaalsContact OG-OE1 3.11Å
149L98.4Very high98.1Very high106 Ų10696 Ų9656%0.55552%0.52SS*.Hα-helixtrans-62.2-37.4179.8-71173.8000112.3Q145 V146 G151 E152 L153Q145-L149 WeakPolarHBondContact O-CG 3.46Å; Q145-L149 PolarHBondContact O-N 3.42Å; V146-L149 PolarHBondContact O-N 3.49Å; L149-G151 VanDerWaalsContact C-N 3.35Å; L149-E152 PolarHBondContact O-N 2.83Å; L149-L153 VanDerWaalsContact O-CB 3.27Å; L149-L153 WeakPolarHBondContact O-CB 3.5Å; L149-L153 PolarHBondContact O-N 3.2Å
150L98.2Very high98.1Very high103 Ų10393.7 Ų93.754%0.53952%0.515SS..Hα-helixtrans-64.1-40.5173-76.2171.5000111.8V146 T147 S148 L153 Q154V146-L150 HydrophobicContact CG1-CD1 3.94Å; V146-L150 HydrophobicContact CG1-CG 4.39Å; V146-L150 WeakPolarHBondContact O-CB 3.42Å; V146-L150 VanDerWaalsContact O-CG 3.25Å; V146-L150 WeakPolarHBondContact O-CG 3.48Å; V146-L150 PolarHBondContact O-N 3.48Å; T147-L150 PolarHBondContact O-N 3.49Å; S148-L150 VanDerWaalsContact C-N 3.31Å; S148-L150 PolarHBondContact O-N 3.49Å; L150-L153 PolarHBondContact O-N 2.82Å; L150-Q154 WeakPolarHBondContact O-CB 3.47Å; L150-Q154 PolarHBondContact O-N 3.39Å
151G98.3Very high98.2Very high34 Ų3495.3 Ų95.335%0.35151%0.512SS..Hα-helixtrans-62.7-48.1174.600000112.4T147 S148 L149 L153 Q154 E155T147-G151 PolarHBondContact O-N 2.85Å; S148-G151 WeakPolarHBondContact O-CA 3.44Å; S148-G151 PolarHBondContact O-N 3.33Å; L149-G151 VanDerWaalsContact C-N 3.35Å; G151-L153 VanDerWaalsContact C-N 3.34Å; G151-L153 PolarHBondContact O-N 3.07Å; G151-Q154 PolarHBondContact O-N 2.94Å; G151-E155 WeakPolarHBondContact O-CB 3.49Å; G151-E155 PolarHBondContact O-N 3.09Å
152E98Very high98.2Very high109 Ų10995.2 Ų95.251%0.50952%0.515SS..Hα-helixtrans-61.1-41.5176.6-71.5168.2-141.900111.9S148 L149 E155 S156S148-E152 WeakPolarHBondContact O-CG 3.33Å; S148-E152 PolarHBondContact O-N 2.88Å; S148-E152 PolarHBondContact OG-OE1 3.12Å; S148-E152 VanDerWaalsContact OG-OE1 3.11Å; L149-E152 PolarHBondContact O-N 2.83Å; E152-E155 PolarHBondContact O-N 3.46Å; E152-S156 VanDerWaalsContact O-CB 3.25Å; E152-S156 WeakPolarHBondContact O-CB 3.47Å; E152-S156 PolarHBondContact O-N 3.49Å
153L98.4Very high98.2Very high111 Ų11193.5 Ų93.558%0.58151%0.509SS*.Hα-helixtrans-63.9-44.5176-178.962.8000111.5L149 L150 G151 S156 Q157L149-L153 VanDerWaalsContact O-CB 3.27Å; L149-L153 WeakPolarHBondContact O-CB 3.5Å; L149-L153 PolarHBondContact O-N 3.2Å; L150-L153 PolarHBondContact O-N 2.82Å; G151-L153 VanDerWaalsContact C-N 3.34Å; G151-L153 PolarHBondContact O-N 3.07Å; L153-S156 PolarHBondContact O-N 2.88Å; L153-Q157 WeakPolarHBondContact O-CB 3.38Å; L153-Q157 PolarHBondContact O-N 2.95Å
154Q98.3Very high98.2Very high135 Ų13589.1 Ų89.163%0.63150%0.496SS*.Hα-helixtrans-64.5-40.1177.8-175.9178.9-300111.8L150 G151 Q157 S158L150-Q154 WeakPolarHBondContact O-CB 3.47Å; L150-Q154 PolarHBondContact O-N 3.39Å; G151-Q154 PolarHBondContact O-N 2.94Å; Q154-Q157 PolarHBondContact O-N 3.44Å; Q154-S158 WeakPolarHBondContact O-CB 3.36Å; Q154-S158 PolarHBondContact O-N 2.85Å; Q154-S158 PolarHBondContact O-OG 2.9Å
155E98.3Very high98.2Very high100 Ų10092.8 Ų92.847%0.46750%0.5SS..Hα-helixtrans-65.4-46.2175.1-175177.4-170.100111.2G151 E152 Q157 S158 R159G151-E155 WeakPolarHBondContact O-CB 3.49Å; G151-E155 PolarHBondContact O-N 3.09Å; E152-E155 PolarHBondContact O-N 3.46Å; E155-Q157 VanDerWaalsContact C-N 3.31Å; E155-Q157 PolarHBondContact O-N 3.09Å; E155-S158 PolarHBondContact O-N 3.13Å; E155-R159 WeakPolarHBondContact O-CG 3.49Å; E155-R159 PolarHBondContact O-N 3.32Å; E155-R159 IonicContact OE1-CZ 2.82Å; E155-R159 IonicContact OE1-NE 2.7Å; E155-R159 PolarHBondContact OE1-NE 2.92Å; E155-R159 IonicContact OE1-NH2 3.79Å; E155-R159 PolarHBondContact OE1-NH2 3.44Å; E155-R159 IonicContact OE2-NH2 2.63Å
156S98Very high98.2Very high73 Ų7393.4 Ų93.451%0.5150%0.503SS..Hα-helixtrans-57.6-44.5175-177.20000111.5E152 L153 R159 L160E152-S156 VanDerWaalsContact O-CB 3.25Å; E152-S156 WeakPolarHBondContact O-CB 3.47Å; E152-S156 PolarHBondContact O-N 3.49Å; L153-S156 PolarHBondContact O-N 2.88Å; S156-R159 PolarHBondContact O-N 2.98Å; S156-L160 WeakPolarHBondContact O-CB 3.31Å; S156-L160 PolarHBondContact O-N 3.34Å
157Q98.2Very high98.2Very high105 Ų10593.2 Ų93.249%0.49150%0.504SS..Hα-helixtrans-62.1-44.9175.6-178.7169.1-1.900111.8L153 Q154 E155 R159 L160 E161L153-Q157 WeakPolarHBondContact O-CB 3.38Å; L153-Q157 PolarHBondContact O-N 2.95Å; Q154-Q157 PolarHBondContact O-N 3.44Å; E155-Q157 VanDerWaalsContact C-N 3.31Å; E155-Q157 PolarHBondContact O-N 3.09Å; Q157-R159 VanDerWaalsContact C-N 3.32Å; Q157-R159 PolarHBondContact O-N 3.48Å; Q157-L160 PolarHBondContact O-N 3.41Å; Q157-E161 PolarHBondContact NE2-OE1 2.92Å; Q157-E161 WeakPolarHBondContact O-CG 3.28Å; Q157-E161 PolarHBondContact O-N 3.34Å
158S98.3Very high98.3Very high64 Ų6494.9 Ų94.945%0.44851%0.506SS..Hα-helixtrans-62-40.4177.5-57.10000111.8Q154 E155 E161 A162Q154-S158 WeakPolarHBondContact O-CB 3.36Å; Q154-S158 PolarHBondContact O-N 2.85Å; Q154-S158 PolarHBondContact O-OG 2.9Å; E155-S158 PolarHBondContact O-N 3.13Å; S158-E161 PolarHBondContact O-N 3.4Å; S158-A162 WeakPolarHBondContact O-CB 3.46Å; S158-A162 PolarHBondContact O-N 3.5Å
159R98.6Very high98.3Very high162 Ų16294.6 Ų94.661%0.61151%0.507SS*.Hα-helixtrans-65.3-42.2175.1-71.1175.4-175.8-170.42.8111.7E155 S156 Q157 A162 A163E155-R159 WeakPolarHBondContact O-CG 3.49Å; E155-R159 PolarHBondContact O-N 3.32Å; E155-R159 IonicContact OE1-CZ 2.82Å; E155-R159 IonicContact OE1-NE 2.7Å; E155-R159 PolarHBondContact OE1-NE 2.92Å; E155-R159 IonicContact OE1-NH2 3.79Å; E155-R159 PolarHBondContact OE1-NH2 3.44Å; E155-R159 IonicContact OE2-NH2 2.63Å; S156-R159 PolarHBondContact O-N 2.98Å; Q157-R159 VanDerWaalsContact C-N 3.32Å; Q157-R159 PolarHBondContact O-N 3.48Å; R159-A162 PolarHBondContact O-N 3.47Å; R159-A163 WeakPolarHBondContact O-CB 3.34Å; R159-A163 PolarHBondContact O-N 2.96Å
160L98.4Very high98.2Very high115 Ų11593.4 Ų93.460%0.60250%0.501SS*.Hα-helixtrans-63-44176.3179.263.6000111.6S156 Q157 A163 T164S156-L160 WeakPolarHBondContact O-CB 3.31Å; S156-L160 PolarHBondContact O-N 3.34Å; Q157-L160 PolarHBondContact O-N 3.41Å; L160-A163 PolarHBondContact O-N 3.44Å; L160-T164 WeakPolarHBondContact O-CB 3.48Å; L160-T164 PolarHBondContact O-N 2.92Å; L160-T164 PolarHBondContact O-OG1 3.36Å
161E98.5Very high98.2Very high94 Ų9493.4 Ų93.444%0.43950%0.498SS..Hα-helixtrans-62.9-41.4176.4-73.3175.1-165.500111.8Q157 S158 T164 K165Q157-E161 PolarHBondContact NE2-OE1 2.92Å; Q157-E161 WeakPolarHBondContact O-CG 3.28Å; Q157-E161 PolarHBondContact O-N 3.34Å; S158-E161 PolarHBondContact O-N 3.4Å; E161-T164 PolarHBondContact O-N 2.97Å; E161-K165 WeakPolarHBondContact O-CG 3.35Å; E161-K165 PolarHBondContact O-N 2.92Å
162A98.4Very high98.2Very high57 Ų5793.6 Ų93.647%0.47150%0.5SS..Hα-helixtrans-63.1-48.4174.900000111.9S158 R159 T164 K165 E166S158-A162 WeakPolarHBondContact O-CB 3.46Å; S158-A162 PolarHBondContact O-N 3.5Å; R159-A162 PolarHBondContact O-N 3.47Å; A162-T164 VanDerWaalsContact C-N 3.3Å; A162-T164 PolarHBondContact O-N 2.86Å; A162-K165 PolarHBondContact O-N 2.85Å; A162-E166 PolarHBondContact O-N 3.42Å
163A98.1Very high98.3Very high45 Ų4596.8 Ų96.837%0.37251%0.508SS..Hα-helixtrans-61.2-39.6176.900000111.8R159 L160 E166 C167R159-A163 WeakPolarHBondContact O-CB 3.34Å; R159-A163 PolarHBondContact O-N 2.96Å; L160-A163 PolarHBondContact O-N 3.44Å; A163-E166 PolarHBondContact O-N 2.86Å; A163-C167 WeakPolarHBondContact O-CB 3.38Å; A163-C167 PolarHBondContact O-N 2.88Å; A163-C167 PolarHBondContact O-SG 3.12Å; A163-C167 VanDerWaalsContact O-SG 3.35Å
164T98Very high98.2Very high61 Ų6194.4 Ų94.437%0.37450%0.504SS..Hα-helixtrans-63.4-43.4176.9-570000111.4L160 E161 A162 E166 C167 Q168L160-T164 WeakPolarHBondContact O-CB 3.48Å; L160-T164 PolarHBondContact O-N 2.92Å; L160-T164 PolarHBondContact O-OG1 3.36Å; E161-T164 PolarHBondContact O-N 2.97Å; A162-T164 VanDerWaalsContact C-N 3.3Å; A162-T164 PolarHBondContact O-N 2.86Å; T164-E166 VanDerWaalsContact C-N 3.34Å; T164-C167 PolarHBondContact O-N 2.63Å; T164-Q168 WeakPolarHBondContact O-CG 3.42Å; T164-Q168 PolarHBondContact O-N 2.71Å
165K98.4Very high98.3Very high138 Ų13896.4 Ų96.460%0.651%0.506SS*.Hα-helixtrans-63.3-40.4175.3-72.9171.2-175.5170.80111.8E161 A162 Q168 A169E161-K165 WeakPolarHBondContact O-CG 3.35Å; E161-K165 PolarHBondContact O-N 2.92Å; A162-K165 PolarHBondContact O-N 2.85Å; K165-Q168 PolarHBondContact O-N 3.25Å; K165-A169 WeakPolarHBondContact O-CB 3.3Å; K165-A169 PolarHBondContact O-N 3.35Å
166E98.3Very high98.3Very high126 Ų12694.6 Ų94.659%0.58951%0.508SS*.Hα-helixtrans-64.3-45.9175.7-174.6174.8-170.600111.6A162 A163 T164 Q168 A169 L170A162-E166 PolarHBondContact O-N 3.42Å; A163-E166 PolarHBondContact O-N 2.86Å; T164-E166 VanDerWaalsContact C-N 3.34Å; E166-Q168 VanDerWaalsContact C-N 3.34Å; E166-Q168 PolarHBondContact O-N 3.42Å; E166-A169 PolarHBondContact O-N 3.43Å; E166-A169 VanDerWaalsContact O-N 3.16Å; E166-L170 HydrophobicContact CG-CD1 4.09Å; E166-L170 HydrophobicContact CG-CG 4.4Å; E166-L170 WeakPolarHBondContact O-CB 3.43Å; E166-L170 WeakPolarHBondContact O-CG 3.32Å; E166-L170 PolarHBondContact O-N 3.22Å
167C98Very high98.3Very high70 Ų7093.7 Ų93.747%0.47351%0.505SS..Hα-helixtrans-56.4-47173.8-73.70000111.5A163 T164 A169 L170 E171A163-C167 WeakPolarHBondContact O-CB 3.38Å; A163-C167 PolarHBondContact O-N 2.88Å; A163-C167 PolarHBondContact O-SG 3.12Å; A163-C167 VanDerWaalsContact O-SG 3.35Å; T164-C167 PolarHBondContact O-N 2.63Å; C167-A169 VanDerWaalsContact C-N 3.33Å; C167-A169 PolarHBondContact O-N 2.97Å; C167-L170 PolarHBondContact O-N 3.48Å; C167-E171 WeakPolarHBondContact O-CB 3.38Å; C167-E171 WeakPolarHBondContact O-CG 3.45Å; C167-E171 PolarHBondContact O-N 3.01Å
168Q98.3Very high98.3Very high121 Ų12192.5 Ų92.557%0.56551%0.509SS*.Hα-helixtrans-60.5-41.1176.4-72.6172.8-1.600112.5T164 K165 E166 G172T164-Q168 WeakPolarHBondContact O-CG 3.42Å; T164-Q168 PolarHBondContact O-N 2.71Å; K165-Q168 PolarHBondContact O-N 3.25Å; E166-Q168 VanDerWaalsContact C-N 3.34Å; E166-Q168 PolarHBondContact O-N 3.42Å; Q168-G172 PolarHBondContact O-N 2.74Å
169A98.3Very high98.3Very high57 Ų5793.6 Ų93.647%0.47151%0.507SS..Hα-helixtrans-65.3-42.4176.500000111.9K165 E166 C167 G172 R173K165-A169 WeakPolarHBondContact O-CB 3.3Å; K165-A169 PolarHBondContact O-N 3.35Å; E166-A169 PolarHBondContact O-N 3.43Å; E166-A169 VanDerWaalsContact O-N 3.16Å; C167-A169 VanDerWaalsContact C-N 3.33Å; C167-A169 PolarHBondContact O-N 2.97Å; A169-G172 PolarHBondContact O-N 3.25Å; A169-R173 WeakPolarHBondContact O-CG 3.3Å; A169-R173 PolarHBondContact O-N 3.13Å
170L98Very high98.3Very high82 Ų8291.4 Ų91.443%0.42950%0.503SS..Hα-helixtrans-66.7-41.2176.7-70.3174.8000111.9E166 C167 R173 A174E166-L170 HydrophobicContact CG-CD1 4.09Å; E166-L170 HydrophobicContact CG-CG 4.4Å; E166-L170 WeakPolarHBondContact O-CB 3.43Å; E166-L170 WeakPolarHBondContact O-CG 3.32Å; E166-L170 PolarHBondContact O-N 3.22Å; C167-L170 PolarHBondContact O-N 3.48Å; L170-R173 PolarHBondContact O-N 2.85Å; L170-A174 WeakPolarHBondContact O-CB 3.39Å; L170-A174 PolarHBondContact O-N 3.11Å
171E98.1Very high98.3Very high102 Ų10288.1 Ų88.148%0.47749%0.492SS..Hα-helixtrans-60.7-43.9172.9-76.9180-164.100111.6C167 R173 A174 R175C167-E171 WeakPolarHBondContact O-CB 3.38Å; C167-E171 WeakPolarHBondContact O-CG 3.45Å; C167-E171 PolarHBondContact O-N 3.01Å; E171-R173 VanDerWaalsContact C-N 3.35Å; E171-R173 PolarHBondContact O-N 3.48Å; E171-A174 PolarHBondContact O-N 2.93Å; E171-R175 VanDerWaalsContact O-CG 3.31Å; E171-R175 WeakPolarHBondContact O-CG 3.41Å; E171-R175 PolarHBondContact O-N 2.94Å; E171-R175 IonicContact OE2-NH2 2.8Å
172G98.4Very high98.3Very high38 Ų3891.2 Ų91.239%0.39250%0.5SS..Hα-helixtrans-59.2-45174.800000112.2Q168 A169 R175 A176Q168-G172 PolarHBondContact O-N 2.74Å; A169-G172 PolarHBondContact O-N 3.25Å; G172-R175 PolarHBondContact O-N 2.99Å; G172-A176 PolarHBondContact O-N 2.7Å
173R98.5Very high98.2Very high176 Ų17693.4 Ų93.466%0.66450%0.501SS*.Hα-helixtrans-63.8-42.3175.4-72.5173.364.4-165.4-1.1112.3A169 L170 E171 A176 A177A169-R173 WeakPolarHBondContact O-CG 3.3Å; A169-R173 PolarHBondContact O-N 3.13Å; L170-R173 PolarHBondContact O-N 2.85Å; E171-R173 VanDerWaalsContact C-N 3.35Å; E171-R173 PolarHBondContact O-N 3.48Å; R173-A176 PolarHBondContact O-N 3.25Å; R173-A177 WeakPolarHBondContact O-CB 3.33Å; R173-A177 PolarHBondContact O-N 2.83Å
174A97.9Very high98.3Very high62 Ų6295.9 Ų95.951%0.51251%0.507SS..Hα-helixtrans-64.1-42.2177.800000111.6L170 E171 A177 S178L170-A174 WeakPolarHBondContact O-CB 3.39Å; L170-A174 PolarHBondContact O-N 3.11Å; E171-A174 PolarHBondContact O-N 2.93Å; A174-A177 PolarHBondContact O-N 3.05Å; A174-S178 WeakPolarHBondContact O-CB 3.33Å; A174-S178 PolarHBondContact O-N 3.45Å
175R98.4Very high98.3Very high176 Ų17698 Ų9866%0.66451%0.512SS*.Hα-helixtrans-61.4-46.9174-71.7177-166.1171.810111.7E171 G172 A177 S178 E179E171-R175 VanDerWaalsContact O-CG 3.31Å; E171-R175 WeakPolarHBondContact O-CG 3.41Å; E171-R175 PolarHBondContact O-N 2.94Å; E171-R175 IonicContact OE2-NH2 2.8Å; G172-R175 PolarHBondContact O-N 2.99Å; R175-A177 PolarHBondContact O-N 2.83Å; R175-S178 PolarHBondContact O-N 3.48Å; R175-E179 PolarHBondContact O-N 3.03Å
176A98.4Very high98.3Very high62 Ų6294.9 Ų94.951%0.51251%0.509SS..Hα-helixtrans-61.4-43.8177.500000112.2G172 R173 S178 E179 Q180G172-A176 PolarHBondContact O-N 2.7Å; R173-A176 PolarHBondContact O-N 3.25Å; A176-S178 VanDerWaalsContact C-N 3.35Å; A176-S178 PolarHBondContact O-N 3.21Å; A176-E179 PolarHBondContact O-N 2.85Å; A176-Q180 WeakPolarHBondContact O-CB 3.45Å; A176-Q180 PolarHBondContact O-N 3.32Å
177A98.3Very high98.3Very high54 Ų5494.5 Ų94.545%0.44651%0.507SS..Hα-helixtrans-64-38.9176.100000112.2R173 A174 R175 Q180 A181R173-A177 WeakPolarHBondContact O-CB 3.33Å; R173-A177 PolarHBondContact O-N 2.83Å; A174-A177 PolarHBondContact O-N 3.05Å; R175-A177 PolarHBondContact O-N 2.83Å; A177-Q180 PolarHBondContact O-N 3.15Å; A177-A181 WeakPolarHBondContact O-CB 3.5Å; A177-A181 PolarHBondContact O-N 3.37Å
178S98.3Very high98.3Very high81 Ų8197.9 Ų97.957%0.56651%0.51SS*.Hα-helixtrans-65.5-40.7175.8-171.30000112.2A174 R175 A176 A181 R182A174-S178 WeakPolarHBondContact O-CB 3.33Å; A174-S178 PolarHBondContact O-N 3.45Å; R175-S178 PolarHBondContact O-N 3.48Å; A176-S178 VanDerWaalsContact C-N 3.35Å; A176-S178 PolarHBondContact O-N 3.21Å; S178-A181 PolarHBondContact O-N 3.08Å; S178-R182 WeakPolarHBondContact O-CB 3.5Å; S178-R182 PolarHBondContact O-N 3.28Å
179E98.4Very high98.3Very high87 Ų8796.7 Ų96.741%0.40750%0.504SS..Hα-helixtrans-64.6-43.5175.9-168.868.6-144.300110.6R175 A176 A181 R182 Q183R175-E179 PolarHBondContact O-N 3.03Å; A176-E179 PolarHBondContact O-N 2.85Å; E179-A181 PolarHBondContact O-N 3.32Å; E179-R182 PolarHBondContact O-N 3.12Å; E179-R182 IonicContact OE1-CZ 3.54Å; E179-R182 IonicContact OE1-NE 2.79Å; E179-R182 PolarHBondContact OE1-NE 3.44Å; E179-R182 IonicContact OE1-NH2 3.47Å; E179-R182 PolarHBondContact OE1-NH2 3.06Å; E179-Q183 WeakPolarHBondContact O-CG 3.35Å; E179-Q183 PolarHBondContact O-N 3.42Å
180Q98.5Very high98.3Very high116 Ų11696.7 Ų96.754%0.54250%0.504SS..Hα-helixtrans-62.1-42.4176.1-173.5179.97.600112A176 A177 Q183 L184A176-Q180 WeakPolarHBondContact O-CB 3.45Å; A176-Q180 PolarHBondContact O-N 3.32Å; A177-Q180 PolarHBondContact O-N 3.15Å; Q180-Q183 PolarHBondContact O-N 2.94Å; Q180-L184 HydrophobicContact CG-CD1 4.37Å; Q180-L184 WeakPolarHBondContact O-CG 3.5Å; Q180-L184 PolarHBondContact O-N 3.49Å
181A97.9Very high98.3Very high45 Ų4597 Ų9737%0.37251%0.506SS..Hα-helixtrans-61.1-44.9175.700000111.4A177 S178 E179 Q183 L184 E185A177-A181 WeakPolarHBondContact O-CB 3.5Å; A177-A181 PolarHBondContact O-N 3.37Å; S178-A181 PolarHBondContact O-N 3.08Å; E179-A181 PolarHBondContact O-N 3.32Å; A181-Q183 VanDerWaalsContact C-N 3.32Å; A181-Q183 PolarHBondContact O-N 2.83Å; A181-L184 PolarHBondContact O-N 3.03Å; A181-E185 WeakPolarHBondContact O-CB 3.31Å; A181-E185 WeakPolarHBondContact O-CG 3.47Å; A181-E185 PolarHBondContact O-N 3.44Å
182R98.4Very high98.3Very high159 Ų15998 Ų9860%0.651%0.51SS*.Hα-helixtrans-61.3-39.4176.6-167.7179.776.1119-1.1112.3S178 E179 S186S178-R182 WeakPolarHBondContact O-CB 3.5Å; S178-R182 PolarHBondContact O-N 3.28Å; E179-R182 PolarHBondContact O-N 3.12Å; E179-R182 IonicContact OE1-CZ 3.54Å; E179-R182 IonicContact OE1-NE 2.79Å; E179-R182 PolarHBondContact OE1-NE 3.44Å; E179-R182 IonicContact OE1-NH2 3.47Å; E179-R182 PolarHBondContact OE1-NH2 3.06Å; R182-S186 PolarHBondContact O-N 3.3Å
183Q98.3Very high98.3Very high104 Ų104102.5 Ų102.549%0.48652%0.521SS..Hα-helixtrans-62.7-49.7174.9-73.2171-11.500111.3E179 Q180 A181 E185 S186 E187E179-Q183 WeakPolarHBondContact O-CG 3.35Å; E179-Q183 PolarHBondContact O-N 3.42Å; Q180-Q183 PolarHBondContact O-N 2.94Å; A181-Q183 VanDerWaalsContact C-N 3.32Å; A181-Q183 PolarHBondContact O-N 2.83Å; Q183-E185 VanDerWaalsContact C-N 3.31Å; Q183-E185 PolarHBondContact O-N 3.35Å; Q183-S186 WeakPolarHBondContact O-CB 3.48Å; Q183-S186 PolarHBondContact O-N 2.91Å; Q183-E187 WeakPolarHBondContact O-CG 3.5Å; Q183-E187 PolarHBondContact O-N 2.99Å
184L98.2Very high98.2Very high96 Ų96100 Ų10050%0.50352%0.517SS..Hα-helixtrans-62.7-36.9178.1-69.7172.9000112.5Q180 A181 E187 R188Q180-L184 HydrophobicContact CG-CD1 4.37Å; Q180-L184 WeakPolarHBondContact O-CG 3.5Å; Q180-L184 PolarHBondContact O-N 3.49Å; A181-L184 PolarHBondContact O-N 3.03Å; L184-E187 PolarHBondContact O-N 3.18Å; L184-R188 WeakPolarHBondContact O-CB 3.32Å; L184-R188 PolarHBondContact O-N 3.41Å
185E98.2Very high98.3Very high105 Ų105101.9 Ų101.949%0.49152%0.515SS..Hα-helixtrans-62.8-45.5173.4-77.4176.617100111.6A181 Q183 E187 R188 E189A181-E185 WeakPolarHBondContact O-CB 3.31Å; A181-E185 WeakPolarHBondContact O-CG 3.47Å; A181-E185 PolarHBondContact O-N 3.44Å; Q183-E185 VanDerWaalsContact C-N 3.31Å; Q183-E185 PolarHBondContact O-N 3.35Å; E185-E187 PolarHBondContact O-N 3.08Å; E185-R188 PolarHBondContact O-N 3.24Å; E185-E189 WeakPolarHBondContact O-CB 3.48Å; E185-E189 WeakPolarHBondContact O-CG 3.33Å; E185-E189 PolarHBondContact O-N 2.98Å
186S98.4Very high98.2Very high74 Ų7496.5 Ų96.552%0.51750%0.504SS..Hα-helixtrans-62.3-40.8175.8-1770000112.4R182 Q183 E189 A190R182-S186 PolarHBondContact O-N 3.3Å; Q183-S186 WeakPolarHBondContact O-CB 3.48Å; Q183-S186 PolarHBondContact O-N 2.91Å; S186-E189 PolarHBondContact O-N 3.45Å; S186-A190 WeakPolarHBondContact O-CB 3.41Å; S186-A190 PolarHBondContact O-N 2.89Å
187E98.3Very high98.2Very high117 Ų11798.1 Ų98.155%0.54751%0.507SS..Hα-helixtrans-65.1-43.5175.9-73.3176.5-174.800111.4Q183 L184 E185 E189 A190 L191Q183-E187 WeakPolarHBondContact O-CG 3.5Å; Q183-E187 PolarHBondContact O-N 2.99Å; L184-E187 PolarHBondContact O-N 3.18Å; E185-E187 PolarHBondContact O-N 3.08Å; E187-E189 VanDerWaalsContact C-N 3.34Å; E187-E189 PolarHBondContact O-N 3.48Å; E187-A190 PolarHBondContact O-N 3.47Å; E187-L191 WeakPolarHBondContact O-CG 3.39Å; E187-L191 PolarHBondContact O-N 3.42Å
188R98.4Very high98.2Very high142 Ų142100.5 Ų100.554%0.53651%0.509SS..Hα-helixtrans-59.9-44.9175.1-175.6-15969178.4-3.3111.1L184 E185 L191 Q192L184-R188 WeakPolarHBondContact O-CB 3.32Å; L184-R188 PolarHBondContact O-N 3.41Å; E185-R188 PolarHBondContact O-N 3.24Å; R188-L191 PolarHBondContact O-N 3Å; R188-Q192 VanDerWaalsContact O-CB 3.31Å; R188-Q192 WeakPolarHBondContact O-CB 3.31Å; R188-Q192 PolarHBondContact O-N 2.96Å
189E98.3Very high98.3Very high96 Ų96100.8 Ų100.845%0.44951%0.507SS..Hα-helixtrans-63-43.5177.8-76176.2-174.600112E185 S186 E187 Q192 Q193E185-E189 WeakPolarHBondContact O-CB 3.48Å; E185-E189 WeakPolarHBondContact O-CG 3.33Å; E185-E189 PolarHBondContact O-N 2.98Å; S186-E189 PolarHBondContact O-N 3.45Å; E187-E189 VanDerWaalsContact C-N 3.34Å; E187-E189 PolarHBondContact O-N 3.48Å; E189-Q192 PolarHBondContact O-N 3.46Å; E189-Q193 WeakPolarHBondContact O-CG 3.39Å; E189-Q193 PolarHBondContact O-N 3.35Å
190A98.3Very high98.3Very high56 Ų56100.6 Ų100.646%0.46351%0.509SS..Hα-helixtrans-61.1-45.9175.500000112S186 E187 Q192 Q193 Q194S186-A190 WeakPolarHBondContact O-CB 3.41Å; S186-A190 PolarHBondContact O-N 2.89Å; E187-A190 PolarHBondContact O-N 3.47Å; A190-Q192 VanDerWaalsContact C-N 3.34Å; A190-Q192 PolarHBondContact O-N 2.99Å; A190-Q193 PolarHBondContact O-N 2.94Å; A190-Q194 PolarHBondContact O-N 3.33Å
191L98.2Very high98.2Very high90 Ų90101.7 Ų101.747%0.47151%0.514SS..Hα-helixtrans-62.6-40.6175.5-74.9171.8000111.9E187 R188 Q194 H195E187-L191 WeakPolarHBondContact O-CG 3.39Å; E187-L191 PolarHBondContact O-N 3.42Å; R188-L191 PolarHBondContact O-N 3Å; L191-Q194 PolarHBondContact O-N 2.9Å; L191-H195 WeakPolarHBondContact O-CB 3.47Å; L191-H195 VanDerWaalsContact O-CG 3.25Å; L191-H195 PolarHBondContact O-N 3.47Å; L191-H195 PolarHBondContact O-ND1 3.22Å
192Q98.2Very high98.3Very high122 Ų122104.4 Ų104.457%0.5752%0.522SS*.Hα-helixtrans-65-40.8177.9-175.5165.8-4.800111.8R188 E189 A190 H195 S196R188-Q192 VanDerWaalsContact O-CB 3.31Å; R188-Q192 WeakPolarHBondContact O-CB 3.31Å; R188-Q192 PolarHBondContact O-N 2.96Å; E189-Q192 PolarHBondContact O-N 3.46Å; A190-Q192 VanDerWaalsContact C-N 3.34Å; A190-Q192 PolarHBondContact O-N 2.99Å; Q192-H195 PolarHBondContact O-N 2.88Å; Q192-S196 WeakPolarHBondContact O-CB 3.43Å; Q192-S196 PolarHBondContact O-N 3.36Å
193Q98.2Very high98.3Very high133 Ų133104.6 Ų104.662%0.62152%0.523SS*.Hα-helixtrans-62.2-45.1172.7-71.3174.416.400111.2E189 A190 H195 S196 V197E189-Q193 WeakPolarHBondContact O-CG 3.39Å; E189-Q193 PolarHBondContact O-N 3.35Å; A190-Q193 PolarHBondContact O-N 2.94Å; Q193-H195 PolarHBondContact O-N 2.87Å; Q193-S196 WeakPolarHBondContact O-CB 3.5Å; Q193-S196 PolarHBondContact O-N 2.86Å; Q193-V197 WeakPolarHBondContact O-CG2 3.35Å; Q193-V197 PolarHBondContact O-N 3.49Å
194Q98Very high98.3Very high124 Ų124105.3 Ų105.358%0.57953%0.528SS*.Hα-helixtrans-59.4-46.9176.6-176-177.3-1300111.9A190 L191 V197 Q198A190-Q194 PolarHBondContact O-N 3.33Å; L191-Q194 PolarHBondContact O-N 2.9Å; Q194-V197 PolarHBondContact O-N 3.33Å; Q194-Q198 WeakPolarHBondContact O-CB 3.38Å; Q194-Q198 PolarHBondContact O-N 3.31Å
195H98Very high98.3Very high101 Ų101106.5 Ų106.547%0.46853%0.531SS..Hα-helixtrans-63.6-39.6176.5-66.9160.5000112.1L191 Q192 Q193 V197 Q198 V199L191-H195 WeakPolarHBondContact O-CB 3.47Å; L191-H195 VanDerWaalsContact O-CG 3.25Å; L191-H195 PolarHBondContact O-N 3.47Å; L191-H195 PolarHBondContact O-ND1 3.22Å; Q192-H195 PolarHBondContact O-N 2.88Å; Q193-H195 PolarHBondContact O-N 2.87Å; H195-V197 PolarHBondContact O-N 3.35Å; H195-Q198 PolarHBondContact O-N 2.86Å; H195-V199 WeakPolarHBondContact O-CG2 3.38Å; H195-V199 PolarHBondContact O-N 2.97Å
196S98.3Very high98.3Very high63 Ų63102.9 Ų102.944%0.44152%0.521SS..Hα-helixtrans-58.3-49.4175.1-1720000111Q192 Q193 Q198 V199 D200Q192-S196 WeakPolarHBondContact O-CB 3.43Å; Q192-S196 PolarHBondContact O-N 3.36Å; Q193-S196 WeakPolarHBondContact O-CB 3.5Å; Q193-S196 PolarHBondContact O-N 2.86Å; S196-Q198 VanDerWaalsContact C-N 3.3Å; S196-Q198 PolarHBondContact O-N 2.84Å; S196-V199 PolarHBondContact O-N 3.31Å; S196-D200 PolarHBondContact O-N 2.95Å
197V98.3Very high98.3Very high96 Ų96103.8 Ų103.858%0.58252%0.517SS*.Hα-helixtrans-61-40.8177.9173.70000111.1Q193 Q194 H195 D200 Q201Q193-V197 WeakPolarHBondContact O-CG2 3.35Å; Q193-V197 PolarHBondContact O-N 3.49Å; Q194-V197 PolarHBondContact O-N 3.33Å; H195-V197 PolarHBondContact O-N 3.35Å; V197-D200 PolarHBondContact O-N 3.27Å; V197-Q201 WeakPolarHBondContact O-CB 3.37Å; V197-Q201 PolarHBondContact O-N 3Å
198Q98.3Very high98.3Very high103 Ų103102.1 Ų102.148%0.48152%0.518SS..Hα-helixtrans-64.1-42.9177.2-172-179.431.400112.2Q194 H195 S196 Q201 L202Q194-Q198 WeakPolarHBondContact O-CB 3.38Å; Q194-Q198 PolarHBondContact O-N 3.31Å; H195-Q198 PolarHBondContact O-N 2.86Å; S196-Q198 VanDerWaalsContact C-N 3.3Å; S196-Q198 PolarHBondContact O-N 2.84Å; Q198-Q201 PolarHBondContact O-N 3.36Å; Q198-L202 WeakPolarHBondContact O-CG 3.44Å; Q198-L202 PolarHBondContact O-N 3.25Å
199V98.6Very high98.3Very high87 Ų8799.8 Ų99.853%0.52752%0.52SS..Hα-helixtrans-63-43.9176.11690000110.7H195 S196 Q201 L202 R203H195-V199 WeakPolarHBondContact O-CG2 3.38Å; H195-V199 PolarHBondContact O-N 2.97Å; S196-V199 PolarHBondContact O-N 3.31Å; V199-Q201 VanDerWaalsContact C-N 3.33Å; V199-Q201 PolarHBondContact O-N 3.5Å; V199-L202 PolarHBondContact O-N 2.96Å; V199-R203 VanDerWaalsContact O-CB 3.3Å; V199-R203 WeakPolarHBondContact O-CB 3.33Å; V199-R203 PolarHBondContact O-N 3.35Å
200D98.4Very high98.3Very high83 Ų83101 Ų10144%0.44453%0.526SS..Hα-helixtrans-62.9-40.8176.5-72.1-28.3000111.3S196 V197 R203 M204S196-D200 PolarHBondContact O-N 2.95Å; V197-D200 PolarHBondContact O-N 3.27Å; D200-R203 PolarHBondContact O-N 3.26Å; D200-M204 VanDerWaalsContact O-CG 3.3Å; D200-M204 WeakPolarHBondContact O-CG 3.49Å; D200-M204 PolarHBondContact O-N 3.39Å
201Q98.3Very high98.3Very high139 Ų139100 Ų10065%0.6552%0.517SS*.Hα-helixtrans-62.3-46.1175.9-169.7173.224.200112.1V197 Q198 V199 R203 M204 Q205V197-Q201 WeakPolarHBondContact O-CB 3.37Å; V197-Q201 PolarHBondContact O-N 3Å; Q198-Q201 PolarHBondContact O-N 3.36Å; V199-Q201 VanDerWaalsContact C-N 3.33Å; V199-Q201 PolarHBondContact O-N 3.5Å; Q201-R203 VanDerWaalsContact C-N 3.34Å; Q201-M204 PolarHBondContact O-N 3.47Å; Q201-Q205 PolarHBondContact O-N 3.24Å
202L98.4Very high98.3Very high102 Ų10298.6 Ų98.653%0.53452%0.519SS..Hα-helixtrans-64.6-38.9175.8-71.7174.5000111.9Q198 V199 Q205 G206Q198-L202 WeakPolarHBondContact O-CG 3.44Å; Q198-L202 PolarHBondContact O-N 3.25Å; V199-L202 PolarHBondContact O-N 2.96Å; L202-Q205 PolarHBondContact O-N 2.88Å; L202-G206 PolarHBondContact O-N 3.34Å
203R98.6Very high98.3Very high164 Ų16497 Ų9762%0.61951%0.513SS*.Hα-helixtrans-61.3-46.6174.8175.4-178.7-89.7-148.4-3.1110.9V199 D200 Q201 Q205 G206 Q207V199-R203 VanDerWaalsContact O-CB 3.3Å; V199-R203 WeakPolarHBondContact O-CB 3.33Å; V199-R203 PolarHBondContact O-N 3.35Å; D200-R203 PolarHBondContact O-N 3.26Å; Q201-R203 VanDerWaalsContact C-N 3.34Å; R203-Q205 VanDerWaalsContact C-N 3.34Å; R203-Q205 PolarHBondContact O-N 2.94Å; R203-G206 PolarHBondContact O-N 2.92Å; R203-Q207 WeakPolarHBondContact O-CG 3.49Å; R203-Q207 PolarHBondContact O-N 3.47Å
204M98.3Very high98.3Very high119 Ų11997.6 Ų97.659%0.58651%0.51SS*.Hα-helixtrans-63.1-40.1176.6-70-55.4-60.800111.9D200 Q201 Q207 S208D200-M204 VanDerWaalsContact O-CG 3.3Å; D200-M204 WeakPolarHBondContact O-CG 3.49Å; D200-M204 PolarHBondContact O-N 3.39Å; Q201-M204 PolarHBondContact O-N 3.47Å; M204-Q207 PolarHBondContact O-N 3.39Å; M204-S208 PolarHBondContact O-N 2.93Å
205Q98.3Very high98.3Very high121 Ų12196.9 Ų96.957%0.56551%0.508SS*.Hα-helixtrans-62.9-44.8174.9-170.4178.517.400111.7Q201 L202 R203 S208 V209Q201-Q205 PolarHBondContact O-N 3.24Å; L202-Q205 PolarHBondContact O-N 2.88Å; R203-Q205 VanDerWaalsContact C-N 3.34Å; R203-Q205 PolarHBondContact O-N 2.94Å; Q205-S208 PolarHBondContact O-N 3.28Å; Q205-V209 WeakPolarHBondContact O-CG2 3.35Å; Q205-V209 PolarHBondContact O-N 3.47Å
206G98.3Very high98.3Very high29 Ų2998.2 Ų98.230%0.29951%0.514SS..Hα-helixtrans-57.8-49.3174.700000112L202 R203 S208 V209 E210L202-G206 PolarHBondContact O-N 3.34Å; R203-G206 PolarHBondContact O-N 2.92Å; G206-S208 VanDerWaalsContact C-N 3.31Å; G206-S208 PolarHBondContact O-N 3.28Å; G206-V209 PolarHBondContact O-N 2.91Å; G206-E210 WeakPolarHBondContact O-CB 3.35Å; G206-E210 VanDerWaalsContact O-CG 3.32Å; G206-E210 WeakPolarHBondContact O-CG 3.35Å; G206-E210 PolarHBondContact O-N 2.87Å
207Q98.4Very high98.3Very high93 Ų93103.3 Ų103.344%0.43552%0.524SS..Hα-helixtrans-59.2-39.7176.9-72.5175.9-100112.7R203 M204 A211R203-Q207 WeakPolarHBondContact O-CG 3.49Å; R203-Q207 PolarHBondContact O-N 3.47Å; M204-Q207 PolarHBondContact O-N 3.39Å; Q207-A211 VanDerWaalsContact O-CB 3.31Å; Q207-A211 WeakPolarHBondContact O-CB 3.47Å; Q207-A211 PolarHBondContact O-N 3.34Å
208S98.4Very high98.3Very high81 Ų81103.7 Ų103.757%0.56652%0.519SS*.Hα-helixtrans-64.8-45176.7-175.60000112M204 Q205 G206 A211 A212M204-S208 PolarHBondContact O-N 2.93Å; Q205-S208 PolarHBondContact O-N 3.28Å; G206-S208 VanDerWaalsContact C-N 3.31Å; G206-S208 PolarHBondContact O-N 3.28Å; S208-A211 PolarHBondContact O-N 2.86Å; S208-A212 PolarHBondContact O-N 3.45Å
209V98.4Very high98.2Very high94 Ų94100.7 Ų100.757%0.5751%0.512SS*.Hα-helixtrans-66.4-42.2178.1172.80000110.8Q205 G206 A211 A212 L213Q205-V209 WeakPolarHBondContact O-CG2 3.35Å; Q205-V209 PolarHBondContact O-N 3.47Å; G206-V209 PolarHBondContact O-N 2.91Å; V209-A211 VanDerWaalsContact C-N 3.32Å; V209-A211 PolarHBondContact O-N 2.91Å; V209-A212 PolarHBondContact O-N 2.93Å; V209-L213 WeakPolarHBondContact O-CB 3.46Å; V209-L213 PolarHBondContact O-N 3.48Å
210E98.3Very high98.2Very high122 Ų12299.2 Ų99.257%0.5751%0.509SS*.Hα-helixtrans-62.2-38.7175.1-74.5175.3-177.300112.3G206 R214G206-E210 WeakPolarHBondContact O-CB 3.35Å; G206-E210 VanDerWaalsContact O-CG 3.32Å; G206-E210 WeakPolarHBondContact O-CG 3.35Å; G206-E210 PolarHBondContact O-N 2.87Å; E210-R214 WeakPolarHBondContact O-CG 3.34Å; E210-R214 PolarHBondContact O-N 2.99Å
211A98.3Very high98.2Very high34 Ų3498.3 Ų98.328%0.28151%0.509SS..Hα-helixtrans-65-46.3174.300000111.8Q207 S208 V209 L213 R214 M215Q207-A211 VanDerWaalsContact O-CB 3.31Å; Q207-A211 WeakPolarHBondContact O-CB 3.47Å; Q207-A211 PolarHBondContact O-N 3.34Å; S208-A211 PolarHBondContact O-N 2.86Å; V209-A211 VanDerWaalsContact C-N 3.32Å; V209-A211 PolarHBondContact O-N 2.91Å; A211-L213 VanDerWaalsContact C-N 3.34Å; A211-L213 PolarHBondContact O-N 3.31Å; A211-R214 PolarHBondContact O-N 3.03Å; A211-M215 WeakPolarHBondContact O-CG 3.39Å; A211-M215 PolarHBondContact O-N 3.47Å; A211-M215 VanDerWaalsContact O-N 3.08Å
212A98.1Very high98.2Very high61 Ų6195 Ų9550%0.50449%0.493SS..Hα-helixtrans-59.8-44.1175.300000111.6S208 V209 R214 M215 E216S208-A212 PolarHBondContact O-N 3.45Å; V209-A212 PolarHBondContact O-N 2.93Å; A212-R214 VanDerWaalsContact C-N 3.34Å; A212-R214 PolarHBondContact O-N 2.94Å; A212-M215 PolarHBondContact O-N 2.89Å; A212-E216 PolarHBondContact O-N 3.45Å
213L98.4Very high98.1Very high87 Ų8795.1 Ų95.146%0.45549%0.491SS..Hα-helixtrans-62.7-38.3176.8-177.463.8000112.4V209 A211 E216 R217V209-L213 WeakPolarHBondContact O-CB 3.46Å; V209-L213 PolarHBondContact O-N 3.48Å; A211-L213 VanDerWaalsContact C-N 3.34Å; A211-L213 PolarHBondContact O-N 3.31Å; L213-E216 PolarHBondContact O-N 3.44Å; L213-R217 WeakPolarHBondContact O-CB 3.39Å; L213-R217 VanDerWaalsContact O-CG 3.28Å; L213-R217 WeakPolarHBondContact O-CG 3.33Å; L213-R217 PolarHBondContact O-N 3.18Å
214R98.5Very high98.1Very high147 Ų14794.8 Ų94.856%0.55550%0.495SS*.Hα-helixtrans-62.1-43.3173.9-83.1-175.3-75.2115.7-6111.7E210 A211 A212 R217 Q218E210-R214 WeakPolarHBondContact O-CG 3.34Å; E210-R214 PolarHBondContact O-N 2.99Å; A211-R214 PolarHBondContact O-N 3.03Å; A212-R214 VanDerWaalsContact C-N 3.34Å; A212-R214 PolarHBondContact O-N 2.94Å; R214-R217 PolarHBondContact O-N 3.42Å; R214-Q218 PolarHBondContact O-N 3.31Å
215M98Very high98.1Very high108 Ų10895.2 Ų95.253%0.53249%0.49SS..Hα-helixtrans-65-44176.4-66.1-66.591.800112A211 A212 R217 Q218 A219A211-M215 WeakPolarHBondContact O-CG 3.39Å; A211-M215 PolarHBondContact O-N 3.47Å; A211-M215 VanDerWaalsContact O-N 3.08Å; A212-M215 PolarHBondContact O-N 2.89Å; M215-R217 VanDerWaalsContact C-N 3.34Å; M215-R217 PolarHBondContact O-N 2.77Å; M215-Q218 WeakPolarHBondContact O-CB 3.25Å; M215-Q218 PolarHBondContact O-N 2.95Å; M215-Q218 VanDerWaalsContact O-N 3.15Å; M215-A219 PolarHBondContact O-N 3.43Å
216E97.6Very high98.1Very high130 Ų13094.7 Ų94.761%0.60749%0.485SS*.Hα-helixtrans-61.7-42177.3-167.561.5-149.900111.8A212 L213 Q218 A219 A220A212-E216 PolarHBondContact O-N 3.45Å; L213-E216 PolarHBondContact O-N 3.44Å; E216-Q218 VanDerWaalsContact C-N 3.32Å; E216-Q218 PolarHBondContact O-N 3.41Å; E216-A219 PolarHBondContact O-N 3.02Å; E216-A220 WeakPolarHBondContact O-CB 3.45Å; E216-A220 PolarHBondContact O-N 3.35Å
217R98Very high98Very high170 Ų17097.9 Ų97.964%0.64250%0.495SS*.Hα-helixtrans-62-40.3174.6-75.4174.6178.6-174.71.3112.2L213 R214 M215 S221L213-R217 WeakPolarHBondContact O-CB 3.39Å; L213-R217 VanDerWaalsContact O-CG 3.28Å; L213-R217 WeakPolarHBondContact O-CG 3.33Å; L213-R217 PolarHBondContact O-N 3.18Å; R214-R217 PolarHBondContact O-N 3.42Å; M215-R217 VanDerWaalsContact C-N 3.34Å; M215-R217 PolarHBondContact O-N 2.77Å; R217-S221 WeakPolarHBondContact O-CB 3.37Å; R217-S221 PolarHBondContact O-N 3.47Å
218Q97.7Very high98Very high104 Ų10495.6 Ų95.649%0.48649%0.492SS..Hα-helixtrans-65-47.8175.7-177.9177.4-23.300110.8R214 M215 E216 A220 S221 E222R214-Q218 PolarHBondContact O-N 3.31Å; M215-Q218 WeakPolarHBondContact O-CB 3.25Å; M215-Q218 PolarHBondContact O-N 2.95Å; M215-Q218 VanDerWaalsContact O-N 3.15Å; E216-Q218 VanDerWaalsContact C-N 3.32Å; E216-Q218 PolarHBondContact O-N 3.41Å; Q218-A220 PolarHBondContact O-N 2.99Å; Q218-S221 WeakPolarHBondContact O-CB 3.32Å; Q218-S221 PolarHBondContact O-N 3.27Å; Q218-S221 VanDerWaalsContact O-N 3.12Å; Q218-E222 PolarHBondContact NE2-OE1 3.4Å; Q218-E222 VanDerWaalsContact NE2-OE1 3.13Å; Q218-E222 WeakPolarHBondContact O-CG 3.39Å; Q218-E222 PolarHBondContact O-N 3Å
219A97.8Very high98Very high39 Ų3997.6 Ų97.632%0.32249%0.493SS..Hα-helixtrans-58.4-45.8176.500000111.7M215 E216 S221 E222 E223M215-A219 PolarHBondContact O-N 3.43Å; E216-A219 PolarHBondContact O-N 3.02Å; A219-S221 VanDerWaalsContact C-N 3.3Å; A219-S221 PolarHBondContact O-N 2.88Å; A219-E222 WeakPolarHBondContact O-CA 3.27Å; A219-E222 WeakPolarHBondContact O-CB 3.25Å; A219-E222 PolarHBondContact O-N 3.48Å; A219-E223 PolarHBondContact O-N 3.28Å
220A97.8Very high97.9Very high56 Ų5698.8 Ų98.846%0.46350%0.495SS..Hα-helixtrans-61-37.6175.700000112.6E216 Q218 E222 K224E216-A220 WeakPolarHBondContact O-CB 3.45Å; E216-A220 PolarHBondContact O-N 3.35Å; Q218-A220 PolarHBondContact O-N 2.99Å; A220-E222 VanDerWaalsContact C-N 3.34Å; A220-K224 WeakPolarHBondContact O-CB 3.44Å; A220-K224 PolarHBondContact O-N 2.96Å
221S97.9Very high97.9Very high64 Ų6498.1 Ų98.145%0.44849%0.492SS..Hα-helixtrans-64.9-39173-179.70000112R217 Q218 A219 K224 R225R217-S221 WeakPolarHBondContact O-CB 3.37Å; R217-S221 PolarHBondContact O-N 3.47Å; Q218-S221 WeakPolarHBondContact O-CB 3.32Å; Q218-S221 PolarHBondContact O-N 3.27Å; Q218-S221 VanDerWaalsContact O-N 3.12Å; A219-S221 VanDerWaalsContact C-N 3.3Å; A219-S221 PolarHBondContact O-N 2.88Å; S221-K224 PolarHBondContact O-N 2.9Å; S221-R225 PolarHBondContact O-N 3.49Å; S221-R225 VanDerWaalsContact O-N 3.08Å
222E97.9Very high97.9Very high69 Ų69100.4 Ų100.432%0.32250%0.503SS..Hα-helixtrans-66.4-45175.9-68.6172.4-168.200112.2Q218 A219 A220 K224 R225 K226Q218-E222 PolarHBondContact NE2-OE1 3.4Å; Q218-E222 VanDerWaalsContact NE2-OE1 3.13Å; Q218-E222 WeakPolarHBondContact O-CG 3.39Å; Q218-E222 PolarHBondContact O-N 3Å; A219-E222 WeakPolarHBondContact O-CA 3.27Å; A219-E222 WeakPolarHBondContact O-CB 3.25Å; A219-E222 PolarHBondContact O-N 3.48Å; A220-E222 VanDerWaalsContact C-N 3.34Å; E222-K224 VanDerWaalsContact C-N 3.35Å; E222-K224 PolarHBondContact O-N 3.26Å; E222-R225 WeakPolarHBondContact O-CB 3.38Å; E222-R225 PolarHBondContact O-N 3.41Å; E222-R225 VanDerWaalsContact O-N 3.11Å; E222-K226 WeakPolarHBondContact O-CG 3.49Å; E222-K226 PolarHBondContact O-N 3.49Å
223E97.5Very high97.9Very high105 Ų10599.5 Ų99.549%0.49150%0.495SS..Hα-helixtrans-62.4-40.6174.5-69.3-51.5126.800112A219 R225 K226 L227A219-E223 PolarHBondContact O-N 3.28Å; E223-R225 VanDerWaalsContact C-N 3.26Å; E223-R225 PolarHBondContact O-N 2.89Å; E223-K226 PolarHBondContact O-N 3.42Å; E223-K226 WeakPolarHBondContact OE1-CD 3.31Å; E223-K226 IonicContact OE1-NZ 2.73Å; E223-K226 PolarHBondContact OE1-NZ 3.28Å; E223-L227 WeakPolarHBondContact O-CB 3.49Å; E223-L227 PolarHBondContact O-N 3.43Å
224K98.1Very high97.8Very high158 Ų158102.6 Ų102.669%0.68750%0.502SS*.Hα-helixtrans-58.6-39.5172.9-174.8177.7-178.8179.30111.7A220 S221 E222 A228A220-K224 WeakPolarHBondContact O-CB 3.44Å; A220-K224 PolarHBondContact O-N 2.96Å; S221-K224 PolarHBondContact O-N 2.9Å; E222-K224 VanDerWaalsContact C-N 3.35Å; E222-K224 PolarHBondContact O-N 3.26Å; K224-A228 PolarHBondContact O-N 3.39Å
225R98Very high97.8Very high128 Ų128101 Ų10148%0.48350%0.5SS..Hα-helixtrans-67.6-44176.6-164.9-171.9-48.799.16.4111.5S221 E222 E223 L227 A228 Q229S221-R225 PolarHBondContact O-N 3.49Å; S221-R225 VanDerWaalsContact O-N 3.08Å; E222-R225 WeakPolarHBondContact O-CB 3.38Å; E222-R225 PolarHBondContact O-N 3.41Å; E222-R225 VanDerWaalsContact O-N 3.11Å; E223-R225 VanDerWaalsContact C-N 3.26Å; E223-R225 PolarHBondContact O-N 2.89Å; R225-L227 VanDerWaalsContact C-N 3.35Å; R225-A228 PolarHBondContact O-N 2.95Å; R225-Q229 WeakPolarHBondContact O-CG 3.29Å; R225-Q229 PolarHBondContact O-N 3.38Å
226K98.1Very high97.7Very high109 Ų109100.8 Ų100.847%0.47450%0.498SS..Hα-helixtrans-60.6-43.8175.4-69.2174.9-1711680111.4E222 E223 A228 Q229 L230E222-K226 WeakPolarHBondContact O-CG 3.49Å; E222-K226 PolarHBondContact O-N 3.49Å; E223-K226 PolarHBondContact O-N 3.42Å; E223-K226 WeakPolarHBondContact OE1-CD 3.31Å; E223-K226 IonicContact OE1-NZ 2.73Å; E223-K226 PolarHBondContact OE1-NZ 3.28Å; K226-A228 PolarHBondContact O-N 2.98Å; K226-Q229 WeakPolarHBondContact O-CB 3.46Å; K226-Q229 PolarHBondContact O-N 3.48Å; K226-L230 WeakPolarHBondContact O-CB 3.49Å; K226-L230 PolarHBondContact O-N 2.83Å
227L97.9Very high97.7Very high96 Ų96100.1 Ų100.150%0.50350%0.498SS..Hα-helixtrans-60.1-45.3175.3179.163.1000111.6E223 R225 Q229 L230 Q231E223-L227 WeakPolarHBondContact O-CB 3.49Å; E223-L227 PolarHBondContact O-N 3.43Å; R225-L227 VanDerWaalsContact C-N 3.35Å; L227-Q229 VanDerWaalsContact C-N 3.33Å; L227-Q229 PolarHBondContact O-N 3Å; L227-L230 PolarHBondContact O-N 2.82Å; L227-Q231 HydrophobicContact CD1-CG 4.45Å; L227-Q231 WeakPolarHBondContact O-CB 3.45Å; L227-Q231 WeakPolarHBondContact O-CG 3.31Å; L227-Q231 PolarHBondContact O-N 2.97Å
228A97.6Very high97.6Very high46 Ų4697.6 Ų97.638%0.3849%0.492SS..Hα-helixtrans-61.7-41.3177.100000111.8K224 R225 K226 Q231 V232K224-A228 PolarHBondContact O-N 3.39Å; R225-A228 PolarHBondContact O-N 2.95Å; K226-A228 PolarHBondContact O-N 2.98Å; A228-Q231 PolarHBondContact O-N 3.39Å; A228-V232 WeakPolarHBondContact O-CG2 3.24Å; A228-V232 PolarHBondContact O-N 3.41Å
229Q97.6Very high97.5Very high123 Ų12398.2 Ų98.258%0.57550%0.495SS*.Hα-helixtrans-61.7-44.6173.8-71.6174.23.200111.7R225 K226 L227 Q231 V232 A233R225-Q229 WeakPolarHBondContact O-CG 3.29Å; R225-Q229 PolarHBondContact O-N 3.38Å; K226-Q229 WeakPolarHBondContact O-CB 3.46Å; K226-Q229 PolarHBondContact O-N 3.48Å; L227-Q229 VanDerWaalsContact C-N 3.33Å; L227-Q229 PolarHBondContact O-N 3Å; Q229-Q231 VanDerWaalsContact C-N 3.34Å; Q229-Q231 PolarHBondContact O-N 2.89Å; Q229-V232 PolarHBondContact O-N 3.3Å; Q229-A233 PolarHBondContact O-N 3.16Å
230L97.9Very high97.4Very high119 Ų119102.4 Ų102.462%0.62351%0.508SS*.Hα-helixtrans-63.8-40.1177.6-175.263.8000111.8K226 L227 A233 Y234K226-L230 WeakPolarHBondContact O-CB 3.49Å; K226-L230 PolarHBondContact O-N 2.83Å; L227-L230 PolarHBondContact O-N 2.82Å; L230-A233 PolarHBondContact O-N 2.97Å; L230-Y234 WeakPolarHBondContact O-CB 3.42Å; L230-Y234 PolarHBondContact O-N 2.91Å
231Q97.6Very high97.2Very high108 Ų108106.7 Ų106.751%0.50551%0.513SS..Hα-helixtrans-59.7-46.6173.9-75.8176-16.800111L227 A228 Q229 Y234 H235L227-Q231 HydrophobicContact CD1-CG 4.45Å; L227-Q231 WeakPolarHBondContact O-CB 3.45Å; L227-Q231 WeakPolarHBondContact O-CG 3.31Å; L227-Q231 PolarHBondContact O-N 2.97Å; A228-Q231 PolarHBondContact O-N 3.39Å; Q229-Q231 VanDerWaalsContact C-N 3.34Å; Q229-Q231 PolarHBondContact O-N 2.89Å; Q231-Y234 PolarHBondContact O-N 3.24Å; Q231-H235 PolarHBondContact O-N 2.72Å; Q231-H235 PolarHBondContact O-ND1 3.48Å
232V98Very high97Very high82 Ų82106.4 Ų106.450%0.49751%0.506SS..Hα-helixtrans-61.1-47.1176.8171.20000111.1A228 Q229 Y234 H235 Q236A228-V232 WeakPolarHBondContact O-CG2 3.24Å; A228-V232 PolarHBondContact O-N 3.41Å; Q229-V232 PolarHBondContact O-N 3.3Å; V232-Y234 VanDerWaalsContact C-N 3.33Å; V232-Y234 PolarHBondContact O-N 2.85Å; V232-H235 PolarHBondContact O-N 2.92Å; V232-Q236 WeakPolarHBondContact O-CG 3.23Å; V232-Q236 PolarHBondContact O-N 2.85Å
233A97.5Very high96.7Very high42 Ų42107.6 Ų107.635%0.34752%0.515SS..Hα-helixtrans-60-42.5177.700000112.1Q229 L230 Q236 L237Q229-A233 PolarHBondContact O-N 3.16Å; L230-A233 PolarHBondContact O-N 2.97Å; A233-Q236 PolarHBondContact O-N 3.41Å; A233-L237 PolarHBondContact O-N 3.42Å
234Y97.3Very high96.4Very high152 Ų152108.1 Ų108.160%0.59652%0.517SS*.Hα-helixtrans-61.3-46.5175.8-179.7-91.2000112L230 Q231 V232 Q236 L237 F238L230-Y234 WeakPolarHBondContact O-CB 3.42Å; L230-Y234 PolarHBondContact O-N 2.91Å; Q231-Y234 PolarHBondContact O-N 3.24Å; V232-Y234 VanDerWaalsContact C-N 3.33Å; V232-Y234 PolarHBondContact O-N 2.85Å; Y234-Q236 VanDerWaalsContact C-N 3.31Å; Y234-Q236 PolarHBondContact O-N 2.85Å; Y234-L237 PolarHBondContact O-N 3.4Å; Y234-F238 WeakPolarHBondContact O-CB 3.47Å; Y234-F238 PolarHBondContact O-N 3.4Å
235H97.5Very high95.9Very high113 Ų113103.7 Ų103.752%0.52350%0.5SS..Hα-helixtrans-62.3-39177.4-75.383000111.8Q231 V232 F238 Q239Q231-H235 PolarHBondContact O-N 2.72Å; Q231-H235 PolarHBondContact O-ND1 3.48Å; V232-H235 PolarHBondContact O-N 2.92Å; H235-F238 PolarHBondContact O-N 3.45Å; H235-Q239 VanDerWaalsContact O-CG 3.27Å; H235-Q239 WeakPolarHBondContact O-CG 3.36Å; H235-Q239 PolarHBondContact O-N 3.28Å
236Q97.3Very high95.5Very high103 Ų103103.6 Ų103.648%0.48150%0.503SS..Hα-helixtrans-61.5-50.2175.3-73.7168.2-2.700111.4V232 A233 Y234 F238 Q239 E240V232-Q236 WeakPolarHBondContact O-CG 3.23Å; V232-Q236 PolarHBondContact O-N 2.85Å; A233-Q236 PolarHBondContact O-N 3.41Å; Y234-Q236 VanDerWaalsContact C-N 3.31Å; Y234-Q236 PolarHBondContact O-N 2.85Å; Q236-F238 VanDerWaalsContact C-N 3.28Å; Q236-F238 PolarHBondContact O-N 3.35Å; Q236-Q239 WeakPolarHBondContact O-CB 3.48Å; Q236-Q239 PolarHBondContact O-N 2.9Å; Q236-Q239 VanDerWaalsContact O-N 3.12Å; Q236-E240 WeakPolarHBondContact O-CG 3.47Å; Q236-E240 PolarHBondContact O-N 2.97Å
237L97Very high94.8Very high116 Ų116101.6 Ų101.661%0.60750%0.503SS*.Hα-helixtrans-61-38.8178.8-128.8150.2000111.9A233 Y234 E240 Y241A233-L237 PolarHBondContact O-N 3.42Å; Y234-L237 PolarHBondContact O-N 3.4Å; L237-E240 PolarHBondContact O-N 3.23Å; L237-Y241 WeakPolarHBondContact O-CB 3.46Å; L237-Y241 PolarHBondContact O-N 3.03Å
238F96.4Very high94Very high118 Ų11899 Ų9952%0.51849%0.493SS..Hα-helixtrans-64.2-43.1175-165.6-88.2000111.9Y234 H235 Q236 Y241 D242Y234-F238 WeakPolarHBondContact O-CB 3.47Å; Y234-F238 PolarHBondContact O-N 3.4Å; H235-F238 PolarHBondContact O-N 3.45Å; Q236-F238 VanDerWaalsContact C-N 3.28Å; Q236-F238 PolarHBondContact O-N 3.35Å; F238-Y241 PolarHBondContact O-N 3.2Å; F238-D242 WeakPolarHBondContact O-CB 3.42Å; F238-D242 PolarHBondContact O-N 3.42Å
239Q95.1Very high92.9Very high117 Ų117100.5 Ų100.555%0.54750%0.497SS..Hα-helixtrans-64.1-44.1175.1-72.617221.500111.7H235 Q236 Y241 D242 N243H235-Q239 VanDerWaalsContact O-CG 3.27Å; H235-Q239 WeakPolarHBondContact O-CG 3.36Å; H235-Q239 PolarHBondContact O-N 3.28Å; Q236-Q239 WeakPolarHBondContact O-CB 3.48Å; Q236-Q239 PolarHBondContact O-N 2.9Å; Q236-Q239 VanDerWaalsContact O-N 3.12Å; Q239-Y241 VanDerWaalsContact C-N 3.33Å; Q239-Y241 PolarHBondContact O-N 2.92Å; Q239-D242 PolarHBondContact O-N 3.01Å; Q239-N243 VanDerWaalsContact O-CB 3.24Å; Q239-N243 WeakPolarHBondContact O-CB 3.31Å; Q239-N243 PolarHBondContact O-N 2.84Å; Q239-N243 PolarHBondContact O-ND2 3.42Å
240E95.1Very high91.7Very high126 Ų12696.3 Ų96.359%0.58949%0.487SS*.Hα-helixtrans-59.1-44.4175.5-73.7174.6-172.500111.5Q236 L237 N243 H244Q236-E240 WeakPolarHBondContact O-CG 3.47Å; Q236-E240 PolarHBondContact O-N 2.97Å; L237-E240 PolarHBondContact O-N 3.23Å; E240-N243 PolarHBondContact O-N 3.3Å; E240-H244 VanDerWaalsContact O-CB 3.29Å; E240-H244 WeakPolarHBondContact O-CB 3.34Å; E240-H244 PolarHBondContact O-N 3.37Å
241Y93.3Very high90.4Very high147 Ų14797 Ų9758%0.57649%0.488SS*.Hα-helixtrans-64.4-46.6176.8-177.7-101.3000112.6L237 F238 Q239 N243 H244 I245L237-Y241 WeakPolarHBondContact O-CB 3.46Å; L237-Y241 PolarHBondContact O-N 3.03Å; F238-Y241 PolarHBondContact O-N 3.2Å; Q239-Y241 VanDerWaalsContact C-N 3.33Å; Q239-Y241 PolarHBondContact O-N 2.92Å; Y241-N243 PolarHBondContact O-N 3.23Å; Y241-H244 WeakPolarHBondContact O-CB 3.36Å; Y241-H244 PolarHBondContact O-N 2.9Å; Y241-I245 HydrophobicContact CD1-CD1 3.83Å; Y241-I245 HydrophobicContact CD1-CG1 4.48Å; Y241-I245 HydrophobicContact CE1-CD1 3.2Å; Y241-I245 HydrophobicContact CE1-CG1 4.12Å; Y241-I245 HydrophobicContact CE2-CD1 4.37Å; Y241-I245 WeakPolarHBondContact O-CG1 3.47Å; Y241-I245 PolarHBondContact O-N 2.8Å
242D94.1Very high89.4Confident57 Ų5797.2 Ų97.231%0.30549%0.489SS..Hα-helixtrans-63-42.2177.2-17446.9000111.5F238 Q239 H244 I245 K246F238-D242 WeakPolarHBondContact O-CB 3.42Å; F238-D242 PolarHBondContact O-N 3.42Å; Q239-D242 PolarHBondContact O-N 3.01Å; D242-H244 VanDerWaalsContact C-N 3.34Å; D242-H244 PolarHBondContact O-N 3.32Å; D242-I245 PolarHBondContact O-N 2.95Å; D242-K246 WeakPolarHBondContact O-CB 3.46Å; D242-K246 WeakPolarHBondContact O-CG 3.34Å; D242-K246 PolarHBondContact O-N 3.36Å; D242-K246 WeakPolarHBondContact OD1-CE 3.42Å; D242-K246 IonicContact OD1-NZ 3.65Å; D242-K246 WeakPolarHBondContact OD2-CE 3.41Å; D242-K246 IonicContact OD2-NZ 2.9Å; D242-K246 PolarHBondContact OD2-NZ 3.37Å
243N91.4Very high88.6Confident94 Ų9497.7 Ų97.750%0.50349%0.489SS..Hα-helixtrans-63.1-39.8173.4-70.8-28.3000111.9Q239 E240 Y241 K246 S247Q239-N243 VanDerWaalsContact O-CB 3.24Å; Q239-N243 WeakPolarHBondContact O-CB 3.31Å; Q239-N243 PolarHBondContact O-N 2.84Å; Q239-N243 PolarHBondContact O-ND2 3.42Å; E240-N243 PolarHBondContact O-N 3.3Å; Y241-N243 PolarHBondContact O-N 3.23Å; N243-K246 PolarHBondContact O-N 2.93Å; N243-S247 WeakPolarHBondContact O-CB 3.4Å; N243-S247 PolarHBondContact O-N 3.49Å; N243-S247 PolarHBondContact O-OG 2.9Å
244H91.1Very high87.8Confident117 Ų117100.9 Ų100.954%0.54250%0.497SS..Hα-helixtrans-63.8-44.4175179.2-84.2000111.6E240 Y241 D242 S247 S248E240-H244 VanDerWaalsContact O-CB 3.29Å; E240-H244 WeakPolarHBondContact O-CB 3.34Å; E240-H244 PolarHBondContact O-N 3.37Å; Y241-H244 WeakPolarHBondContact O-CB 3.36Å; Y241-H244 PolarHBondContact O-N 2.9Å; D242-H244 VanDerWaalsContact C-N 3.34Å; D242-H244 PolarHBondContact O-N 3.32Å; H244-S247 WeakPolarHBondContact CA-OG 3.48Å; H244-S247 PolarHBondContact O-N 2.89Å; H244-S247 PolarHBondContact O-OG 3.46Å; H244-S247 VanDerWaalsContact O-OG 3.12Å; H244-S248 WeakPolarHBondContact O-CB 3.28Å; H244-S248 PolarHBondContact O-N 3.27Å
245I88.5Confident87.2Confident64 Ų6497.9 Ų97.933%0.32849%0.491SS..Hα-helixtrans-60.5-50.4174.4-70.4178.1000110.3Y241 D242 S247 S248 V249Y241-I245 HydrophobicContact CD1-CD1 3.83Å; Y241-I245 HydrophobicContact CD1-CG1 4.48Å; Y241-I245 HydrophobicContact CE1-CD1 3.2Å; Y241-I245 HydrophobicContact CE1-CG1 4.12Å; Y241-I245 HydrophobicContact CE2-CD1 4.37Å; Y241-I245 WeakPolarHBondContact O-CG1 3.47Å; Y241-I245 PolarHBondContact O-N 2.8Å; D242-I245 PolarHBondContact O-N 2.95Å; I245-S247 VanDerWaalsContact C-N 3.32Å; I245-S247 PolarHBondContact O-N 3.48Å; I245-S248 PolarHBondContact O-N 3.45Å; I245-V249 HydrophobicContact CG2-CG2 4.06Å; I245-V249 VanDerWaalsContact O-CB 3.24Å; I245-V249 WeakPolarHBondContact O-CB 3.44Å; I245-V249 WeakPolarHBondContact O-CG2 3.45Å; I245-V249 PolarHBondContact O-N 3.49Å
246K88.5Confident86.6Confident127 Ų12797.9 Ų97.955%0.55249%0.494SS*.Hα-helixtrans-60.8-41.2-178.6-73.4173.3-173.1165.10112.3D242 N243 G250D242-K246 WeakPolarHBondContact O-CB 3.46Å; D242-K246 WeakPolarHBondContact O-CG 3.34Å; D242-K246 PolarHBondContact O-N 3.36Å; D242-K246 WeakPolarHBondContact OD1-CE 3.42Å; D242-K246 IonicContact OD1-NZ 3.65Å; D242-K246 WeakPolarHBondContact OD2-CE 3.41Å; D242-K246 IonicContact OD2-NZ 2.9Å; D242-K246 PolarHBondContact OD2-NZ 3.37Å; N243-K246 PolarHBondContact O-N 2.93Å; K246-G250 VanDerWaalsContact O-CA 3.22Å; K246-G250 WeakPolarHBondContact O-CA 3.43Å; K246-G250 PolarHBondContact O-N 2.9Å
247S83.4Confident86Confident66 Ų6697.8 Ų97.846%0.46249%0.492SS..Hα-helixtrans-73.7-47.4178.454.40000112.4N243 H244 I245 M251N243-S247 WeakPolarHBondContact O-CB 3.4Å; N243-S247 PolarHBondContact O-N 3.49Å; N243-S247 PolarHBondContact O-OG 2.9Å; H244-S247 WeakPolarHBondContact CA-OG 3.48Å; H244-S247 PolarHBondContact O-N 2.89Å; H244-S247 PolarHBondContact O-OG 3.46Å; H244-S247 VanDerWaalsContact O-OG 3.12Å; I245-S247 VanDerWaalsContact C-N 3.32Å; I245-S247 PolarHBondContact O-N 3.48Å; S247-M251 VanDerWaalsContact O-CB 3.23Å; S247-M251 WeakPolarHBondContact O-CB 3.35Å; S247-M251 PolarHBondContact O-N 3.43Å
248S81.4Confident85.6Confident42 Ų4297.8 Ų97.829%0.29449%0.489SS..Hα-helixtrans-66.1-50.2-179.7-177.50000112.1H244 I245 Q252H244-S248 WeakPolarHBondContact O-CB 3.28Å; H244-S248 PolarHBondContact O-N 3.27Å; I245-S248 PolarHBondContact O-N 3.45Å; S248-Q252 WeakPolarHBondContact O-CB 3.32Å; S248-Q252 VanDerWaalsContact O-CG 3.22Å; S248-Q252 WeakPolarHBondContact O-CG 3.3Å; S248-Q252 PolarHBondContact O-N 3.34Å; S248-Q252 VanDerWaalsContact O-N 3.08Å
249V74Confident85.3Confident78 Ų7898.4 Ų98.447%0.47349%0.493SS..Hα-helixtrans-73.4-36.4-180-177.90000110.4I245 L253I245-V249 HydrophobicContact CG2-CG2 4.06Å; I245-V249 VanDerWaalsContact O-CB 3.24Å; I245-V249 WeakPolarHBondContact O-CB 3.44Å; I245-V249 WeakPolarHBondContact O-CG2 3.45Å; I245-V249 PolarHBondContact O-N 3.49Å; V249-L253 WeakPolarHBondContact O-CB 3.34Å; V249-L253 PolarHBondContact O-N 2.98Å
250G72.8Confident85Confident35 Ų3597.8 Ų97.836%0.36149%0.493SS..Hα-helixtrans-61.4-46.2175.500000112.4K246 L253 E254K246-G250 VanDerWaalsContact O-CA 3.22Å; K246-G250 WeakPolarHBondContact O-CA 3.43Å; K246-G250 PolarHBondContact O-N 2.9Å; G250-L253 PolarHBondContact O-N 3.39Å; G250-E254 PolarHBondContact O-N 2.85Å
251M71.4Confident84.8Confident132 Ų13297 Ų9765%0.6549%0.49SS*.Hα-helixtrans-67.1-44.9177.9-158.3111.174.100111.6S247 L253 E254 D255S247-M251 VanDerWaalsContact O-CB 3.23Å; S247-M251 WeakPolarHBondContact O-CB 3.35Å; S247-M251 PolarHBondContact O-N 3.43Å; M251-L253 VanDerWaalsContact C-N 3.34Å; M251-L253 PolarHBondContact O-N 3.24Å; M251-E254 PolarHBondContact O-N 2.88Å; M251-D255 PolarHBondContact O-N 2.64Å
252Q75.4Confident84.6Confident113 Ų11395.8 Ų95.853%0.52849%0.489SS..Hα-helixtrans-62.3-39.4176.4-74.9173.4-7.400112.6S248 L256S248-Q252 WeakPolarHBondContact O-CB 3.32Å; S248-Q252 VanDerWaalsContact O-CG 3.22Å; S248-Q252 WeakPolarHBondContact O-CG 3.3Å; S248-Q252 PolarHBondContact O-N 3.34Å; S248-Q252 VanDerWaalsContact O-N 3.08Å; Q252-L256 WeakPolarHBondContact O-CB 3.49Å; Q252-L256 WeakPolarHBondContact O-CD1 3.39Å; Q252-L256 PolarHBondContact O-N 2.89Å
253L81.4Confident84.3Confident93 Ų9395.4 Ų95.449%0.48749%0.494SS..Hα-helixtrans-66.4-40.5178.4-177.967.4000111.3V249 G250 M251 L256 K257V249-L253 WeakPolarHBondContact O-CB 3.34Å; V249-L253 PolarHBondContact O-N 2.98Å; G250-L253 PolarHBondContact O-N 3.39Å; M251-L253 VanDerWaalsContact C-N 3.34Å; M251-L253 PolarHBondContact O-N 3.24Å; L253-L256 PolarHBondContact O-N 2.87Å; L253-K257 VanDerWaalsContact O-CG 3.32Å; L253-K257 WeakPolarHBondContact O-CG 3.47Å; L253-K257 PolarHBondContact O-N 3.47Å
254E82.4Confident84.3Confident109 Ų10996.1 Ų96.151%0.50949%0.494SS..Hα-helixtrans-70.1-39.9178.9-146.663-166.900111.5G250 M251 L256 K257 Q258G250-E254 PolarHBondContact O-N 2.85Å; M251-E254 PolarHBondContact O-N 2.88Å; E254-L256 PolarHBondContact O-N 2.91Å; E254-K257 PolarHBondContact O-N 3.04Å; E254-K257 IonicContact OE2-NZ 3.83Å; E254-K257 PolarHBondContact OE2-NZ 3.04Å; E254-Q258 WeakPolarHBondContact O-CB 3.47Å; E254-Q258 PolarHBondContact O-N 3.29Å
255D84.1Confident84.3Confident88 Ų8896 Ų9647%0.47149%0.494SS..Hα-helixtrans-59.7-45.2171.8-75.1-17.9000111.6M251 Q258 Q259M251-D255 PolarHBondContact O-N 2.64Å; D255-Q258 PolarHBondContact O-N 3.22Å; D255-Q259 WeakPolarHBondContact O-CG 3.41Å; D255-Q259 PolarHBondContact O-N 3.11Å
256L84.5Confident84.5Confident113 Ų11395.3 Ų95.359%0.59250%0.498SS*.Hα-helixtrans-65-40.9177.3-99.478.4000112.4Q252 L253 E254 Q258 Q259 L260Q252-L256 WeakPolarHBondContact O-CB 3.49Å; Q252-L256 WeakPolarHBondContact O-CD1 3.39Å; Q252-L256 PolarHBondContact O-N 2.89Å; L253-L256 PolarHBondContact O-N 2.87Å; E254-L256 PolarHBondContact O-N 2.91Å; L256-Q258 VanDerWaalsContact C-N 3.33Å; L256-Q259 PolarHBondContact O-N 3.18Å; L256-L260 WeakPolarHBondContact O-CB 3.49Å; L256-L260 PolarHBondContact O-N 3.01Å
257K85Confident84.6Confident101 Ų10194.9 Ų94.944%0.43950%0.501SS..Hα-helixtrans-61.4-43.2174.8-76.6175.4-169161.20111.3L253 E254 L260 Q261L253-K257 VanDerWaalsContact O-CG 3.32Å; L253-K257 WeakPolarHBondContact O-CG 3.47Å; L253-K257 PolarHBondContact O-N 3.47Å; E254-K257 PolarHBondContact O-N 3.04Å; E254-K257 IonicContact OE2-NZ 3.83Å; E254-K257 PolarHBondContact OE2-NZ 3.04Å; K257-L260 PolarHBondContact O-N 3.49Å; K257-Q261 WeakPolarHBondContact O-CB 3.35Å; K257-Q261 PolarHBondContact O-N 3.33Å
258Q88.9Confident85.1Confident117 Ų11795.8 Ų95.855%0.54750%0.504SS..Hα-helixtrans-67-39.7-179.9-168.3163.517.800111.8E254 D255 L256 Q261 Q262E254-Q258 WeakPolarHBondContact O-CB 3.47Å; E254-Q258 PolarHBondContact O-N 3.29Å; D255-Q258 PolarHBondContact O-N 3.22Å; L256-Q258 VanDerWaalsContact C-N 3.33Å; Q258-Q261 PolarHBondContact O-N 2.89Å; Q258-Q262 PolarHBondContact O-N 3.43Å
259Q88.8Confident85.5Confident130 Ų13096 Ų9661%0.60751%0.508SS*.Hα-helixtrans-63.6-42172.1-74.7179.9-6.600112.4D255 L256 Q262 A263D255-Q259 WeakPolarHBondContact O-CG 3.41Å; D255-Q259 PolarHBondContact O-N 3.11Å; L256-Q259 PolarHBondContact O-N 3.18Å; Q259-Q262 PolarHBondContact O-N 2.71Å; Q259-A263 WeakPolarHBondContact O-CB 3.28Å; Q259-A263 PolarHBondContact O-N 3.31Å
260L90Very high86.4Confident105 Ų10599 Ų9955%0.5552%0.515SS..Hα-helixtrans-61.5-47.9176.7-176.369.6000110.8L256 K257 Q262 A263 E264L256-L260 WeakPolarHBondContact O-CB 3.49Å; L256-L260 PolarHBondContact O-N 3.01Å; K257-L260 PolarHBondContact O-N 3.49Å; L260-Q262 PolarHBondContact O-N 2.85Å; L260-A263 WeakPolarHBondContact O-CB 3.35Å; L260-A263 PolarHBondContact O-N 2.81Å; L260-A263 VanDerWaalsContact O-N 3.13Å; L260-E264 WeakPolarHBondContact O-CG 3.47Å; L260-E264 PolarHBondContact O-N 3.43Å
261Q89.8Confident87.3Confident110 Ų110101.6 Ų101.651%0.51452%0.518SS..Hα-helixtrans-61.6-42.9179.3-174.1173.9-15.900111.9K257 Q258 A263 E264 E265K257-Q261 WeakPolarHBondContact O-CB 3.35Å; K257-Q261 PolarHBondContact O-N 3.33Å; Q258-Q261 PolarHBondContact O-N 2.89Å; Q261-A263 VanDerWaalsContact C-N 3.32Å; Q261-A263 PolarHBondContact O-N 2.9Å; Q261-E264 PolarHBondContact O-N 2.99Å; Q261-E265 PolarHBondContact NE2-OE1 2.83Å; Q261-E265 WeakPolarHBondContact O-CG 3.48Å; Q261-E265 PolarHBondContact O-N 3.4Å
262Q89.9Confident88.2Confident121 Ų121100.6 Ų100.657%0.56551%0.511SS*.Hα-helixtrans-62.5-38.5174.1-79.4-178.72.300112.6Q258 Q259 L260 A266Q258-Q262 PolarHBondContact O-N 3.43Å; Q259-Q262 PolarHBondContact O-N 2.71Å; L260-Q262 PolarHBondContact O-N 2.85Å; Q262-A266 VanDerWaalsContact O-CB 3.29Å; Q262-A266 WeakPolarHBondContact O-CB 3.46Å; Q262-A266 PolarHBondContact O-N 3.46Å
263A88.7Confident89.1Confident49 Ų4999.2 Ų99.241%0.40551%0.51SS..Hα-helixtrans-67.5-39.4176.600000111.8Q259 L260 Q261 A266 L267Q259-A263 WeakPolarHBondContact O-CB 3.28Å; Q259-A263 PolarHBondContact O-N 3.31Å; L260-A263 WeakPolarHBondContact O-CB 3.35Å; L260-A263 PolarHBondContact O-N 2.81Å; L260-A263 VanDerWaalsContact O-N 3.13Å; Q261-A263 VanDerWaalsContact C-N 3.32Å; Q261-A263 PolarHBondContact O-N 2.9Å; A263-A266 PolarHBondContact O-N 3.43Å; A263-L267 WeakPolarHBondContact O-CB 3.33Å; A263-L267 VanDerWaalsContact O-CG 3.31Å; A263-L267 WeakPolarHBondContact O-CG 3.38Å; A263-L267 PolarHBondContact O-N 3.13Å
264E90.2Very high89.6Confident109 Ų10998.2 Ų98.251%0.50951%0.505SS..Hα-helixtrans-61.5-49174.1-74.1176.2169.900111.5L260 Q261 A266 L267 V268L260-E264 WeakPolarHBondContact O-CG 3.47Å; L260-E264 PolarHBondContact O-N 3.43Å; Q261-E264 PolarHBondContact O-N 2.99Å; E264-A266 VanDerWaalsContact C-N 3.32Å; E264-A266 PolarHBondContact O-N 3Å; E264-L267 WeakPolarHBondContact O-CB 3.24Å; E264-L267 PolarHBondContact O-N 3.31Å; E264-L267 VanDerWaalsContact O-N 3.16Å; E264-V268 WeakPolarHBondContact O-CG2 3.43Å; E264-V268 PolarHBondContact O-N 2.95Å
265E91.4Very high90.1Very high114 Ų11496.7 Ų96.753%0.53350%0.5SS..Hα-helixtrans-60.3-41.4176.1-71.4173-169.500111.7Q261 L267 V268 A269Q261-E265 PolarHBondContact NE2-OE1 2.83Å; Q261-E265 WeakPolarHBondContact O-CG 3.48Å; Q261-E265 PolarHBondContact O-N 3.4Å; E265-L267 VanDerWaalsContact C-N 3.35Å; E265-L267 PolarHBondContact O-N 3.44Å; E265-V268 PolarHBondContact O-N 3.16Å; E265-A269 PolarHBondContact O-N 2.88Å
266A92.1Very high90.5Very high50 Ų5098.7 Ų98.741%0.41351%0.505SS..Hα-helixtrans-66.2-35.317600000112.7Q262 A263 E264 K270Q262-A266 VanDerWaalsContact O-CB 3.29Å; Q262-A266 WeakPolarHBondContact O-CB 3.46Å; Q262-A266 PolarHBondContact O-N 3.46Å; A263-A266 PolarHBondContact O-N 3.43Å; E264-A266 VanDerWaalsContact C-N 3.32Å; E264-A266 PolarHBondContact O-N 3Å; A266-K270 WeakPolarHBondContact O-CB 3.36Å; A266-K270 WeakPolarHBondContact O-CG 3.5Å; A266-K270 PolarHBondContact O-N 3.05Å
267L90.4Very high90.9Very high117 Ų11798.1 Ų98.161%0.61350%0.502SS*.Hα-helixtrans-67.2-41.8174-77.8173.1000111.3A263 E264 E265 K270 Q271A263-L267 WeakPolarHBondContact O-CB 3.33Å; A263-L267 VanDerWaalsContact O-CG 3.31Å; A263-L267 WeakPolarHBondContact O-CG 3.38Å; A263-L267 PolarHBondContact O-N 3.13Å; E264-L267 WeakPolarHBondContact O-CB 3.24Å; E264-L267 PolarHBondContact O-N 3.31Å; E264-L267 VanDerWaalsContact O-N 3.16Å; E265-L267 VanDerWaalsContact C-N 3.35Å; E265-L267 PolarHBondContact O-N 3.44Å; L267-K270 PolarHBondContact O-N 3.45Å; L267-Q271 WeakPolarHBondContact O-CB 3.39Å; L267-Q271 PolarHBondContact O-N 3.39Å
268V93.6Very high91.2Very high85 Ų8599.4 Ų99.452%0.51551%0.507SS..Hα-helixtrans-59.9-48.4173.9173.60000110.4E264 E265 K270 Q271 E272E264-V268 WeakPolarHBondContact O-CG2 3.43Å; E264-V268 PolarHBondContact O-N 2.95Å; E265-V268 PolarHBondContact O-N 3.16Å; V268-K270 VanDerWaalsContact C-N 3.32Å; V268-K270 PolarHBondContact O-N 3.36Å; V268-Q271 WeakPolarHBondContact O-CA 3.39Å; V268-Q271 WeakPolarHBondContact O-CB 3.48Å; V268-Q271 PolarHBondContact O-N 2.84Å; V268-E272 PolarHBondContact O-N 3.18Å
269A90.8Very high91.4Very high48 Ų4899.8 Ų99.840%0.39751%0.509SS..Hα-helixtrans-60.8-39.1177.100000112.6E265 E272 V273E265-A269 PolarHBondContact O-N 2.88Å; A269-E272 PolarHBondContact O-N 2.93Å; A269-V273 WeakPolarHBondContact O-CG2 3.4Å; A269-V273 PolarHBondContact O-N 3.29Å
270K91.9Very high91.5Very high141 Ų14198.1 Ų98.161%0.61350%0.501SS*.Hα-helixtrans-65.8-37.5173.1-77.9-177.9-177.3-64.30112.1A266 L267 V268 V273 I274A266-K270 WeakPolarHBondContact O-CB 3.36Å; A266-K270 WeakPolarHBondContact O-CG 3.5Å; A266-K270 PolarHBondContact O-N 3.05Å; L267-K270 PolarHBondContact O-N 3.45Å; V268-K270 VanDerWaalsContact C-N 3.32Å; V268-K270 PolarHBondContact O-N 3.36Å; K270-V273 PolarHBondContact O-N 2.91Å; K270-I274 WeakPolarHBondContact O-CG1 3.37Å; K270-I274 PolarHBondContact O-N 3.02Å
271Q91.8Very high91.5Very high88 Ų8895.9 Ų95.941%0.41150%0.498SS..Hα-helixtrans-63.8-43177-171.654.955.700110.7L267 V268 V273 I274 D275L267-Q271 WeakPolarHBondContact O-CB 3.39Å; L267-Q271 PolarHBondContact O-N 3.39Å; V268-Q271 WeakPolarHBondContact O-CA 3.39Å; V268-Q271 WeakPolarHBondContact O-CB 3.48Å; V268-Q271 PolarHBondContact O-N 2.84Å; Q271-V273 VanDerWaalsContact C-N 3.3Å; Q271-V273 PolarHBondContact O-N 2.94Å; Q271-I274 WeakPolarHBondContact O-CB 3.49Å; Q271-I274 PolarHBondContact O-N 3.31Å; Q271-I274 VanDerWaalsContact O-N 3.12Å; Q271-D275 PolarHBondContact NE2-OD1 3.42Å; Q271-D275 VanDerWaalsContact O-CG 3.26Å; Q271-D275 PolarHBondContact O-N 3.36Å
272E92.2Very high91.6Very high112 Ų11295.2 Ų95.252%0.52349%0.494SS..Hα-helixtrans-59.7-39.1174.6-69176.8179.100112.5V268 A269 D275 K276V268-E272 PolarHBondContact O-N 3.18Å; A269-E272 PolarHBondContact O-N 2.93Å; E272-D275 PolarHBondContact O-N 2.9Å; E272-K276 WeakPolarHBondContact O-CG 3.22Å; E272-K276 PolarHBondContact O-N 2.93Å
273V93.7Very high91.6Very high83 Ų8394.4 Ų94.450%0.50349%0.491SS..Hα-helixtrans-66.3-41.5175173.40000111.3A269 K270 Q271 D275 K276 L277A269-V273 WeakPolarHBondContact O-CG2 3.4Å; A269-V273 PolarHBondContact O-N 3.29Å; K270-V273 PolarHBondContact O-N 2.91Å; Q271-V273 VanDerWaalsContact C-N 3.3Å; Q271-V273 PolarHBondContact O-N 2.94Å; V273-D275 VanDerWaalsContact C-N 3.31Å; V273-D275 PolarHBondContact O-N 3.47Å; V273-K276 PolarHBondContact O-N 3.27Å; V273-L277 HydrophobicContact CG1-CD1 4.04Å; V273-L277 HydrophobicContact CG1-CG 4.42Å; V273-L277 WeakPolarHBondContact O-CB 3.46Å; V273-L277 WeakPolarHBondContact O-CG 3.48Å; V273-L277 PolarHBondContact O-N 3.29Å
274I90.6Very high91.7Very high72 Ų7298 Ų9837%0.36950%0.499SS..Hα-helixtrans-61.2-43.7175.4-70.8166.8000110.5K270 Q271 L277 K278K270-I274 WeakPolarHBondContact O-CG1 3.37Å; K270-I274 PolarHBondContact O-N 3.02Å; Q271-I274 WeakPolarHBondContact O-CB 3.49Å; Q271-I274 PolarHBondContact O-N 3.31Å; Q271-I274 VanDerWaalsContact O-N 3.12Å; I274-L277 PolarHBondContact O-N 3.48Å; I274-K278 HydrophobicContact CG2-CD 4.14Å; I274-K278 HydrophobicContact CG2-CG 4.41Å; I274-K278 WeakPolarHBondContact O-CG 3.49Å; I274-K278 PolarHBondContact O-N 2.91Å
275D92.8Very high91.8Very high77 Ų7797.6 Ų97.641%0.41250%0.495SS..Hα-helixtrans-65.2-40.8-179-65.5-24.4000111.1Q271 E272 V273 K278 E279Q271-D275 PolarHBondContact NE2-OD1 3.42Å; Q271-D275 VanDerWaalsContact O-CG 3.26Å; Q271-D275 PolarHBondContact O-N 3.36Å; E272-D275 PolarHBondContact O-N 2.9Å; V273-D275 VanDerWaalsContact C-N 3.31Å; V273-D275 PolarHBondContact O-N 3.47Å; D275-K278 PolarHBondContact O-N 3.4Å; D275-E279 PolarHBondContact O-N 3.5Å
276K94.2Very high91.7Very high131 Ų13197 Ų9757%0.5750%0.495SS*.Hα-helixtrans-60.3-47.5171-74.8179.1-177.5177.60112.7E272 V273 K278 E279 E280E272-K276 WeakPolarHBondContact O-CG 3.22Å; E272-K276 PolarHBondContact O-N 2.93Å; V273-K276 PolarHBondContact O-N 3.27Å; K276-K278 VanDerWaalsContact C-N 3.27Å; K276-K278 PolarHBondContact O-N 2.9Å; K276-E279 WeakPolarHBondContact O-CB 3.39Å; K276-E279 PolarHBondContact O-N 2.85Å; K276-E279 VanDerWaalsContact O-N 3.16Å; K276-E280 WeakPolarHBondContact O-CG 3.32Å; K276-E280 PolarHBondContact O-N 3.36Å
277L92.2Very high91.7Very high101 Ų10199.1 Ų99.153%0.52950%0.502SS..Hα-helixtrans-63.3-34.5178.9-73.8172.9000112.1V273 I274 A281V273-L277 HydrophobicContact CG1-CD1 4.04Å; V273-L277 HydrophobicContact CG1-CG 4.42Å; V273-L277 WeakPolarHBondContact O-CB 3.46Å; V273-L277 WeakPolarHBondContact O-CG 3.48Å; V273-L277 PolarHBondContact O-N 3.29Å; I274-L277 PolarHBondContact O-N 3.48Å; L277-A281 VanDerWaalsContact O-CB 3.24Å; L277-A281 WeakPolarHBondContact O-CB 3.3Å; L277-A281 PolarHBondContact O-N 3.43Å
278K91.8Very high91.5Very high128 Ų12899.9 Ų99.956%0.55750%0.504SS*.Hα-helixtrans-67-41.3173.3-77.1176.2179.1173.80111.9I274 D275 K276 A281 E282I274-K278 HydrophobicContact CG2-CD 4.14Å; I274-K278 HydrophobicContact CG2-CG 4.41Å; I274-K278 WeakPolarHBondContact O-CG 3.49Å; I274-K278 PolarHBondContact O-N 2.91Å; D275-K278 PolarHBondContact O-N 3.4Å; K276-K278 VanDerWaalsContact C-N 3.27Å; K276-K278 PolarHBondContact O-N 2.9Å; K278-A281 PolarHBondContact O-N 3.14Å; K278-E282 PolarHBondContact O-N 3.04Å
279E91.7Very high91.3Very high124 Ų124101.6 Ų101.658%0.57951%0.507SS*.Hα-helixtrans-62.4-48.9175.8-171.9-179.318000111.2D275 K276 A281 E282 Q283D275-E279 PolarHBondContact O-N 3.5Å; K276-E279 WeakPolarHBondContact O-CB 3.39Å; K276-E279 PolarHBondContact O-N 2.85Å; K276-E279 VanDerWaalsContact O-N 3.16Å; E279-A281 VanDerWaalsContact C-N 3.29Å; E279-A281 PolarHBondContact O-N 2.9Å; E279-E282 PolarHBondContact O-N 2.9Å; E279-Q283 WeakPolarHBondContact O-CG 3.39Å; E279-Q283 PolarHBondContact O-N 3.36Å
280E91.8Very high91.2Very high96 Ų96102.6 Ų102.645%0.44951%0.508SS..Hα-helixtrans-59.6-39.3174.8-71.4176.6-176.700111.9K276 Q283 H284K276-E280 WeakPolarHBondContact O-CG 3.32Å; K276-E280 PolarHBondContact O-N 3.36Å; E280-Q283 PolarHBondContact O-N 2.91Å; E280-H284 WeakPolarHBondContact O-CB 3.36Å; E280-H284 VanDerWaalsContact O-CG 3.29Å; E280-H284 PolarHBondContact O-N 2.84Å; E280-H284 PolarHBondContact O-ND1 3.43Å
281A90.3Very high91.1Very high57 Ų57100 Ų10047%0.47150%0.504SS..Hα-helixtrans-63.7-40.5176.100000112.4L277 K278 E279 H284 K285L277-A281 VanDerWaalsContact O-CB 3.24Å; L277-A281 WeakPolarHBondContact O-CB 3.3Å; L277-A281 PolarHBondContact O-N 3.43Å; K278-A281 PolarHBondContact O-N 3.14Å; E279-A281 VanDerWaalsContact C-N 3.29Å; E279-A281 PolarHBondContact O-N 2.9Å; A281-H284 PolarHBondContact O-N 2.92Å; A281-K285 WeakPolarHBondContact O-CB 3.42Å; A281-K285 PolarHBondContact O-N 3.42Å
282E90.8Very high91Very high96 Ų9699.9 Ų99.945%0.44951%0.511SS..Hα-helixtrans-69.6-38.1176.6-162.263.6-156.300111.3K278 E279 H284 K285 I286K278-E282 PolarHBondContact O-N 3.04Å; E279-E282 PolarHBondContact O-N 2.9Å; E282-H284 PolarHBondContact O-N 3.33Å; E282-K285 WeakPolarHBondContact O-CB 3.28Å; E282-K285 PolarHBondContact O-N 2.9Å; E282-K285 IonicContact OE1-NZ 2.78Å; E282-K285 PolarHBondContact OE1-NZ 3.4Å; E282-K285 IonicContact OE2-NZ 3.34Å; E282-K285 PolarHBondContact OE2-NZ 3.32Å; E282-I286 WeakPolarHBondContact O-CG1 3.49Å; E282-I286 PolarHBondContact O-N 3.29Å; E282-I286 VanDerWaalsContact O-N 3.09Å
283Q90.9Very high90.9Very high104 Ų10499.2 Ų99.249%0.48651%0.514SS..Hα-helixtrans-59.4-46.7171.5-69.7174.78.500111.5E279 E280 K285 I286 V287E279-Q283 WeakPolarHBondContact O-CG 3.39Å; E279-Q283 PolarHBondContact O-N 3.36Å; E280-Q283 PolarHBondContact O-N 2.91Å; Q283-K285 VanDerWaalsContact C-N 3.3Å; Q283-K285 PolarHBondContact O-N 3.38Å; Q283-I286 PolarHBondContact O-N 2.84Å; Q283-V287 PolarHBondContact O-N 3.33Å; Q283-V287 VanDerWaalsContact O-N 3.17Å
284H91.6Very high90.7Very high124 Ų124100.1 Ų100.157%0.57452%0.516SS*.Hα-helixtrans-61.4-38.1175.8-72.3145.3000112.4E280 A281 E282 V287 M288E280-H284 WeakPolarHBondContact O-CB 3.36Å; E280-H284 VanDerWaalsContact O-CG 3.29Å; E280-H284 PolarHBondContact O-N 2.84Å; E280-H284 PolarHBondContact O-ND1 3.43Å; A281-H284 PolarHBondContact O-N 2.92Å; E282-H284 PolarHBondContact O-N 3.33Å; H284-V287 PolarHBondContact O-N 2.9Å; H284-M288 WeakPolarHBondContact O-CG 3.31Å; H284-M288 PolarHBondContact O-N 2.91Å
285K92Very high90.7Very high101 Ų101102.1 Ų102.144%0.43952%0.522SS..Hα-helixtrans-61.8-43.6176.9-176.7179.9156.8-1470112.1A281 E282 Q283 V287 M288 E289A281-K285 WeakPolarHBondContact O-CB 3.42Å; A281-K285 PolarHBondContact O-N 3.42Å; E282-K285 WeakPolarHBondContact O-CB 3.28Å; E282-K285 PolarHBondContact O-N 2.9Å; E282-K285 IonicContact OE1-NZ 2.78Å; E282-K285 PolarHBondContact OE1-NZ 3.4Å; E282-K285 IonicContact OE2-NZ 3.34Å; E282-K285 PolarHBondContact OE2-NZ 3.32Å; Q283-K285 VanDerWaalsContact C-N 3.3Å; Q283-K285 PolarHBondContact O-N 3.38Å; K285-V287 VanDerWaalsContact C-N 3.34Å; K285-V287 PolarHBondContact O-N 3.1Å; K285-M288 WeakPolarHBondContact O-CB 3.34Å; K285-M288 PolarHBondContact O-N 2.88Å; K285-M288 VanDerWaalsContact O-N 3.14Å; K285-E289 WeakPolarHBondContact O-CG 3.48Å; K285-E289 PolarHBondContact O-N 3.15Å
286I89.3Confident90.6Very high102 Ų102100.8 Ų100.852%0.52352%0.522SS..Hα-helixtrans-60.2-44.1174.8-63.4164000110.8E282 Q283 M288 E289E282-I286 WeakPolarHBondContact O-CG1 3.49Å; E282-I286 PolarHBondContact O-N 3.29Å; E282-I286 VanDerWaalsContact O-N 3.09Å; Q283-I286 PolarHBondContact O-N 2.84Å; I286-M288 VanDerWaalsContact C-N 3.32Å; I286-M288 PolarHBondContact O-N 3.02Å; I286-E289 WeakPolarHBondContact O-CB 3.19Å; I286-E289 PolarHBondContact O-N 3.13Å
287V90.6Very high90.4Very high94 Ų9498.5 Ų98.557%0.5751%0.513SS*.Hα-helixtrans-64-40175.9177.90000110.9Q283 H284 K285 E289 T290Q283-V287 PolarHBondContact O-N 3.33Å; Q283-V287 VanDerWaalsContact O-N 3.17Å; H284-V287 PolarHBondContact O-N 2.9Å; K285-V287 VanDerWaalsContact C-N 3.34Å; K285-V287 PolarHBondContact O-N 3.1Å; V287-E289 VanDerWaalsContact C-N 3.28Å; V287-E289 PolarHBondContact O-N 3.07Å; V287-T290 WeakPolarHBondContact O-CB 3.3Å; V287-T290 WeakPolarHBondContact O-CG2 3.4Å; V287-T290 PolarHBondContact O-N 3.04Å; V287-T290 VanDerWaalsContact O-N 3.07Å; V287-T290 PolarHBondContact O-OG1 3.29Å
288M87.7Confident90.2Very high133 Ų13396.3 Ų96.366%0.65551%0.509SS*.Hα-helixtrans-63.1-30.4176.9-76.2-1607300113.4H284 K285 I286 T290 V291 P292H284-M288 WeakPolarHBondContact O-CG 3.31Å; H284-M288 PolarHBondContact O-N 2.91Å; K285-M288 WeakPolarHBondContact O-CB 3.34Å; K285-M288 PolarHBondContact O-N 2.88Å; K285-M288 VanDerWaalsContact O-N 3.14Å; I286-M288 VanDerWaalsContact C-N 3.32Å; I286-M288 PolarHBondContact O-N 3.02Å; M288-T290 PolarHBondContact O-N 3.3Å; M288-T290 VanDerWaalsContact O-N 3.16Å; M288-V291 WeakPolarHBondContact O-CB 3.22Å; M288-V291 PolarHBondContact O-N 2.84Å; M288-P292 WeakPolarHBondContact O-CD 3.37Å
289E88.8Confident90.2Very high122 Ų12293.7 Ų93.757%0.5750%0.501SS*.THydrogen-bonded Turntrans-63.5-15.3173.8-70.8175.8-179.600113.3K285 I286 V287 P292K285-E289 WeakPolarHBondContact O-CG 3.48Å; K285-E289 PolarHBondContact O-N 3.15Å; I286-E289 WeakPolarHBondContact O-CB 3.19Å; I286-E289 PolarHBondContact O-N 3.13Å; V287-E289 VanDerWaalsContact C-N 3.28Å; V287-E289 PolarHBondContact O-N 3.07Å; E289-P292 WeakPolarHBondContact O-CD 3.42Å
290T89.4Confident90.1Very high68 Ų6892.6 Ų92.642%0.41750%0.498SS..Hα-helixtrans-77.3-21.8173.171.50000113.3V287 M288 V293 L294V287-T290 WeakPolarHBondContact O-CB 3.3Å; V287-T290 WeakPolarHBondContact O-CG2 3.4Å; V287-T290 PolarHBondContact O-N 3.04Å; V287-T290 VanDerWaalsContact O-N 3.07Å; V287-T290 PolarHBondContact O-OG1 3.29Å; M288-T290 PolarHBondContact O-N 3.3Å; M288-T290 VanDerWaalsContact O-N 3.16Å; T290-V293 WeakPolarHBondContact O-CB 3.5Å; T290-V293 PolarHBondContact O-N 2.93Å; T290-L294 WeakPolarHBondContact O-CG 3.44Å; T290-L294 PolarHBondContact O-N 3.47Å
291V88.3Confident90.1Very high86 Ų8694.8 Ų94.852%0.52150%0.504SS..Hα-helixtrans-64.2-45.9-176.8-179.70000112.1M288 V293 L294 K295M288-V291 WeakPolarHBondContact O-CB 3.22Å; M288-V291 PolarHBondContact O-N 2.84Å; V291-V293 VanDerWaalsContact C-N 3.27Å; V291-V293 PolarHBondContact O-N 3.29Å; V291-L294 PolarHBondContact O-N 3.08Å; V291-K295 WeakPolarHBondContact O-CB 3.27Å; V291-K295 PolarHBondContact O-N 2.9Å
292P89.9Confident90.2Very high87 Ų8798.1 Ų98.157%0.56551%0.507SS*.Hα-helixtrans-57.5-37.4172.4-25.133.8000113.5M288 E289 K295 A296M288-P292 WeakPolarHBondContact O-CD 3.37Å; E289-P292 WeakPolarHBondContact O-CD 3.42Å; P292-K295 PolarHBondContact O-N 2.92Å; P292-A296 WeakPolarHBondContact O-CB 3.48Å; P292-A296 PolarHBondContact O-N 3.34Å
293V90.4Very high90.2Very high98 Ų9896 Ų9659%0.59451%0.506SS*.Hα-helixtrans-66.6-49.5178.7-179.70000110.8T290 V291 K295 A296 Q297T290-V293 WeakPolarHBondContact O-CB 3.5Å; T290-V293 PolarHBondContact O-N 2.93Å; V291-V293 VanDerWaalsContact C-N 3.27Å; V291-V293 PolarHBondContact O-N 3.29Å; V293-K295 VanDerWaalsContact C-N 3.27Å; V293-K295 PolarHBondContact O-N 2.93Å; V293-A296 PolarHBondContact O-N 3.24Å; V293-Q297 WeakPolarHBondContact O-CB 3.3Å; V293-Q297 PolarHBondContact O-N 3.34Å
294L90.3Very high90.2Very high101 Ų10195.5 Ų95.553%0.52951%0.507SS..Hα-helixtrans-62.3-36176.3-69.2172.4000111.8T290 V291 Q297 A298T290-L294 WeakPolarHBondContact O-CG 3.44Å; T290-L294 PolarHBondContact O-N 3.47Å; V291-L294 PolarHBondContact O-N 3.08Å; L294-Q297 PolarHBondContact O-N 3.02Å; L294-A298 PolarHBondContact O-N 3.46Å
295K90.7Very high90.2Very high114 Ų11496.5 Ų96.550%0.49651%0.51SS..Hα-helixtrans-64.2-46.7174.9-176.268.8-174.782.20111.6V291 P292 V293 Q297 A298 D299V291-K295 WeakPolarHBondContact O-CB 3.27Å; V291-K295 PolarHBondContact O-N 2.9Å; P292-K295 PolarHBondContact O-N 2.92Å; V293-K295 VanDerWaalsContact C-N 3.27Å; V293-K295 PolarHBondContact O-N 2.93Å; K295-Q297 VanDerWaalsContact C-N 3.33Å; K295-Q297 PolarHBondContact O-N 3.31Å; K295-A298 PolarHBondContact O-N 3.44Å; K295-D299 IonicContact NZ-OD1 2.64Å; K295-D299 PolarHBondContact NZ-OD1 2.91Å; K295-D299 IonicContact NZ-OD2 3.91Å; K295-D299 PolarHBondContact NZ-OD2 2.83Å; K295-D299 PolarHBondContact O-N 3.02Å
296A90.4Very high90.1Very high50 Ų5096.6 Ų96.641%0.41351%0.512SS..Hα-helixtrans-61.6-41.5175.500000111.5P292 V293 A298 D299 I300P292-A296 WeakPolarHBondContact O-CB 3.48Å; P292-A296 PolarHBondContact O-N 3.34Å; V293-A296 PolarHBondContact O-N 3.24Å; A296-A298 PolarHBondContact O-N 2.9Å; A296-D299 PolarHBondContact O-N 3.26Å; A296-I300 WeakPolarHBondContact O-CG1 3.33Å; A296-I300 PolarHBondContact O-N 3.2Å
297Q89Confident90.2Very high83 Ų8394.4 Ų94.439%0.38851%0.509SS..Hα-helixtrans-60-43.6175.5-172175.813.800112.1V293 L294 K295 D299 I300 Y301V293-Q297 WeakPolarHBondContact O-CB 3.3Å; V293-Q297 PolarHBondContact O-N 3.34Å; L294-Q297 PolarHBondContact O-N 3.02Å; K295-Q297 VanDerWaalsContact C-N 3.33Å; K295-Q297 PolarHBondContact O-N 3.31Å; Q297-D299 VanDerWaalsContact C-N 3.35Å; Q297-D299 PolarHBondContact O-N 3.5Å; Q297-I300 PolarHBondContact O-N 2.96Å; Q297-Y301 HydrophobicContact CG-CD2 4.08Å; Q297-Y301 HydrophobicContact CG-CE2 3.57Å; Q297-Y301 PolarHBondContact NE2-OH 2.79Å; Q297-Y301 VanDerWaalsContact NE2-OH 3.17Å; Q297-Y301 WeakPolarHBondContact O-CD2 3.26Å; Q297-Y301 PolarHBondContact O-N 3.46Å
298A88.7Confident90.2Very high54 Ų5495.1 Ų95.145%0.44651%0.506SS..Hα-helixtrans-64.5-37.2175.500000112.7L294 K295 A296 K302L294-A298 PolarHBondContact O-N 3.46Å; K295-A298 PolarHBondContact O-N 3.44Å; A296-A298 PolarHBondContact O-N 2.9Å; A298-K302 WeakPolarHBondContact O-CB 3.44Å; A298-K302 PolarHBondContact O-N 3.3Å
299D90.9Very high90.3Very high74 Ų7496 Ų9640%0.39650%0.502SS..Hα-helixtrans-69.5-37.6177-70.1-32.3000112.1K295 A296 Q297 K302 A303K295-D299 IonicContact NZ-OD1 2.64Å; K295-D299 PolarHBondContact NZ-OD1 2.91Å; K295-D299 IonicContact NZ-OD2 3.91Å; K295-D299 PolarHBondContact NZ-OD2 2.83Å; K295-D299 PolarHBondContact O-N 3.02Å; A296-D299 PolarHBondContact O-N 3.26Å; Q297-D299 VanDerWaalsContact C-N 3.35Å; Q297-D299 PolarHBondContact O-N 3.5Å; D299-K302 PolarHBondContact O-N 3.38Å; D299-A303 PolarHBondContact O-N 2.85Å
300I90.2Very high90.4Very high100 Ų10095.6 Ų95.651%0.51350%0.5SS..Hα-helixtrans-63.1-51172.8-67.6165.1000110.5A296 Q297 K302 A303 D304A296-I300 WeakPolarHBondContact O-CG1 3.33Å; A296-I300 PolarHBondContact O-N 3.2Å; Q297-I300 PolarHBondContact O-N 2.96Å; I300-K302 PolarHBondContact O-N 3.21Å; I300-A303 WeakPolarHBondContact O-CA 3.17Å; I300-A303 WeakPolarHBondContact O-CB 3.32Å; I300-A303 PolarHBondContact O-N 3.35Å; I300-D304 PolarHBondContact O-N 2.93Å
301Y92.3Very high90.3Very high143 Ų14395 Ų9556%0.56150%0.502SS*.Hα-helixtrans-59.9-34.9178.4-71.9-37.4000113Q297 F305Q297-Y301 HydrophobicContact CG-CD2 4.08Å; Q297-Y301 HydrophobicContact CG-CE2 3.57Å; Q297-Y301 PolarHBondContact NE2-OH 2.79Å; Q297-Y301 VanDerWaalsContact NE2-OH 3.17Å; Q297-Y301 WeakPolarHBondContact O-CD2 3.26Å; Q297-Y301 PolarHBondContact O-N 3.46Å; Y301-F305 VanDerWaalsContact O-CB 3.3Å; Y301-F305 WeakPolarHBondContact O-CB 3.42Å; Y301-F305 PolarHBondContact O-N 2.9Å
302K92.4Very high90.3Very high127 Ų12799 Ų9955%0.55251%0.508SS*.Hα-helixtrans-64.9-43.1173.4-178-177.8175.8-173.60111.6A298 D299 I300 Q306A298-K302 WeakPolarHBondContact O-CB 3.44Å; A298-K302 PolarHBondContact O-N 3.3Å; D299-K302 PolarHBondContact O-N 3.38Å; I300-K302 PolarHBondContact O-N 3.21Å; K302-Q306 VanDerWaalsContact O-CG 3.3Å; K302-Q306 WeakPolarHBondContact O-CG 3.43Å; K302-Q306 PolarHBondContact O-N 2.9Å; K302-Q306 VanDerWaalsContact O-N 3.1Å
303A90.6Very high90.2Very high51 Ų5199 Ų9942%0.42150%0.5SS..Hα-helixtrans-63.8-45.8176.400000111.5D299 I300 F305 Q306 A307D299-A303 PolarHBondContact O-N 2.85Å; I300-A303 WeakPolarHBondContact O-CA 3.17Å; I300-A303 WeakPolarHBondContact O-CB 3.32Å; I300-A303 PolarHBondContact O-N 3.35Å; A303-F305 PolarHBondContact O-N 3.22Å; A303-Q306 PolarHBondContact O-N 3.27Å; A303-A307 PolarHBondContact O-N 2.87Å
304D91.6Very high90.1Very high93 Ų93100.5 Ų100.550%0.49750%0.499SS..Hα-helixtrans-61.1-44.3177.5-70.7-13.9000111.7I300 Q306 A307 E308I300-D304 PolarHBondContact O-N 2.93Å; D304-Q306 VanDerWaalsContact C-N 3.32Å; D304-Q306 PolarHBondContact O-N 3.49Å; D304-A307 PolarHBondContact O-N 2.86Å; D304-E308 WeakPolarHBondContact O-CB 3.24Å; D304-E308 PolarHBondContact O-N 2.87Å
305F90.9Very high89.8Confident145 Ų145101.4 Ų101.464%0.63650%0.503SS*.Hα-helixtrans-60.5-40.5175.5177.3-96.6000112.3Y301 A303 R309Y301-F305 VanDerWaalsContact O-CB 3.3Å; Y301-F305 WeakPolarHBondContact O-CB 3.42Å; Y301-F305 PolarHBondContact O-N 2.9Å; A303-F305 PolarHBondContact O-N 3.22Å; F305-R309 WeakPolarHBondContact O-CB 3.4Å; F305-R309 PolarHBondContact O-N 2.92Å
306Q90.8Very high89.6Confident103 Ų10398.5 Ų98.548%0.48150%0.501SS..Hα-helixtrans-67.4-40.3176.4-73176.1-2.800112K302 A303 D304 R309 Q310K302-Q306 VanDerWaalsContact O-CG 3.3Å; K302-Q306 WeakPolarHBondContact O-CG 3.43Å; K302-Q306 PolarHBondContact O-N 2.9Å; K302-Q306 VanDerWaalsContact O-N 3.1Å; A303-Q306 PolarHBondContact O-N 3.27Å; D304-Q306 VanDerWaalsContact C-N 3.32Å; D304-Q306 PolarHBondContact O-N 3.49Å; Q306-R309 PolarHBondContact O-N 3.33Å; Q306-Q310 WeakPolarHBondContact O-CG 3.28Å; Q306-Q310 PolarHBondContact O-N 2.87Å
307A89.5Confident89.4Confident56 Ų56102.7 Ų102.746%0.46351%0.512SS..Hα-helixtrans-62.8-46.1175.500000111.7A303 D304 R309 Q310 A311A303-A307 PolarHBondContact O-N 2.87Å; D304-A307 PolarHBondContact O-N 2.86Å; A307-R309 VanDerWaalsContact C-N 3.34Å; A307-R309 PolarHBondContact O-N 2.82Å; A307-Q310 PolarHBondContact O-N 3.5Å; A307-A311 WeakPolarHBondContact O-CB 3.25Å; A307-A311 PolarHBondContact O-N 3.45Å
308E91.1Very high89.3Confident109 Ų109105.3 Ų105.351%0.50952%0.522SS..Hα-helixtrans-62-41.3176.6-174.962-158.200111.6D304 A311 R312D304-E308 WeakPolarHBondContact O-CB 3.24Å; D304-E308 PolarHBondContact O-N 2.87Å; E308-A311 PolarHBondContact O-N 3.44Å; E308-R312 PolarHBondContact O-N 2.84Å
309R90.8Very high89.1Confident151 Ų151108.8 Ų108.857%0.5753%0.527SS*.Hα-helixtrans-61-49.1174.6178-179.8170.1171.7-0.2111.8F305 Q306 A307 A311 R312 E313F305-R309 WeakPolarHBondContact O-CB 3.4Å; F305-R309 PolarHBondContact O-N 2.92Å; Q306-R309 PolarHBondContact O-N 3.33Å; A307-R309 VanDerWaalsContact C-N 3.34Å; A307-R309 PolarHBondContact O-N 2.82Å; R309-A311 VanDerWaalsContact C-N 3.29Å; R309-A311 PolarHBondContact O-N 3.3Å; R309-R312 WeakPolarHBondContact O-CB 3.44Å; R309-R312 PolarHBondContact O-N 2.91Å; R309-R312 VanDerWaalsContact O-N 3.16Å; R309-E313 IonicContact CZ-OE1 3.42Å; R309-E313 IonicContact NE-OE1 2.81Å; R309-E313 PolarHBondContact NE-OE1 3.45Å; R309-E313 IonicContact NH2-OE1 3.12Å; R309-E313 PolarHBondContact NH2-OE1 3.31Å; R309-E313 VanDerWaalsContact NH2-OE1 3.12Å; R309-E313 WeakPolarHBondContact O-CG 3.26Å; R309-E313 PolarHBondContact O-N 3.36Å
310Q89.9Confident88.8Confident115 Ų115110.4 Ų110.454%0.53753%0.532SS..Hα-helixtrans-61.2-38.6177.8-76.9-178.9-5.600112Q306 A307 E313 K314Q306-Q310 WeakPolarHBondContact O-CG 3.28Å; Q306-Q310 PolarHBondContact O-N 2.87Å; A307-Q310 PolarHBondContact O-N 3.5Å; Q310-E313 PolarHBondContact O-N 3.5Å; Q310-K314 WeakPolarHBondContact O-CG 3.48Å; Q310-K314 PolarHBondContact O-N 2.85Å
311A87.2Confident88.5Confident54 Ų54110.1 Ų110.145%0.44653%0.531SS..Hα-helixtrans-62.7-42.3174.800000111.5A307 E308 R309 L315A307-A311 WeakPolarHBondContact O-CB 3.25Å; A307-A311 PolarHBondContact O-N 3.45Å; E308-A311 PolarHBondContact O-N 3.44Å; R309-A311 VanDerWaalsContact C-N 3.29Å; R309-A311 PolarHBondContact O-N 3.3Å; A311-L315 WeakPolarHBondContact O-CB 3.32Å; A311-L315 PolarHBondContact O-N 3.1Å
312R87.8Confident88Confident172 Ų172108.6 Ų108.665%0.64953%0.532SS*.Hα-helixtrans-64.1-43.2174.1-97.8-174.7168.3132.8-2113.4E308 R309 L315 A316E308-R312 PolarHBondContact O-N 2.84Å; R309-R312 WeakPolarHBondContact O-CB 3.44Å; R309-R312 PolarHBondContact O-N 2.91Å; R309-R312 VanDerWaalsContact O-N 3.16Å; R312-L315 PolarHBondContact O-N 3.3Å; R312-A316 WeakPolarHBondContact O-CB 3.32Å; R312-A316 PolarHBondContact O-N 3.43Å
313E88Confident87.5Confident85 Ų85107 Ų10740%0.39753%0.526SS..Hα-helixtrans-60.3-46.6177.1-74.5170.1173.900110.5R309 Q310 L315 A316 E317R309-E313 IonicContact CZ-OE1 3.42Å; R309-E313 IonicContact NE-OE1 2.81Å; R309-E313 PolarHBondContact NE-OE1 3.45Å; R309-E313 IonicContact NH2-OE1 3.12Å; R309-E313 PolarHBondContact NH2-OE1 3.31Å; R309-E313 VanDerWaalsContact NH2-OE1 3.12Å; R309-E313 WeakPolarHBondContact O-CG 3.26Å; R309-E313 PolarHBondContact O-N 3.36Å; Q310-E313 PolarHBondContact O-N 3.5Å; E313-L315 VanDerWaalsContact C-N 3.31Å; E313-L315 PolarHBondContact O-N 2.85Å; E313-A316 WeakPolarHBondContact O-CB 3.42Å; E313-A316 PolarHBondContact O-N 3.18Å; E313-E317 WeakPolarHBondContact O-CG 3.42Å; E313-E317 PolarHBondContact O-N 3.38Å
314K88.3Confident87Confident131 Ų131110.4 Ų110.457%0.5753%0.534SS*.Hα-helixtrans-62-35.1174.2-72178.7-177.81760113.5Q310 K318Q310-K314 WeakPolarHBondContact O-CG 3.48Å; Q310-K314 PolarHBondContact O-N 2.85Å; K314-K318 WeakPolarHBondContact O-CG 3.41Å; K314-K318 PolarHBondContact O-N 3.35Å; K314-K318 VanDerWaalsContact O-N 3.12Å
315L85.7Confident86.5Confident119 Ų119111.1 Ų111.162%0.62353%0.534SS*.Hα-helixtrans-70.2-39.8176.6-16773.6000111.2A311 R312 E313 K318 K319A311-L315 WeakPolarHBondContact O-CB 3.32Å; A311-L315 PolarHBondContact O-N 3.1Å; R312-L315 PolarHBondContact O-N 3.3Å; E313-L315 VanDerWaalsContact C-N 3.31Å; E313-L315 PolarHBondContact O-N 2.85Å; L315-K318 PolarHBondContact O-N 2.84Å; L315-K319 PolarHBondContact O-N 3.4Å
316A86.4Confident85.9Confident54 Ų54109.2 Ų109.245%0.44653%0.53SS..Hα-helixtrans-62.9-45.2174.600000111.2R312 E313 K318 K319 E320R312-A316 WeakPolarHBondContact O-CB 3.32Å; R312-A316 PolarHBondContact O-N 3.43Å; E313-A316 WeakPolarHBondContact O-CB 3.42Å; E313-A316 PolarHBondContact O-N 3.18Å; A316-K318 VanDerWaalsContact C-N 3.35Å; A316-K318 PolarHBondContact O-N 2.83Å; A316-K319 WeakPolarHBondContact O-CB 3.3Å; A316-K319 PolarHBondContact O-N 3.04Å; A316-K319 VanDerWaalsContact O-N 3.13Å; A316-E320 WeakPolarHBondContact O-CG 3.34Å; A316-E320 PolarHBondContact O-N 3.31Å
317E85.8Confident85.5Confident137 Ų137109 Ų10964%0.6453%0.529SS*.Hα-helixtrans-55.7-46.6173.1-74.5175.3175.400112.2E313 K319 E320 L321E313-E317 WeakPolarHBondContact O-CG 3.42Å; E313-E317 PolarHBondContact O-N 3.38Å; E317-K319 VanDerWaalsContact C-N 3.33Å; E317-K319 PolarHBondContact O-N 3.07Å; E317-E320 PolarHBondContact O-N 3.32Å; E317-L321 PolarHBondContact O-N 2.83Å
318K85.5Confident85Confident139 Ų139110.2 Ų110.260%0.60453%0.525SS*.Hα-helixtrans-64-36.3176.8-74.9-179.6-179.3-178.50113K314 L315 A316 L322K314-K318 WeakPolarHBondContact O-CG 3.41Å; K314-K318 PolarHBondContact O-N 3.35Å; K314-K318 VanDerWaalsContact O-N 3.12Å; L315-K318 PolarHBondContact O-N 2.84Å; A316-K318 VanDerWaalsContact C-N 3.35Å; A316-K318 PolarHBondContact O-N 2.83Å; K318-L322 WeakPolarHBondContact O-CB 3.33Å; K318-L322 WeakPolarHBondContact O-CG 3.43Å; K318-L322 PolarHBondContact O-N 3.41Å
319K84.6Confident84.5Confident126 Ų126110.7 Ų110.755%0.54853%0.53SS..Hα-helixtrans-64.8-48.6177-178.1-163.6166.2-159.60110.6L315 A316 E317 L321 L322 Q323L315-K319 PolarHBondContact O-N 3.4Å; A316-K319 WeakPolarHBondContact O-CB 3.3Å; A316-K319 PolarHBondContact O-N 3.04Å; A316-K319 VanDerWaalsContact O-N 3.13Å; E317-K319 VanDerWaalsContact C-N 3.33Å; E317-K319 PolarHBondContact O-N 3.07Å; K319-L321 PolarHBondContact O-N 3.47Å; K319-L322 PolarHBondContact O-N 2.88Å; K319-Q323 VanDerWaalsContact O-CB 3.3Å; K319-Q323 WeakPolarHBondContact O-CB 3.23Å; K319-Q323 PolarHBondContact O-N 3.13Å
320E84.9Confident83.7Confident109 Ų109109 Ų10951%0.50953%0.529SS..Hα-helixtrans-58.7-46.2177.1-67.8-61.8140.400110.9A316 E317 L322 Q323 E324A316-E320 WeakPolarHBondContact O-CG 3.34Å; A316-E320 PolarHBondContact O-N 3.31Å; E317-E320 PolarHBondContact O-N 3.32Å; E320-L322 PolarHBondContact O-N 3.07Å; E320-Q323 WeakPolarHBondContact O-CB 3.36Å; E320-Q323 PolarHBondContact O-N 2.8Å; E320-Q323 VanDerWaalsContact O-N 3.12Å; E320-E324 PolarHBondContact O-N 3.45Å
321L84.3Confident83.2Confident94 Ų94109.5 Ų109.549%0.49253%0.526SS..Hα-helixtrans-58.7-46.2177.3-174.276.3000112.9E317 K319 Q323 E324 Q325E317-L321 PolarHBondContact O-N 2.83Å; K319-L321 PolarHBondContact O-N 3.47Å; L321-Q323 VanDerWaalsContact C-N 3.28Å; L321-Q323 PolarHBondContact O-N 3.27Å; L321-E324 PolarHBondContact O-N 3.3Å; L321-Q325 WeakPolarHBondContact O-CG 3.27Å; L321-Q325 PolarHBondContact O-N 3.48Å
322L82.3Confident82.7Confident111 Ų111111.3 Ų111.358%0.58153%0.525SS*.Hα-helixtrans-67-33.1177.8-76170000111.8K318 K319 E320 Q325 L326K318-L322 WeakPolarHBondContact O-CB 3.33Å; K318-L322 WeakPolarHBondContact O-CG 3.43Å; K318-L322 PolarHBondContact O-N 3.41Å; K319-L322 PolarHBondContact O-N 2.88Å; E320-L322 PolarHBondContact O-N 3.07Å; L322-Q325 PolarHBondContact O-N 3.41Å; L322-L326 WeakPolarHBondContact O-CB 3.37Å; L322-L326 PolarHBondContact O-N 2.93Å
323Q80.6Confident81.9Confident93 Ų93110.8 Ų110.844%0.43552%0.524SS..Hα-helixtrans-68.6-43.8177.5-167.6138.3-7.600111.2K319 E320 L321 Q325 L326 E327K319-Q323 VanDerWaalsContact O-CB 3.3Å; K319-Q323 WeakPolarHBondContact O-CB 3.23Å; K319-Q323 PolarHBondContact O-N 3.13Å; E320-Q323 WeakPolarHBondContact O-CB 3.36Å; E320-Q323 PolarHBondContact O-N 2.8Å; E320-Q323 VanDerWaalsContact O-N 3.12Å; L321-Q323 VanDerWaalsContact C-N 3.28Å; L321-Q323 PolarHBondContact O-N 3.27Å; Q323-Q325 PolarHBondContact O-N 2.84Å; Q323-L326 PolarHBondContact O-N 3.41Å; Q323-E327 PolarHBondContact O-N 2.92Å
324E81.8Confident81.1Confident123 Ų123110.4 Ų110.458%0.57553%0.531SS*.Hα-helixtrans-59.4-43.2171.8-72.8-179168.800112.3E320 L321 L326 E327 Q328E320-E324 PolarHBondContact O-N 3.45Å; L321-E324 PolarHBondContact O-N 3.3Å; E324-L326 VanDerWaalsContact C-N 3.3Å; E324-L326 PolarHBondContact O-N 2.81Å; E324-E327 PolarHBondContact O-N 2.77Å; E324-Q328 WeakPolarHBondContact O-CB 3.32Å; E324-Q328 PolarHBondContact O-N 3.28Å
325Q80.7Confident80.3Confident108 Ų108112 Ų11251%0.50554%0.538SS..Hα-helixtrans-61.6-38.2176.4-74.3178.413.500112.1L321 L322 Q323 Q328 L329L321-Q325 WeakPolarHBondContact O-CG 3.27Å; L321-Q325 PolarHBondContact O-N 3.48Å; L322-Q325 PolarHBondContact O-N 3.41Å; Q323-Q325 PolarHBondContact O-N 2.84Å; Q325-Q328 PolarHBondContact O-N 2.94Å; Q325-L329 WeakPolarHBondContact O-CB 3.29Å; Q325-L329 PolarHBondContact O-N 2.9Å
326L79.1Confident79.4Confident104 Ų104112.8 Ų112.855%0.54554%0.542SS..Hα-helixtrans-70.7-40.3179.8-156121.8000111.8L322 Q323 E324 L329 Q330L322-L326 WeakPolarHBondContact O-CB 3.37Å; L322-L326 PolarHBondContact O-N 2.93Å; Q323-L326 PolarHBondContact O-N 3.41Å; E324-L326 VanDerWaalsContact C-N 3.3Å; E324-L326 PolarHBondContact O-N 2.81Å; L326-L329 PolarHBondContact O-N 3.45Å; L326-Q330 WeakPolarHBondContact O-CB 3.29Å; L326-Q330 WeakPolarHBondContact O-CG 3.31Å; L326-Q330 PolarHBondContact O-N 3.19Å
327E80.9Confident78.4Confident99 Ų99116.3 Ų116.346%0.46355%0.547SS..Hα-helixtrans-64.3-39173.7-72.2-178.7-178.200112.3Q323 E324 Q330 R331Q323-E327 PolarHBondContact O-N 2.92Å; E324-E327 PolarHBondContact O-N 2.77Å; E327-Q330 PolarHBondContact O-N 2.83Å; E327-R331 WeakPolarHBondContact O-CB 3.48Å; E327-R331 WeakPolarHBondContact O-CG 3.41Å; E327-R331 PolarHBondContact O-N 3.46Å; E327-R331 PolarHBondContact O-NE 3.39Å
328Q79.9Confident77.3Confident82 Ų82112.7 Ų112.738%0.38354%0.541SS..Hα-helixtrans-60.4-48173.4-178.170.724.800111.2E324 Q325 Q330 R331 E332E324-Q328 WeakPolarHBondContact O-CB 3.32Å; E324-Q328 PolarHBondContact O-N 3.28Å; Q325-Q328 PolarHBondContact O-N 2.94Å; Q328-Q330 PolarHBondContact O-N 2.86Å; Q328-R331 WeakPolarHBondContact O-CB 3.42Å; Q328-R331 PolarHBondContact O-N 2.79Å; Q328-R331 VanDerWaalsContact OE1-CZ 3.25Å; Q328-E332 PolarHBondContact NE2-OE1 3.3Å; Q328-E332 PolarHBondContact O-N 3.16Å
329L79.4Confident75.9Confident118 Ų118110.7 Ų110.762%0.61854%0.544SS*.Hα-helixtrans-66.4-37.3-179-157.470.3000112Q325 L326 E332 Y333Q325-L329 WeakPolarHBondContact O-CB 3.29Å; Q325-L329 PolarHBondContact O-N 2.9Å; L326-L329 PolarHBondContact O-N 3.45Å; L329-E332 PolarHBondContact O-N 3.4Å; L329-Y333 WeakPolarHBondContact O-CB 3.3Å; L329-Y333 PolarHBondContact O-N 3.25Å
330Q74.9Confident74.6Confident116 Ų116109.8 Ų109.854%0.54255%0.553SS.*Hα-helixtrans-64.5-38.3172.7-79.9-179.9-13.800112.3L326 E327 Q328 S334L326-Q330 WeakPolarHBondContact O-CB 3.29Å; L326-Q330 WeakPolarHBondContact O-CG 3.31Å; L326-Q330 PolarHBondContact O-N 3.19Å; E327-Q330 PolarHBondContact O-N 2.83Å; Q328-Q330 PolarHBondContact O-N 2.86Å; Q330-S334 WeakPolarHBondContact O-CB 3.5Å; Q330-S334 PolarHBondContact O-N 3.43Å; Q330-S334 PolarHBondContact O-OG 2.82Å
331R78.5Confident73.1Confident125 Ų125111.6 Ų111.647%0.47256%0.561SS.*Hα-helixtrans-65.7-39.5175.7-79.1-177.4-81.3108.6-4.9112.2E327 Q328 K335E327-R331 WeakPolarHBondContact O-CB 3.48Å; E327-R331 WeakPolarHBondContact O-CG 3.41Å; E327-R331 PolarHBondContact O-N 3.46Å; E327-R331 PolarHBondContact O-NE 3.39Å; Q328-R331 WeakPolarHBondContact O-CB 3.42Å; Q328-R331 PolarHBondContact O-N 2.79Å; Q328-R331 VanDerWaalsContact OE1-CZ 3.25Å; R331-K335 PolarHBondContact O-N 2.69Å
332E78Confident71.5Confident92 Ų92115.3 Ų115.343%0.4358%0.576SS.*Hα-helixtrans-70.2-42.2177.4-72.6176.6-168.400112.6Q328 L329 S334 K335 L336Q328-E332 PolarHBondContact NE2-OE1 3.3Å; Q328-E332 PolarHBondContact O-N 3.16Å; L329-E332 PolarHBondContact O-N 3.4Å; E332-S334 VanDerWaalsContact C-N 3.31Å; E332-S334 PolarHBondContact O-N 3.12Å; E332-K335 PolarHBondContact O-N 2.58Å; E332-L336 PolarHBondContact O-N 3.1Å; E332-L336 VanDerWaalsContact O-N 3.15Å
333Y71.4Confident70Confident162 Ų162115.4 Ų115.464%0.63559%0.586SS**Hα-helixtrans-60.4-41.1174.4-176.5-99.1000112.2L329 K335 K337L329-Y333 WeakPolarHBondContact O-CB 3.3Å; L329-Y333 PolarHBondContact O-N 3.25Å; Y333-K335 PolarHBondContact O-N 3.29Å; Y333-K337 PolarHBondContact O-N 3.18Å
334S69.9Low68.5Low77 Ų77115.1 Ų115.154%0.53860%0.6SS.*Hα-helixtrans-64.6-37.3177.9-58.10000112.5Q330 E332Q330-S334 WeakPolarHBondContact O-CB 3.5Å; Q330-S334 PolarHBondContact O-N 3.43Å; Q330-S334 PolarHBondContact O-OG 2.82Å; E332-S334 VanDerWaalsContact C-N 3.31Å; E332-S334 PolarHBondContact O-N 3.12Å
335K72.7Confident67.1Low164 Ų164120.2 Ų120.271%0.71361%0.614SS**Hα-helixtrans-68.2-45177.3-82.8179.6175.9179.10113R331 E332 Y333 K337 A338R331-K335 PolarHBondContact O-N 2.69Å; E332-K335 PolarHBondContact O-N 2.58Å; Y333-K335 PolarHBondContact O-N 3.29Å; K335-K337 VanDerWaalsContact C-N 3.28Å; K335-K337 PolarHBondContact O-N 3.33Å; K335-A338 PolarHBondContact O-N 2.87Å
336L66.1Low65.6Low136 Ų136122.9 Ų122.971%0.71263%0.63SS**Hα-helixtrans-64.3-34.6-179.3-103.775.6000112.3E332 S339E332-L336 PolarHBondContact O-N 3.1Å; E332-L336 VanDerWaalsContact O-N 3.15Å; L336-S339 PolarHBondContact O-N 2.74Å
337K66.1Low63.9Low128 Ų128127.3 Ų127.356%0.55765%0.647SS**Hα-helixtrans-68.2-35.6-177.9-166.7175.6-178.4179.30113.2Y333 K335Y333-K337 PolarHBondContact O-N 3.18Å; K335-K337 VanDerWaalsContact C-N 3.28Å; K335-K337 PolarHBondContact O-N 3.33Å
338A60.8Low62.3Low61 Ų61130 Ų13050%0.50467%0.665SS.*Hα-helixtrans-68.7-36.8178.600000112.5K335 C340K335-A338 PolarHBondContact O-N 2.87Å; A338-C340 VanDerWaalsContact C-N 3.3Å; A338-C340 PolarHBondContact O-N 3.43Å
339S57.7Low60.5Low97 Ų97134.8 Ų134.868%0.67869%0.69SS**Hα-helixtrans-69.7-22.1-176-169.70000114.5L336L336-S339 PolarHBondContact O-N 2.74Å
340C56.7Low58.5Low107 Ų107141 Ų14172%0.72371%0.705SS**Hα-helixtrans-86.3-20.8-175-143.80000112.8A338A338-C340 VanDerWaalsContact C-N 3.3Å; A338-C340 PolarHBondContact O-N 3.43Å
341Q53.6Low56.8Low147 Ų147144.1 Ų144.169%0.68772%0.717SS**Hα-helixtrans-87.3-19.9-176.6-73-176.7-25.200114
342E50.8Low55.1Low171 Ų171148.6 Ų148.680%0.79973%0.733SS**G310 helixtrans-76.3-27.1-178-147.680.8-155.900113.2A344E342-A344 PolarHBondContact O-N 2.82Å
343S50.8Low52.9Low114 Ų114153.5 Ų153.580%0.79776%0.756SS**G310 helixtrans-86.4-2.2-170.4-164.70000115
344A49Very low51.7Low87 Ų87151.9 Ų151.972%0.71976%0.763SS**G310 helixtrans-97.710.5-170.200000115.4E342E342-A344 PolarHBondContact O-N 2.82Å
345R53.1Low49.8Very low230 Ų230156.7 Ų156.787%0.86878%0.777SS**SBendtrans-122.80.8-165.8-84.5-172.9176.9172.40.4119.6
346I48.3Very low47.6Very low164 Ų164155 Ų15584%0.84178%0.78SS**SBendtrans-120.3-8.7-167.9-76.6179.2000119.6
347E43.2Very low45.8Very low196 Ų196153.5 Ų153.592%0.91678%0.781SS**  trans-135.279-173-106.3175.8169.600115.6
348D47.1Very low44Very low155 Ų155156.4 Ų156.483%0.82980%0.796SS**  trans-142.150.3172.9-168.728.4000113.8
349M42Very low42.5Very low183 Ų183157.7 Ų157.790%0.90181%0.807SS**  trans-160.766.8172-89.2-55.9-91.900114.9
350R38.4Very low41.6Very low248 Ų248158.9 Ų158.994%0.93681%0.812SS**  trans-171.1102.1155-103.1158.2-164.4-156.86.2114.8
351K38.3Very low40.7Very low183 Ų183161.4 Ų161.480%0.79682%0.818SS**  trans51.3116.3145-70.8-178.8177.9178.70123.6
352R42.8Very low40.7Very low218 Ų218159.5 Ų159.582%0.82382%0.818SS**  40.9115.8122.8-60.3-167.3-122.5164.8-3.2122.1
353H31.7Very low40.6Very low195 Ų195157.1 Ų157.190%0.90382%0.818SS**  176.7154.2111.7-103.9145.1000109.8
354V46.8Very low39.8Very low128 Ų128156 Ų15678%0.77682%0.815SS**  trans-72.3156.7178.1159.40000111.2
355E30.9Very low39.7Very low179 Ų179157.8 Ų157.884%0.83682%0.82SS**  trans104.6143.6155.9-102.5166.7-163.500121.5
356V24.5Very low38.7Very low128 Ų128150.7 Ų150.778%0.77681%0.81SS**  trans91.997.6164.9-1700000120.8
357S29.5Very low37.9Very low104 Ų104153.7 Ų153.773%0.72781%0.812SS**  16.1136.7127.6-48.60000122.9
358Q29Very low37.5Very low189 Ų189151.7 Ų151.788%0.88381%0.807SS**  157.6136.987.3-126.3176.22600115.1
359A27.4Very low36.8Very low88 Ų88149.4 Ų149.473%0.72780%0.803SS**  trans67.6169.4140.600000121.4
360P39.7Very low36.3Very low123 Ų123146.2 Ų146.280%0.79980%0.799SS**  cis-138.2174.3-45.835.5-16.6000114.7
361L38Very low36.5Very low159 Ų159139.6 Ų139.683%0.83279%0.788SS**  trans-39.9-173.5154.4-71166.3000115.8
362P52.7Low36.1Very low108 Ų108138.6 Ų138.670%0.70179%0.79SS**  cis-136.4-135.3-30.433.3-8000109.4
363P48.6Very low35.6Very low121 Ų121132 Ų13279%0.78678%0.782SS**  cis-132.5-173.3-26.730.5-6.1000115.9
364A35.4Very low35.6Very low90 Ų90130.5 Ų130.574%0.74478%0.78SS**  trans-50.5-167.5177.100000117.7
365P46.7Very low35.8Very low125 Ų125129.1 Ų129.181%0.81277%0.774SS**  cis-147.2-166.1739.1-14.2000117.4
366A32.8Very low35.6Very low80 Ų80124.7 Ų124.766%0.66176%0.763SS**  trans107.4109.8139.600000123.3
367Y30.3Very low35.8Very low228 Ų228126.4 Ų126.489%0.89476%0.762SS**  69.7143.4123.3-76-84.2000125.6
368L35.8Very low36Very low153 Ų153132.5 Ų132.580%0.80177%0.769SS**  trans87.7100.4169.7-59.5171.2000116.6
369S31.6Very low35.9Very low107 Ų107134.9 Ų134.975%0.74877%0.77SS**  80.1129.589.5-65.90000112.3
370S30.9Very low36.1Very low117 Ų117135.8 Ų135.882%0.81877%0.771SS**  cis-162172.629.4-100.80000111.3
371P42.6Very low36.8Very low108 Ų108135.3 Ų135.370%0.70177%0.768SS**  trans-118.2174.9-152.139.9-28000116.7
372L31.2Very low37Very low162 Ų162133 Ų13385%0.84876%0.763SS**  trans136.2100.5145.4-74.1161.8000109.7
373A30.9Very low36.1Very low79 Ų79136.6 Ų136.665%0.65377%0.77SS**  66.4104.76900000113.8
374L32.4Very low35.4Very low164 Ų164139.7 Ų139.786%0.85977%0.774SS**  29168.9115.9-94.9100000118.5
375P50.6Low36.4Very low99 Ų99140.8 Ų140.864%0.64377%0.774SS**  cis-145.5-167.2-47.539.2-19.4000111.2
376S27.2Very low37.2Very low86 Ų86138.9 Ų138.960%0.60176%0.761SS**  trans80.6137.5133.5-168.50000121.6
377Q29.2Very low38Very low165 Ų165140.7 Ų140.777%0.77176%0.76SS**  trans72.2116.6141-86.2-17969.200121.3
378R32.8Very low39.7Very low231 Ų231135.2 Ų135.287%0.87274%0.741SS**  36.1102.4110.3-159-164.1-83.1-116.78.3115.3
379R26.9Very low41.3Very low240 Ų240130.1 Ų130.191%0.90672%0.717SS**  trans-160.5124.9144.4-125.9-171.6-107.3-159.3-4.2110.3
380S32.9Very low43.4Very low106 Ų106125.2 Ų125.274%0.74168%0.683SS**  trans-90.2-173.314445.10000108.5
381P53.9Low45.3Very low113 Ų113125.7 Ų125.773%0.73468%0.683SS**  -81.3-177.2-114.641-24.5000116.3
382P41.3Very low46.8Very low111 Ų111127 Ų12772%0.72168%0.678SS**  -138.6151.986.925-2.3000114.5
383E33.8Very low49.1Very low184 Ų184122.4 Ų122.486%0.8666%0.659SS**  50.1116.693.9-104.6176.115800113.3
384E34Very low51.2Low186 Ų186126.2 Ų126.287%0.86966%0.663SS**  -151.4170.251.6-94.6179.4126.400113.8
385P55.9Low53.3Low113 Ų113124.2 Ų124.273%0.73465%0.645SS**  trans-119-151.1-158.536.6-14.9000112.8
386P63.8Low54.3Low84 Ų84125.4 Ų125.455%0.54564%0.642SS.*  -127.7-175.1-80.539.7-22.9000111.5
387D51Low56.4Low119 Ų119121.7 Ų121.764%0.63662%0.617SS**  trans-146.687.4157.2-91.4-32.1000110.8C389 Q396D387-C389 PolarHBondContact O-N 3.42Å; D387-C389 PolarHBondContact OD1-SG 2.81Å; D387-Q396 PolarHBondContact OD1-NE2 2.79Å
388F65.4Low58.7Low113 Ų113119.3 Ų119.350%0.49662%0.615SS.*  trans-92.381.3161.8-70.4-67.1000107.8A397 L403F388-A397 PolarHBondContact O-N 3.48Å; F388-L403 HydrophobicContact CB-CD2 4.21Å; F388-L403 HydrophobicContact CD1-CD2 4.38Å
389C68.3Low60.8Low46 Ų46111.5 Ų111.531%0.31159%0.591SS.*BIsolated β-bridgetrans-103.5134.2-175.2-57.70000110.1D387 P391D387-C389 PolarHBondContact O-N 3.42Å; D387-C389 PolarHBondContact OD1-SG 2.81Å; C389-P391 WeakPolarHBondContact O-CD 3.41Å
390C75.9Confident63.3Low4 Ų4104.9 Ų104.93%0.02757%0.571CS.*  trans-66.2122.6165.5-179.80000109.7K392 C393 Q394 Y395 L403 H406C390-K392 PolarHBondContact O-N 2.87Å; C390-K392 VanDerWaalsContact O-N 3.09Å; C390-C393 PolarHBondContact O-N 2.88Å; C390-Q394 VanDerWaalsContact O-CA 3.28Å; C390-Q394 WeakPolarHBondContact O-CA 3.2Å; C390-Q394 PolarHBondContact O-N 3.41Å; C390-Y395 PolarHBondContact N-O 3.21Å; C390-Y395 VanDerWaalsContact N-O 3.13Å; C390-L403 HydrophobicContact CB-CD1 4.4Å; C390-H406 WeakPolarHBondContact CB-CD2 3.24Å; C390-H406 VanDerWaalsContact CB-NE2 3.34Å; C390-H406 WeakPolarHBondContact CB-NE2 3.17Å; C390-H406 VanDerWaalsContact SG-CD2 3.57Å; C390-H406 PolarHBondContact SG-NE2 2.89Å; C390-H406 VanDerWaalsContact SG-NE2 3.41Å
391P70.9Confident65.5Low127 Ų127104.5 Ų104.583%0.82556%0.561SS**THydrogen-bonded Turntrans-65.7-15.3-174.523.6-32.5000114.4C389C389-P391 WeakPolarHBondContact O-CD 3.41Å
392K73.9Confident66.7Low135 Ų135101.4 Ų101.459%0.58754%0.54SS*.THydrogen-bonded Turntrans-86.2-45.2179.4-117.9-164.1-168.8176.50113.3C390 C410 E412C390-K392 PolarHBondContact O-N 2.87Å; C390-K392 VanDerWaalsContact O-N 3.09Å; K392-C410 WeakPolarHBondContact CD-O 3.35Å; K392-C410 PolarHBondContact NZ-O 3.28Å; K392-E412 PolarHBondContact NZ-O 3.44Å
393C79.9Confident68.6Low65 Ų6597.6 Ų97.644%0.43951%0.513SS..THydrogen-bonded Turntrans-120.7-0.6-170.867.80000113.7C390 Y395 H406C390-C393 PolarHBondContact O-N 2.88Å; C393-Y395 PolarHBondContact O-N 3.49Å; C393-Y395 VanDerWaalsContact O-N 3.13Å; C393-Y395 VanDerWaalsContact SG-CB 3.55Å; C393-H406 VanDerWaalsContact SG-CE1 3.54Å; C393-H406 PolarHBondContact SG-NE2 3.09Å
394Q75.1Confident70.7Confident160 Ų16094.4 Ų94.475%0.74850%0.498SS*.  trans57.224.7179.5-60.9171.817.500113.9C390 Q396C390-Q394 VanDerWaalsContact O-CA 3.28Å; C390-Q394 WeakPolarHBondContact O-CA 3.2Å; C390-Q394 PolarHBondContact O-N 3.41Å; Q394-Q396 PolarHBondContact O-N 2.84Å
395Y75.6Confident72.9Confident121 Ų12190.6 Ų90.648%0.47548%0.483SS..PPolyproline II helixtrans-68.2124.8172.5-179.6-106.1000110.4C390 C393 A397 H406C390-Y395 PolarHBondContact N-O 3.21Å; C390-Y395 VanDerWaalsContact N-O 3.13Å; C393-Y395 PolarHBondContact O-N 3.49Å; C393-Y395 VanDerWaalsContact O-N 3.13Å; C393-Y395 VanDerWaalsContact SG-CB 3.55Å; Y395-A397 HydrophobicContact CE1-CB 4.41Å; Y395-H406 AromaticContact CD1-CE1 3.85Å; Y395-H406 AromaticContact CD1-CG 3.89Å; Y395-H406 AromaticContact CD1-ND1 3.65Å
396Q73.2Confident74.1Confident124 Ų12487 Ų8758%0.57946%0.457SS*.BIsolated β-bridgetrans-87.7117176.6-86.4177.5-12.500110D387 Q394D387-Q396 PolarHBondContact OD1-NE2 2.79Å; Q394-Q396 PolarHBondContact O-N 2.84Å
397A70Confident74.7Confident9 Ų985.5 Ų85.57%0.07445%0.445CS..PPolyproline II helixtrans-99.6140.8176.900000111.2F388 Y395 D399 T402 L403F388-A397 PolarHBondContact O-N 3.48Å; Y395-A397 HydrophobicContact CE1-CB 4.41Å; A397-D399 VanDerWaalsContact C-N 3.32Å; A397-D399 PolarHBondContact O-N 2.74Å; A397-T402 HydrophobicContact CB-CG2 4.05Å; A397-L403 HydrophobicContact CB-CB 4.02Å
398P78.8Confident75.8Confident114 Ų11487.5 Ų87.574%0.7445%0.453SS*.SBendtrans-75.5-14.4-176.127.8-33.2000114.7
399D76.7Confident76.1Confident67 Ų6789 Ų8936%0.35846%0.462SS..SBendtrans-154.5163.7177.667.5-77.1000111.3A397 D401 T402 L403A397-D399 VanDerWaalsContact C-N 3.32Å; A397-D399 PolarHBondContact O-N 2.74Å; D399-D401 PolarHBondContact O-N 3.44Å; D399-D401 WeakPolarHBondContact OD2-CB 3.26Å; D399-D401 PolarHBondContact OD2-N 2.8Å; D399-D401 VanDerWaalsContact OD2-N 3.11Å; D399-T402 PolarHBondContact O-N 3.25Å; D399-T402 WeakPolarHBondContact OD1-CB 3.48Å; D399-T402 PolarHBondContact OD1-OG1 3.45Å; D399-T402 PolarHBondContact OD2-N 2.96Å; D399-T402 PolarHBondContact OD2-OG1 2.91Å; D399-L403 PolarHBondContact O-N 3.25Å; D399-L403 VanDerWaalsContact O-N 3.08Å
400M78Confident76.4Confident101 Ų10188 Ų8850%0.49846%0.455SS..Hα-helixtrans-66.7-33.2-175-174-126.254.900112.7L403 Q404M400-L403 PolarHBondContact O-N 3.44Å; M400-Q404 VanDerWaalsContact CE-OE1 3.25Å; M400-Q404 WeakPolarHBondContact O-CB 3.15Å; M400-Q404 PolarHBondContact O-N 2.92Å
401D79.9Confident75.9Confident99 Ų9994 Ų9453%0.52949%0.485SS..Hα-helixtrans-68.2-40.5177.5-72.8-20.7000110.2D399 L403 Q404 I405D399-D401 PolarHBondContact O-N 3.44Å; D399-D401 WeakPolarHBondContact OD2-CB 3.26Å; D399-D401 PolarHBondContact OD2-N 2.8Å; D399-D401 VanDerWaalsContact OD2-N 3.11Å; D401-L403 VanDerWaalsContact C-N 3.34Å; D401-L403 PolarHBondContact O-N 3.32Å; D401-Q404 WeakPolarHBondContact O-CB 3.34Å; D401-Q404 PolarHBondContact O-N 2.79Å; D401-Q404 VanDerWaalsContact O-N 3.09Å; D401-I405 WeakPolarHBondContact O-CG1 3.26Å; D401-I405 PolarHBondContact O-N 2.88Å
402T79.5Confident75.1Confident47 Ų4798.8 Ų98.829%0.28850%0.496SS..Hα-helixtrans-63.5-37.6173.5-580000112.2A397 D399 Q404 H406A397-T402 HydrophobicContact CB-CG2 4.05Å; D399-T402 PolarHBondContact O-N 3.25Å; D399-T402 WeakPolarHBondContact OD1-CB 3.48Å; D399-T402 PolarHBondContact OD1-OG1 3.45Å; D399-T402 PolarHBondContact OD2-N 2.96Å; D399-T402 PolarHBondContact OD2-OG1 2.91Å; T402-Q404 VanDerWaalsContact C-N 3.34Å; T402-H406 WeakPolarHBondContact O-CB 3.45Å; T402-H406 PolarHBondContact O-N 3.38Å
403L81.6Confident75.2Confident31 Ų3197 Ų9716%0.16249%0.492CS..Hα-helixtrans-64.7-38.7170.9-176.566.9000111.4F388 C390 A397 D399 M400 D401 H406 V407F388-L403 HydrophobicContact CB-CD2 4.21Å; F388-L403 HydrophobicContact CD1-CD2 4.38Å; C390-L403 HydrophobicContact CB-CD1 4.4Å; A397-L403 HydrophobicContact CB-CB 4.02Å; D399-L403 PolarHBondContact O-N 3.25Å; D399-L403 VanDerWaalsContact O-N 3.08Å; M400-L403 PolarHBondContact O-N 3.44Å; D401-L403 VanDerWaalsContact C-N 3.34Å; D401-L403 PolarHBondContact O-N 3.32Å; L403-H406 PolarHBondContact O-N 3.38Å; L403-V407 HydrophobicContact CD1-CG2 4.16Å; L403-V407 HydrophobicContact CG-CG2 4.2Å; L403-V407 WeakPolarHBondContact O-CB 3.38Å; L403-V407 VanDerWaalsContact O-CG2 3.24Å; L403-V407 WeakPolarHBondContact O-CG2 3.49Å; L403-V407 PolarHBondContact O-N 2.86Å
404Q77.6Confident75Confident117 Ų11798.6 Ų98.655%0.54750%0.495SS..Hα-helixtrans-67.7-37.4-178.4-138.9171.2-2.600112.2M400 D401 T402 M408M400-Q404 VanDerWaalsContact CE-OE1 3.25Å; M400-Q404 WeakPolarHBondContact O-CB 3.15Å; M400-Q404 PolarHBondContact O-N 2.92Å; D401-Q404 WeakPolarHBondContact O-CB 3.34Å; D401-Q404 PolarHBondContact O-N 2.79Å; D401-Q404 VanDerWaalsContact O-N 3.09Å; T402-Q404 VanDerWaalsContact C-N 3.34Å; Q404-M408 PolarHBondContact O-N 3.09Å
405I79.1Confident75Confident107 Ų10795.2 Ų95.255%0.54948%0.481SS..Hα-helixtrans-67.1-45.9171.8-61.9164.1000110.3D401 V407 M408 E409D401-I405 WeakPolarHBondContact O-CG1 3.26Å; D401-I405 PolarHBondContact O-N 2.88Å; I405-V407 PolarHBondContact O-N 3.06Å; I405-M408 WeakPolarHBondContact O-CB 3.24Å; I405-M408 PolarHBondContact O-N 3.46Å; I405-E409 PolarHBondContact O-N 3.47Å
406H81.3Confident74.9Confident38 Ų3893.7 Ų93.718%0.17648%0.481CS..Hα-helixtrans-64-39.4179.6179.282.8000112.8C390 C393 Y395 T402 L403 M408 E409 C410C390-H406 WeakPolarHBondContact CB-CD2 3.24Å; C390-H406 VanDerWaalsContact CB-NE2 3.34Å; C390-H406 WeakPolarHBondContact CB-NE2 3.17Å; C390-H406 VanDerWaalsContact SG-CD2 3.57Å; C390-H406 PolarHBondContact SG-NE2 2.89Å; C390-H406 VanDerWaalsContact SG-NE2 3.41Å; C393-H406 VanDerWaalsContact SG-CE1 3.54Å; C393-H406 PolarHBondContact SG-NE2 3.09Å; Y395-H406 AromaticContact CD1-CE1 3.85Å; Y395-H406 AromaticContact CD1-CG 3.89Å; Y395-H406 AromaticContact CD1-ND1 3.65Å; T402-H406 WeakPolarHBondContact O-CB 3.45Å; T402-H406 PolarHBondContact O-N 3.38Å; L403-H406 PolarHBondContact O-N 3.38Å; H406-M408 VanDerWaalsContact C-N 3.28Å; H406-M408 PolarHBondContact O-N 3.22Å; H406-E409 PolarHBondContact O-N 3.42Å; H406-C410 VanDerWaalsContact O-CB 3.23Å; H406-C410 WeakPolarHBondContact O-CB 3.27Å; H406-C410 PolarHBondContact O-N 2.84Å
407V76.8Confident75Confident51 Ų5191.8 Ų91.831%0.30948%0.475SS..Hα-helixtrans-65.7-30.5176170.60000111.6L403 I405 E409 I411L403-V407 HydrophobicContact CD1-CG2 4.16Å; L403-V407 HydrophobicContact CG-CG2 4.2Å; L403-V407 WeakPolarHBondContact O-CB 3.38Å; L403-V407 VanDerWaalsContact O-CG2 3.24Å; L403-V407 WeakPolarHBondContact O-CG2 3.49Å; L403-V407 PolarHBondContact O-N 2.86Å; I405-V407 PolarHBondContact O-N 3.06Å; V407-E409 VanDerWaalsContact C-N 3.32Å; V407-E409 PolarHBondContact O-N 2.91Å; V407-I411 HydrophobicContact CG1-CD1 3.67Å; V407-I411 HydrophobicContact CG1-CG1 4.37Å; V407-I411 WeakPolarHBondContact O-CD1 3.29Å; V407-I411 VanDerWaalsContact O-CG1 3.31Å; V407-I411 WeakPolarHBondContact O-CG1 3.45Å; V407-I411 PolarHBondContact O-N 3.44Å
408M74.9Confident75.4Confident162 Ų16297.3 Ų97.380%0.79850%0.502SS*.Hα-helixtrans-67-28.9172.9-93173.352.700113.3Q404 I405 H406Q404-M408 PolarHBondContact O-N 3.09Å; I405-M408 WeakPolarHBondContact O-CB 3.24Å; I405-M408 PolarHBondContact O-N 3.46Å; H406-M408 VanDerWaalsContact C-N 3.28Å; H406-M408 PolarHBondContact O-N 3.22Å
409E71.8Confident75.1Confident145 Ų14596.1 Ų96.168%0.67848%0.484SS*.Hα-helixtrans-94-26.2176-66.5-177.9170.600113I405 H406 V407 I411I405-E409 PolarHBondContact O-N 3.47Å; H406-E409 PolarHBondContact O-N 3.42Å; V407-E409 VanDerWaalsContact C-N 3.32Å; V407-E409 PolarHBondContact O-N 2.91Å; E409-I411 VanDerWaalsContact C-N 3.33Å; E409-I411 PolarHBondContact O-N 3.49Å
410C74.1Confident75Confident25 Ų2598.4 Ų98.417%0.16949%0.494CS..Hα-helixtrans-82.5-6.1-177.4-150.60000113.6K392 H406K392-C410 WeakPolarHBondContact CD-O 3.35Å; K392-C410 PolarHBondContact NZ-O 3.28Å; H406-C410 VanDerWaalsContact O-CB 3.23Å; H406-C410 WeakPolarHBondContact O-CB 3.27Å; H406-C410 PolarHBondContact O-N 2.84Å
411I66Low74.7Confident128 Ų12898.2 Ų98.266%0.65649%0.494SS*.THydrogen-bonded Turntrans-88.1-1.2177.4-72.4173.3000113.4V407 E409V407-I411 HydrophobicContact CG1-CD1 3.67Å; V407-I411 HydrophobicContact CG1-CG1 4.37Å; V407-I411 WeakPolarHBondContact O-CD1 3.29Å; V407-I411 VanDerWaalsContact O-CG1 3.31Å; V407-I411 WeakPolarHBondContact O-CG1 3.45Å; V407-I411 PolarHBondContact O-N 3.44Å; E409-I411 VanDerWaalsContact C-N 3.33Å; E409-I411 PolarHBondContact O-N 3.49Å
412E54.2Low74.3Confident228 Ų22898.1 Ų98.1100%1.06549%0.491SS*.  trans-67.60162.1-68.4-167.6166.500112.8K392K392-E412 PolarHBondContact NZ-O 3.44Å

Retrieved 412 of 412 residues in 438 ms (Link to these results)