A0A077ZEY5_TRITR Loading...

RabGAP-TBC domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZEY5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 387 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
1F38.2Very low37.7Very low218 Ų218127.7 Ų127.796%0.95664%0.639SS**  0-18.70-104.4-91000115.6G3F1-G3 PolarHBondContact O-N 3.46Å; F1-G3 VanDerWaalsContact O-N 3.16Å
2I37.3Very low37.3Very low151 Ų151125.1 Ų125.177%0.77463%0.629SS**Hα-helixtrans-68-12.1178-61.5170.8000113.5N6I2-N6 PolarHBondContact O-ND2 3.02Å
3G37.7Very low37.2Very low50 Ų50130.5 Ų130.552%0.51564%0.637SS.*Hα-helixtrans-79.3-38.7-179.200000115.7F1F1-G3 PolarHBondContact O-N 3.46Å; F1-G3 VanDerWaalsContact O-N 3.16Å
4E38Very low36.9Very low143 Ų143134.5 Ų134.567%0.66864%0.642SS**Hα-helixtrans-86.9-33.3-169.6-74.5-175.1158.200113.7N6 L7E4-N6 VanDerWaalsContact C-N 3.26Å; E4-N6 PolarHBondContact O-N 3.34Å; E4-L7 WeakPolarHBondContact O-CB 3.39Å; E4-L7 PolarHBondContact O-N 3.02Å; E4-L7 VanDerWaalsContact O-N 3.09Å
5V41.4Very low36.6Very low100 Ų100130.3 Ų130.361%0.60663%0.632SS**Hα-helixtrans-68.5-30.1176-174.70000111.2L7V5-L7 VanDerWaalsContact C-N 3.31Å; V5-L7 PolarHBondContact O-N 3.14Å
6N37Very low36.6Very low87 Ų87132.2 Ų132.247%0.46564%0.636SS.*Hα-helixtrans-72.6-22.5173.2-95.6-48.4000113.3I2 E4 N10I2-N6 PolarHBondContact O-ND2 3.02Å; E4-N6 VanDerWaalsContact C-N 3.26Å; E4-N6 PolarHBondContact O-N 3.34Å; N6-N10 WeakPolarHBondContact O-CB 3.33Å; N6-N10 PolarHBondContact O-N 3.08Å; N6-N10 PolarHBondContact O-ND2 2.96Å
7L39.1Very low36.8Very low113 Ų113130 Ų13059%0.59264%0.638SS**Hα-helixtrans-73.2-36.5178.4-104.5142.2000111.7E4 V5 F11E4-L7 WeakPolarHBondContact O-CB 3.39Å; E4-L7 PolarHBondContact O-N 3.02Å; E4-L7 VanDerWaalsContact O-N 3.09Å; V5-L7 VanDerWaalsContact C-N 3.31Å; V5-L7 PolarHBondContact O-N 3.14Å; L7-F11 VanDerWaalsContact O-CB 3.27Å; L7-F11 WeakPolarHBondContact O-CB 3.25Å; L7-F11 PolarHBondContact O-N 3.24Å
8F36.8Very low36.7Very low166 Ų166134.1 Ų134.173%0.72865%0.647SS**Hα-helixtrans-72.5-36.9179-137.8-95.5000112.8
9F36.8Very low36.5Very low155 Ų155132.2 Ų132.268%0.6865%0.647SS**Hα-helixtrans-77-32.8173.4-91.5-83.4000113.2R13F9-R13 PolarHBondContact O-N 3.11Å
10N34.9Very low36.6Very low77 Ų77129 Ų12941%0.41264%0.643SS.*Hα-helixtrans-78.4-24.1174.6-80.6-65.2000113.8N6 R13 R14N6-N10 WeakPolarHBondContact O-CB 3.33Å; N6-N10 PolarHBondContact O-N 3.08Å; N6-N10 PolarHBondContact O-ND2 2.96Å; N10-R13 PolarHBondContact O-N 3.19Å; N10-R14 VanDerWaalsContact O-CB 3.28Å; N10-R14 WeakPolarHBondContact O-CB 3.33Å; N10-R14 PolarHBondContact O-N 3.45Å
11F37.3Very low36.7Very low145 Ų145128.1 Ų128.164%0.63665%0.647SS**Hα-helixtrans-67.6-39.4175.1-153.6-98.2000110.9L7 C15L7-F11 VanDerWaalsContact O-CB 3.27Å; L7-F11 WeakPolarHBondContact O-CB 3.25Å; L7-F11 PolarHBondContact O-N 3.24Å; F11-C15 PolarHBondContact O-N 3.21Å; F11-C15 PolarHBondContact O-SG 2.94Å; F11-C15 VanDerWaalsContact O-SG 3.41Å
12N33.3Very low36.5Very low96 Ų96125.4 Ų125.451%0.51364%0.641SS.*Hα-helixtrans-73.9-34.1174.2-93.1-47.8000113.5F16N12-F16 WeakPolarHBondContact O-CD2 3.35Å; N12-F16 PolarHBondContact O-N 3.12Å
13R36.1Very low36.8Very low195 Ų195129 Ų12974%0.73665%0.645SS**Hα-helixtrans-76.1-33.4174.5-89.1-170.7175.2-165.20.7114.2F9 N10 F16 S17F9-R13 PolarHBondContact O-N 3.11Å; N10-R13 PolarHBondContact O-N 3.19Å; R13-F16 PolarHBondContact O-N 3.36Å; R13-S17 VanDerWaalsContact O-CB 3.23Å; R13-S17 WeakPolarHBondContact O-CB 3.49Å; R13-S17 PolarHBondContact O-N 2.92Å
14R32.4Very low37Very low187 Ų187130.7 Ų130.771%0.70665%0.646SS**Hα-helixtrans-68.2-35.5173.4-92.3-178.7167.1171.9-3.5111.7N10 Y18N10-R14 VanDerWaalsContact O-CB 3.28Å; N10-R14 WeakPolarHBondContact O-CB 3.33Å; N10-R14 PolarHBondContact O-N 3.45Å; R14-Y18 WeakPolarHBondContact O-CD2 3.43Å
15C33Very low37.2Very low72 Ų72127.3 Ų127.349%0.48664%0.636SS.*Hα-helixtrans-71.8-31.2174.8-70.80000113.1F11F11-C15 PolarHBondContact O-N 3.21Å; F11-C15 PolarHBondContact O-SG 2.94Å; F11-C15 VanDerWaalsContact O-SG 3.41Å
16F36.9Very low37.7Very low160 Ų160129.1 Ų129.170%0.70265%0.647SS**Hα-helixtrans-87.3-24.8177-89.5-86.4000114.9N12 R13 Y18 C19N12-F16 WeakPolarHBondContact O-CD2 3.35Å; N12-F16 PolarHBondContact O-N 3.12Å; R13-F16 PolarHBondContact O-N 3.36Å; F16-Y18 VanDerWaalsContact C-N 3.33Å; F16-Y18 PolarHBondContact O-N 3.35Å; F16-C19 PolarHBondContact O-N 2.82Å
17S39.9Very low38.1Very low95 Ų95131.2 Ų131.266%0.66465%0.654SS**Hα-helixtrans-76.5-17.9178.8-169.40000113.7R13R13-S17 VanDerWaalsContact O-CB 3.23Å; R13-S17 WeakPolarHBondContact O-CB 3.49Å; R13-S17 PolarHBondContact O-N 2.92Å
18Y34.8Very low38.6Very low204 Ų204129.3 Ų129.380%0.864%0.644SS**THydrogen-bonded Turntrans-91.3-6.3172.9-82.1-78.8000113.8R14 F16 A20R14-Y18 WeakPolarHBondContact O-CD2 3.43Å; F16-Y18 VanDerWaalsContact C-N 3.33Å; F16-Y18 PolarHBondContact O-N 3.35Å; Y18-A20 PolarHBondContact O-N 2.88Å
19C32.7Very low39.2Very low98 Ų98124.8 Ų124.866%0.66263%0.631SS**  trans-93.254.9162.2-72.20000109.7F16F16-C19 PolarHBondContact O-N 2.82Å
20A39.3Very low40Very low68 Ų68122.1 Ų122.156%0.56262%0.623SS**SBendtrans-49.6138.6143.700000105.8Y18 L22Y18-A20 PolarHBondContact O-N 2.88Å; A20-L22 PolarHBondContact O-N 2.79Å
21P38.3Very low40.7Very low110 Ų110122.8 Ų122.871%0.71463%0.626SS**  trans-47.2126.7168.822.1-31000104.8R23P21-R23 PolarHBondContact O-N 2.93Å
22L34.2Very low41.5Very low162 Ų162121.3 Ų121.385%0.84862%0.624SS**  trans-47.797170.2-88.6155.1000104.2A20 V24A20-L22 PolarHBondContact O-N 2.79Å; L22-V24 PolarHBondContact O-N 2.92Å
23R42.3Very low42.4Very low225 Ų225126.6 Ų126.685%0.84964%0.637SS**  trans-67.189.9163.4-83.5-173.1-179.9-174.11.198.8P21 P25P21-R23 PolarHBondContact O-N 2.93Å; R23-P25 VanDerWaalsContact C-N 3.3Å; R23-P25 WeakPolarHBondContact O-CD 3.46Å
24V42.8Very low43.3Very low87 Ų87122.5 Ų122.553%0.52763%0.629SS.*  trans-46.5109.5169.6178.60000102.4L22 V26 L28L22-V24 PolarHBondContact O-N 2.92Å; V24-V26 PolarHBondContact O-N 3.33Å; V24-L28 HydrophobicContact CG1-CB 3.44Å; V24-L28 VanDerWaalsContact CG1-CB 3.44Å; V24-L28 HydrophobicContact CG1-CD2 3.83Å; V24-L28 HydrophobicContact CG1-CG 4.16Å
25P41.8Very low44.5Very low71 Ų71120.2 Ų120.246%0.46163%0.63SS.*  trans-53.1139.6178.1-22.933.1000105.1R23 E27 L28R23-P25 VanDerWaalsContact C-N 3.3Å; R23-P25 WeakPolarHBondContact O-CD 3.46Å; P25-E27 HydrophobicContact CB-CB 4.47Å; P25-E27 PolarHBondContact O-N 3.46Å; P25-L28 PolarHBondContact O-N 3.06Å
26V52.6Low45.3Very low139 Ų139119.7 Ų119.784%0.84263%0.626SS**THydrogen-bonded Turntrans-53.2-15.5178-173.80000110.9V24 P29V24-V26 PolarHBondContact O-N 3.33Å; V26-P29 WeakPolarHBondContact O-CD 3.39Å
27E44.2Very low46.3Very low130 Ų130122.4 Ų122.461%0.60763%0.632SS**THydrogen-bonded Turntrans-87.2-9176-57.1-178.2171.100116.4P25 P29 I30 L31P25-E27 HydrophobicContact CB-CB 4.47Å; P25-E27 PolarHBondContact O-N 3.46Å; E27-P29 VanDerWaalsContact C-CD 3.43Å; E27-P29 VanDerWaalsContact C-N 3.33Å; E27-I30 CarbonylContact O-C 3.07Å; E27-I30 WeakPolarHBondContact O-CA 3.37Å; E27-I30 WeakPolarHBondContact O-CB 3.34Å; E27-I30 PolarHBondContact O-N 3.43Å; E27-L31 PolarHBondContact O-N 3.29Å
28L49.6Very low47.4Very low73 Ų73124.3 Ų124.338%0.38264%0.64SS.*Hα-helixtrans-58.3-38175.6-148.192000113V24 P25 I30 L31 L32V24-L28 HydrophobicContact CG1-CB 3.44Å; V24-L28 VanDerWaalsContact CG1-CB 3.44Å; V24-L28 HydrophobicContact CG1-CD2 3.83Å; V24-L28 HydrophobicContact CG1-CG 4.16Å; P25-L28 PolarHBondContact O-N 3.06Å; L28-I30 PolarHBondContact O-N 3Å; L28-L31 PolarHBondContact O-N 3.47Å; L28-L32 HydrophobicContact CD2-CD1 4.25Å; L28-L32 WeakPolarHBondContact O-CB 3.46Å; L28-L32 PolarHBondContact O-N 3.04Å
29P51.2Low48.7Very low72 Ų72120.2 Ų120.247%0.46863%0.631SS.*Hα-helixtrans-60.8-30.5169.8-22.233.6000113.4V26 E27 R33V26-P29 WeakPolarHBondContact O-CD 3.39Å; E27-P29 VanDerWaalsContact C-CD 3.43Å; E27-P29 VanDerWaalsContact C-N 3.33Å; P29-R33 VanDerWaalsContact O-CG 3.25Å; P29-R33 WeakPolarHBondContact O-CG 3.32Å; P29-R33 PolarHBondContact O-N 3.25Å
30I53.1Low50.5Low99 Ų99120.6 Ų120.651%0.50863%0.632SS.*Hα-helixtrans-75.5-43.7177.5-57177000109.9E27 L28 R33 L34E27-I30 CarbonylContact O-C 3.07Å; E27-I30 WeakPolarHBondContact O-CA 3.37Å; E27-I30 WeakPolarHBondContact O-CB 3.34Å; E27-I30 PolarHBondContact O-N 3.43Å; L28-I30 PolarHBondContact O-N 3Å; I30-R33 PolarHBondContact O-N 3.38Å; I30-L34 HydrophobicContact CG2-CD1 4.04Å; I30-L34 WeakPolarHBondContact O-CG 3.44Å; I30-L34 PolarHBondContact O-N 2.8Å
31L49.8Very low51.9Low91 Ų91123.3 Ų123.348%0.47664%0.644SS.*Hα-helixtrans-62.2-42.2175.3-87.6161.8000112.6E27 L28 R33 L34 L35E27-L31 PolarHBondContact O-N 3.29Å; L28-L31 PolarHBondContact O-N 3.47Å; L31-R33 VanDerWaalsContact C-N 3.33Å; L31-R33 PolarHBondContact O-N 3.42Å; L31-L34 PolarHBondContact O-N 2.9Å; L31-L34 VanDerWaalsContact O-N 3.14Å; L31-L35 PolarHBondContact O-N 2.9Å
32L53.6Low53.4Low113 Ų113122.5 Ų122.559%0.59263%0.629SS**Hα-helixtrans-63.9-36.2175.1-85.5158.5000112.5L28 L34L28-L32 HydrophobicContact CD2-CD1 4.25Å; L28-L32 WeakPolarHBondContact O-CB 3.46Å; L28-L32 PolarHBondContact O-N 3.04Å; L32-L34 VanDerWaalsContact C-N 3.31Å
33R52.4Low55.8Low208 Ų208118 Ų11879%0.78561%0.611SS**Hα-helixtrans-68.4-29.9173.2-76.7176.7-176.2-152.61.3112.7P29 I30 L31P29-R33 VanDerWaalsContact O-CG 3.25Å; P29-R33 WeakPolarHBondContact O-CG 3.32Å; P29-R33 PolarHBondContact O-N 3.25Å; I30-R33 PolarHBondContact O-N 3.38Å; L31-R33 VanDerWaalsContact C-N 3.33Å; L31-R33 PolarHBondContact O-N 3.42Å
34L54.6Low57.9Low109 Ų109112.2 Ų112.257%0.57160%0.601SS**Hα-helixtrans-79.7-34.3179.4-73.5164.2000113I30 L31 L32I30-L34 HydrophobicContact CG2-CD1 4.04Å; I30-L34 WeakPolarHBondContact O-CG 3.44Å; I30-L34 PolarHBondContact O-N 2.8Å; L31-L34 PolarHBondContact O-N 2.9Å; L31-L34 VanDerWaalsContact O-N 3.14Å; L32-L34 VanDerWaalsContact C-N 3.31Å
35L57.1Low60Low138 Ų138112.3 Ų112.372%0.72361%0.605SS**Hα-helixtrans-82.7-23-174.7-90.8143.7000115L31L31-L35 PolarHBondContact O-N 2.9Å
36C51Low62Low61 Ų61113 Ų11341%0.41260%0.603SS.*  trans-122.669-176.2-75.30000112.7T38 L39C36-T38 PolarHBondContact O-N 3.18Å; C36-L39 HydrophobicContact CB-CB 4.48Å; C36-L39 HydrophobicContact CB-CD1 3.77Å; C36-L39 HydrophobicContact CB-CG 4.14Å
37R56.4Low63.6Low218 Ų218110.3 Ų110.382%0.82358%0.581SS**SBendtrans-72.3-14.3168.8-70.8-173.4176.4-140.80.9113.7
38T63.7Low65.7Low134 Ų134109.6 Ų109.682%0.82258%0.578SS**SBendtrans-99.1-7.4-173.750.20000114.6C36C36-T38 PolarHBondContact O-N 3.18Å
39L62.1Low67.4Low118 Ų118114 Ų11462%0.61859%0.589SS**SBendtrans-81.9133.2175-69.4174.5000109.5C36C36-L39 HydrophobicContact CB-CB 4.48Å; C36-L39 HydrophobicContact CB-CD1 3.77Å; C36-L39 HydrophobicContact CB-CG 4.14Å
40P71.1Confident69Low106 Ų106115.5 Ų115.569%0.68859%0.59SS**PPolyproline II helixtrans-57.5146173.522.5-30.4000110.2K42P40-K42 PolarHBondContact O-N 3.15Å
41P67.6Low70.7Confident125 Ų125119.1 Ų119.181%0.81260%0.597SS**PPolyproline II helixtrans-55.8134.4175.723.5-32.2000109.4
42K71.4Confident72.7Confident93 Ų93121 Ų12140%0.40460%0.603SS.*PPolyproline II helixtrans-57.1144.4175.8-67.9-174.9170.6-142.10109.7P40 E46 E47P40-K42 PolarHBondContact O-N 3.15Å; K42-E46 WeakPolarHBondContact CD-OE1 3.03Å; K42-E46 WeakPolarHBondContact CE-OE1 3.48Å; K42-E46 IonicContact NZ-OE1 3.6Å; K42-E46 PolarHBondContact NZ-OE1 3.41Å; K42-E47 HydrophobicContact CB-CG 3.97Å
43S83.5Confident74.5Confident67 Ų67119.5 Ų119.547%0.46959%0.593SS.*PPolyproline II helixtrans-62.9146.3175.572.80000110.2S45 E46 E47S43-S45 PolarHBondContact O-N 3.01Å; S43-S45 VanDerWaalsContact O-N 3.11Å; S43-E46 WeakPolarHBondContact O-CB 3.42Å; S43-E46 PolarHBondContact O-N 3.32Å; S43-E46 WeakPolarHBondContact OG-CB 3.22Å; S43-E46 PolarHBondContact OG-N 2.74Å; S43-E47 PolarHBondContact O-N 3.48Å; S43-E47 VanDerWaalsContact O-N 3.08Å
44V86Confident76.3Confident105 Ų105116.5 Ų116.564%0.63658%0.583SS**Hα-helixtrans-54.3-34.4177.8177.80000111.5Q48V44-Q48 WeakPolarHBondContact O-CG 3.22Å; V44-Q48 PolarHBondContact O-N 2.95Å; V44-Q48 VanDerWaalsContact O-N 3.12Å
45S86.7Confident78Confident88 Ų88114 Ų11462%0.61558%0.578SS**Hα-helixtrans-65.9-42.4175.8-179.60000112.7S43 Q48 R49S43-S45 PolarHBondContact O-N 3.01Å; S43-S45 VanDerWaalsContact O-N 3.11Å; S45-Q48 PolarHBondContact O-N 3.37Å; S45-R49 PolarHBondContact O-N 2.97Å
46E85.4Confident79.8Confident87 Ų87112.4 Ų112.441%0.40757%0.567SS.*Hα-helixtrans-65.4-42.2176.8-170.4-166.514800111.5K42 S43 Q48 R49 Q50K42-E46 WeakPolarHBondContact CD-OE1 3.03Å; K42-E46 WeakPolarHBondContact CE-OE1 3.48Å; K42-E46 IonicContact NZ-OE1 3.6Å; K42-E46 PolarHBondContact NZ-OE1 3.41Å; S43-E46 WeakPolarHBondContact O-CB 3.42Å; S43-E46 PolarHBondContact O-N 3.32Å; S43-E46 WeakPolarHBondContact OG-CB 3.22Å; S43-E46 PolarHBondContact OG-N 2.74Å; E46-Q48 PolarHBondContact O-N 2.57Å; E46-R49 PolarHBondContact O-N 3.35Å; E46-Q50 WeakPolarHBondContact O-CB 3.4Å; E46-Q50 PolarHBondContact O-N 2.96Å
47E85.2Confident81.8Confident82 Ų82114.5 Ų114.538%0.38357%0.573SS.*Hα-helixtrans-62.6-41.2177.1-69-167.217200112.3K42 S43 Q50 R51K42-E47 HydrophobicContact CB-CG 3.97Å; S43-E47 PolarHBondContact O-N 3.48Å; S43-E47 VanDerWaalsContact O-N 3.08Å; E47-Q50 PolarHBondContact O-N 3.48Å; E47-R51 VanDerWaalsContact O-CG 3.32Å; E47-R51 WeakPolarHBondContact O-CG 3.35Å; E47-R51 PolarHBondContact O-N 2.92Å
48Q88.4Confident83.6Confident115 Ų115108.3 Ų108.354%0.53756%0.556SS.*Hα-helixtrans-63.6-44.7176.2-76.9178.2-12.400111.6V44 S45 E46 R51 Q52V44-Q48 WeakPolarHBondContact O-CG 3.22Å; V44-Q48 PolarHBondContact O-N 2.95Å; V44-Q48 VanDerWaalsContact O-N 3.12Å; S45-Q48 PolarHBondContact O-N 3.37Å; E46-Q48 PolarHBondContact O-N 2.57Å; Q48-R51 PolarHBondContact O-N 3.29Å; Q48-Q52 WeakPolarHBondContact O-CG 3.49Å; Q48-Q52 PolarHBondContact O-N 2.9Å
49R85.9Confident85.1Confident166 Ų166106 Ų10663%0.62654%0.536SS*.Hα-helixtrans-60.5-46.6176.2-177178.8172.3173.42.2111.4S45 E46 R51 Q52 E53S45-R49 PolarHBondContact O-N 2.97Å; E46-R49 PolarHBondContact O-N 3.35Å; R49-R51 VanDerWaalsContact C-N 3.31Å; R49-R51 PolarHBondContact O-N 3.36Å; R49-Q52 PolarHBondContact O-N 3.4Å; R49-E53 HydrophobicContact CG-CG 4.42Å; R49-E53 WeakPolarHBondContact CG-OE1 3.47Å; R49-E53 IonicContact CZ-OE1 2.77Å; R49-E53 IonicContact NE-OE1 3.59Å; R49-E53 PolarHBondContact NE-OE1 2.94Å; R49-E53 IonicContact NH2-OE1 2.72Å; R49-E53 PolarHBondContact NH2-OE1 3.37Å; R49-E53 WeakPolarHBondContact O-CG 3.37Å; R49-E53 PolarHBondContact O-N 3.44Å
50Q85Confident86.6Confident103 Ų103107 Ų10748%0.48154%0.535SS..Hα-helixtrans-62.9-37178.6-169.41757.800112.1E46 E47 Y54E46-Q50 WeakPolarHBondContact O-CB 3.4Å; E46-Q50 PolarHBondContact O-N 2.96Å; E47-Q50 PolarHBondContact O-N 3.48Å; Q50-Y54 VanDerWaalsContact O-CB 3.22Å; Q50-Y54 WeakPolarHBondContact O-CB 3.33Å; Q50-Y54 PolarHBondContact O-N 2.93Å
51R87.7Confident87.8Confident175 Ų175104.4 Ų104.466%0.6652%0.523SS*.Hα-helixtrans-64.3-41.3174.1-75.2177.4-171.1-173.77.1112.2E47 Q48 R49 A55E47-R51 VanDerWaalsContact O-CG 3.32Å; E47-R51 WeakPolarHBondContact O-CG 3.35Å; E47-R51 PolarHBondContact O-N 2.92Å; Q48-R51 PolarHBondContact O-N 3.29Å; R49-R51 VanDerWaalsContact C-N 3.31Å; R49-R51 PolarHBondContact O-N 3.36Å; R51-A55 WeakPolarHBondContact O-CB 3.47Å; R51-A55 PolarHBondContact O-N 3.3Å
52Q91.3Very high89.1Confident129 Ų129105.2 Ų105.260%0.60351%0.51SS*.Hα-helixtrans-64.9-50176-71.7174.6-8.600111.1Q48 R49 Y54 A55 E56Q48-Q52 WeakPolarHBondContact O-CG 3.49Å; Q48-Q52 PolarHBondContact O-N 2.9Å; R49-Q52 PolarHBondContact O-N 3.4Å; Q52-Y54 VanDerWaalsContact C-N 3.32Å; Q52-Y54 PolarHBondContact O-N 3.48Å; Q52-A55 PolarHBondContact O-N 3.46Å; Q52-A55 VanDerWaalsContact O-N 3.15Å; Q52-E56 PolarHBondContact O-N 2.92Å
53E91.8Very high90.2Very high83 Ų83105.9 Ų105.939%0.38851%0.513SS..Hα-helixtrans-59-42.9177.6-71.7175.3-178.500111.6R49 E56 I57R49-E53 HydrophobicContact CG-CG 4.42Å; R49-E53 WeakPolarHBondContact CG-OE1 3.47Å; R49-E53 IonicContact CZ-OE1 2.77Å; R49-E53 IonicContact NE-OE1 3.59Å; R49-E53 PolarHBondContact NE-OE1 2.94Å; R49-E53 IonicContact NH2-OE1 2.72Å; R49-E53 PolarHBondContact NH2-OE1 3.37Å; R49-E53 WeakPolarHBondContact O-CG 3.37Å; R49-E53 PolarHBondContact O-N 3.44Å; E53-E56 PolarHBondContact O-N 2.95Å; E53-I57 WeakPolarHBondContact O-CD1 3.48Å; E53-I57 VanDerWaalsContact O-CG1 3.22Å; E53-I57 WeakPolarHBondContact O-CG1 3.46Å; E53-I57 PolarHBondContact O-N 2.65Å
54Y89.9Confident90.8Very high144 Ų144109 Ų10957%0.56552%0.518SS*.Hα-helixtrans-63.5-42.3176.1-174.2-106.5000112.3Q50 Q52 E56 I57 L58Q50-Y54 VanDerWaalsContact O-CB 3.22Å; Q50-Y54 WeakPolarHBondContact O-CB 3.33Å; Q50-Y54 PolarHBondContact O-N 2.93Å; Q52-Y54 VanDerWaalsContact C-N 3.32Å; Q52-Y54 PolarHBondContact O-N 3.48Å; Y54-E56 PolarHBondContact O-N 2.86Å; Y54-I57 PolarHBondContact O-N 3.35Å; Y54-L58 HydrophobicContact CD1-CD1 3.8Å; Y54-L58 HydrophobicContact CD1-CG 4.25Å; Y54-L58 HydrophobicContact CE1-CD1 3.32Å; Y54-L58 HydrophobicContact CE1-CD2 4.42Å; Y54-L58 HydrophobicContact CE1-CG 3.92Å; Y54-L58 HydrophobicContact CE2-CD2 4.48Å; Y54-L58 HydrophobicContact CE2-CG 4.44Å; Y54-L58 WeakPolarHBondContact O-CG 3.4Å; Y54-L58 PolarHBondContact O-N 2.91Å
55A91.5Very high91.2Very high57 Ų57109.1 Ų109.147%0.47151%0.511SS..Hα-helixtrans-62.1-41.6176.100000112R51 Q52 L58 E59R51-A55 WeakPolarHBondContact O-CB 3.47Å; R51-A55 PolarHBondContact O-N 3.3Å; Q52-A55 PolarHBondContact O-N 3.46Å; Q52-A55 VanDerWaalsContact O-N 3.15Å; A55-L58 PolarHBondContact O-N 2.8Å; A55-E59 PolarHBondContact O-N 3.18Å
56E94Very high91.6Very high105 Ų105109 Ų10949%0.49150%0.501SS..Hα-helixtrans-64.8-42.1174.8-72.1-176.2-167.200112.6Q52 E53 Y54 L58 E59 K60Q52-E56 PolarHBondContact O-N 2.92Å; E53-E56 PolarHBondContact O-N 2.95Å; Y54-E56 PolarHBondContact O-N 2.86Å; E56-L58 VanDerWaalsContact C-N 3.34Å; E56-E59 PolarHBondContact O-N 3.37Å; E56-K60 WeakPolarHBondContact O-CB 3.23Å; E56-K60 WeakPolarHBondContact O-CG 3.44Å; E56-K60 PolarHBondContact O-N 2.91Å
57I93.9Very high92.1Very high105 Ų105110.6 Ų110.654%0.53851%0.511SS..Hα-helixtrans-59.9-46.8175.8-71.4164.6000110E53 Y54 E59 K60 A61E53-I57 WeakPolarHBondContact O-CD1 3.48Å; E53-I57 VanDerWaalsContact O-CG1 3.22Å; E53-I57 WeakPolarHBondContact O-CG1 3.46Å; E53-I57 PolarHBondContact O-N 2.65Å; Y54-I57 PolarHBondContact O-N 3.35Å; I57-E59 VanDerWaalsContact C-N 3.35Å; I57-E59 PolarHBondContact O-N 2.98Å; I57-K60 PolarHBondContact O-N 3.41Å; I57-A61 WeakPolarHBondContact O-CB 3.44Å; I57-A61 PolarHBondContact O-N 3.21Å
58L94.4Very high92.6Very high87 Ų87110.6 Ų110.646%0.45551%0.512SS..Hα-helixtrans-62.5-40.2177-71.6-178000112.1Y54 A55 E56 A61 R62Y54-L58 HydrophobicContact CD1-CD1 3.8Å; Y54-L58 HydrophobicContact CD1-CG 4.25Å; Y54-L58 HydrophobicContact CE1-CD1 3.32Å; Y54-L58 HydrophobicContact CE1-CD2 4.42Å; Y54-L58 HydrophobicContact CE1-CG 3.92Å; Y54-L58 HydrophobicContact CE2-CD2 4.48Å; Y54-L58 HydrophobicContact CE2-CG 4.44Å; Y54-L58 WeakPolarHBondContact O-CG 3.4Å; Y54-L58 PolarHBondContact O-N 2.91Å; A55-L58 PolarHBondContact O-N 2.8Å; E56-L58 VanDerWaalsContact C-N 3.34Å; L58-A61 PolarHBondContact O-N 3.46Å; L58-R62 WeakPolarHBondContact O-CB 3.19Å; L58-R62 PolarHBondContact O-N 3.17Å
59E94Very high93Very high85 Ų85108.9 Ų108.940%0.39750%0.504SS..Hα-helixtrans-65.9-44.7177.7-164.5-165.4155.900111.9A55 E56 I57 R62 K63A55-E59 PolarHBondContact O-N 3.18Å; E56-E59 PolarHBondContact O-N 3.37Å; I57-E59 VanDerWaalsContact C-N 3.35Å; I57-E59 PolarHBondContact O-N 2.98Å; E59-R62 PolarHBondContact O-N 3.44Å; E59-K63 HydrophobicContact CG-CD 4.46Å; E59-K63 WeakPolarHBondContact O-CB 3.48Å; E59-K63 WeakPolarHBondContact O-CG 3.1Å; E59-K63 PolarHBondContact O-N 3.07Å; E59-K63 WeakPolarHBondContact OE1-CE 3.43Å; E59-K63 IonicContact OE1-NZ 2.93Å; E59-K63 PolarHBondContact OE1-NZ 3Å
60K94.4Very high93.4Very high139 Ų139106.5 Ų106.560%0.60450%0.499SS*.Hα-helixtrans-61.2-43.8175.1-74.3174.5-175.6167.20111.2E56 I57 K63 K64E56-K60 WeakPolarHBondContact O-CB 3.23Å; E56-K60 WeakPolarHBondContact O-CG 3.44Å; E56-K60 PolarHBondContact O-N 2.91Å; I57-K60 PolarHBondContact O-N 3.41Å; K60-K63 PolarHBondContact O-N 3.41Å; K60-K64 WeakPolarHBondContact O-CB 3.28Å; K60-K64 PolarHBondContact O-N 3.44Å
61A95.1Very high94Very high52 Ų52105.8 Ų105.843%0.4350%0.495SS..Hα-helixtrans-60.4-47.3176.100000111.4I57 L58 K63 K64 E65I57-A61 WeakPolarHBondContact O-CB 3.44Å; I57-A61 PolarHBondContact O-N 3.21Å; L58-A61 PolarHBondContact O-N 3.46Å; A61-K63 PolarHBondContact O-N 2.95Å; A61-K64 PolarHBondContact O-N 3.17Å; A61-E65 WeakPolarHBondContact O-CB 3.47Å; A61-E65 PolarHBondContact O-N 3.39Å
62R95.1Very high94.3Very high143 Ų143104 Ų10454%0.5449%0.489SS..Hα-helixtrans-61.1-43.5176.7-172.2-176.769.8161.3-0.8112.3L58 E59 E65 Q66L58-R62 WeakPolarHBondContact O-CB 3.19Å; L58-R62 PolarHBondContact O-N 3.17Å; E59-R62 PolarHBondContact O-N 3.44Å; R62-E65 PolarHBondContact O-N 3.48Å; R62-Q66 WeakPolarHBondContact O-CB 3.28Å; R62-Q66 VanDerWaalsContact O-CG 3.28Å; R62-Q66 WeakPolarHBondContact O-CG 3.27Å; R62-Q66 PolarHBondContact O-N 2.85Å
63K95.3Very high94.6Very high107 Ų107103.4 Ų103.447%0.46549%0.486SS..Hα-helixtrans-62.2-44.9177.1-80.2173167.7165.60111.4E59 K60 A61 Q66 L67E59-K63 HydrophobicContact CG-CD 4.46Å; E59-K63 WeakPolarHBondContact O-CB 3.48Å; E59-K63 WeakPolarHBondContact O-CG 3.1Å; E59-K63 PolarHBondContact O-N 3.07Å; E59-K63 WeakPolarHBondContact OE1-CE 3.43Å; E59-K63 IonicContact OE1-NZ 2.93Å; E59-K63 PolarHBondContact OE1-NZ 3Å; K60-K63 PolarHBondContact O-N 3.41Å; A61-K63 PolarHBondContact O-N 2.95Å; K63-Q66 PolarHBondContact O-N 2.89Å; K63-L67 WeakPolarHBondContact O-CG 2.93Å; K63-L67 PolarHBondContact O-N 2.89Å
64K95.2Very high94.8Very high133 Ų133107.1 Ų107.158%0.57850%0.496SS*.Hα-helixtrans-61-47.7176-178.8176.8172.6179.70111.4K60 A61 Q66 L67 E68K60-K64 WeakPolarHBondContact O-CB 3.28Å; K60-K64 PolarHBondContact O-N 3.44Å; A61-K64 PolarHBondContact O-N 3.17Å; K64-Q66 VanDerWaalsContact C-N 3.33Å; K64-Q66 PolarHBondContact O-N 3.41Å; K64-L67 PolarHBondContact O-N 3.41Å; K64-E68 WeakPolarHBondContact CE-OE1 3.35Å; K64-E68 WeakPolarHBondContact O-CG 3.35Å; K64-E68 PolarHBondContact O-N 2.84Å
65E95.1Very high95Very high107 Ų107105 Ų10550%0.549%0.491SS..Hα-helixtrans-60.2-41.8178.5-168.8-176.6-169.500111.9A61 R62 E68 M69A61-E65 WeakPolarHBondContact O-CB 3.47Å; A61-E65 PolarHBondContact O-N 3.39Å; R62-E65 PolarHBondContact O-N 3.48Å; E65-E68 PolarHBondContact O-N 3.09Å; E65-M69 HydrophobicContact CG-CE 4.14Å; E65-M69 WeakPolarHBondContact O-CB 3.31Å; E65-M69 VanDerWaalsContact O-CG 3.31Å; E65-M69 WeakPolarHBondContact O-CG 3.4Å; E65-M69 PolarHBondContact O-N 3.5Å
66Q95.7Very high95.2Very high84 Ų84106.7 Ų106.739%0.39349%0.492SS..Hα-helixtrans-63.9-39.8175.6-74.5177.20.100113.1R62 K63 K64 M69 K70R62-Q66 WeakPolarHBondContact O-CB 3.28Å; R62-Q66 VanDerWaalsContact O-CG 3.28Å; R62-Q66 WeakPolarHBondContact O-CG 3.27Å; R62-Q66 PolarHBondContact O-N 2.85Å; K63-Q66 PolarHBondContact O-N 2.89Å; K64-Q66 VanDerWaalsContact C-N 3.33Å; K64-Q66 PolarHBondContact O-N 3.41Å; Q66-M69 HydrophobicContact CG-CE 4.16Å; Q66-K70 WeakPolarHBondContact O-CG 3.38Å; Q66-K70 PolarHBondContact O-N 3.37Å
67L95.7Very high95.4Very high121 Ų121108.9 Ų108.963%0.63450%0.5SS*.Hα-helixtrans-65.9-44.8176-71.4171.5000111.1K63 K64 K70 Q71K63-L67 WeakPolarHBondContact O-CG 2.93Å; K63-L67 PolarHBondContact O-N 2.89Å; K64-L67 PolarHBondContact O-N 3.41Å; L67-K70 PolarHBondContact O-N 2.93Å; L67-Q71 WeakPolarHBondContact O-CB 3.48Å; L67-Q71 PolarHBondContact O-N 2.98Å
68E95.7Very high95.4Very high83 Ų83109.6 Ų109.639%0.38850%0.501SS..Hα-helixtrans-63.8-39.7176.2-70.8175.4-177.200112.1K64 E65 Q71 R72K64-E68 WeakPolarHBondContact CE-OE1 3.35Å; K64-E68 WeakPolarHBondContact O-CG 3.35Å; K64-E68 PolarHBondContact O-N 2.84Å; E65-E68 PolarHBondContact O-N 3.09Å; E68-Q71 PolarHBondContact O-N 3.42Å; E68-R72 WeakPolarHBondContact O-CB 3.49Å; E68-R72 WeakPolarHBondContact O-CG 3.36Å; E68-R72 PolarHBondContact O-N 2.88Å; E68-R72 PolarHBondContact O-NE 3.47Å
69M95.4Very high95.4Very high78 Ų78109.7 Ų109.738%0.38450%0.499SS..Hα-helixtrans-61.9-45.4172.9-77.3-169-7000111.9E65 Q66 Q71 R72 Q73E65-M69 HydrophobicContact CG-CE 4.14Å; E65-M69 WeakPolarHBondContact O-CB 3.31Å; E65-M69 VanDerWaalsContact O-CG 3.31Å; E65-M69 WeakPolarHBondContact O-CG 3.4Å; E65-M69 PolarHBondContact O-N 3.5Å; Q66-M69 HydrophobicContact CG-CE 4.16Å; M69-Q71 PolarHBondContact O-N 3.31Å; M69-R72 PolarHBondContact O-N 3.42Å; M69-Q73 WeakPolarHBondContact O-CB 3.41Å; M69-Q73 VanDerWaalsContact O-CG 3.31Å; M69-Q73 WeakPolarHBondContact O-CG 3.42Å; M69-Q73 PolarHBondContact O-N 3.05Å
70K96Very high95.5Very high117 Ų117109.4 Ų109.451%0.50950%0.5SS..Hα-helixtrans-63.9-39.8176.7-75.3176.7-179.31790112.1Q66 L67 Q73 R74Q66-K70 WeakPolarHBondContact O-CG 3.38Å; Q66-K70 PolarHBondContact O-N 3.37Å; L67-K70 PolarHBondContact O-N 2.93Å; K70-Q73 PolarHBondContact O-N 3.38Å; K70-R74 WeakPolarHBondContact O-CG 3.44Å; K70-R74 PolarHBondContact O-N 3.27Å
71Q95.9Very high95.6Very high87 Ų87108.8 Ų108.841%0.40750%0.497SS..Hα-helixtrans-64.9-48.7177.3-176.859.322.500111.2L67 E68 M69 Q73 R74 E75L67-Q71 WeakPolarHBondContact O-CB 3.48Å; L67-Q71 PolarHBondContact O-N 2.98Å; E68-Q71 PolarHBondContact O-N 3.42Å; M69-Q71 PolarHBondContact O-N 3.31Å; Q71-Q73 VanDerWaalsContact C-N 3.28Å; Q71-Q73 PolarHBondContact O-N 3.16Å; Q71-R74 WeakPolarHBondContact O-CB 3.27Å; Q71-R74 PolarHBondContact O-N 2.81Å; Q71-E75 WeakPolarHBondContact CG-OE1 3.47Å; Q71-E75 PolarHBondContact NE2-OE1 3.17Å; Q71-E75 PolarHBondContact O-N 2.85Å
72R95.6Very high95.3Very high138 Ų138113.9 Ų113.952%0.52151%0.506SS..Hα-helixtrans-57.4-39.9174.6-75.7-175.6-74.7-135.3-1.6112.6E68 M69 L76E68-R72 WeakPolarHBondContact O-CB 3.49Å; E68-R72 WeakPolarHBondContact O-CG 3.36Å; E68-R72 PolarHBondContact O-N 2.88Å; E68-R72 PolarHBondContact O-NE 3.47Å; M69-R72 PolarHBondContact O-N 3.42Å; R72-L76 VanDerWaalsContact O-CB 3.27Å; R72-L76 WeakPolarHBondContact O-CB 3.31Å; R72-L76 PolarHBondContact O-N 2.94Å
73Q96.5Very high95.3Very high117 Ų117111.6 Ų111.655%0.54750%0.501SS..Hα-helixtrans-66.3-35175.9-76.2177.5-4.500113M69 K70 Q71 K77M69-Q73 WeakPolarHBondContact O-CB 3.41Å; M69-Q73 VanDerWaalsContact O-CG 3.31Å; M69-Q73 WeakPolarHBondContact O-CG 3.42Å; M69-Q73 PolarHBondContact O-N 3.05Å; K70-Q73 PolarHBondContact O-N 3.38Å; Q71-Q73 VanDerWaalsContact C-N 3.28Å; Q71-Q73 PolarHBondContact O-N 3.16Å; Q73-K77 WeakPolarHBondContact O-CB 3.26Å; Q73-K77 VanDerWaalsContact O-CG 3.26Å; Q73-K77 WeakPolarHBondContact O-CG 3.37Å; Q73-K77 PolarHBondContact O-N 3.13Å; Q73-K77 VanDerWaalsContact O-N 3.13Å
74R96.1Very high95.3Very high161 Ų161113.1 Ų113.161%0.60851%0.51SS*.Hα-helixtrans-69-49.1175.5-72.7171.2179.8-175.9-2.9111K70 Q71 L76 K77 E78K70-R74 WeakPolarHBondContact O-CG 3.44Å; K70-R74 PolarHBondContact O-N 3.27Å; Q71-R74 WeakPolarHBondContact O-CB 3.27Å; Q71-R74 PolarHBondContact O-N 2.81Å; R74-L76 VanDerWaalsContact C-N 3.32Å; R74-L76 PolarHBondContact O-N 3.04Å; R74-K77 PolarHBondContact O-N 3.4Å; R74-K77 VanDerWaalsContact O-N 3.17Å; R74-E78 WeakPolarHBondContact O-CG 3.41Å; R74-E78 PolarHBondContact O-N 3.32Å
75E95.2Very high95.1Very high98 Ų98112.2 Ų112.246%0.45851%0.507SS..Hα-helixtrans-58.9-43.3177.6-71.7168.7-17400111.7Q71 E78 Q79Q71-E75 WeakPolarHBondContact CG-OE1 3.47Å; Q71-E75 PolarHBondContact NE2-OE1 3.17Å; Q71-E75 PolarHBondContact O-N 2.85Å; E75-E78 PolarHBondContact O-N 2.96Å; E75-Q79 WeakPolarHBondContact O-CB 3.45Å; E75-Q79 PolarHBondContact O-N 2.95Å
76L96Very high95Very high94 Ų94111 Ų11149%0.49250%0.504SS..Hα-helixtrans-63.4-42.6176.4-177.163000111.9R72 R74 E78 Q79 L80R72-L76 VanDerWaalsContact O-CB 3.27Å; R72-L76 WeakPolarHBondContact O-CB 3.31Å; R72-L76 PolarHBondContact O-N 2.94Å; R74-L76 VanDerWaalsContact C-N 3.32Å; R74-L76 PolarHBondContact O-N 3.04Å; L76-E78 VanDerWaalsContact C-N 3.34Å; L76-E78 PolarHBondContact O-N 2.89Å; L76-Q79 PolarHBondContact O-N 3.31Å; L76-L80 HydrophobicContact CD1-CG 4.45Å; L76-L80 HydrophobicContact CG-CD1 4.21Å; L76-L80 WeakPolarHBondContact O-CB 3.32Å; L76-L80 WeakPolarHBondContact O-CG 3.49Å; L76-L80 PolarHBondContact O-N 3.49Å
77K96.8Very high95Very high150 Ų150110.9 Ų110.965%0.65251%0.512SS*.Hα-helixtrans-63.3-40.1176.1-77.4176.1178.9-174.80112.2Q73 R74 K81Q73-K77 WeakPolarHBondContact O-CB 3.26Å; Q73-K77 VanDerWaalsContact O-CG 3.26Å; Q73-K77 WeakPolarHBondContact O-CG 3.37Å; Q73-K77 PolarHBondContact O-N 3.13Å; Q73-K77 VanDerWaalsContact O-N 3.13Å; R74-K77 PolarHBondContact O-N 3.4Å; R74-K77 VanDerWaalsContact O-N 3.17Å; K77-K81 WeakPolarHBondContact O-CB 3.48Å; K77-K81 PolarHBondContact O-N 2.86Å
78E94.8Very high95Very high121 Ų121107.8 Ų107.857%0.56551%0.505SS*.Hα-helixtrans-68.9-35.6176.2-72.2174.7-176.800112.2R74 E75 L76 R82R74-E78 WeakPolarHBondContact O-CG 3.41Å; R74-E78 PolarHBondContact O-N 3.32Å; E75-E78 PolarHBondContact O-N 2.96Å; L76-E78 VanDerWaalsContact C-N 3.34Å; L76-E78 PolarHBondContact O-N 2.89Å; E78-R82 WeakPolarHBondContact O-CG 3.44Å; E78-R82 PolarHBondContact O-N 2.91Å; E78-R82 VanDerWaalsContact O-N 3.12Å; E78-R82 PolarHBondContact O-NE 3.08Å
79Q94.2Very high94.9Very high88 Ų88104.8 Ų104.841%0.41149%0.493SS..Hα-helixtrans-64.4-51.5172.4-178.4179.4-6.300111.3E75 L76 K81 R82 E83E75-Q79 WeakPolarHBondContact O-CB 3.45Å; E75-Q79 PolarHBondContact O-N 2.95Å; L76-Q79 PolarHBondContact O-N 3.31Å; Q79-K81 VanDerWaalsContact C-N 3.3Å; Q79-K81 PolarHBondContact O-N 3.03Å; Q79-R82 WeakPolarHBondContact O-CB 3.34Å; Q79-R82 PolarHBondContact O-N 3.34Å; Q79-E83 HydrophobicContact CG-CG 4.49Å; Q79-E83 WeakPolarHBondContact CG-OE1 3.38Å; Q79-E83 PolarHBondContact NE2-OE1 2.87Å; Q79-E83 PolarHBondContact O-N 3.12Å
80L96Very high95Very high79 Ų79103 Ų10341%0.41449%0.486SS..Hα-helixtrans-57.9-43.3178.5-72.1171.1000111.5L76 R82 E83 E84L76-L80 HydrophobicContact CD1-CG 4.45Å; L76-L80 HydrophobicContact CG-CD1 4.21Å; L76-L80 WeakPolarHBondContact O-CB 3.32Å; L76-L80 WeakPolarHBondContact O-CG 3.49Å; L76-L80 PolarHBondContact O-N 3.49Å; L80-R82 VanDerWaalsContact C-N 3.3Å; L80-R82 PolarHBondContact O-N 3Å; L80-E83 PolarHBondContact O-N 3.36Å; L80-E84 WeakPolarHBondContact O-CB 3.37Å; L80-E84 WeakPolarHBondContact O-CG 3.29Å; L80-E84 PolarHBondContact O-N 3.42Å
81K95.5Very high95Very high127 Ų127103.2 Ų103.255%0.55249%0.487SS*.Hα-helixtrans-59.8-40.1175.4-174.7179.2179.2-176.80112.3K77 Q79 Q85K77-K81 WeakPolarHBondContact O-CB 3.48Å; K77-K81 PolarHBondContact O-N 2.86Å; Q79-K81 VanDerWaalsContact C-N 3.3Å; Q79-K81 PolarHBondContact O-N 3.03Å; K81-Q85 WeakPolarHBondContact O-CB 3.39Å; K81-Q85 WeakPolarHBondContact O-CG 3.37Å; K81-Q85 PolarHBondContact O-N 2.83Å
82R90.4Very high95.1Very high159 Ų159101.1 Ų101.160%0.648%0.477SS*.Hα-helixtrans-67.6-41.2176.4-76.3-177.3-70.8160.9-3.3111.8E78 Q79 L80 Q85 L86E78-R82 WeakPolarHBondContact O-CG 3.44Å; E78-R82 PolarHBondContact O-N 2.91Å; E78-R82 VanDerWaalsContact O-N 3.12Å; E78-R82 PolarHBondContact O-NE 3.08Å; Q79-R82 WeakPolarHBondContact O-CB 3.34Å; Q79-R82 PolarHBondContact O-N 3.34Å; L80-R82 VanDerWaalsContact C-N 3.3Å; L80-R82 PolarHBondContact O-N 3Å; R82-Q85 PolarHBondContact O-N 2.86Å; R82-L86 WeakPolarHBondContact O-CB 3.35Å; R82-L86 PolarHBondContact O-N 2.76Å
83E93.7Very high95.2Very high95 Ų9594.6 Ų94.644%0.44445%0.452SS..Hα-helixtrans-65.5-41.7177-71.4174.3-171.100111.8Q79 L80 L86 S87Q79-E83 HydrophobicContact CG-CG 4.49Å; Q79-E83 WeakPolarHBondContact CG-OE1 3.38Å; Q79-E83 PolarHBondContact NE2-OE1 2.87Å; Q79-E83 PolarHBondContact O-N 3.12Å; L80-E83 PolarHBondContact O-N 3.36Å; E83-L86 PolarHBondContact O-N 3.22Å; E83-S87 VanDerWaalsContact O-CB 3.29Å; E83-S87 WeakPolarHBondContact O-CB 3.47Å; E83-S87 PolarHBondContact O-N 3.02Å
84E95.1Very high95.2Very high138 Ų13891.4 Ų91.465%0.64544%0.443SS*.Hα-helixtrans-62.7-44.9174-74.4174.8174.300111.8L80 L86 S87 A88L80-E84 WeakPolarHBondContact O-CB 3.37Å; L80-E84 WeakPolarHBondContact O-CG 3.29Å; L80-E84 PolarHBondContact O-N 3.42Å; E84-L86 VanDerWaalsContact C-N 3.35Å; E84-S87 PolarHBondContact O-N 3.42Å; E84-A88 WeakPolarHBondContact O-CB 3.32Å; E84-A88 PolarHBondContact O-N 3.36Å
85Q92.6Very high95.2Very high114 Ų11489.8 Ų89.853%0.53344%0.442SS..Hα-helixtrans-62.2-42.3175.4-76.5175.3-15.600111.9K81 R82 S89K81-Q85 WeakPolarHBondContact O-CB 3.39Å; K81-Q85 WeakPolarHBondContact O-CG 3.37Å; K81-Q85 PolarHBondContact O-N 2.83Å; R82-Q85 PolarHBondContact O-N 2.86Å; Q85-S89 VanDerWaalsContact O-CB 3.3Å; Q85-S89 WeakPolarHBondContact O-CB 3.2Å; Q85-S89 PolarHBondContact O-N 3.37Å
86L92.4Very high95.3Very high82 Ų8289.1 Ų89.143%0.42944%0.44SS..Hα-helixtrans-63.8-46.8176.5-176.862.2000110.8R82 E83 E84 A88 S89 V90 P119R82-L86 WeakPolarHBondContact O-CB 3.35Å; R82-L86 PolarHBondContact O-N 2.76Å; E83-L86 PolarHBondContact O-N 3.22Å; E84-L86 VanDerWaalsContact C-N 3.35Å; L86-A88 PolarHBondContact O-N 3.35Å; L86-S89 WeakPolarHBondContact O-CB 3.39Å; L86-S89 PolarHBondContact O-N 3.02Å; L86-V90 HydrophobicContact CD1-CG2 4.45Å; L86-V90 HydrophobicContact CG-CG2 4.48Å; L86-V90 VanDerWaalsContact O-CG2 3.28Å; L86-V90 WeakPolarHBondContact O-CG2 3.29Å; L86-V90 PolarHBondContact O-N 2.9Å; L86-P119 HydrophobicContact CD1-CB 3.8Å; L86-P119 HydrophobicContact CD1-CG 4.2Å
87S95.1Very high95.4Very high81 Ų8184.7 Ų84.757%0.56642%0.416SS*.Hα-helixtrans-60.9-44.1178.6-176.30000112.1E83 E84 V90 K91E83-S87 VanDerWaalsContact O-CB 3.29Å; E83-S87 WeakPolarHBondContact O-CB 3.47Å; E83-S87 PolarHBondContact O-N 3.02Å; E84-S87 PolarHBondContact O-N 3.42Å; S87-V90 PolarHBondContact O-N 3.37Å; S87-K91 PolarHBondContact O-N 3.39Å
88A95.2Very high95.4Very high57 Ų5779.1 Ų79.147%0.47139%0.393SS..Hα-helixtrans-61.5-45.4174.100000111.7E84 L86 K91 E92E84-A88 WeakPolarHBondContact O-CB 3.32Å; E84-A88 PolarHBondContact O-N 3.36Å; L86-A88 PolarHBondContact O-N 3.35Å; A88-K91 PolarHBondContact O-N 3.19Å; A88-E92 WeakPolarHBondContact O-CB 3.38Å; A88-E92 PolarHBondContact O-N 3.1Å
89S94.9Very high95.6Very high20 Ų2077.2 Ų77.214%0.1439%0.392CS..Hα-helixtrans-61.8-45.4177-176.20000111.8Q85 L86 K91 E92 W93 P119Q85-S89 VanDerWaalsContact O-CB 3.3Å; Q85-S89 WeakPolarHBondContact O-CB 3.2Å; Q85-S89 PolarHBondContact O-N 3.37Å; L86-S89 WeakPolarHBondContact O-CB 3.39Å; L86-S89 PolarHBondContact O-N 3.02Å; S89-K91 VanDerWaalsContact C-N 3.31Å; S89-K91 PolarHBondContact O-N 2.92Å; S89-E92 PolarHBondContact O-N 3.17Å; S89-W93 WeakPolarHBondContact O-CB 3.3Å; S89-W93 PolarHBondContact O-N 3.07Å; S89-P119 VanDerWaalsContact OG-CG 3.29Å; S89-P119 WeakPolarHBondContact OG-CG 3.3Å
90V96.6Very high95.7Very high40 Ų4077.5 Ų77.524%0.24239%0.393CS..Hα-helixtrans-57.6-45175.71700000111L86 S87 S94 P119L86-V90 HydrophobicContact CD1-CG2 4.45Å; L86-V90 HydrophobicContact CG-CG2 4.48Å; L86-V90 VanDerWaalsContact O-CG2 3.28Å; L86-V90 WeakPolarHBondContact O-CG2 3.29Å; L86-V90 PolarHBondContact O-N 2.9Å; S87-V90 PolarHBondContact O-N 3.37Å; V90-S94 WeakPolarHBondContact O-CB 3.08Å; V90-S94 PolarHBondContact O-N 3.23Å; V90-S94 PolarHBondContact O-OG 3.15Å; V90-P119 HydrophobicContact CG2-CB 3.46Å; V90-P119 VanDerWaalsContact CG2-CB 3.46Å; V90-P119 HydrophobicContact CG2-CG 3.91Å
91K97Very high95.7Very high122 Ų12274.7 Ų74.753%0.5338%0.377SS..Hα-helixtrans-62.3-48178.4-172.2-175.7176.1-175.30111.4S87 A88 S89 S94 Q95S87-K91 PolarHBondContact O-N 3.39Å; A88-K91 PolarHBondContact O-N 3.19Å; S89-K91 VanDerWaalsContact C-N 3.31Å; S89-K91 PolarHBondContact O-N 2.92Å; K91-S94 PolarHBondContact O-N 2.85Å; K91-Q95 HydrophobicContact CG-CG 4.25Å; K91-Q95 VanDerWaalsContact O-CB 3.26Å; K91-Q95 WeakPolarHBondContact O-CB 3.44Å; K91-Q95 WeakPolarHBondContact O-CG 3.48Å; K91-Q95 PolarHBondContact O-N 2.98Å
92E96.5Very high95.7Very high43 Ų4374.7 Ų74.720%0.20138%0.383CS..Iπ-helixtrans-59.7-48.5178.7-174.7174.3-175.200111.4A88 S89 E96 I97 R109 L113A88-E92 WeakPolarHBondContact O-CB 3.38Å; A88-E92 PolarHBondContact O-N 3.1Å; S89-E92 PolarHBondContact O-N 3.17Å; E92-E96 WeakPolarHBondContact O-CB 3.5Å; E92-E96 PolarHBondContact O-N 2.82Å; E92-I97 HydrophobicContact CG-CD1 4.11Å; E92-I97 PolarHBondContact O-N 3.46Å; E92-I97 VanDerWaalsContact O-N 3.1Å; E92-R109 VanDerWaalsContact CD-NH2 3.32Å; E92-R109 IonicContact OE1-CZ 2.82Å; E92-R109 IonicContact OE1-NE 3.26Å; E92-R109 PolarHBondContact OE1-NE 3.16Å; E92-R109 IonicContact OE1-NH2 3.57Å; E92-R109 PolarHBondContact OE1-NH2 2.93Å; E92-L113 HydrophobicContact CG-CD2 4.05Å
93W97.8Very high96Very high0 Ų074.1 Ų74.10%039%0.387CS..Iπ-helixtrans-62-47.3176.8-82.6104.1000112.7S89 I97 L98 W101 V110 L113 W114 L118 V122 V126S89-W93 WeakPolarHBondContact O-CB 3.3Å; S89-W93 PolarHBondContact O-N 3.07Å; W93-I97 HydrophobicContact CD2-CD1 3.79Å; W93-I97 HydrophobicContact CE3-CB 3.95Å; W93-I97 HydrophobicContact CE3-CD1 3.85Å; W93-I97 HydrophobicContact CE3-CG2 3.73Å; W93-I97 HydrophobicContact CG-CD1 4.24Å; W93-I97 HydrophobicContact CH2-CD1 4.42Å; W93-I97 HydrophobicContact CH2-CG2 4.47Å; W93-I97 HydrophobicContact CZ2-CD1 4.35Å; W93-I97 HydrophobicContact CZ3-CB 4.33Å; W93-I97 HydrophobicContact CZ3-CD1 4.18Å; W93-I97 HydrophobicContact CZ3-CG2 3.6Å; W93-L98 WeakPolarHBondContact O-CB 3.33Å; W93-L98 VanDerWaalsContact O-CG 3.31Å; W93-L98 WeakPolarHBondContact O-CG 3.49Å; W93-L98 PolarHBondContact O-N 3.13Å; W93-W101 HydrophobicContact CZ3-CZ3 4.13Å; W93-V110 HydrophobicContact CH2-CG1 3.83Å; W93-V110 HydrophobicContact CZ3-CG1 4.3Å; W93-L113 HydrophobicContact CD2-CD2 4.47Å; W93-L113 HydrophobicContact CZ2-CD2 4.11Å; W93-L113 HydrophobicContact CZ2-CG 4.18Å; W93-L113 VanDerWaalsContact NE1-CD2 3.34Å; W93-W114 HydrophobicContact CH2-CB 3.97Å; W93-W114 AromaticContact CH2-CD2 3.98Å; W93-W114 HydrophobicContact CH2-CD2 3.98Å; W93-W114 AromaticContact CH2-CE3 3.97Å; W93-W114 HydrophobicContact CH2-CE3 3.97Å; W93-W114 HydrophobicContact CH2-CG 4.02Å; W93-W114 HydrophobicContact CZ2-CB 3.83Å; W93-W114 HydrophobicContact CZ2-CG 4.16Å; W93-L118 HydrophobicContact CD2-CD2 4.11Å; W93-L118 HydrophobicContact CE3-CD2 4.36Å; W93-L118 HydrophobicContact CH2-CD2 3.61Å; W93-L118 HydrophobicContact CZ2-CD2 3.3Å; W93-L118 HydrophobicContact CZ3-CD2 4.12Å; W93-V122 HydrophobicContact CB-CB 4.4Å; W93-V122 HydrophobicContact CB-CG1 4.03Å; W93-V122 HydrophobicContact CB-CG2 4.09Å; W93-V122 HydrophobicContact CG-CG2 4.12Å; W93-V126 HydrophobicContact CE3-CG2 4Å; W93-V126 HydrophobicContact CZ3-CG2 4.03Å
94S97.2Very high96.2Very high51 Ų5171.6 Ų71.636%0.35738%0.376SS..Iπ-helixtrans-78.1-35.6-171.5-51.40000113.3V90 K91 P99V90-S94 WeakPolarHBondContact O-CB 3.08Å; V90-S94 PolarHBondContact O-N 3.23Å; V90-S94 PolarHBondContact O-OG 3.15Å; K91-S94 PolarHBondContact O-N 2.85Å; S94-P99 WeakPolarHBondContact O-CD 3.48Å
95Q96.7Very high96.1Very high126 Ų12668.7 Ų68.759%0.58936%0.362SS*.Iπ-helixtrans-101-27.6-172.2-59.1-176.7-500113.4K91K91-Q95 HydrophobicContact CG-CG 4.25Å; K91-Q95 VanDerWaalsContact O-CB 3.26Å; K91-Q95 WeakPolarHBondContact O-CB 3.44Å; K91-Q95 WeakPolarHBondContact O-CG 3.48Å; K91-Q95 PolarHBondContact O-N 2.98Å
96E96.3Very high96.2Very high85 Ų8567 Ų6740%0.39736%0.363SS..Iπ-helixtrans-108.1-53.9-177.2-57.2179.8-164.200111.6E92 H100 L104 R109E92-E96 WeakPolarHBondContact O-CB 3.5Å; E92-E96 PolarHBondContact O-N 2.82Å; E96-H100 PolarHBondContact O-ND1 3.22Å; E96-L104 WeakPolarHBondContact O-CD1 3.21Å; E96-R109 IonicContact OE2-CZ 3.15Å; E96-R109 IonicContact OE2-NH1 3.08Å; E96-R109 PolarHBondContact OE2-NH1 3.48Å; E96-R109 IonicContact OE2-NH2 2.75Å; E96-R109 PolarHBondContact OE2-NH2 3.24Å
97I97.7Very high96.4Very high0 Ų065.5 Ų65.50%036%0.356CS..Iπ-helixtrans-78.3-55-167.9-57.8170.3000112.1E92 W93 H100 W101 V110 L113E92-I97 HydrophobicContact CG-CD1 4.11Å; E92-I97 PolarHBondContact O-N 3.46Å; E92-I97 VanDerWaalsContact O-N 3.1Å; W93-I97 HydrophobicContact CD2-CD1 3.79Å; W93-I97 HydrophobicContact CE3-CB 3.95Å; W93-I97 HydrophobicContact CE3-CD1 3.85Å; W93-I97 HydrophobicContact CE3-CG2 3.73Å; W93-I97 HydrophobicContact CG-CD1 4.24Å; W93-I97 HydrophobicContact CH2-CD1 4.42Å; W93-I97 HydrophobicContact CH2-CG2 4.47Å; W93-I97 HydrophobicContact CZ2-CD1 4.35Å; W93-I97 HydrophobicContact CZ3-CB 4.33Å; W93-I97 HydrophobicContact CZ3-CD1 4.18Å; W93-I97 HydrophobicContact CZ3-CG2 3.6Å; I97-H100 CarbonylContact O-C 3.2Å; I97-H100 VanDerWaalsContact O-C 3.24Å; I97-H100 PolarHBondContact O-N 2.9Å; I97-W101 HydrophobicContact CG2-CE3 4.36Å; I97-W101 VanDerWaalsContact O-CA 3.29Å; I97-W101 WeakPolarHBondContact O-CA 3.4Å; I97-W101 PolarHBondContact O-N 2.94Å; I97-V110 HydrophobicContact CD1-CG1 4.43Å; I97-V110 HydrophobicContact CD1-CG2 3.91Å; I97-V110 HydrophobicContact CG1-CG2 3.99Å; I97-V110 HydrophobicContact CG2-CG1 4.09Å; I97-V110 HydrophobicContact CG2-CG2 4.17Å; I97-L113 HydrophobicContact CD1-CD2 3.58Å
98L98Very high96.5Very high33 Ų3369 Ų6917%0.17336%0.362CS..THydrogen-bonded Turntrans-60.6-40.8-176.1-77174.6000113.6W93 H100 W101 V122 R125 V126 L129W93-L98 WeakPolarHBondContact O-CB 3.33Å; W93-L98 VanDerWaalsContact O-CG 3.31Å; W93-L98 WeakPolarHBondContact O-CG 3.49Å; W93-L98 PolarHBondContact O-N 3.13Å; L98-H100 VanDerWaalsContact C-N 3.28Å; L98-H100 PolarHBondContact O-N 3.27Å; L98-W101 HydrophobicContact CD2-CE3 4.45Å; L98-W101 PolarHBondContact O-N 2.73Å; L98-V122 HydrophobicContact CD1-CB 4.43Å; L98-R125 HydrophobicContact CD1-CB 4.18Å; L98-R125 HydrophobicContact CD1-CG 3.88Å; L98-R125 HydrophobicContact CD2-CB 4.44Å; L98-R125 HydrophobicContact CD2-CG 3.75Å; L98-R125 HydrophobicContact CG-CG 4.41Å; L98-V126 HydrophobicContact CD2-CG2 3.85Å; L98-L129 HydrophobicContact CD2-CD1 3.74Å
99P97.7Very high96.5Very high82 Ų8271.9 Ų71.953%0.53236%0.36SS..THydrogen-bonded Turntrans-63-31.9175.7-26.237.6000113.8S94S94-P99 WeakPolarHBondContact O-CD 3.48Å
100H97.2Very high96.6Very high94 Ų9471 Ų7144%0.43535%0.354SS..THydrogen-bonded Turntrans-112.834.7-179.3-50.592.3000111.6E96 I97 L98 N102 E103 L104E96-H100 PolarHBondContact O-ND1 3.22Å; I97-H100 CarbonylContact O-C 3.2Å; I97-H100 VanDerWaalsContact O-C 3.24Å; I97-H100 PolarHBondContact O-N 2.9Å; L98-H100 VanDerWaalsContact C-N 3.28Å; L98-H100 PolarHBondContact O-N 3.27Å; H100-N102 VanDerWaalsContact C-N 3.35Å; H100-N102 PolarHBondContact O-N 3.2Å; H100-E103 PolarHBondContact O-N 2.95Å; H100-E103 VanDerWaalsContact O-N 3.09Å; H100-L104 HydrophobicContact CB-CD1 3.84Å; H100-L104 HydrophobicContact CB-CG 4.04Å; H100-L104 PolarHBondContact O-N 3.37Å
101W96.6Very high96.5Very high19 Ų1973.6 Ų73.67%0.07236%0.362CS..Hα-helixtrans-50.8-49.3-169.6171.4-108.9000113.6W93 I97 L98 E103 L104 K105 W114 V126 L129W93-W101 HydrophobicContact CZ3-CZ3 4.13Å; I97-W101 HydrophobicContact CG2-CE3 4.36Å; I97-W101 VanDerWaalsContact O-CA 3.29Å; I97-W101 WeakPolarHBondContact O-CA 3.4Å; I97-W101 PolarHBondContact O-N 2.94Å; L98-W101 HydrophobicContact CD2-CE3 4.45Å; L98-W101 PolarHBondContact O-N 2.73Å; W101-E103 PolarHBondContact O-N 3.28Å; W101-L104 PolarHBondContact O-N 2.89Å; W101-K105 HydrophobicContact CD2-CB 3.94Å; W101-K105 HydrophobicContact CD2-CD 4.29Å; W101-K105 HydrophobicContact CE3-CB 4.01Å; W101-K105 HydrophobicContact CG-CD 4.49Å; W101-K105 HydrophobicContact CH2-CB 4.12Å; W101-K105 HydrophobicContact CZ2-CB 4.03Å; W101-K105 HydrophobicContact CZ2-CD 4.12Å; W101-K105 HydrophobicContact CZ3-CB 4.1Å; W101-K105 WeakPolarHBondContact O-CB 3.28Å; W101-K105 VanDerWaalsContact O-CG 3.3Å; W101-K105 WeakPolarHBondContact O-CG 3.29Å; W101-K105 PolarHBondContact O-N 2.88Å; W101-W114 HydrophobicContact CH2-CE3 4.47Å; W101-W114 AromaticContact CH2-CH2 3.62Å; W101-W114 HydrophobicContact CH2-CH2 3.62Å; W101-W114 AromaticContact CH2-CZ3 3.46Å; W101-W114 HydrophobicContact CH2-CZ3 3.46Å; W101-W114 VanDerWaalsContact CH2-CZ3 3.46Å; W101-W114 HydrophobicContact CZ2-CH2 4.41Å; W101-W114 HydrophobicContact CZ2-CZ3 4.39Å; W101-W114 HydrophobicContact CZ3-CZ3 4.11Å; W101-V126 HydrophobicContact CH2-CG1 3.91Å; W101-V126 HydrophobicContact CZ3-CG1 4.17Å; W101-L129 HydrophobicContact CB-CD1 4.27Å; W101-L129 HydrophobicContact CD2-CB 4.33Å; W101-L129 HydrophobicContact CD2-CD1 3.87Å; W101-L129 HydrophobicContact CE3-CD1 4.34Å; W101-L129 HydrophobicContact CG-CD1 3.82Å; W101-L129 HydrophobicContact CZ2-CB 3.92Å
102N95.5Very high96.4Very high127 Ų12772.4 Ų72.468%0.67936%0.358SS*.Hα-helixtrans-63.5-30.5-175-71.4-38.4000113H100H100-N102 VanDerWaalsContact C-N 3.35Å; H100-N102 PolarHBondContact O-N 3.2Å
103E96.5Very high96.3Very high147 Ų14771.9 Ų71.969%0.68736%0.357SS*.Hα-helixtrans-83.5-40.4179-62.4171.8-16300111.3H100 W101H100-E103 PolarHBondContact O-N 2.95Å; H100-E103 VanDerWaalsContact O-N 3.09Å; W101-E103 PolarHBondContact O-N 3.28Å
104L96.9Very high96.2Very high43 Ų4372.1 Ų72.123%0.22536%0.357CS..Hα-helixtrans-94.3-26.3-168.1-65.1-177.6000114.7E96 H100 W101 S106 T107 V110E96-L104 WeakPolarHBondContact O-CD1 3.21Å; H100-L104 HydrophobicContact CB-CD1 3.84Å; H100-L104 HydrophobicContact CB-CG 4.04Å; H100-L104 PolarHBondContact O-N 3.37Å; W101-L104 PolarHBondContact O-N 2.89Å; L104-S106 PolarHBondContact O-N 3.3Å; L104-T107 HydrophobicContact CD2-CG2 4.21Å; L104-T107 WeakPolarHBondContact O-CB 3.5Å; L104-T107 WeakPolarHBondContact O-CG2 3.3Å; L104-T107 PolarHBondContact O-N 3.12Å; L104-T107 PolarHBondContact O-OG1 3.27Å; L104-V110 HydrophobicContact CB-CG2 4.13Å; L104-V110 WeakPolarHBondContact O-CB 3.47Å; L104-V110 WeakPolarHBondContact O-CG2 3.48Å
105K94.8Very high96.1Very high77 Ų7772.6 Ų72.634%0.33535%0.354SS..THydrogen-bonded Turntrans-53.9-32.3-172.867.9-173.1-176-177.30114.4W101W101-K105 HydrophobicContact CD2-CB 3.94Å; W101-K105 HydrophobicContact CD2-CD 4.29Å; W101-K105 HydrophobicContact CE3-CB 4.01Å; W101-K105 HydrophobicContact CG-CD 4.49Å; W101-K105 HydrophobicContact CH2-CB 4.12Å; W101-K105 HydrophobicContact CZ2-CB 4.03Å; W101-K105 HydrophobicContact CZ2-CD 4.12Å; W101-K105 HydrophobicContact CZ3-CB 4.1Å; W101-K105 WeakPolarHBondContact O-CB 3.28Å; W101-K105 VanDerWaalsContact O-CG 3.3Å; W101-K105 WeakPolarHBondContact O-CG 3.29Å; W101-K105 PolarHBondContact O-N 2.88Å
106S94.4Very high95.9Very high79 Ų7972.2 Ų72.255%0.55236%0.356SS*.THydrogen-bonded Turntrans-93.6-7.7-176.4-64.70000114L104 K111L104-S106 PolarHBondContact O-N 3.3Å; S106-K111 WeakPolarHBondContact O-CE 3.21Å
107T97Very high95.7Very high49 Ų4968.9 Ų68.930%0.30134%0.344SS..SBendtrans-66.8148.3-177.8660000111.3L104 R109 V110 K111L104-T107 HydrophobicContact CD2-CG2 4.21Å; L104-T107 WeakPolarHBondContact O-CB 3.5Å; L104-T107 WeakPolarHBondContact O-CG2 3.3Å; L104-T107 PolarHBondContact O-N 3.12Å; L104-T107 PolarHBondContact O-OG1 3.27Å; T107-R109 VanDerWaalsContact C-N 3.29Å; T107-R109 PolarHBondContact O-N 3.27Å; T107-V110 PolarHBondContact O-N 3.46Å; T107-V110 WeakPolarHBondContact OG1-CB 3.46Å; T107-V110 VanDerWaalsContact OG1-CG2 3.3Å; T107-V110 WeakPolarHBondContact OG1-CG2 3.26Å; T107-V110 PolarHBondContact OG1-N 2.96Å; T107-K111 WeakPolarHBondContact O-CG 3.1Å; T107-K111 PolarHBondContact O-N 2.95Å
108K96.2Very high95.7Very high155 Ų15569.1 Ų69.167%0.67435%0.346SS*.Hα-helixtrans-56.5-43.4178.4-178.9176.7169.9179.60112V110 K111 E112K108-V110 PolarHBondContact O-N 3.41Å; K108-K111 PolarHBondContact O-N 2.89Å; K108-E112 WeakPolarHBondContact CE-OE1 3.24Å; K108-E112 HydrophobicContact CG-CG 4.45Å; K108-E112 IonicContact NZ-OE1 2.89Å; K108-E112 WeakPolarHBondContact O-CG 3.43Å; K108-E112 PolarHBondContact O-N 3.02Å
109R95.3Very high95.6Very high118 Ų11867.7 Ų67.745%0.44534%0.338SS..Hα-helixtrans-55-52.6176.9175.7-172166-151.88.8111.6E92 E96 T107 K111 E112 L113E92-R109 VanDerWaalsContact CD-NH2 3.32Å; E92-R109 IonicContact OE1-CZ 2.82Å; E92-R109 IonicContact OE1-NE 3.26Å; E92-R109 PolarHBondContact OE1-NE 3.16Å; E92-R109 IonicContact OE1-NH2 3.57Å; E92-R109 PolarHBondContact OE1-NH2 2.93Å; E96-R109 IonicContact OE2-CZ 3.15Å; E96-R109 IonicContact OE2-NH1 3.08Å; E96-R109 PolarHBondContact OE2-NH1 3.48Å; E96-R109 IonicContact OE2-NH2 2.75Å; E96-R109 PolarHBondContact OE2-NH2 3.24Å; T107-R109 VanDerWaalsContact C-N 3.29Å; T107-R109 PolarHBondContact O-N 3.27Å; R109-K111 VanDerWaalsContact C-N 3.33Å; R109-K111 PolarHBondContact O-N 3.5Å; R109-E112 PolarHBondContact O-N 3.12Å; R109-L113 PolarHBondContact O-N 2.92Å
110V96.3Very high95.5Very high1 Ų167.2 Ų67.21%0.00634%0.335CS..Hα-helixtrans-66.7-37.7-177.9173.10000111.2W93 I97 L104 T107 K108 L113 W114W93-V110 HydrophobicContact CH2-CG1 3.83Å; W93-V110 HydrophobicContact CZ3-CG1 4.3Å; I97-V110 HydrophobicContact CD1-CG1 4.43Å; I97-V110 HydrophobicContact CD1-CG2 3.91Å; I97-V110 HydrophobicContact CG1-CG2 3.99Å; I97-V110 HydrophobicContact CG2-CG1 4.09Å; I97-V110 HydrophobicContact CG2-CG2 4.17Å; L104-V110 HydrophobicContact CB-CG2 4.13Å; L104-V110 WeakPolarHBondContact O-CB 3.47Å; L104-V110 WeakPolarHBondContact O-CG2 3.48Å; T107-V110 PolarHBondContact O-N 3.46Å; T107-V110 WeakPolarHBondContact OG1-CB 3.46Å; T107-V110 VanDerWaalsContact OG1-CG2 3.3Å; T107-V110 WeakPolarHBondContact OG1-CG2 3.26Å; T107-V110 PolarHBondContact OG1-N 2.96Å; K108-V110 PolarHBondContact O-N 3.41Å; V110-L113 PolarHBondContact O-N 3.34Å; V110-W114 VanDerWaalsContact O-CB 3.25Å; V110-W114 WeakPolarHBondContact O-CB 3.31Å; V110-W114 PolarHBondContact O-N 2.75Å
111K95.8Very high95.5Very high95 Ų9567.3 Ų67.341%0.41335%0.345SS..Hα-helixtrans-61.1-45.7173.7-71.7180176.6179.80111.9S106 T107 K108 R109 L113 W114 E115 R311S106-K111 WeakPolarHBondContact O-CE 3.21Å; T107-K111 WeakPolarHBondContact O-CG 3.1Å; T107-K111 PolarHBondContact O-N 2.95Å; K108-K111 PolarHBondContact O-N 2.89Å; R109-K111 VanDerWaalsContact C-N 3.33Å; R109-K111 PolarHBondContact O-N 3.5Å; K111-L113 PolarHBondContact O-N 3.36Å; K111-W114 PolarHBondContact O-N 2.71Å; K111-E115 WeakPolarHBondContact O-CB 3.19Å; K111-E115 PolarHBondContact O-N 3.28Å; K111-R311 PolarHBondContact O-NH1 3.43Å
112E94.5Very high95.5Very high97 Ų9766.6 Ų66.645%0.45334%0.343SS..Hα-helixtrans-64.3-40.2177.1-72.6173.8171.200112K108 R109 E115 N116K108-E112 WeakPolarHBondContact CE-OE1 3.24Å; K108-E112 HydrophobicContact CG-CG 4.45Å; K108-E112 IonicContact NZ-OE1 2.89Å; K108-E112 WeakPolarHBondContact O-CG 3.43Å; K108-E112 PolarHBondContact O-N 3.02Å; R109-E112 PolarHBondContact O-N 3.12Å; E112-E115 WeakPolarHBondContact O-CB 3.46Å; E112-E115 PolarHBondContact O-N 3.06Å; E112-N116 PolarHBondContact O-ND2 2.86Å; E112-N116 VanDerWaalsContact O-ND2 3.1Å
113L94.7Very high95.6Very high31 Ų3161.5 Ų61.516%0.16231%0.314CS..Hα-helixtrans-62.8-47.5175.6-176.564000111.3E92 W93 I97 R109 V110 K111 E115 N116E92-L113 HydrophobicContact CG-CD2 4.05Å; W93-L113 HydrophobicContact CD2-CD2 4.47Å; W93-L113 HydrophobicContact CZ2-CD2 4.11Å; W93-L113 HydrophobicContact CZ2-CG 4.18Å; W93-L113 VanDerWaalsContact NE1-CD2 3.34Å; I97-L113 HydrophobicContact CD1-CD2 3.58Å; R109-L113 PolarHBondContact O-N 2.92Å; V110-L113 PolarHBondContact O-N 3.34Å; K111-L113 PolarHBondContact O-N 3.36Å; L113-E115 VanDerWaalsContact C-N 3.27Å; L113-E115 PolarHBondContact O-N 3.15Å; L113-N116 PolarHBondContact O-N 3.42Å
114W95.8Very high95.7Very high5 Ų554.8 Ų54.82%0.01929%0.285CS..Hα-helixtrans-64.7-31.2178.6-162.7-15.2000111.6W93 W101 V110 K111 N116 G117 L118 V126 A130 D307 L308 R311W93-W114 HydrophobicContact CH2-CB 3.97Å; W93-W114 AromaticContact CH2-CD2 3.98Å; W93-W114 HydrophobicContact CH2-CD2 3.98Å; W93-W114 AromaticContact CH2-CE3 3.97Å; W93-W114 HydrophobicContact CH2-CE3 3.97Å; W93-W114 HydrophobicContact CH2-CG 4.02Å; W93-W114 HydrophobicContact CZ2-CB 3.83Å; W93-W114 HydrophobicContact CZ2-CG 4.16Å; W101-W114 HydrophobicContact CH2-CE3 4.47Å; W101-W114 AromaticContact CH2-CH2 3.62Å; W101-W114 HydrophobicContact CH2-CH2 3.62Å; W101-W114 AromaticContact CH2-CZ3 3.46Å; W101-W114 HydrophobicContact CH2-CZ3 3.46Å; W101-W114 VanDerWaalsContact CH2-CZ3 3.46Å; W101-W114 HydrophobicContact CZ2-CH2 4.41Å; W101-W114 HydrophobicContact CZ2-CZ3 4.39Å; W101-W114 HydrophobicContact CZ3-CZ3 4.11Å; V110-W114 VanDerWaalsContact O-CB 3.25Å; V110-W114 WeakPolarHBondContact O-CB 3.31Å; V110-W114 PolarHBondContact O-N 2.75Å; K111-W114 PolarHBondContact O-N 2.71Å; W114-N116 PolarHBondContact O-N 3.43Å; W114-G117 WeakPolarHBondContact O-CA 3.48Å; W114-G117 PolarHBondContact O-N 3.42Å; W114-L118 HydrophobicContact CD2-CD2 4.33Å; W114-L118 HydrophobicContact CG-CD2 3.96Å; W114-L118 HydrophobicContact CG-CG 4.49Å; W114-L118 HydrophobicContact CZ2-CD1 4.47Å; W114-V126 HydrophobicContact CH2-CG1 3.73Å; W114-V126 HydrophobicContact CZ2-CG1 3.51Å; W114-V126 HydrophobicContact CZ3-CG1 4.38Å; W114-A130 HydrophobicContact CH2-CB 4.26Å; W114-D307 WeakPolarHBondContact CZ2-O 3.39Å; W114-D307 VanDerWaalsContact NE1-C 3.35Å; W114-D307 PolarHBondContact NE1-O 3.02Å; W114-L308 WeakPolarHBondContact O-CD2 3.48Å; W114-R311 HydrophobicContact CD2-CB 3.94Å; W114-R311 VanDerWaalsContact CD2-CD 3.5Å; W114-R311 HydrophobicContact CD2-CG 3.86Å; W114-R311 HydrophobicContact CE3-CB 4.02Å; W114-R311 VanDerWaalsContact CE3-CD 3.47Å; W114-R311 HydrophobicContact CE3-CG 3.56Å; W114-R311 HydrophobicContact CH2-CB 3.73Å; W114-R311 HydrophobicContact CH2-CG 3.98Å; W114-R311 HydrophobicContact CZ2-CB 3.66Å; W114-R311 HydrophobicContact CZ2-CG 4.28Å; W114-R311 HydrophobicContact CZ3-CB 3.92Å; W114-R311 HydrophobicContact CZ3-CG 3.62Å
115E94.2Very high95.7Very high62 Ų6259 Ų5929%0.2930%0.298SS..Hα-helixtrans-60.8-29176.8-165.5174.3161.900113K111 E112 L113 G117 R304 R361K111-E115 WeakPolarHBondContact O-CB 3.19Å; K111-E115 PolarHBondContact O-N 3.28Å; E112-E115 WeakPolarHBondContact O-CB 3.46Å; E112-E115 PolarHBondContact O-N 3.06Å; L113-E115 VanDerWaalsContact C-N 3.27Å; L113-E115 PolarHBondContact O-N 3.15Å; E115-G117 PolarHBondContact O-N 3.27Å; E115-R304 PolarHBondContact O-NH2 3.29Å; E115-R304 VanDerWaalsContact O-NH2 3.16Å; E115-R361 WeakPolarHBondContact OE1-CD 3.43Å
116N91.9Very high95.9Very high118 Ų11855.3 Ų55.363%0.63128%0.282SS*.THydrogen-bonded Turntrans-79.2-4.8176.1-64.8-50.4000113.5E112 L113 W114E112-N116 PolarHBondContact O-ND2 2.86Å; E112-N116 VanDerWaalsContact O-ND2 3.1Å; L113-N116 PolarHBondContact O-N 3.42Å; W114-N116 PolarHBondContact O-N 3.43Å
117G93.8Very high96.1Very high14 Ų1451.6 Ų51.614%0.14426%0.255CS..  trans99.7151.2-178.200000112.8W114 E115W114-G117 WeakPolarHBondContact O-CA 3.48Å; W114-G117 PolarHBondContact O-N 3.42Å; E115-G117 PolarHBondContact O-N 3.27Å
118L97.2Very high96.1Very high6 Ų651.6 Ų51.63%0.03125%0.252CS..  trans-84.4142.1176.9-64.1178.2000111W93 W114 V122 R123 V126 D307W93-L118 HydrophobicContact CD2-CD2 4.11Å; W93-L118 HydrophobicContact CE3-CD2 4.36Å; W93-L118 HydrophobicContact CH2-CD2 3.61Å; W93-L118 HydrophobicContact CZ2-CD2 3.3Å; W93-L118 HydrophobicContact CZ3-CD2 4.12Å; W114-L118 HydrophobicContact CD2-CD2 4.33Å; W114-L118 HydrophobicContact CG-CD2 3.96Å; W114-L118 HydrophobicContact CG-CG 4.49Å; W114-L118 HydrophobicContact CZ2-CD1 4.47Å; L118-V122 HydrophobicContact CB-CG2 4.35Å; L118-R123 HydrophobicContact CB-CG 3.82Å; L118-R123 HydrophobicContact CD1-CG 4.28Å; L118-R123 PolarHBondContact O-NH2 3.23Å; L118-V126 HydrophobicContact CD1-CB 3.73Å; L118-V126 HydrophobicContact CD1-CG1 3.51Å; L118-V126 HydrophobicContact CD1-CG2 4.19Å; L118-V126 HydrophobicContact CD2-CG1 4.38Å; L118-V126 HydrophobicContact CD2-CG2 4.44Å; L118-D307 WeakPolarHBondContact CB-OD2 3.27Å; L118-D307 HydrophobicContact CD1-CB 4.18Å; L118-D307 WeakPolarHBondContact CD1-OD1 3.04Å; L118-D307 HydrophobicContact CG-CB 4.04Å; L118-D307 PolarHBondContact N-OD2 2.53Å
119P96.6Very high96.2Very high3 Ų346.7 Ų46.72%0.01923%0.233CC..  trans-56.1136.9163.5-22.932000111.1L86 S89 V90 C121 V122 R123L86-P119 HydrophobicContact CD1-CB 3.8Å; L86-P119 HydrophobicContact CD1-CG 4.2Å; S89-P119 VanDerWaalsContact OG-CG 3.29Å; S89-P119 WeakPolarHBondContact OG-CG 3.3Å; V90-P119 HydrophobicContact CG2-CB 3.46Å; V90-P119 VanDerWaalsContact CG2-CB 3.46Å; V90-P119 HydrophobicContact CG2-CG 3.91Å; P119-C121 VanDerWaalsContact C-N 3.27Å; P119-C121 PolarHBondContact O-N 2.83Å; P119-C121 VanDerWaalsContact O-N 3.15Å; P119-V122 HydrophobicContact CB-CG2 4.05Å; P119-V122 HydrophobicContact CG-CG2 4.12Å; P119-V122 VanDerWaalsContact O-CG2 3.27Å; P119-V122 WeakPolarHBondContact O-CG2 3.37Å; P119-V122 PolarHBondContact O-N 2.98Å; P119-R123 PolarHBondContact O-N 3.46Å
120P95.2Very high96.2Very high71 Ų7142.2 Ų42.246%0.46122%0.221SC..Hα-helixtrans-53.3-41.1-175.9-28.934.5000114.1V122 R123P120-V122 PolarHBondContact O-N 3.01Å; P120-R123 WeakPolarHBondContact O-CB 3.45Å; P120-R123 PolarHBondContact O-N 3.38Å
121C95.7Very high96.3Very high96 Ų9642.5 Ų42.565%0.64922%0.223SC*.Hα-helixtrans-70.3-13.8-176.664.70000114.9P119P119-C121 VanDerWaalsContact C-N 3.27Å; P119-C121 PolarHBondContact O-N 2.83Å; P119-C121 VanDerWaalsContact O-N 3.15Å
122V97.5Very high96.3Very high4 Ų439.3 Ų39.32%0.02422%0.217CC..Hα-helixtrans-103.5-10.4176.6-53.80000112.6W93 L98 L118 P119 P120 G124 R125 V126W93-V122 HydrophobicContact CB-CB 4.4Å; W93-V122 HydrophobicContact CB-CG1 4.03Å; W93-V122 HydrophobicContact CB-CG2 4.09Å; W93-V122 HydrophobicContact CG-CG2 4.12Å; L98-V122 HydrophobicContact CD1-CB 4.43Å; L118-V122 HydrophobicContact CB-CG2 4.35Å; P119-V122 HydrophobicContact CB-CG2 4.05Å; P119-V122 HydrophobicContact CG-CG2 4.12Å; P119-V122 VanDerWaalsContact O-CG2 3.27Å; P119-V122 WeakPolarHBondContact O-CG2 3.37Å; P119-V122 PolarHBondContact O-N 2.98Å; P120-V122 PolarHBondContact O-N 3.01Å; V122-G124 PolarHBondContact O-N 2.91Å; V122-R125 PolarHBondContact O-N 3.42Å; V122-V126 HydrophobicContact CG2-CG2 4.39Å; V122-V126 WeakPolarHBondContact O-CG2 3.36Å; V122-V126 PolarHBondContact O-N 3.13Å
123R97.9Very high96.4Very high20 Ų2037.4 Ų37.48%0.07521%0.21CC..Hα-helixtrans-54.9-51.3-177.4-79.1-177.8-177.6133.64.7111.9L118 P119 P120 R125 V126 W127 N222 D307L118-R123 HydrophobicContact CB-CG 3.82Å; L118-R123 HydrophobicContact CD1-CG 4.28Å; L118-R123 PolarHBondContact O-NH2 3.23Å; P119-R123 PolarHBondContact O-N 3.46Å; P120-R123 WeakPolarHBondContact O-CB 3.45Å; P120-R123 PolarHBondContact O-N 3.38Å; R123-R125 VanDerWaalsContact C-N 3.31Å; R123-R125 PolarHBondContact O-N 3.38Å; R123-V126 PolarHBondContact O-N 3.2Å; R123-V126 VanDerWaalsContact O-N 3.17Å; R123-W127 HydrophobicContact CB-CD2 4.22Å; R123-W127 HydrophobicContact CB-CZ2 4.18Å; R123-W127 HydrophobicContact CG-CZ2 4.1Å; R123-W127 VanDerWaalsContact O-CB 3.23Å; R123-W127 WeakPolarHBondContact O-CB 3.09Å; R123-W127 PolarHBondContact O-N 3.37Å; R123-N222 HydrophobicContact CB-CB 4.34Å; R123-N222 WeakPolarHBondContact CD-OD1 3.32Å; R123-D307 IonicContact NE-OD1 2.8Å; R123-D307 IonicContact NE-OD2 2.65Å; R123-D307 IonicContact NH2-OD2 3.42Å
124G97.7Very high96.4Very high7 Ų742.7 Ų42.77%0.07224%0.238CC..Hα-helixtrans-50.3-52.5179.700000112.3V122 V126 W127 Q128 N222 L223V122-G124 PolarHBondContact O-N 2.91Å; G124-V126 PolarHBondContact O-N 3.28Å; G124-W127 PolarHBondContact O-N 2.94Å; G124-Q128 WeakPolarHBondContact O-CB 3.27Å; G124-Q128 VanDerWaalsContact O-CG 3.25Å; G124-Q128 WeakPolarHBondContact O-CG 3.49Å; G124-Q128 PolarHBondContact O-N 3.05Å; G124-N222 WeakPolarHBondContact CA-O 3.41Å; G124-L223 VanDerWaalsContact O-CD2 3.31Å; G124-L223 WeakPolarHBondContact O-CD2 3.39Å
125R97.8Very high96.4Very high131 Ų13144.7 Ų44.749%0.49425%0.249SC..Hα-helixtrans-65.3-43.9-179.2-174.656.6179.6158.2-0.2113.1L98 V122 R123 L129L98-R125 HydrophobicContact CD1-CB 4.18Å; L98-R125 HydrophobicContact CD1-CG 3.88Å; L98-R125 HydrophobicContact CD2-CB 4.44Å; L98-R125 HydrophobicContact CD2-CG 3.75Å; L98-R125 HydrophobicContact CG-CG 4.41Å; V122-R125 PolarHBondContact O-N 3.42Å; R123-R125 VanDerWaalsContact C-N 3.31Å; R123-R125 PolarHBondContact O-N 3.38Å; R125-L129 HydrophobicContact CG-CD1 4.3Å; R125-L129 VanDerWaalsContact O-CG 3.31Å; R125-L129 WeakPolarHBondContact O-CG 3.46Å; R125-L129 PolarHBondContact O-N 2.91Å
126V98.3Very high96.4Very high0 Ų047.5 Ų47.50%027%0.266CS..Hα-helixtrans-66.9-42.2179.7175.10000111W93 L98 W101 W114 L118 V122 R123 G124 L129 A130W93-V126 HydrophobicContact CE3-CG2 4Å; W93-V126 HydrophobicContact CZ3-CG2 4.03Å; L98-V126 HydrophobicContact CD2-CG2 3.85Å; W101-V126 HydrophobicContact CH2-CG1 3.91Å; W101-V126 HydrophobicContact CZ3-CG1 4.17Å; W114-V126 HydrophobicContact CH2-CG1 3.73Å; W114-V126 HydrophobicContact CZ2-CG1 3.51Å; W114-V126 HydrophobicContact CZ3-CG1 4.38Å; L118-V126 HydrophobicContact CD1-CB 3.73Å; L118-V126 HydrophobicContact CD1-CG1 3.51Å; L118-V126 HydrophobicContact CD1-CG2 4.19Å; L118-V126 HydrophobicContact CD2-CG1 4.38Å; L118-V126 HydrophobicContact CD2-CG2 4.44Å; V122-V126 HydrophobicContact CG2-CG2 4.39Å; V122-V126 WeakPolarHBondContact O-CG2 3.36Å; V122-V126 PolarHBondContact O-N 3.13Å; R123-V126 PolarHBondContact O-N 3.2Å; R123-V126 VanDerWaalsContact O-N 3.17Å; G124-V126 PolarHBondContact O-N 3.28Å; V126-L129 PolarHBondContact O-N 3.47Å; V126-A130 WeakPolarHBondContact O-CB 3.28Å; V126-A130 PolarHBondContact O-N 2.92Å
127W98.3Very high96.4Very high0 Ų042 Ų420%024%0.236CC..Hα-helixtrans-65.9-43.5179-66.81.4000111.4R123 G124 L129 A130 I131 V218 N222 C303 W306 D307 L310R123-W127 HydrophobicContact CB-CD2 4.22Å; R123-W127 HydrophobicContact CB-CZ2 4.18Å; R123-W127 HydrophobicContact CG-CZ2 4.1Å; R123-W127 VanDerWaalsContact O-CB 3.23Å; R123-W127 WeakPolarHBondContact O-CB 3.09Å; R123-W127 PolarHBondContact O-N 3.37Å; G124-W127 PolarHBondContact O-N 2.94Å; W127-L129 VanDerWaalsContact C-N 3.29Å; W127-L129 PolarHBondContact O-N 3.34Å; W127-A130 PolarHBondContact O-N 3.48Å; W127-A130 VanDerWaalsContact O-N 3.15Å; W127-I131 HydrophobicContact CB-CD1 4.46Å; W127-I131 WeakPolarHBondContact O-CB 3.33Å; W127-I131 VanDerWaalsContact O-CG1 3.22Å; W127-I131 WeakPolarHBondContact O-CG1 3.46Å; W127-I131 PolarHBondContact O-N 2.91Å; W127-V218 HydrophobicContact CH2-CG1 3.83Å; W127-V218 HydrophobicContact CZ3-CG1 3.89Å; W127-N222 HydrophobicContact CE3-CB 3.97Å; W127-N222 HydrophobicContact CH2-CB 4.35Å; W127-N222 WeakPolarHBondContact CH2-ND2 3.01Å; W127-N222 HydrophobicContact CZ3-CB 3.67Å; W127-N222 VanDerWaalsContact CZ3-ND2 3.33Å; W127-N222 WeakPolarHBondContact CZ3-ND2 2.97Å; W127-C303 HydrophobicContact CH2-CB 4.36Å; W127-C303 HydrophobicContact CZ2-CB 4.37Å; W127-W306 HydrophobicContact CE3-CE3 4.13Å; W127-W306 HydrophobicContact CH2-CB 4.06Å; W127-W306 HydrophobicContact CH2-CD2 4.45Å; W127-W306 AromaticContact CH2-CE3 3.94Å; W127-W306 HydrophobicContact CH2-CE3 3.94Å; W127-W306 HydrophobicContact CZ2-CB 3.66Å; W127-W306 HydrophobicContact CZ2-CE3 4.46Å; W127-W306 AromaticContact CZ3-CE3 3.76Å; W127-W306 HydrophobicContact CZ3-CE3 3.76Å; W127-W306 HydrophobicContact CZ3-CZ3 4.26Å; W127-D307 PolarHBondContact NE1-OD1 3.08Å; W127-L310 HydrophobicContact CB-CD1 3.78Å; W127-L310 VanDerWaalsContact CD1-CD1 3.46Å; W127-L310 HydrophobicContact CD2-CD1 3.99Å; W127-L310 HydrophobicContact CG-CD1 3.45Å; W127-L310 VanDerWaalsContact CG-CD1 3.45Å
128Q97.6Very high96.2Very high50 Ų5045 Ų4523%0.23425%0.252CS..Hα-helixtrans-53.3-48.1171.9-75.6166.13.900111.7G124 A130 G132 L223 E227G124-Q128 WeakPolarHBondContact O-CB 3.27Å; G124-Q128 VanDerWaalsContact O-CG 3.25Å; G124-Q128 WeakPolarHBondContact O-CG 3.49Å; G124-Q128 PolarHBondContact O-N 3.05Å; Q128-A130 VanDerWaalsContact C-N 3.31Å; Q128-A130 PolarHBondContact O-N 3.22Å; Q128-G132 PolarHBondContact O-N 3.25Å; Q128-L223 HydrophobicContact CG-CD2 3.52Å; Q128-E227 HydrophobicContact CG-CB 4.49Å; Q128-E227 VanDerWaalsContact NE2-CB 3.31Å
129L97.7Very high95.3Very high52 Ų5251.2 Ų51.227%0.27228%0.281SS..Hα-helixtrans-68.2-29.4-179.1-71.7171.3000113.3L98 W101 R125 V126 W127L98-L129 HydrophobicContact CD2-CD1 3.74Å; W101-L129 HydrophobicContact CB-CD1 4.27Å; W101-L129 HydrophobicContact CD2-CB 4.33Å; W101-L129 HydrophobicContact CD2-CD1 3.87Å; W101-L129 HydrophobicContact CE3-CD1 4.34Å; W101-L129 HydrophobicContact CG-CD1 3.82Å; W101-L129 HydrophobicContact CZ2-CB 3.92Å; R125-L129 HydrophobicContact CG-CD1 4.3Å; R125-L129 VanDerWaalsContact O-CG 3.31Å; R125-L129 WeakPolarHBondContact O-CG 3.46Å; R125-L129 PolarHBondContact O-N 2.91Å; V126-L129 PolarHBondContact O-N 3.47Å; W127-L129 VanDerWaalsContact C-N 3.29Å; W127-L129 PolarHBondContact O-N 3.34Å
130A96.7Very high94Very high23 Ų2354.4 Ų54.419%0.1931%0.314CS..Hα-helixtrans-86.5-30.5179.200000113.2W114 V126 W127 Q128 R238 L310W114-A130 HydrophobicContact CH2-CB 4.26Å; V126-A130 WeakPolarHBondContact O-CB 3.28Å; V126-A130 PolarHBondContact O-N 2.92Å; W127-A130 PolarHBondContact O-N 3.48Å; W127-A130 VanDerWaalsContact O-N 3.15Å; Q128-A130 VanDerWaalsContact C-N 3.31Å; Q128-A130 PolarHBondContact O-N 3.22Å; A130-R238 PolarHBondContact O-NH2 2.77Å; A130-R238 VanDerWaalsContact O-NH2 3.14Å; A130-L310 HydrophobicContact CB-CB 3.95Å
131I97.2Very high92.3Very high8 Ų852.8 Ų52.84%0.04131%0.305CS..Hα-helixtrans-76.2-45.6174.9-66.8170.7000109.9W127 L219 A231 N234 L235 L310W127-I131 HydrophobicContact CB-CD1 4.46Å; W127-I131 WeakPolarHBondContact O-CB 3.33Å; W127-I131 VanDerWaalsContact O-CG1 3.22Å; W127-I131 WeakPolarHBondContact O-CG1 3.46Å; W127-I131 PolarHBondContact O-N 2.91Å; I131-L219 HydrophobicContact CD1-CD2 4.04Å; I131-A231 HydrophobicContact CD1-CB 3.86Å; I131-A231 HydrophobicContact CG2-CB 4.49Å; I131-N234 HydrophobicContact CG2-CB 3.79Å; I131-L235 HydrophobicContact CG2-CB 4.44Å; I131-L310 HydrophobicContact CD1-CD1 4.4Å; I131-L310 HydrophobicContact CD1-CD2 4.12Å; I131-L310 HydrophobicContact CG1-CD1 4.33Å; I131-L310 HydrophobicContact CG1-CD2 3.42Å; I131-L310 VanDerWaalsContact CG1-CD2 3.42Å
132G95.9Very high90.2Very high28 Ų2850.1 Ų50.129%0.28928%0.284SS..  trans79.2-173.1-174.500000113.2Q128Q128-G132 PolarHBondContact O-N 3.25Å
133N96.6Very high87.6Confident57 Ų5752.3 Ų52.331%0.30531%0.307SS..  trans-138.954.3174.5-171.418.4000110.6L135 N136 V137 V230 N234N133-L135 PolarHBondContact O-N 3.16Å; N133-N136 PolarHBondContact O-N 2.84Å; N133-N136 PolarHBondContact OD1-N 3.3Å; N133-V137 PolarHBondContact ND2-N 3.42Å; N133-V137 PolarHBondContact ND2-O 2.88Å; N133-V137 PolarHBondContact OD1-N 3.07Å; N133-V230 HydrophobicContact CB-CG1 4.04Å; N133-N234 VanDerWaalsContact C-OD1 3.31Å; N133-N234 WeakPolarHBondContact CA-OD1 3.34Å; N133-N234 PolarHBondContact OD1-ND2 3.26Å
134D94.8Very high84.9Confident142 Ų14260.1 Ų60.176%0.75935%0.345SS*.THydrogen-bonded Turntrans-61.8-28.2-178-63.6-19.7000112.5N136 N234D134-N136 PolarHBondContact O-N 3.25Å; D134-N136 PolarHBondContact O-ND2 3.22Å; D134-N234 PolarHBondContact N-OD1 3.36Å
135L94.8Very high82Confident46 Ų4662.7 Ų62.724%0.24137%0.371CS..THydrogen-bonded Turntrans-72.3-8.4173.2-71.9-179.3000114N133 V137 Y202 C233 N234 N237N133-L135 PolarHBondContact O-N 3.16Å; L135-V137 HydrophobicContact CB-CG2 3.82Å; L135-V137 HydrophobicContact CD1-CG2 4.47Å; L135-V137 PolarHBondContact O-N 3.4Å; L135-Y202 HydrophobicContact CD1-CE1 4.27Å; L135-C233 HydrophobicContact CD1-CB 4.04Å; L135-C233 WeakPolarHBondContact CD1-O 3.42Å; L135-N234 WeakPolarHBondContact CB-OD1 3.47Å; L135-N234 PolarHBondContact N-OD1 2.81Å; L135-N237 HydrophobicContact CD1-CB 3.79Å; L135-N237 HydrophobicContact CD2-CB 4.39Å; L135-N237 HydrophobicContact CG-CB 4.26Å
136N94.2Very high79Confident121 Ų12164.9 Ų64.965%0.64739%0.387SS*.  trans50.843.2-174.7-58.8-71.1000112.6N133 D134 T138N133-N136 PolarHBondContact O-N 2.84Å; N133-N136 PolarHBondContact OD1-N 3.3Å; D134-N136 PolarHBondContact O-N 3.25Å; D134-N136 PolarHBondContact O-ND2 3.22Å; N136-T138 PolarHBondContact O-N 3.41Å
137V93.2Very high76.3Confident2 Ų268.8 Ų68.81%0.01241%0.414CS..  trans-62.8128.4174.9-175.80000108.1N133 L135 Y202 Y226 F229 V230 C233N133-V137 PolarHBondContact ND2-N 3.42Å; N133-V137 PolarHBondContact ND2-O 2.88Å; N133-V137 PolarHBondContact OD1-N 3.07Å; L135-V137 HydrophobicContact CB-CG2 3.82Å; L135-V137 HydrophobicContact CD1-CG2 4.47Å; L135-V137 PolarHBondContact O-N 3.4Å; V137-Y202 HydrophobicContact CG2-CE1 4.36Å; V137-Y226 PolarHBondContact O-OH 3.09Å; V137-F229 HydrophobicContact CG1-CD1 4.12Å; V137-F229 HydrophobicContact CG1-CE1 3.86Å; V137-V230 HydrophobicContact CB-CG1 4.31Å; V137-V230 HydrophobicContact CB-CG2 4.08Å; V137-V230 HydrophobicContact CG1-CG2 3.92Å; V137-C233 HydrophobicContact CG2-CB 3.95Å
138T89.9Confident73.1Confident78 Ų7873 Ų7348%0.47944%0.441SS..  trans-121.2163.4179.953.30000110N136 G140 S141 Y226N136-T138 PolarHBondContact O-N 3.41Å; T138-G140 PolarHBondContact O-N 3.26Å; T138-S141 PolarHBondContact N-OG 3.41Å; T138-S141 VanDerWaalsContact N-OG 3.11Å; T138-S141 WeakPolarHBondContact O-CA 3.37Å; T138-S141 WeakPolarHBondContact O-CB 3.37Å; T138-S141 PolarHBondContact O-N 3.1Å; T138-S141 PolarHBondContact O-OG 2.89Å; T138-S141 VanDerWaalsContact O-OG 3.1Å; T138-S141 PolarHBondContact OG1-OG 3.02Å; T138-Y226 VanDerWaalsContact C-OH 3.25Å; T138-Y226 VanDerWaalsContact CA-OH 3.28Å; T138-Y226 WeakPolarHBondContact CA-OH 3.23Å
139E78.2Confident69.8Low136 Ų13678.5 Ų78.564%0.63647%0.467SS*.G310 helixtrans-55.6-37.1-176.9-70.8-178.4173.200113.1S141 N142 Y226E139-S141 PolarHBondContact O-N 2.91Å; E139-N142 VanDerWaalsContact O-CB 3.3Å; E139-N142 WeakPolarHBondContact O-CB 3.02Å; E139-N142 VanDerWaalsContact O-CG 3.3Å; E139-N142 PolarHBondContact O-N 2.63Å; E139-N142 PolarHBondContact O-ND2 2.99Å; E139-Y226 HydrophobicContact CB-CE2 4.25Å; E139-Y226 HydrophobicContact CG-CD1 4.29Å; E139-Y226 HydrophobicContact CG-CD2 4.12Å; E139-Y226 HydrophobicContact CG-CE1 3.86Å; E139-Y226 HydrophobicContact CG-CE2 3.66Å; E139-Y226 HydrophobicContact CG-CG 4.39Å; E139-Y226 PolarHBondContact N-OH 3.37Å; E139-Y226 VanDerWaalsContact N-OH 3.14Å
140G67.8Low66.6Low70 Ų7081 Ų8172%0.72249%0.486SS*.G310 helixtrans-75.4-5.2175.100000115.1T138 N142T138-G140 PolarHBondContact O-N 3.26Å; G140-N142 VanDerWaalsContact C-N 3.31Å
141S60.6Low63.4Low37 Ų3785 Ų8526%0.25951%0.512SS..G310 helixtrans-80.4-19.1170.8-45.60000111.8T138 E139 G143T138-S141 PolarHBondContact N-OG 3.41Å; T138-S141 VanDerWaalsContact N-OG 3.11Å; T138-S141 WeakPolarHBondContact O-CA 3.37Å; T138-S141 WeakPolarHBondContact O-CB 3.37Å; T138-S141 PolarHBondContact O-N 3.1Å; T138-S141 PolarHBondContact O-OG 2.89Å; T138-S141 VanDerWaalsContact O-OG 3.1Å; T138-S141 PolarHBondContact OG1-OG 3.02Å; E139-S141 PolarHBondContact O-N 2.91Å; S141-G143 PolarHBondContact O-N 3.07Å
142N50.4Low60.6Low40 Ų4091.8 Ų91.821%0.21455%0.549CS..SBendtrans-67.3106.1164.8-50.5-21.9000104E139 G140 E144 Y226 F229E139-N142 VanDerWaalsContact O-CB 3.3Å; E139-N142 WeakPolarHBondContact O-CB 3.02Å; E139-N142 VanDerWaalsContact O-CG 3.3Å; E139-N142 PolarHBondContact O-N 2.63Å; E139-N142 PolarHBondContact O-ND2 2.99Å; G140-N142 VanDerWaalsContact C-N 3.31Å; N142-E144 VanDerWaalsContact C-N 3.31Å; N142-E144 PolarHBondContact O-N 3.1Å; N142-Y226 WeakPolarHBondContact ND2-CD2 3.31Å; N142-F229 WeakPolarHBondContact OD1-CD1 3.49Å; N142-F229 WeakPolarHBondContact OD1-CE1 3.31Å
143G44.6Very low57.6Low50 Ų5098.6 Ų98.652%0.51557%0.573SS.*  trans-54.8106.716800000106.5S141 G145S141-G143 PolarHBondContact O-N 3.07Å; G143-G145 PolarHBondContact O-N 2.8Å
144E39.8Very low54.7Low184 Ų184101.1 Ų101.186%0.8659%0.586SS**  trans-66.533.9172.8-60.7-17914800110.9N142 E146N142-E144 VanDerWaalsContact C-N 3.31Å; N142-E144 PolarHBondContact O-N 3.1Å; E144-E146 VanDerWaalsContact C-N 3.32Å; E144-E146 PolarHBondContact O-N 3.33Å
145G37.7Very low51.9Low61 Ų61102 Ų10263%0.62959%0.591SS**  trans-66.6100.4157.100000106.5G143 C147G143-G145 PolarHBondContact O-N 2.8Å; G145-C147 PolarHBondContact O-N 3.39Å
146E34.9Very low49.3Very low177 Ų177102.5 Ų102.583%0.82761%0.608SS**  trans-27.5130.5136.9-66.8172.1153.100108.4E144 P148E144-E146 VanDerWaalsContact C-N 3.32Å; E144-E146 PolarHBondContact O-N 3.33Å; E146-P148 VanDerWaalsContact O-CD 3.28Å; E146-P148 WeakPolarHBondContact O-CD 3.48Å
147C40.6Very low47Very low83 Ų83103.3 Ų103.356%0.56161%0.607SS**  trans-41.2116.6171.9-730000107G145 E149G145-C147 PolarHBondContact O-N 3.39Å; C147-E149 PolarHBondContact O-N 3.24Å
148P32.7Very low44.7Very low87 Ų87105.2 Ų105.257%0.56562%0.621SS**  trans-59.3109.3-176.4-2231.1000107.1E146E146-P148 VanDerWaalsContact O-CD 3.28Å; E146-P148 WeakPolarHBondContact O-CD 3.48Å
149E27.6Very low42.6Very low166 Ų166104.5 Ų104.578%0.77662%0.623SS**  trans-54.5130.5157.3-79.7-72.2163.500105.2C147 S151C147-E149 PolarHBondContact O-N 3.24Å; E149-S151 PolarHBondContact O-N 2.92Å
150P30.5Very low42.1Very low106 Ų106104.1 Ų104.169%0.68863%0.625SS**  trans-60.7101-17122.2-30.9000109.4
151S29.9Very low42.3Very low105 Ų105104.3 Ų104.373%0.73461%0.607SS**  trans-101.8118.6172.160.60000108.7E149 E153E149-S151 PolarHBondContact O-N 2.92Å; S151-E153 PolarHBondContact O-N 3.27Å
152D37.5Very low43.2Very low152 Ų152107.9 Ų107.981%0.81362%0.62SS**SBendtrans-62.326.7-165.3-77.8-44.3000118.1
153E32.3Very low44.9Very low171 Ų171107.2 Ų107.280%0.79962%0.623SS**  trans-128.641.4-165.8-66.1-171.8167.300116.7S151S151-E153 PolarHBondContact O-N 3.27Å
154L35.9Very low47.1Very low110 Ų110106.3 Ų106.358%0.57661%0.607SS**  trans-149.285.2160.1-70.7178.9000112.3G156 E157 S158L154-G156 PolarHBondContact O-N 3.18Å; L154-E157 WeakPolarHBondContact CD1-OE2 3.49Å; L154-E157 PolarHBondContact O-N 3.38Å; L154-S158 WeakPolarHBondContact O-CB 3.27Å; L154-S158 PolarHBondContact O-N 3.07Å; L154-S158 VanDerWaalsContact O-N 3.13Å; L154-S158 PolarHBondContact O-OG 2.69Å; L154-S158 VanDerWaalsContact O-OG 3.09Å
155N36.9Very low49.5Very low159 Ų15999.6 Ų99.685%0.8558%0.579SS**THydrogen-bonded Turntrans-61.98.4-167.8-68.9-37.1000118.7
156G40.8Very low52.2Low58 Ų58103 Ų10360%0.59858%0.578SS**THydrogen-bonded Turntrans-133.5-28.1178.100000114.4L154L154-G156 PolarHBondContact O-N 3.18Å
157E44.6Very low55.1Low137 Ų13797.3 Ų97.364%0.6455%0.553SS**THydrogen-bonded Turntrans-89.4-27.2175.9-69.6170.5167.400111.4L154 A159 N160 H161L154-E157 WeakPolarHBondContact CD1-OE2 3.49Å; L154-E157 PolarHBondContact O-N 3.38Å; E157-A159 PolarHBondContact O-N 2.97Å; E157-N160 PolarHBondContact O-N 3.3Å; E157-H161 WeakPolarHBondContact O-CB 3.49Å; E157-H161 PolarHBondContact O-N 3.38Å
158S44.6Very low57.8Low42 Ų4293.5 Ų93.529%0.29453%0.527SS..Hα-helixtrans-57.8-45177.757.60000112.9L154 N160 H161 E162L154-S158 WeakPolarHBondContact O-CB 3.27Å; L154-S158 PolarHBondContact O-N 3.07Å; L154-S158 VanDerWaalsContact O-N 3.13Å; L154-S158 PolarHBondContact O-OG 2.69Å; L154-S158 VanDerWaalsContact O-OG 3.09Å; S158-N160 PolarHBondContact O-N 2.88Å; S158-H161 PolarHBondContact O-N 3.28Å; S158-E162 WeakPolarHBondContact O-CB 3.44Å; S158-E162 WeakPolarHBondContact O-CG 3.34Å; S158-E162 PolarHBondContact O-N 2.99Å
159A47.6Very low60.8Low63 Ų6392.9 Ų92.952%0.52152%0.517SS..Hα-helixtrans-63.6-37.8-178.500000113.2E157 G163E157-A159 PolarHBondContact O-N 2.97Å; A159-G163 PolarHBondContact O-N 3.27Å
160N66.8Low64.1Low129 Ų12990.4 Ų90.469%0.6951%0.508SS*.Hα-helixtrans-73.7-34.7175.6-80.5-9.5000111.8E157 S158 T164E157-N160 PolarHBondContact O-N 3.3Å; S158-N160 PolarHBondContact O-N 2.88Å; N160-T164 WeakPolarHBondContact O-CB 3.23Å; N160-T164 PolarHBondContact O-N 3Å; N160-T164 PolarHBondContact O-OG1 3.3Å
161H72.6Confident67.2Low73 Ų7385.3 Ų85.334%0.33848%0.475SS..Hα-helixtrans-68.2-48.4176.1-171.369.9000111.7E157 S158 G163 T164 V165E157-H161 WeakPolarHBondContact O-CB 3.49Å; E157-H161 PolarHBondContact O-N 3.38Å; S158-H161 PolarHBondContact O-N 3.28Å; H161-G163 VanDerWaalsContact C-N 3.34Å; H161-G163 PolarHBondContact O-N 2.96Å; H161-T164 WeakPolarHBondContact O-CA 3.37Å; H161-T164 WeakPolarHBondContact O-CB 3.31Å; H161-T164 PolarHBondContact O-N 3.1Å; H161-V165 WeakPolarHBondContact O-CG2 3.32Å; H161-V165 PolarHBondContact O-N 3.29Å
162E79.1Confident70.5Confident112 Ų11280.3 Ų80.352%0.52344%0.44SS..Hα-helixtrans-55.7-48.3176.4-75.4171.7-166.500111.1S158 T164 V165 E166S158-E162 WeakPolarHBondContact O-CB 3.44Å; S158-E162 WeakPolarHBondContact O-CG 3.34Å; S158-E162 PolarHBondContact O-N 2.99Å; E162-T164 VanDerWaalsContact C-N 3.3Å; E162-T164 PolarHBondContact O-N 3.46Å; E162-V165 PolarHBondContact O-N 3.3Å; E162-E166 WeakPolarHBondContact O-CG 3.12Å; E162-E166 PolarHBondContact O-N 3.47Å
163G86.1Confident73.3Confident27 Ų2776 Ų7628%0.27843%0.425SS..Hα-helixtrans-61.1-37.9175.500000113.1A159 H161 L167A159-G163 PolarHBondContact O-N 3.27Å; H161-G163 VanDerWaalsContact C-N 3.34Å; H161-G163 PolarHBondContact O-N 2.96Å; G163-L167 WeakPolarHBondContact O-CB 3.34Å; G163-L167 WeakPolarHBondContact O-CG 3.1Å; G163-L167 PolarHBondContact O-N 3.24Å
164T90Very high76.3Confident30 Ų3072.4 Ų72.418%0.18440%0.404CS..Hα-helixtrans-64.6-45.9176.1-65.60000111.7N160 H161 E162 L167 I168 A200N160-T164 WeakPolarHBondContact O-CB 3.23Å; N160-T164 PolarHBondContact O-N 3Å; N160-T164 PolarHBondContact O-OG1 3.3Å; H161-T164 WeakPolarHBondContact O-CA 3.37Å; H161-T164 WeakPolarHBondContact O-CB 3.31Å; H161-T164 PolarHBondContact O-N 3.1Å; E162-T164 VanDerWaalsContact C-N 3.3Å; E162-T164 PolarHBondContact O-N 3.46Å; T164-L167 PolarHBondContact O-N 3.08Å; T164-I168 HydrophobicContact CG2-CD1 3.88Å; T164-I168 VanDerWaalsContact O-CG1 3.29Å; T164-I168 WeakPolarHBondContact O-CG1 3.24Å; T164-I168 PolarHBondContact O-N 3.45Å; T164-A200 HydrophobicContact CG2-CB 4.13Å
165V91.5Very high79.3Confident44 Ų4467.1 Ų67.127%0.26738%0.377SS..Hα-helixtrans-63.1-44.4179.2171.40000110.9H161 E162 L167 I168 H169H161-V165 WeakPolarHBondContact O-CG2 3.32Å; H161-V165 PolarHBondContact O-N 3.29Å; E162-V165 PolarHBondContact O-N 3.3Å; V165-L167 PolarHBondContact O-N 2.96Å; V165-I168 PolarHBondContact O-N 3.46Å; V165-H169 PolarHBondContact O-CD2 2.95Å; V165-H169 PolarHBondContact O-N 2.88Å
166E93.7Very high82.1Confident132 Ų13260.5 Ų60.562%0.61734%0.34SS*.Hα-helixtrans-59.4-46.1175.1-73.2-175.3172.200112.2E162 I168 H169 L170E162-E166 WeakPolarHBondContact O-CG 3.12Å; E162-E166 PolarHBondContact O-N 3.47Å; E166-I168 VanDerWaalsContact C-N 3.34Å; E166-I168 PolarHBondContact O-N 2.61Å; E166-H169 PolarHBondContact O-N 2.71Å; E166-L170 WeakPolarHBondContact O-CG 3.42Å; E166-L170 PolarHBondContact O-N 2.9Å
167L95.1Very high84.7Confident58 Ų5861.4 Ų61.430%0.30434%0.336SS..Hα-helixtrans-60-44.2177.1-73.2172.5000111.8G163 T164 V165 L170 D171 Y208 Q210G163-L167 WeakPolarHBondContact O-CB 3.34Å; G163-L167 WeakPolarHBondContact O-CG 3.1Å; G163-L167 PolarHBondContact O-N 3.24Å; T164-L167 PolarHBondContact O-N 3.08Å; V165-L167 PolarHBondContact O-N 2.96Å; L167-L170 PolarHBondContact O-N 3.38Å; L167-D171 WeakPolarHBondContact O-CB 3.49Å; L167-D171 PolarHBondContact O-N 3.25Å; L167-D171 VanDerWaalsContact O-N 3.08Å; L167-Y208 HydrophobicContact CB-CD1 3.85Å; L167-Y208 HydrophobicContact CB-CE1 3.88Å; L167-Q210 HydrophobicContact CD2-CG 4.02Å
168I97.5Very high87Confident3 Ų361.3 Ų61.32%0.01534%0.344CS..Hα-helixtrans-59.1-49.3176.6-72.5168.9000110.2T164 V165 E166 L170 D171 V172 L193 L196 Y208T164-I168 HydrophobicContact CG2-CD1 3.88Å; T164-I168 VanDerWaalsContact O-CG1 3.29Å; T164-I168 WeakPolarHBondContact O-CG1 3.24Å; T164-I168 PolarHBondContact O-N 3.45Å; V165-I168 PolarHBondContact O-N 3.46Å; E166-I168 VanDerWaalsContact C-N 3.34Å; E166-I168 PolarHBondContact O-N 2.61Å; I168-L170 PolarHBondContact O-N 3.12Å; I168-D171 PolarHBondContact O-N 2.9Å; I168-V172 HydrophobicContact CG2-CG2 4.23Å; I168-V172 WeakPolarHBondContact O-CB 3.49Å; I168-V172 VanDerWaalsContact O-CG2 3.29Å; I168-V172 WeakPolarHBondContact O-CG2 3.42Å; I168-V172 PolarHBondContact O-N 3.19Å; I168-L193 HydrophobicContact CG2-CD2 3.47Å; I168-L193 VanDerWaalsContact CG2-CD2 3.47Å; I168-L196 HydrophobicContact CD1-CB 4.05Å; I168-L196 HydrophobicContact CG1-CB 4.19Å; I168-L196 HydrophobicContact CG2-CB 4.12Å; I168-L196 HydrophobicContact CG2-CD1 3.86Å; I168-Y208 HydrophobicContact CB-CE1 4.4Å; I168-Y208 HydrophobicContact CD1-CD2 4.14Å; I168-Y208 HydrophobicContact CD1-CG 4.07Å; I168-Y208 HydrophobicContact CG1-CD1 3.59Å; I168-Y208 HydrophobicContact CG1-CD2 3.57Å; I168-Y208 HydrophobicContact CG1-CE1 3.74Å; I168-Y208 HydrophobicContact CG1-CE2 3.72Å; I168-Y208 HydrophobicContact CG1-CG 3.49Å; I168-Y208 VanDerWaalsContact CG1-CG 3.49Å
169H96.2Very high89.4Confident74 Ų7462.8 Ų62.834%0.34335%0.349SS..Hα-helixtrans-63.4-41.1-178.6-76.2-60.6000113.2V165 E166 D171 A173 Y189V165-H169 PolarHBondContact O-CD2 2.95Å; V165-H169 PolarHBondContact O-N 2.88Å; E166-H169 PolarHBondContact O-N 2.71Å; H169-D171 VanDerWaalsContact C-N 3.29Å; H169-D171 PolarHBondContact O-N 3.11Å; H169-A173 PolarHBondContact O-N 3.4Å; H169-A173 VanDerWaalsContact O-N 3.12Å; H169-Y189 PolarHBondContact ND1-OH 2.99Å
170L96.4Very high91.7Very high113 Ų11361.7 Ų61.759%0.59234%0.344SS*.Hα-helixtrans-60.8-41.2175.8-72.8173.2000111.7E166 L167 I168 R174E166-L170 WeakPolarHBondContact O-CG 3.42Å; E166-L170 PolarHBondContact O-N 2.9Å; L167-L170 PolarHBondContact O-N 3.38Å; I168-L170 PolarHBondContact O-N 3.12Å; L170-R174 WeakPolarHBondContact O-CG 3.33Å
171D97.1Very high93.2Very high0 Ų057.6 Ų57.60%032%0.321CS..Hα-helixtrans-69.5-47.7179.1-102.433.6000112.9L167 I168 H169 A173 R174 T175 Y208 G211 S213L167-D171 WeakPolarHBondContact O-CB 3.49Å; L167-D171 PolarHBondContact O-N 3.25Å; L167-D171 VanDerWaalsContact O-N 3.08Å; I168-D171 PolarHBondContact O-N 2.9Å; H169-D171 VanDerWaalsContact C-N 3.29Å; H169-D171 PolarHBondContact O-N 3.11Å; D171-A173 PolarHBondContact O-N 3.17Å; D171-R174 CarbonylContact O-C 3.24Å; D171-R174 WeakPolarHBondContact O-CG 2.98Å; D171-R174 PolarHBondContact O-N 2.86Å; D171-R174 IonicContact OD1-CZ 3.95Å; D171-R174 IonicContact OD1-NE 3.02Å; D171-R174 PolarHBondContact OD1-NE 3.04Å; D171-R174 IonicContact OD1-NH2 3.6Å; D171-R174 PolarHBondContact OD1-NH2 2.91Å; D171-R174 IonicContact OD2-NH2 3.56Å; D171-T175 PolarHBondContact O-N 2.7Å; D171-T175 PolarHBondContact O-OG1 3.42Å; D171-Y208 WeakPolarHBondContact CB-OH 3.35Å; D171-Y208 PolarHBondContact OD2-OH 3.22Å; D171-G211 WeakPolarHBondContact OD2-CA 3.45Å; D171-G211 PolarHBondContact OD2-N 2.77Å; D171-S213 WeakPolarHBondContact CB-OG 3.43Å; D171-S213 PolarHBondContact OD2-OG 2.82Å; D171-S213 VanDerWaalsContact OD2-OG 3.11Å
172V97.7Very high94.4Very high0 Ų054.1 Ų54.10%031%0.305CS..Hα-helixtrans-58.1-38177.8169.40000111.3I168 R174 T175 F182 Q183 Y189 L192 L193 L196I168-V172 HydrophobicContact CG2-CG2 4.23Å; I168-V172 WeakPolarHBondContact O-CB 3.49Å; I168-V172 VanDerWaalsContact O-CG2 3.29Å; I168-V172 WeakPolarHBondContact O-CG2 3.42Å; I168-V172 PolarHBondContact O-N 3.19Å; V172-R174 PolarHBondContact O-N 3.31Å; V172-T175 PolarHBondContact O-N 2.9Å; V172-F182 WeakPolarHBondContact CG1-O 3.36Å; V172-Q183 PolarHBondContact O-NE2 3.21Å; V172-Y189 HydrophobicContact CG1-CD2 3.63Å; V172-Y189 HydrophobicContact CG1-CE2 3.68Å; V172-L192 HydrophobicContact CB-CD2 4.46Å; V172-L192 HydrophobicContact CG1-CD2 4.18Å; V172-L192 HydrophobicContact CG2-CD2 3.82Å; V172-L192 HydrophobicContact CG2-CG 3.96Å; V172-L193 HydrophobicContact CG2-CD2 3.98Å; V172-L196 HydrophobicContact CG2-CD1 3.9Å
173A97Very high95.2Very high60 Ų6050.5 Ų50.550%0.49629%0.288SS..Hα-helixtrans-60.5-30.5175.600000113.3H169 D171H169-A173 PolarHBondContact O-N 3.4Å; H169-A173 VanDerWaalsContact O-N 3.12Å; D171-A173 PolarHBondContact O-N 3.17Å
174R95.8Very high95.7Very high96 Ų9657.9 Ų57.936%0.36231%0.313SS..Hα-helixtrans-101.3-1.5179.464.9-176.2-178.9172.14.7114.4L170 D171 V172 F176 P177 F214L170-R174 WeakPolarHBondContact O-CG 3.33Å; D171-R174 CarbonylContact O-C 3.24Å; D171-R174 WeakPolarHBondContact O-CG 2.98Å; D171-R174 PolarHBondContact O-N 2.86Å; D171-R174 IonicContact OD1-CZ 3.95Å; D171-R174 IonicContact OD1-NE 3.02Å; D171-R174 PolarHBondContact OD1-NE 3.04Å; D171-R174 IonicContact OD1-NH2 3.6Å; D171-R174 PolarHBondContact OD1-NH2 2.91Å; D171-R174 IonicContact OD2-NH2 3.56Å; V172-R174 PolarHBondContact O-N 3.31Å; R174-F176 PolarHBondContact O-N 2.95Å; R174-P177 WeakPolarHBondContact O-CD 3.44Å; R174-F214 HydrophobicContact CG-CZ 4.47Å
175T97.3Very high95.9Very high0 Ų060.2 Ų60.20%034%0.343CS..SBendtrans-78.6112.8176.7-55.90000111.1D171 V172 Q183 L192 S213 F214 A217D171-T175 PolarHBondContact O-N 2.7Å; D171-T175 PolarHBondContact O-OG1 3.42Å; V172-T175 PolarHBondContact O-N 2.9Å; T175-Q183 PolarHBondContact O-NE2 3.44Å; T175-L192 HydrophobicContact CG2-CD2 4.39Å; T175-S213 VanDerWaalsContact OG1-CB 3.24Å; T175-S213 WeakPolarHBondContact OG1-CB 3.5Å; T175-S213 PolarHBondContact OG1-OG 2.92Å; T175-F214 HydrophobicContact CG2-CD1 4.08Å; T175-F214 HydrophobicContact CG2-CE1 4.44Å; T175-F214 HydrophobicContact CG2-CG 4.38Å; T175-A217 HydrophobicContact CG2-CB 3.47Å; T175-A217 VanDerWaalsContact CG2-CB 3.47Å
176F95.8Very high96.2Very high19 Ų1958.7 Ų58.78%0.08334%0.336CS..SBendtrans42.455.4-179.1-57.4-62.5000114.2R174 T178 L179 F182 F214 A217 V218 A294 L299R174-F176 PolarHBondContact O-N 2.95Å; F176-T178 PolarHBondContact O-N 2.88Å; F176-L179 HydrophobicContact CB-CD1 3.63Å; F176-L179 HydrophobicContact CB-CG 3.99Å; F176-L179 HydrophobicContact CG-CD1 4.2Å; F176-L179 WeakPolarHBondContact O-CB 3.29Å; F176-L179 PolarHBondContact O-N 3.34Å; F176-F182 HydrophobicContact CB-CD2 4.4Å; F176-F182 HydrophobicContact CD2-CD2 4.46Å; F176-F182 HydrophobicContact CD2-CE2 4.21Å; F176-F214 HydrophobicContact CE2-CD1 4.47Å; F176-F214 HydrophobicContact CZ-CD1 4.4Å; F176-A217 HydrophobicContact CD2-CB 4.07Å; F176-A217 HydrophobicContact CE2-CB 4.05Å; F176-V218 HydrophobicContact CE2-CG2 3.82Å; F176-V218 HydrophobicContact CZ-CG2 3.79Å; F176-A294 WeakPolarHBondContact CE1-O 3.49Å; F176-A294 HydrophobicContact CZ-CB 4.1Å; F176-A294 VanDerWaalsContact CZ-O 3.31Å; F176-A294 WeakPolarHBondContact CZ-O 3.49Å; F176-L299 HydrophobicContact CE1-CB 4.24Å; F176-L299 HydrophobicContact CE1-CD1 4.31Å; F176-L299 HydrophobicContact CE2-CD1 4.3Å; F176-L299 HydrophobicContact CZ-CD1 3.98Å
177P95.3Very high96.4Very high77 Ų7757.2 Ų57.250%0.534%0.338SS..THydrogen-bonded Turntrans-64-23.1-168.427.2-35.9000113.5R174 L179 G180R174-P177 WeakPolarHBondContact O-CD 3.44Å; P177-L179 PolarHBondContact O-N 2.77Å; P177-G180 PolarHBondContact O-N 3.4Å
178T93.7Very high96.6Very high135 Ų13557.4 Ų57.483%0.82834%0.336SS*.THydrogen-bonded Turntrans-70.1-1917753.90000113.4F176F176-T178 PolarHBondContact O-N 2.88Å
179L94.8Very high96.6Very high74 Ų7458.7 Ų58.739%0.38734%0.341SS..THydrogen-bonded Turntrans-79.6-29.9175.8-59179.7000112F176 P177 I181 F182 L299F176-L179 HydrophobicContact CB-CD1 3.63Å; F176-L179 HydrophobicContact CB-CG 3.99Å; F176-L179 HydrophobicContact CG-CD1 4.2Å; F176-L179 WeakPolarHBondContact O-CB 3.29Å; F176-L179 PolarHBondContact O-N 3.34Å; P177-L179 PolarHBondContact O-N 2.77Å; L179-I181 HydrophobicContact CB-CD1 4.24Å; L179-I181 HydrophobicContact CB-CG1 3.93Å; L179-I181 HydrophobicContact CD1-CD1 4.19Å; L179-I181 PolarHBondContact O-N 3.44Å; L179-I181 VanDerWaalsContact O-N 3.08Å; L179-F182 HydrophobicContact CD1-CE2 4.45Å; L179-L299 HydrophobicContact CD1-CD2 3.85Å
180G95.9Very high96.7Very high40 Ų4060.3 Ų60.341%0.41235%0.352SS..  trans69.1-1.2-179.800000115.3P177P177-G180 PolarHBondContact O-N 3.4Å
181I98Very high96.8Very high42 Ų4257.9 Ų57.922%0.21534%0.34CS..SBendtrans-88.1-24.7-174.763.8-179.5000113.6L179 G186 P187 F188 Y189 L221L179-I181 HydrophobicContact CB-CD1 4.24Å; L179-I181 HydrophobicContact CB-CG1 3.93Å; L179-I181 HydrophobicContact CD1-CD1 4.19Å; L179-I181 PolarHBondContact O-N 3.44Å; L179-I181 VanDerWaalsContact O-N 3.08Å; I181-G186 CarbonylContact O-C 3.45Å; I181-G186 WeakPolarHBondContact O-CA 3.38Å; I181-P187 HydrophobicContact CB-CG 4.37Å; I181-P187 HydrophobicContact CG2-CG 4.41Å; I181-F188 HydrophobicContact CB-CD2 4.02Å; I181-F188 HydrophobicContact CD1-CD2 4.07Å; I181-F188 HydrophobicContact CD1-CE2 4.41Å; I181-F188 HydrophobicContact CG1-CD2 4.29Å; I181-F188 WeakPolarHBondContact O-CA 3.16Å; I181-F188 WeakPolarHBondContact O-CB 3.49Å; I181-F188 PolarHBondContact O-N 3.17Å; I181-Y189 PolarHBondContact O-N 3.46Å; I181-L221 HydrophobicContact CD1-CD2 3.67Å
182F97.9Very high96.9Very high0 Ų057.9 Ų57.90%034%0.34CS..SBendtrans-98-3.8178.7-67.6-64.3000112.8V172 F176 L179 F188 Y189 L192 A217 L220 L221V172-F182 WeakPolarHBondContact CG1-O 3.36Å; F176-F182 HydrophobicContact CB-CD2 4.4Å; F176-F182 HydrophobicContact CD2-CD2 4.46Å; F176-F182 HydrophobicContact CD2-CE2 4.21Å; L179-F182 HydrophobicContact CD1-CE2 4.45Å; F182-F188 HydrophobicContact CD1-CB 3.52Å; F182-F188 HydrophobicContact CE1-CB 3.5Å; F182-F188 HydrophobicContact CE1-CD1 4.29Å; F182-F188 HydrophobicContact CE1-CG 4.14Å; F182-F188 HydrophobicContact CG-CB 4.43Å; F182-F188 HydrophobicContact CZ-CB 4.39Å; F182-Y189 VanDerWaalsContact O-CD2 3.29Å; F182-Y189 WeakPolarHBondContact O-CD2 3.46Å; F182-L192 HydrophobicContact CB-CD2 4.22Å; F182-L192 HydrophobicContact CD1-CB 4.06Å; F182-L192 HydrophobicContact CD1-CD2 3.57Å; F182-L192 HydrophobicContact CD1-CG 4.4Å; F182-L192 HydrophobicContact CE1-CB 4.39Å; F182-L192 HydrophobicContact CE1-CD2 4.14Å; F182-L192 HydrophobicContact CG-CD2 4.06Å; F182-A217 HydrophobicContact CD1-CB 4.48Å; F182-A217 HydrophobicContact CD2-CB 4.31Å; F182-A217 HydrophobicContact CE1-CB 3.95Å; F182-A217 HydrophobicContact CE2-CB 3.77Å; F182-A217 HydrophobicContact CZ-CB 3.56Å; F182-L220 HydrophobicContact CE1-CD2 4.17Å; F182-L221 HydrophobicContact CE2-CD1 4.11Å; F182-L221 HydrophobicContact CE2-CD2 4.25Å; F182-L221 HydrophobicContact CE2-CG 4.11Å; F182-L221 HydrophobicContact CZ-CD1 4.28Å; F182-L221 HydrophobicContact CZ-CD2 4.11Å; F182-L221 HydrophobicContact CZ-CG 3.84Å
183Q97.4Very high96.9Very high36 Ų3658.7 Ų58.717%0.16834%0.344CS..SBendtrans-85.9161.1178.6-74.962.155.700109.6V172 T175 G185 G186 Y189V172-Q183 PolarHBondContact O-NE2 3.21Å; T175-Q183 PolarHBondContact O-NE2 3.44Å; Q183-G185 PolarHBondContact O-N 2.91Å; Q183-G186 WeakPolarHBondContact O-CA 3.19Å; Q183-G186 PolarHBondContact O-N 3.37Å; Q183-Y189 WeakPolarHBondContact O-CB 3.47Å
184K95.4Very high96.9Very high182 Ų18258.1 Ų58.179%0.79134%0.337SS*.THydrogen-bonded Turntrans-51.5123.9-178.1-171.9171.1-175.2168.20111.5Y189K184-Y189 HydrophobicContact CB-CD2 4.44Å; K184-Y189 HydrophobicContact CB-CE1 4.38Å; K184-Y189 HydrophobicContact CB-CE2 4.07Å; K184-Y189 HydrophobicContact CG-CE1 4.16Å
185G95.5Very high97Very high80 Ų8053.7 Ų53.783%0.82532%0.32SS*.THydrogen-bonded Turntrans88-3.8-174.500000115.1Q183Q183-G185 PolarHBondContact O-N 2.91Å
186G97.5Very high97.1Very high11 Ų1153.7 Ų53.711%0.11332%0.32CS..SBendtrans-79.3151.7169.600000111.8I181 Q183 F188 Y189I181-G186 CarbonylContact O-C 3.45Å; I181-G186 WeakPolarHBondContact O-CA 3.38Å; Q183-G186 WeakPolarHBondContact O-CA 3.19Å; Q183-G186 PolarHBondContact O-N 3.37Å; G186-F188 PolarHBondContact O-N 3.43Å; G186-F188 VanDerWaalsContact O-N 3.16Å; G186-Y189 WeakPolarHBondContact O-CB 3.27Å; G186-Y189 PolarHBondContact O-N 3.31Å; G186-Y189 VanDerWaalsContact O-N 3.17Å
187P97.6Very high97.1Very high102 Ų10254.3 Ų54.366%0.66233%0.326SS*.THydrogen-bonded Turntrans-66.4-17.9-171.823.1-32.6000115.1I181I181-P187 HydrophobicContact CB-CG 4.37Å; I181-P187 HydrophobicContact CG2-CG 4.41Å
188F98.1Very high97.1Very high61 Ų6151.6 Ų51.627%0.26831%0.311SS..THydrogen-bonded Turntrans-104.80.8179.3-72.8-97.2000113.2I181 F182 G186 L191 L192 L220I181-F188 HydrophobicContact CB-CD2 4.02Å; I181-F188 HydrophobicContact CD1-CD2 4.07Å; I181-F188 HydrophobicContact CD1-CE2 4.41Å; I181-F188 HydrophobicContact CG1-CD2 4.29Å; I181-F188 WeakPolarHBondContact O-CA 3.16Å; I181-F188 WeakPolarHBondContact O-CB 3.49Å; I181-F188 PolarHBondContact O-N 3.17Å; F182-F188 HydrophobicContact CD1-CB 3.52Å; F182-F188 HydrophobicContact CE1-CB 3.5Å; F182-F188 HydrophobicContact CE1-CD1 4.29Å; F182-F188 HydrophobicContact CE1-CG 4.14Å; F182-F188 HydrophobicContact CG-CB 4.43Å; F182-F188 HydrophobicContact CZ-CB 4.39Å; G186-F188 PolarHBondContact O-N 3.43Å; G186-F188 VanDerWaalsContact O-N 3.16Å; F188-L191 HydrophobicContact CD1-CD1 4.09Å; F188-L192 WeakPolarHBondContact O-CB 3.28Å; F188-L192 PolarHBondContact O-N 2.82Å; F188-L220 HydrophobicContact CD1-CD2 3.93Å; F188-L220 HydrophobicContact CD1-CG 3.8Å; F188-L220 HydrophobicContact CE1-CG 4.22Å
189Y98.3Very high97.2Very high30 Ų3045.2 Ų45.212%0.11827%0.272CS..Hα-helixtrans-58-58.1-177.5179.2-108.3000111.7H169 V172 I181 F182 Q183 K184 G186 L191 L192 L193H169-Y189 PolarHBondContact ND1-OH 2.99Å; V172-Y189 HydrophobicContact CG1-CD2 3.63Å; V172-Y189 HydrophobicContact CG1-CE2 3.68Å; I181-Y189 PolarHBondContact O-N 3.46Å; F182-Y189 VanDerWaalsContact O-CD2 3.29Å; F182-Y189 WeakPolarHBondContact O-CD2 3.46Å; Q183-Y189 WeakPolarHBondContact O-CB 3.47Å; K184-Y189 HydrophobicContact CB-CD2 4.44Å; K184-Y189 HydrophobicContact CB-CE1 4.38Å; K184-Y189 HydrophobicContact CB-CE2 4.07Å; K184-Y189 HydrophobicContact CG-CE1 4.16Å; G186-Y189 WeakPolarHBondContact O-CB 3.27Å; G186-Y189 PolarHBondContact O-N 3.31Å; G186-Y189 VanDerWaalsContact O-N 3.17Å; Y189-L191 VanDerWaalsContact C-N 3.33Å; Y189-L191 PolarHBondContact O-N 3.19Å; Y189-L192 PolarHBondContact O-N 2.91Å; Y189-L193 HydrophobicContact CD1-CD1 4Å; Y189-L193 HydrophobicContact CE1-CD1 3.52Å; Y189-L193 HydrophobicContact CE2-CD1 4.3Å; Y189-L193 WeakPolarHBondContact O-CG 3.31Å; Y189-L193 PolarHBondContact O-N 3.12Å
190D97.9Very high97.2Very high108 Ų10842.5 Ų42.558%0.57826%0.259SS*.Hα-helixtrans-67.2-36.6-177.2-58.7-41.7000111.5L192 L193 S194D190-L192 VanDerWaalsContact C-N 3.33Å; D190-L192 PolarHBondContact O-N 3.2Å; D190-L193 PolarHBondContact O-N 3.28Å; D190-S194 WeakPolarHBondContact O-CB 3.43Å; D190-S194 PolarHBondContact O-N 3.33Å; D190-S194 PolarHBondContact O-OG 3.35Å
191L98.4Very high97.1Very high62 Ų6244.8 Ų44.833%0.32527%0.268SS..Hα-helixtrans-61-41.9176.4-60.9-178.5000112.1F188 Y189 S194 I195 L220 L225F188-L191 HydrophobicContact CD1-CD1 4.09Å; Y189-L191 VanDerWaalsContact C-N 3.33Å; Y189-L191 PolarHBondContact O-N 3.19Å; L191-S194 PolarHBondContact O-N 3.09Å; L191-I195 PolarHBondContact O-N 2.88Å; L191-I195 VanDerWaalsContact O-N 3.15Å; L191-L220 HydrophobicContact CB-CD1 4.31Å; L191-L220 HydrophobicContact CB-CD2 3.61Å; L191-L225 HydrophobicContact CB-CD1 4.26Å; L191-L225 HydrophobicContact CD2-CD1 4.29Å; L191-L225 HydrophobicContact CD2-CD2 4.03Å
192L98.5Very high97Very high0 Ų045.7 Ų45.70%027%0.269CS..Hα-helixtrans-69.1-41.5177.3-178.157.4000111.2V172 T175 F182 F188 Y189 D190 S194 I195 L196 A216 A217 L220V172-L192 HydrophobicContact CB-CD2 4.46Å; V172-L192 HydrophobicContact CG1-CD2 4.18Å; V172-L192 HydrophobicContact CG2-CD2 3.82Å; V172-L192 HydrophobicContact CG2-CG 3.96Å; T175-L192 HydrophobicContact CG2-CD2 4.39Å; F182-L192 HydrophobicContact CB-CD2 4.22Å; F182-L192 HydrophobicContact CD1-CB 4.06Å; F182-L192 HydrophobicContact CD1-CD2 3.57Å; F182-L192 HydrophobicContact CD1-CG 4.4Å; F182-L192 HydrophobicContact CE1-CB 4.39Å; F182-L192 HydrophobicContact CE1-CD2 4.14Å; F182-L192 HydrophobicContact CG-CD2 4.06Å; F188-L192 WeakPolarHBondContact O-CB 3.28Å; F188-L192 PolarHBondContact O-N 2.82Å; Y189-L192 PolarHBondContact O-N 2.91Å; D190-L192 VanDerWaalsContact C-N 3.33Å; D190-L192 PolarHBondContact O-N 3.2Å; L192-S194 VanDerWaalsContact C-N 3.29Å; L192-S194 PolarHBondContact O-N 2.86Å; L192-I195 PolarHBondContact O-N 3.02Å; L192-L196 HydrophobicContact CD1-CD1 4.16Å; L192-L196 HydrophobicContact CD1-CG 4.27Å; L192-L196 HydrophobicContact CG-CD1 4.15Å; L192-L196 VanDerWaalsContact O-CG 3.3Å; L192-L196 WeakPolarHBondContact O-CG 3.37Å; L192-L196 PolarHBondContact O-N 3.28Å; L192-A216 HydrophobicContact CD1-CB 3.56Å; L192-A217 HydrophobicContact CD1-CB 4.3Å; L192-A217 HydrophobicContact CD2-CB 4.2Å; L192-L220 HydrophobicContact CB-CD2 4.19Å
193L98Very high96.7Very high17 Ų1747.1 Ų47.19%0.08928%0.275CS..Hα-helixtrans-58.5-42.9173.1-68178.3000111.6I168 V172 Y189 D190 L196 S197I168-L193 HydrophobicContact CG2-CD2 3.47Å; I168-L193 VanDerWaalsContact CG2-CD2 3.47Å; V172-L193 HydrophobicContact CG2-CD2 3.98Å; Y189-L193 HydrophobicContact CD1-CD1 4Å; Y189-L193 HydrophobicContact CE1-CD1 3.52Å; Y189-L193 HydrophobicContact CE2-CD1 4.3Å; Y189-L193 WeakPolarHBondContact O-CG 3.31Å; Y189-L193 PolarHBondContact O-N 3.12Å; D190-L193 PolarHBondContact O-N 3.28Å; L193-L196 PolarHBondContact O-N 2.83Å; L193-S197 VanDerWaalsContact O-CB 3.31Å; L193-S197 WeakPolarHBondContact O-CB 3.09Å; L193-S197 PolarHBondContact O-N 3.09Å; L193-S197 PolarHBondContact O-OG 2.84Å
194S97.6Very high96.4Very high49 Ų4950.5 Ų50.534%0.34330%0.3SS..Hα-helixtrans-61-47.2178.6-65.50000112.3D190 L191 L192 L196 A198D190-S194 WeakPolarHBondContact O-CB 3.43Å; D190-S194 PolarHBondContact O-N 3.33Å; D190-S194 PolarHBondContact O-OG 3.35Å; L191-S194 PolarHBondContact O-N 3.09Å; L192-S194 VanDerWaalsContact C-N 3.29Å; L192-S194 PolarHBondContact O-N 2.86Å; S194-L196 PolarHBondContact O-N 3.02Å; S194-A198 WeakPolarHBondContact O-CB 3.3Å; S194-A198 PolarHBondContact O-N 2.87Å
195I98.3Very high96.1Very high2 Ų245.9 Ų45.91%0.0128%0.284CS..Hα-helixtrans-60.1-46.3178-69.9178.4000111.2L191 L192 Y199 A216 L220 L225 A228 F229 F232L191-I195 PolarHBondContact O-N 2.88Å; L191-I195 VanDerWaalsContact O-N 3.15Å; L192-I195 PolarHBondContact O-N 3.02Å; I195-Y199 WeakPolarHBondContact O-CB 3.31Å; I195-Y199 PolarHBondContact O-N 3.47Å; I195-A216 HydrophobicContact CG2-CB 3.89Å; I195-L220 HydrophobicContact CD1-CB 4.18Å; I195-L220 HydrophobicContact CD1-CD1 4Å; I195-L220 HydrophobicContact CD1-CD2 4.25Å; I195-L220 HydrophobicContact CD1-CG 4.36Å; I195-L225 HydrophobicContact CD1-CD1 3.98Å; I195-L225 HydrophobicContact CG1-CD1 3.63Å; I195-A228 HydrophobicContact CD1-CB 3.63Å; I195-F229 HydrophobicContact CG1-CB 4.45Å; I195-F229 HydrophobicContact CG2-CD2 4.35Å; I195-F232 HydrophobicContact CG2-CB 4.37Å; I195-F232 HydrophobicContact CG2-CD1 3.82Å; I195-F232 HydrophobicContact CG2-CE1 4.26Å; I195-F232 HydrophobicContact CG2-CG 4.12Å
196L98.2Very high95.9Very high1 Ų143.1 Ų43.11%0.00525%0.251CS..Hα-helixtrans-68.5-42.5-175.4-65.2176.7000111.9I168 V172 L192 L193 S194 Y199 A200 Y208 M212 A216 F232I168-L196 HydrophobicContact CD1-CB 4.05Å; I168-L196 HydrophobicContact CG1-CB 4.19Å; I168-L196 HydrophobicContact CG2-CB 4.12Å; I168-L196 HydrophobicContact CG2-CD1 3.86Å; V172-L196 HydrophobicContact CG2-CD1 3.9Å; L192-L196 HydrophobicContact CD1-CD1 4.16Å; L192-L196 HydrophobicContact CD1-CG 4.27Å; L192-L196 HydrophobicContact CG-CD1 4.15Å; L192-L196 VanDerWaalsContact O-CG 3.3Å; L192-L196 WeakPolarHBondContact O-CG 3.37Å; L192-L196 PolarHBondContact O-N 3.28Å; L193-L196 PolarHBondContact O-N 2.83Å; S194-L196 PolarHBondContact O-N 3.02Å; L196-Y199 PolarHBondContact O-N 2.89Å; L196-A200 PolarHBondContact O-N 3.18Å; L196-Y208 HydrophobicContact CB-CD2 4.34Å; L196-Y208 HydrophobicContact CB-CE2 4.23Å; L196-Y208 HydrophobicContact CD1-CE2 3.93Å; L196-Y208 HydrophobicContact CD2-CD2 4.29Å; L196-Y208 HydrophobicContact CD2-CE2 3.78Å; L196-Y208 HydrophobicContact CG-CE2 4.18Å; L196-M212 HydrophobicContact CD2-CB 4.2Å; L196-A216 HydrophobicContact CD2-CB 3.74Å; L196-A216 HydrophobicContact CG-CB 4.41Å; L196-F232 HydrophobicContact CD2-CE1 4.31Å; L196-F232 HydrophobicContact CD2-CZ 3.95Å
197S96.3Very high95.6Very high31 Ų3143.4 Ų43.422%0.21725%0.253CS..Hα-helixtrans-68.3-45.9178.1-51.80000110.9L193 Y199 A200 C201L193-S197 VanDerWaalsContact O-CB 3.31Å; L193-S197 WeakPolarHBondContact O-CB 3.09Å; L193-S197 PolarHBondContact O-N 3.09Å; L193-S197 PolarHBondContact O-OG 2.84Å; S197-Y199 VanDerWaalsContact C-N 3.25Å; S197-Y199 PolarHBondContact O-N 3.22Å; S197-A200 PolarHBondContact O-N 3.47Å; S197-C201 PolarHBondContact O-N 3.05Å; S197-C201 PolarHBondContact O-SG 3.19Å; S197-C201 VanDerWaalsContact O-SG 3.39Å
198A96.1Very high95.5Very high21 Ų2139.2 Ų39.217%0.17423%0.225CC..Hα-helixtrans-58.8-38.5175.500000111.6S194 C201 Y202 F229S194-A198 WeakPolarHBondContact O-CB 3.3Å; S194-A198 PolarHBondContact O-N 2.87Å; A198-C201 PolarHBondContact O-N 3.35Å; A198-Y202 VanDerWaalsContact O-CB 3.23Å; A198-Y202 WeakPolarHBondContact O-CB 3.48Å; A198-Y202 PolarHBondContact O-N 3.23Å; A198-F229 HydrophobicContact CB-CD2 4.09Å; A198-F229 HydrophobicContact CB-CE2 3.61Å; A198-F229 HydrophobicContact CB-CZ 4.09Å
199Y96.1Very high95.2Very high1 Ų138.2 Ų38.20%0.00422%0.223CC..Hα-helixtrans-67.7-44.2177.3178.9-92.1000111.9I195 L196 S197 C201 Y202 R203 V206 G207 M212 F232 L236I195-Y199 WeakPolarHBondContact O-CB 3.31Å; I195-Y199 PolarHBondContact O-N 3.47Å; L196-Y199 PolarHBondContact O-N 2.89Å; S197-Y199 VanDerWaalsContact C-N 3.25Å; S197-Y199 PolarHBondContact O-N 3.22Å; Y199-C201 PolarHBondContact O-N 3.22Å; Y199-Y202 PolarHBondContact O-N 3.11Å; Y199-Y202 VanDerWaalsContact O-N 3.09Å; Y199-R203 HydrophobicContact CE1-CB 4.25Å; Y199-R203 HydrophobicContact CE2-CB 4.3Å; Y199-R203 HydrophobicContact CE2-CG 4.03Å; Y199-R203 PolarHBondContact O-N 3.04Å; Y199-V206 HydrophobicContact CE1-CG1 4.35Å; Y199-G207 WeakPolarHBondContact CE1-O 3.43Å; Y199-M212 HydrophobicContact CD1-CE 4.46Å; Y199-M212 HydrophobicContact CD1-SD 4.11Å; Y199-M212 HydrophobicContact CE1-CE 3.69Å; Y199-M212 HydrophobicContact CE1-SD 3.93Å; Y199-F232 AromaticContact CD1-CE1 3.99Å; Y199-F232 HydrophobicContact CD1-CE1 3.99Å; Y199-F232 AromaticContact CD2-CD1 3.71Å; Y199-F232 HydrophobicContact CD2-CD1 3.71Å; Y199-F232 AromaticContact CD2-CE1 3.68Å; Y199-F232 HydrophobicContact CD2-CE1 3.68Å; Y199-F232 HydrophobicContact CE2-CD1 4.47Å; Y199-F232 HydrophobicContact CE2-CE1 4.38Å; Y199-F232 AromaticContact CG-CD1 3.9Å; Y199-F232 HydrophobicContact CG-CD1 3.9Å; Y199-F232 AromaticContact CG-CE1 3.45Å; Y199-F232 HydrophobicContact CG-CE1 3.45Å; Y199-F232 VanDerWaalsContact CG-CE1 3.45Å; Y199-L236 HydrophobicContact CD1-CD1 4.35Å; Y199-L236 HydrophobicContact CD2-CD1 4.23Å; Y199-L236 HydrophobicContact CE1-CD1 3.83Å; Y199-L236 HydrophobicContact CE2-CB 4.12Å; Y199-L236 HydrophobicContact CE2-CD1 3.68Å; Y199-L236 HydrophobicContact CE2-CG 4.44Å; Y199-L236 VanDerWaalsContact CZ-CD1 3.45Å
200A95.1Very high94.9Very high16 Ų1640.9 Ų40.913%0.13224%0.237CC..Hα-helixtrans-58.8-35.917700000111.7T164 L196 S197T164-A200 HydrophobicContact CG2-CB 4.13Å; L196-A200 PolarHBondContact O-N 3.18Å; S197-A200 PolarHBondContact O-N 3.47Å
201C93.9Very high94.7Very high88 Ų8835.8 Ų35.860%0.59521%0.21SC*.Hα-helixtrans-73.5-39.2172.6-64.60000113.2S197 A198 Y199S197-C201 PolarHBondContact O-N 3.05Å; S197-C201 PolarHBondContact O-SG 3.19Å; S197-C201 VanDerWaalsContact O-SG 3.39Å; A198-C201 PolarHBondContact O-N 3.35Å; Y199-C201 PolarHBondContact O-N 3.22Å
202Y94.4Very high94.6Very high62 Ų6232.8 Ų32.824%0.24319%0.194CC..Hα-helixtrans-71.1-34.4-178.7176.1-108.2000112.7L135 V137 A198 Y199 P204 F229 C233L135-Y202 HydrophobicContact CD1-CE1 4.27Å; V137-Y202 HydrophobicContact CG2-CE1 4.36Å; A198-Y202 VanDerWaalsContact O-CB 3.23Å; A198-Y202 WeakPolarHBondContact O-CB 3.48Å; A198-Y202 PolarHBondContact O-N 3.23Å; Y199-Y202 PolarHBondContact O-N 3.11Å; Y199-Y202 VanDerWaalsContact O-N 3.09Å; Y202-P204 VanDerWaalsContact C-CD 3.5Å; Y202-P204 WeakPolarHBondContact O-CD 3.44Å; Y202-F229 HydrophobicContact CD1-CZ 4.46Å; Y202-F229 HydrophobicContact CG-CZ 4.19Å; Y202-C233 HydrophobicContact CD1-CB 4.34Å; Y202-C233 VanDerWaalsContact CD1-SG 3.56Å; Y202-C233 HydrophobicContact CE1-CB 4.01Å
203R91.7Very high94.6Very high30 Ų3032.8 Ų32.811%0.11319%0.194CC..  trans-12469.3178.3-70.2-61.6-60.5-87.3-6111.2Y199 D205 V206 G207 N237 R246Y199-R203 HydrophobicContact CE1-CB 4.25Å; Y199-R203 HydrophobicContact CE2-CB 4.3Å; Y199-R203 HydrophobicContact CE2-CG 4.03Å; Y199-R203 PolarHBondContact O-N 3.04Å; R203-D205 IonicContact CZ-OD1 3.61Å; R203-D205 IonicContact CZ-OD2 3.54Å; R203-D205 IonicContact NE-OD1 2.67Å; R203-D205 PolarHBondContact NE-OD1 3.23Å; R203-D205 IonicContact NE-OD2 3.48Å; R203-D205 PolarHBondContact NE-OD2 2.9Å; R203-D205 IonicContact NH2-OD1 3.75Å; R203-D205 IonicContact NH2-OD2 2.61Å; R203-D205 PolarHBondContact NH2-OD2 2.81Å; R203-D205 PolarHBondContact O-N 2.91Å; R203-D205 VanDerWaalsContact O-N 3.13Å; R203-V206 HydrophobicContact CB-CB 4.34Å; R203-V206 HydrophobicContact CB-CG2 4.43Å; R203-V206 PolarHBondContact O-N 2.76Å; R203-G207 PolarHBondContact O-N 3.17Å; R203-N237 PolarHBondContact NH1-OD1 3.39Å; R203-R246 VanDerWaalsContact NH2-NH2 3.18Å
204P90.9Very high94.6Very high106 Ų10632.6 Ų32.669%0.68819%0.193SC*.THydrogen-bonded Turntrans-64.3-20.1-179.628.3-35.5000112.7Y202 V206Y202-P204 VanDerWaalsContact C-CD 3.5Å; Y202-P204 WeakPolarHBondContact O-CD 3.44Å; P204-V206 VanDerWaalsContact C-N 3.26Å; P204-V206 PolarHBondContact O-N 3.26Å
205D89.7Confident94.6Very high86 Ų8630.3 Ų30.346%0.4618%0.176SC..THydrogen-bonded Turntrans-70-21.1173.667-63.7000113.7R203 R246R203-D205 IonicContact CZ-OD1 3.61Å; R203-D205 IonicContact CZ-OD2 3.54Å; R203-D205 IonicContact NE-OD1 2.67Å; R203-D205 PolarHBondContact NE-OD1 3.23Å; R203-D205 IonicContact NE-OD2 3.48Å; R203-D205 PolarHBondContact NE-OD2 2.9Å; R203-D205 IonicContact NH2-OD1 3.75Å; R203-D205 IonicContact NH2-OD2 2.61Å; R203-D205 PolarHBondContact NH2-OD2 2.81Å; R203-D205 PolarHBondContact O-N 2.91Å; R203-D205 VanDerWaalsContact O-N 3.13Å; D205-R246 IonicContact OD2-CZ 2.88Å; D205-R246 IonicContact OD2-NE 3.78Å; D205-R246 IonicContact OD2-NH2 3.75Å; D205-R246 PolarHBondContact OD2-NH2 3.12Å
206V91.2Very high94.6Very high22 Ų2230.2 Ų30.213%0.13318%0.176CC..THydrogen-bonded Turntrans-106.1-41.2174.1-177.30000110.3Y199 R203 P204 V209 M212 L242 F245 R246Y199-V206 HydrophobicContact CE1-CG1 4.35Å; R203-V206 HydrophobicContact CB-CB 4.34Å; R203-V206 HydrophobicContact CB-CG2 4.43Å; R203-V206 PolarHBondContact O-N 2.76Å; P204-V206 VanDerWaalsContact C-N 3.26Å; P204-V206 PolarHBondContact O-N 3.26Å; V206-V209 HydrophobicContact CG1-CG2 4.34Å; V206-M212 HydrophobicContact CG1-CE 3.83Å; V206-L242 HydrophobicContact CG2-CD2 4.45Å; V206-F245 HydrophobicContact CG1-CB 4.33Å; V206-R246 HydrophobicContact CG2-CG 4.24Å
207G92.3Very high94.6Very high16 Ų1630.1 Ų30.117%0.16518%0.176CC..  trans64.1-157.9-170.900000112.1Y199 R203Y199-G207 WeakPolarHBondContact CE1-O 3.43Å; R203-G207 PolarHBondContact O-N 3.17Å
208Y94.3Very high94.7Very high15 Ų1528.7 Ų28.76%0.05917%0.165CC..  trans-90.8134.6170.9180-104.3000111L167 I168 D171 L196 M212L167-Y208 HydrophobicContact CB-CD1 3.85Å; L167-Y208 HydrophobicContact CB-CE1 3.88Å; I168-Y208 HydrophobicContact CB-CE1 4.4Å; I168-Y208 HydrophobicContact CD1-CD2 4.14Å; I168-Y208 HydrophobicContact CD1-CG 4.07Å; I168-Y208 HydrophobicContact CG1-CD1 3.59Å; I168-Y208 HydrophobicContact CG1-CD2 3.57Å; I168-Y208 HydrophobicContact CG1-CE1 3.74Å; I168-Y208 HydrophobicContact CG1-CE2 3.72Å; I168-Y208 HydrophobicContact CG1-CG 3.49Å; I168-Y208 VanDerWaalsContact CG1-CG 3.49Å; D171-Y208 WeakPolarHBondContact CB-OH 3.35Å; D171-Y208 PolarHBondContact OD2-OH 3.22Å; L196-Y208 HydrophobicContact CB-CD2 4.34Å; L196-Y208 HydrophobicContact CB-CE2 4.23Å; L196-Y208 HydrophobicContact CD1-CE2 3.93Å; L196-Y208 HydrophobicContact CD2-CD2 4.29Å; L196-Y208 HydrophobicContact CD2-CE2 3.78Å; L196-Y208 HydrophobicContact CG-CE2 4.18Å; Y208-M212 HydrophobicContact CD2-CB 4.15Å; Y208-M212 HydrophobicContact CD2-SD 4.1Å; Y208-M212 HydrophobicContact CE2-CB 3.69Å
209V92.7Very high94.9Very high40 Ų4027.7 Ų27.724%0.24216%0.157CC..  trans-123.4135.7175.1-175.70000109.4V206 G211 M212 F245V206-V209 HydrophobicContact CG1-CG2 4.34Å; V209-G211 PolarHBondContact O-N 2.88Å; V209-M212 HydrophobicContact CB-CE 3.86Å; V209-M212 HydrophobicContact CB-CG 4.46Å; V209-M212 HydrophobicContact CB-SD 4.26Å; V209-M212 HydrophobicContact CG2-CE 3.85Å; V209-M212 PolarHBondContact N-SD 3.19Å; V209-M212 VanDerWaalsContact N-SD 3.37Å; V209-M212 VanDerWaalsContact O-CB 3.24Å; V209-M212 WeakPolarHBondContact O-CB 3.38Å; V209-M212 WeakPolarHBondContact O-CG 3.4Å; V209-M212 PolarHBondContact O-N 2.76Å; V209-M212 VanDerWaalsContact O-N 3.13Å; V209-F245 HydrophobicContact CB-CD1 3.79Å; V209-F245 HydrophobicContact CB-CE1 4.39Å; V209-F245 HydrophobicContact CG1-CD1 3.94Å; V209-F245 HydrophobicContact CG2-CD1 4.31Å
210Q91.9Very high95Very high85 Ų8527.9 Ų27.940%0.39716%0.158SC..THydrogen-bonded Turntrans-52.9132.5179.6-72-173-8.800111.8L167 Y290L167-Q210 HydrophobicContact CD2-CG 4.02Å; Q210-Y290 WeakPolarHBondContact O-CE2 3.49Å; Q210-Y290 PolarHBondContact O-OH 3.27Å
211G92.8Very high95.1Very high1 Ų129.7 Ų29.71%0.0117%0.165CC..THydrogen-bonded Turntrans99.2-14.8-177.400000114.1D171 V209 S213 F214D171-G211 WeakPolarHBondContact OD2-CA 3.45Å; D171-G211 PolarHBondContact OD2-N 2.77Å; V209-G211 PolarHBondContact O-N 2.88Å; G211-S213 PolarHBondContact O-N 3.2Å; G211-F214 PolarHBondContact O-N 2.91Å
212M96.6Very high95.3Very high0 Ų027 Ų270%015%0.145CC..Hα-helixtrans-56.5-31.3172-82.9-175.9179.300113L196 Y199 V206 Y208 V209 F214 V215 A216 F232 L236 F245L196-M212 HydrophobicContact CD2-CB 4.2Å; Y199-M212 HydrophobicContact CD1-CE 4.46Å; Y199-M212 HydrophobicContact CD1-SD 4.11Å; Y199-M212 HydrophobicContact CE1-CE 3.69Å; Y199-M212 HydrophobicContact CE1-SD 3.93Å; V206-M212 HydrophobicContact CG1-CE 3.83Å; Y208-M212 HydrophobicContact CD2-CB 4.15Å; Y208-M212 HydrophobicContact CD2-SD 4.1Å; Y208-M212 HydrophobicContact CE2-CB 3.69Å; V209-M212 HydrophobicContact CB-CE 3.86Å; V209-M212 HydrophobicContact CB-CG 4.46Å; V209-M212 HydrophobicContact CB-SD 4.26Å; V209-M212 HydrophobicContact CG2-CE 3.85Å; V209-M212 PolarHBondContact N-SD 3.19Å; V209-M212 VanDerWaalsContact N-SD 3.37Å; V209-M212 VanDerWaalsContact O-CB 3.24Å; V209-M212 WeakPolarHBondContact O-CB 3.38Å; V209-M212 WeakPolarHBondContact O-CG 3.4Å; V209-M212 PolarHBondContact O-N 2.76Å; V209-M212 VanDerWaalsContact O-N 3.13Å; M212-F214 VanDerWaalsContact C-N 3.27Å; M212-F214 PolarHBondContact O-N 3.37Å; M212-V215 PolarHBondContact O-N 2.95Å; M212-A216 PolarHBondContact O-N 3.21Å; M212-F232 HydrophobicContact CB-CZ 4.01Å; M212-F232 HydrophobicContact CG-CZ 4.25Å; M212-F232 HydrophobicContact SD-CZ 4.41Å; M212-L236 HydrophobicContact CE-CD1 3.87Å; M212-L236 HydrophobicContact CG-CD1 4.22Å; M212-L236 HydrophobicContact SD-CD1 4.08Å; M212-F245 HydrophobicContact CE-CB 4.13Å; M212-F245 HydrophobicContact CE-CD1 3.57Å; M212-F245 HydrophobicContact CE-CD2 4.46Å; M212-F245 HydrophobicContact CE-CE1 4Å; M212-F245 HydrophobicContact CE-CG 3.81Å; M212-F245 HydrophobicContact CG-CD1 4.02Å; M212-F245 HydrophobicContact CG-CE1 3.45Å; M212-F245 VanDerWaalsContact CG-CE1 3.45Å; M212-F245 HydrophobicContact CG-CZ 3.91Å
213S98Very high95.5Very high0 Ų024.7 Ų24.70%014%0.137CC..Hα-helixtrans-56.1-38.6177.457.30000113.3D171 T175 G211 A217D171-S213 WeakPolarHBondContact CB-OG 3.43Å; D171-S213 PolarHBondContact OD2-OG 2.82Å; D171-S213 VanDerWaalsContact OD2-OG 3.11Å; T175-S213 VanDerWaalsContact OG1-CB 3.24Å; T175-S213 WeakPolarHBondContact OG1-CB 3.5Å; T175-S213 PolarHBondContact OG1-OG 2.92Å; G211-S213 PolarHBondContact O-N 3.2Å; S213-A217 WeakPolarHBondContact O-CB 3.34Å; S213-A217 PolarHBondContact O-N 3.33Å
214F98.1Very high95.7Very high13 Ų1329 Ų296%0.05716%0.162CC..Hα-helixtrans-67.5-41.7179-67.9-89.9000111.6R174 T175 F176 G211 M212 A217 V218 A294 R295R174-F214 HydrophobicContact CG-CZ 4.47Å; T175-F214 HydrophobicContact CG2-CD1 4.08Å; T175-F214 HydrophobicContact CG2-CE1 4.44Å; T175-F214 HydrophobicContact CG2-CG 4.38Å; F176-F214 HydrophobicContact CE2-CD1 4.47Å; F176-F214 HydrophobicContact CZ-CD1 4.4Å; G211-F214 PolarHBondContact O-N 2.91Å; M212-F214 VanDerWaalsContact C-N 3.27Å; M212-F214 PolarHBondContact O-N 3.37Å; F214-A217 PolarHBondContact O-N 3.49Å; F214-V218 WeakPolarHBondContact O-CG2 3.35Å; F214-V218 PolarHBondContact O-N 3.38Å; F214-V218 VanDerWaalsContact O-N 3.09Å; F214-A294 HydrophobicContact CB-CB 3.77Å; F214-R295 HydrophobicContact CD1-CB 4.12Å; F214-R295 HydrophobicContact CD2-CB 4.16Å; F214-R295 HydrophobicContact CD2-CG 4.47Å; F214-R295 HydrophobicContact CE1-CB 4.18Å; F214-R295 HydrophobicContact CE1-CG 4.23Å; F214-R295 HydrophobicContact CE2-CB 4.24Å; F214-R295 HydrophobicContact CE2-CG 4.06Å; F214-R295 HydrophobicContact CG-CB 4.11Å; F214-R295 HydrophobicContact CZ-CB 4.25Å; F214-R295 HydrophobicContact CZ-CG 3.93Å
215V98.2Very high96Very high0 Ų027.3 Ų27.30%015%0.147CC..Hα-helixtrans-65.4-48.2177.8178.70000110.2M212 A217 V218 L219 F232 L235 L236 L292 W306M212-V215 PolarHBondContact O-N 2.95Å; V215-A217 VanDerWaalsContact C-N 3.34Å; V215-A217 PolarHBondContact O-N 3.36Å; V215-V218 PolarHBondContact O-N 3.45Å; V215-L219 PolarHBondContact O-N 3.49Å; V215-F232 HydrophobicContact CB-CE2 4.06Å; V215-F232 HydrophobicContact CG1-CD2 3.98Å; V215-F232 HydrophobicContact CG1-CE2 3.97Å; V215-L235 HydrophobicContact CG1-CD2 3.97Å; V215-L236 HydrophobicContact CG1-CD2 4.42Å; V215-L292 HydrophobicContact CG1-CD1 4.22Å; V215-L292 HydrophobicContact CG2-CD1 4.43Å; V215-W306 HydrophobicContact CB-CH2 4.44Å; V215-W306 HydrophobicContact CG1-CH2 3.81Å; V215-W306 HydrophobicContact CG1-CZ2 4.26Å
216A98.5Very high96.4Very high0 Ų026 Ų260%014%0.136CC..Hα-helixtrans-60.5-41.6176.900000112.2L192 I195 L196 M212 L219 L220 F232L192-A216 HydrophobicContact CD1-CB 3.56Å; I195-A216 HydrophobicContact CG2-CB 3.89Å; L196-A216 HydrophobicContact CD2-CB 3.74Å; L196-A216 HydrophobicContact CG-CB 4.41Å; M212-A216 PolarHBondContact O-N 3.21Å; A216-L219 PolarHBondContact O-N 3.38Å; A216-L220 VanDerWaalsContact O-CB 3.31Å; A216-L220 WeakPolarHBondContact O-CB 3.23Å; A216-L220 PolarHBondContact O-N 2.87Å; A216-F232 HydrophobicContact CB-CD2 4.01Å; A216-F232 HydrophobicContact CB-CE2 3.79Å; A216-F232 HydrophobicContact CB-CZ 4.16Å
217A98.6Very high96.7Very high0 Ų028.2 Ų28.20%015%0.145CC..Hα-helixtrans-63-42.3177.700000112.9T175 F176 F182 L192 S213 F214 V215 L219 L220 L221T175-A217 HydrophobicContact CG2-CB 3.47Å; T175-A217 VanDerWaalsContact CG2-CB 3.47Å; F176-A217 HydrophobicContact CD2-CB 4.07Å; F176-A217 HydrophobicContact CE2-CB 4.05Å; F182-A217 HydrophobicContact CD1-CB 4.48Å; F182-A217 HydrophobicContact CD2-CB 4.31Å; F182-A217 HydrophobicContact CE1-CB 3.95Å; F182-A217 HydrophobicContact CE2-CB 3.77Å; F182-A217 HydrophobicContact CZ-CB 3.56Å; L192-A217 HydrophobicContact CD1-CB 4.3Å; L192-A217 HydrophobicContact CD2-CB 4.2Å; S213-A217 WeakPolarHBondContact O-CB 3.34Å; S213-A217 PolarHBondContact O-N 3.33Å; F214-A217 PolarHBondContact O-N 3.49Å; V215-A217 VanDerWaalsContact C-N 3.34Å; V215-A217 PolarHBondContact O-N 3.36Å; A217-L219 VanDerWaalsContact C-N 3.32Å; A217-L219 PolarHBondContact O-N 2.96Å; A217-L220 PolarHBondContact O-N 3.29Å; A217-L221 VanDerWaalsContact O-CG 3.3Å; A217-L221 WeakPolarHBondContact O-CG 3.19Å; A217-L221 PolarHBondContact O-N 2.92Å
218V98.6Very high97Very high0 Ų027.5 Ų27.50%014%0.137CC..Hα-helixtrans-63.4-40177175.30000111.2W127 F176 F214 V215 N222 A294 L299 T302 W306W127-V218 HydrophobicContact CH2-CG1 3.83Å; W127-V218 HydrophobicContact CZ3-CG1 3.89Å; F176-V218 HydrophobicContact CE2-CG2 3.82Å; F176-V218 HydrophobicContact CZ-CG2 3.79Å; F214-V218 WeakPolarHBondContact O-CG2 3.35Å; F214-V218 PolarHBondContact O-N 3.38Å; F214-V218 VanDerWaalsContact O-N 3.09Å; V215-V218 PolarHBondContact O-N 3.45Å; V218-N222 PolarHBondContact O-ND2 3.42Å; V218-A294 HydrophobicContact CG2-CB 3.75Å; V218-L299 HydrophobicContact CG2-CD1 4.19Å; V218-T302 HydrophobicContact CG2-CG2 4.05Å; V218-W306 HydrophobicContact CB-CE3 4.38Å; V218-W306 HydrophobicContact CB-CH2 3.67Å; V218-W306 HydrophobicContact CB-CZ2 3.85Å; V218-W306 HydrophobicContact CB-CZ3 3.96Å; V218-W306 HydrophobicContact CG1-CD2 3.63Å; V218-W306 HydrophobicContact CG1-CE3 3.5Å; V218-W306 VanDerWaalsContact CG1-CE3 3.5Å; V218-W306 HydrophobicContact CG1-CG 4.38Å; V218-W306 HydrophobicContact CG1-CH2 3.72Å; V218-W306 HydrophobicContact CG1-CZ2 3.86Å; V218-W306 HydrophobicContact CG1-CZ3 3.55Å; V218-W306 HydrophobicContact CG2-CZ2 4.26Å
219L98.7Very high97.2Very high0 Ų027.1 Ų27.10%014%0.136CC..Hα-helixtrans-63-51.3174.8-71.1170.2000111.1I131 V215 A216 A217 L221 N222 L223 A228 A231 F232 W306I131-L219 HydrophobicContact CD1-CD2 4.04Å; V215-L219 PolarHBondContact O-N 3.49Å; A216-L219 PolarHBondContact O-N 3.38Å; A217-L219 VanDerWaalsContact C-N 3.32Å; A217-L219 PolarHBondContact O-N 2.96Å; L219-L221 PolarHBondContact O-N 3.48Å; L219-N222 CarbonylContact O-C 3.59Å; L219-N222 PolarHBondContact O-N 3.37Å; L219-L223 HydrophobicContact CB-CD1 4.11Å; L219-L223 HydrophobicContact CD2-CD1 3.71Å; L219-L223 VanDerWaalsContact O-CB 3.28Å; L219-L223 WeakPolarHBondContact O-CB 3.49Å; L219-L223 PolarHBondContact O-N 3.26Å; L219-A228 HydrophobicContact CB-CB 4.25Å; L219-A231 HydrophobicContact CD1-CB 4.25Å; L219-A231 HydrophobicContact CD2-CB 3.88Å; L219-F232 VanDerWaalsContact CD1-CA 3.48Å; L219-F232 HydrophobicContact CD1-CB 3.63Å; L219-F232 HydrophobicContact CD1-CD2 3.95Å; L219-F232 HydrophobicContact CD1-CG 4.3Å; L219-W306 HydrophobicContact CD2-CH2 4.5Å; L219-W306 HydrophobicContact CD2-CZ3 3.7Å; L219-W306 HydrophobicContact CG-CH2 4.16Å; L219-W306 HydrophobicContact CG-CZ3 3.8Å
220L98.2Very high97.4Very high6 Ų626 Ų263%0.03113%0.129CC..Hα-helixtrans-65.2-22.5-177-173.961.8000113.7F182 F188 L191 L192 I195 A216 A217 N222 L225 A228F182-L220 HydrophobicContact CE1-CD2 4.17Å; F188-L220 HydrophobicContact CD1-CD2 3.93Å; F188-L220 HydrophobicContact CD1-CG 3.8Å; F188-L220 HydrophobicContact CE1-CG 4.22Å; L191-L220 HydrophobicContact CB-CD1 4.31Å; L191-L220 HydrophobicContact CB-CD2 3.61Å; L192-L220 HydrophobicContact CB-CD2 4.19Å; I195-L220 HydrophobicContact CD1-CB 4.18Å; I195-L220 HydrophobicContact CD1-CD1 4Å; I195-L220 HydrophobicContact CD1-CD2 4.25Å; I195-L220 HydrophobicContact CD1-CG 4.36Å; A216-L220 VanDerWaalsContact O-CB 3.31Å; A216-L220 WeakPolarHBondContact O-CB 3.23Å; A216-L220 PolarHBondContact O-N 2.87Å; A217-L220 PolarHBondContact O-N 3.29Å; L220-N222 VanDerWaalsContact C-N 3.26Å; L220-N222 PolarHBondContact O-N 3.17Å; L220-L225 HydrophobicContact CD1-CD1 4.35Å; L220-A228 HydrophobicContact CB-CB 4.42Å; L220-A228 HydrophobicContact CD1-CB 4.27Å
221L97.9Very high97.7Very high53 Ų5322.1 Ų22.128%0.27711%0.111SC..THydrogen-bonded Turntrans-70.5-20.8170.5-79.1170000114I181 F182 A217 L219 L299I181-L221 HydrophobicContact CD1-CD2 3.67Å; F182-L221 HydrophobicContact CE2-CD1 4.11Å; F182-L221 HydrophobicContact CE2-CD2 4.25Å; F182-L221 HydrophobicContact CE2-CG 4.11Å; F182-L221 HydrophobicContact CZ-CD1 4.28Å; F182-L221 HydrophobicContact CZ-CD2 4.11Å; F182-L221 HydrophobicContact CZ-CG 3.84Å; A217-L221 VanDerWaalsContact O-CG 3.3Å; A217-L221 WeakPolarHBondContact O-CG 3.19Å; A217-L221 PolarHBondContact O-N 2.92Å; L219-L221 PolarHBondContact O-N 3.48Å; L221-L299 HydrophobicContact CD1-CD1 3.75Å; L221-L299 HydrophobicContact CD1-CD2 3.59Å; L221-L299 HydrophobicContact CD1-CG 4.32Å
222N98Very high98Very high32 Ų3222 Ų2217%0.17111%0.111CC..THydrogen-bonded Turntrans-121-7.2-172.1-65.5-89.1000112.6R123 G124 W127 V218 L219 L220R123-N222 HydrophobicContact CB-CB 4.34Å; R123-N222 WeakPolarHBondContact CD-OD1 3.32Å; G124-N222 WeakPolarHBondContact CA-O 3.41Å; W127-N222 HydrophobicContact CE3-CB 3.97Å; W127-N222 HydrophobicContact CH2-CB 4.35Å; W127-N222 WeakPolarHBondContact CH2-ND2 3.01Å; W127-N222 HydrophobicContact CZ3-CB 3.67Å; W127-N222 VanDerWaalsContact CZ3-ND2 3.33Å; W127-N222 WeakPolarHBondContact CZ3-ND2 2.97Å; V218-N222 PolarHBondContact O-ND2 3.42Å; L219-N222 CarbonylContact O-C 3.59Å; L219-N222 PolarHBondContact O-N 3.37Å; L220-N222 VanDerWaalsContact C-N 3.26Å; L220-N222 PolarHBondContact O-N 3.17Å
223L97.9Very high98.1Very high13 Ų1322.1 Ų22.17%0.06811%0.111CC..SBendtrans-138.6149.2-171.8-63.5166.3000109.9G124 Q128 L219 E227 A228 A231G124-L223 VanDerWaalsContact O-CD2 3.31Å; G124-L223 WeakPolarHBondContact O-CD2 3.39Å; Q128-L223 HydrophobicContact CG-CD2 3.52Å; L219-L223 HydrophobicContact CB-CD1 4.11Å; L219-L223 HydrophobicContact CD2-CD1 3.71Å; L219-L223 VanDerWaalsContact O-CB 3.28Å; L219-L223 WeakPolarHBondContact O-CB 3.49Å; L219-L223 PolarHBondContact O-N 3.26Å; L223-E227 HydrophobicContact CB-CB 4.48Å; L223-E227 HydrophobicContact CD2-CB 4.37Å; L223-A228 HydrophobicContact CB-CB 3.87Å; L223-A228 HydrophobicContact CD1-CB 4.49Å; L223-A231 HydrophobicContact CD1-CB 3.88Å
224D97Very high98Very high121 Ų12122.5 Ų22.565%0.64711%0.114SC*.  trans-66.4160.5167.2-66-45.3000110.7Y226 E227 A228D224-Y226 VanDerWaalsContact C-N 3.33Å; D224-Y226 PolarHBondContact O-N 2.98Å; D224-E227 WeakPolarHBondContact CB-OE2 3.39Å; D224-E227 PolarHBondContact O-N 3.33Å; D224-A228 VanDerWaalsContact O-CB 3.23Å; D224-A228 WeakPolarHBondContact O-CB 3.38Å; D224-A228 PolarHBondContact O-N 2.91Å
225L97.5Very high98Very high70 Ų7022 Ų2237%0.36611%0.111SC..Hα-helixtrans-52.2-48.1-168.4177.164.3000113.3L191 I195 L220 F229L191-L225 HydrophobicContact CB-CD1 4.26Å; L191-L225 HydrophobicContact CD2-CD1 4.29Å; L191-L225 HydrophobicContact CD2-CD2 4.03Å; I195-L225 HydrophobicContact CD1-CD1 3.98Å; I195-L225 HydrophobicContact CG1-CD1 3.63Å; L220-L225 HydrophobicContact CD1-CD1 4.35Å; L225-F229 PolarHBondContact O-N 2.71Å
226Y96.8Very high97.8Very high60 Ų6022 Ų2224%0.23511%0.111CC..Hα-helixtrans-68-48.4-176.7172.1-116.8000111.4V137 T138 E139 N142 D224 A228 F229 V230V137-Y226 PolarHBondContact O-OH 3.09Å; T138-Y226 VanDerWaalsContact C-OH 3.25Å; T138-Y226 VanDerWaalsContact CA-OH 3.28Å; T138-Y226 WeakPolarHBondContact CA-OH 3.23Å; E139-Y226 HydrophobicContact CB-CE2 4.25Å; E139-Y226 HydrophobicContact CG-CD1 4.29Å; E139-Y226 HydrophobicContact CG-CD2 4.12Å; E139-Y226 HydrophobicContact CG-CE1 3.86Å; E139-Y226 HydrophobicContact CG-CE2 3.66Å; E139-Y226 HydrophobicContact CG-CG 4.39Å; E139-Y226 PolarHBondContact N-OH 3.37Å; E139-Y226 VanDerWaalsContact N-OH 3.14Å; N142-Y226 WeakPolarHBondContact ND2-CD2 3.31Å; D224-Y226 VanDerWaalsContact C-N 3.33Å; D224-Y226 PolarHBondContact O-N 2.98Å; Y226-A228 VanDerWaalsContact C-N 3.28Å; Y226-A228 PolarHBondContact O-N 3.47Å; Y226-F229 WeakPolarHBondContact O-CB 3.45Å; Y226-F229 PolarHBondContact O-N 3.5Å; Y226-F229 VanDerWaalsContact O-N 3.11Å; Y226-V230 HydrophobicContact CD2-CG2 4.14Å; Y226-V230 HydrophobicContact CE1-CG2 4.08Å; Y226-V230 HydrophobicContact CE2-CG2 3.66Å; Y226-V230 WeakPolarHBondContact O-CG2 3.17Å; Y226-V230 PolarHBondContact O-N 3.05Å
227E97.8Very high97.6Very high68 Ų6824.4 Ų24.432%0.31812%0.124SC..Hα-helixtrans-66.7-33179.4-66.489159.900112Q128 L223 D224 A231Q128-E227 HydrophobicContact CG-CB 4.49Å; Q128-E227 VanDerWaalsContact NE2-CB 3.31Å; L223-E227 HydrophobicContact CB-CB 4.48Å; L223-E227 HydrophobicContact CD2-CB 4.37Å; D224-E227 WeakPolarHBondContact CB-OE2 3.39Å; D224-E227 PolarHBondContact O-N 3.33Å; E227-A231 WeakPolarHBondContact O-CB 3.36Å; E227-A231 PolarHBondContact O-N 3.39Å
228A98.5Very high97.3Very high0 Ų026.8 Ų26.80%013%0.133CC..Hα-helixtrans-61.8-4517100000110.9I195 L219 L220 L223 D224 Y226 A231 F232I195-A228 HydrophobicContact CD1-CB 3.63Å; L219-A228 HydrophobicContact CB-CB 4.25Å; L220-A228 HydrophobicContact CB-CB 4.42Å; L220-A228 HydrophobicContact CD1-CB 4.27Å; L223-A228 HydrophobicContact CB-CB 3.87Å; L223-A228 HydrophobicContact CD1-CB 4.49Å; D224-A228 VanDerWaalsContact O-CB 3.23Å; D224-A228 WeakPolarHBondContact O-CB 3.38Å; D224-A228 PolarHBondContact O-N 2.91Å; Y226-A228 VanDerWaalsContact C-N 3.28Å; Y226-A228 PolarHBondContact O-N 3.47Å; A228-A231 PolarHBondContact O-N 3Å; A228-F232 WeakPolarHBondContact O-CB 3.47Å; A228-F232 PolarHBondContact O-N 3.44Å
229F98.4Very high96.8Very high7 Ų730.2 Ų30.23%0.03116%0.155CC..Hα-helixtrans-63.2-47.9175.9177.8-106.3000112.4V137 N142 I195 A198 Y202 L225 Y226 A231 F232 C233V137-F229 HydrophobicContact CG1-CD1 4.12Å; V137-F229 HydrophobicContact CG1-CE1 3.86Å; N142-F229 WeakPolarHBondContact OD1-CD1 3.49Å; N142-F229 WeakPolarHBondContact OD1-CE1 3.31Å; I195-F229 HydrophobicContact CG1-CB 4.45Å; I195-F229 HydrophobicContact CG2-CD2 4.35Å; A198-F229 HydrophobicContact CB-CD2 4.09Å; A198-F229 HydrophobicContact CB-CE2 3.61Å; A198-F229 HydrophobicContact CB-CZ 4.09Å; Y202-F229 HydrophobicContact CD1-CZ 4.46Å; Y202-F229 HydrophobicContact CG-CZ 4.19Å; L225-F229 PolarHBondContact O-N 2.71Å; Y226-F229 WeakPolarHBondContact O-CB 3.45Å; Y226-F229 PolarHBondContact O-N 3.5Å; Y226-F229 VanDerWaalsContact O-N 3.11Å; F229-A231 VanDerWaalsContact C-N 3.33Å; F229-A231 PolarHBondContact O-N 2.98Å; F229-F232 WeakPolarHBondContact O-CB 3.25Å; F229-F232 PolarHBondContact O-N 2.92Å; F229-F232 VanDerWaalsContact O-N 3.15Å; F229-C233 VanDerWaalsContact CE2-SG 3.58Å; F229-C233 WeakPolarHBondContact CZ-SG 3.25Å; F229-C233 PolarHBondContact O-N 3.11Å; F229-C233 PolarHBondContact O-SG 3.22Å; F229-C233 VanDerWaalsContact O-SG 3.35Å
230V98.3Very high96.1Very high17 Ų1730.5 Ų30.510%0.10316%0.157CC..Hα-helixtrans-57.3-48.1176.3172.90000110.7N133 V137 Y226 F232 C233 N234N133-V230 HydrophobicContact CB-CG1 4.04Å; V137-V230 HydrophobicContact CB-CG1 4.31Å; V137-V230 HydrophobicContact CB-CG2 4.08Å; V137-V230 HydrophobicContact CG1-CG2 3.92Å; Y226-V230 HydrophobicContact CD2-CG2 4.14Å; Y226-V230 HydrophobicContact CE1-CG2 4.08Å; Y226-V230 HydrophobicContact CE2-CG2 3.66Å; Y226-V230 WeakPolarHBondContact O-CG2 3.17Å; Y226-V230 PolarHBondContact O-N 3.05Å; V230-F232 VanDerWaalsContact C-N 3.32Å; V230-F232 PolarHBondContact O-N 3.34Å; V230-C233 PolarHBondContact O-N 3.35Å; V230-N234 PolarHBondContact O-N 3Å; V230-N234 VanDerWaalsContact O-N 3.12Å; V230-N234 PolarHBondContact O-ND2 2.96Å
231A98.4Very high95.7Very high3 Ų330.5 Ų30.53%0.02516%0.157CC..Hα-helixtrans-62.6-40.5177.800000111.6I131 L219 L223 E227 A228 F229 N234 L235I131-A231 HydrophobicContact CD1-CB 3.86Å; I131-A231 HydrophobicContact CG2-CB 4.49Å; L219-A231 HydrophobicContact CD1-CB 4.25Å; L219-A231 HydrophobicContact CD2-CB 3.88Å; L223-A231 HydrophobicContact CD1-CB 3.88Å; E227-A231 WeakPolarHBondContact O-CB 3.36Å; E227-A231 PolarHBondContact O-N 3.39Å; A228-A231 PolarHBondContact O-N 3Å; F229-A231 VanDerWaalsContact C-N 3.33Å; F229-A231 PolarHBondContact O-N 2.98Å; A231-N234 PolarHBondContact O-N 2.96Å; A231-L235 WeakPolarHBondContact O-CB 2.82Å; A231-L235 PolarHBondContact O-N 3.07Å
232F98.1Very high95.2Very high0 Ų029 Ų290%015%0.15CC..Hα-helixtrans-61.6-50.2178.2-175.2-115.2000111.4I195 L196 Y199 M212 V215 A216 L219 A228 F229 V230 N234 L235 L236I195-F232 HydrophobicContact CG2-CB 4.37Å; I195-F232 HydrophobicContact CG2-CD1 3.82Å; I195-F232 HydrophobicContact CG2-CE1 4.26Å; I195-F232 HydrophobicContact CG2-CG 4.12Å; L196-F232 HydrophobicContact CD2-CE1 4.31Å; L196-F232 HydrophobicContact CD2-CZ 3.95Å; Y199-F232 AromaticContact CD1-CE1 3.99Å; Y199-F232 HydrophobicContact CD1-CE1 3.99Å; Y199-F232 AromaticContact CD2-CD1 3.71Å; Y199-F232 HydrophobicContact CD2-CD1 3.71Å; Y199-F232 AromaticContact CD2-CE1 3.68Å; Y199-F232 HydrophobicContact CD2-CE1 3.68Å; Y199-F232 HydrophobicContact CE2-CD1 4.47Å; Y199-F232 HydrophobicContact CE2-CE1 4.38Å; Y199-F232 AromaticContact CG-CD1 3.9Å; Y199-F232 HydrophobicContact CG-CD1 3.9Å; Y199-F232 AromaticContact CG-CE1 3.45Å; Y199-F232 HydrophobicContact CG-CE1 3.45Å; Y199-F232 VanDerWaalsContact CG-CE1 3.45Å; M212-F232 HydrophobicContact CB-CZ 4.01Å; M212-F232 HydrophobicContact CG-CZ 4.25Å; M212-F232 HydrophobicContact SD-CZ 4.41Å; V215-F232 HydrophobicContact CB-CE2 4.06Å; V215-F232 HydrophobicContact CG1-CD2 3.98Å; V215-F232 HydrophobicContact CG1-CE2 3.97Å; A216-F232 HydrophobicContact CB-CD2 4.01Å; A216-F232 HydrophobicContact CB-CE2 3.79Å; A216-F232 HydrophobicContact CB-CZ 4.16Å; L219-F232 VanDerWaalsContact CD1-CA 3.48Å; L219-F232 HydrophobicContact CD1-CB 3.63Å; L219-F232 HydrophobicContact CD1-CD2 3.95Å; L219-F232 HydrophobicContact CD1-CG 4.3Å; A228-F232 WeakPolarHBondContact O-CB 3.47Å; A228-F232 PolarHBondContact O-N 3.44Å; F229-F232 WeakPolarHBondContact O-CB 3.25Å; F229-F232 PolarHBondContact O-N 2.92Å; F229-F232 VanDerWaalsContact O-N 3.15Å; V230-F232 VanDerWaalsContact C-N 3.32Å; V230-F232 PolarHBondContact O-N 3.34Å; F232-N234 PolarHBondContact O-N 2.84Å; F232-L235 PolarHBondContact O-N 2.88Å; F232-L236 HydrophobicContact CD1-CD1 4.11Å; F232-L236 HydrophobicContact CD2-CD1 4.11Å; F232-L236 HydrophobicContact CD2-CG 4.12Å; F232-L236 HydrophobicContact CE1-CD1 3.56Å; F232-L236 HydrophobicContact CE1-CG 4.5Å; F232-L236 HydrophobicContact CE2-CD1 3.56Å; F232-L236 HydrophobicContact CE2-CD2 4.27Å; F232-L236 HydrophobicContact CE2-CG 3.93Å; F232-L236 HydrophobicContact CG-CD1 4.37Å; F232-L236 HydrophobicContact CG-CG 4.5Å; F232-L236 HydrophobicContact CZ-CD1 3.26Å; F232-L236 HydrophobicContact CZ-CG 4.14Å; F232-L236 WeakPolarHBondContact O-CB 3.29Å; F232-L236 VanDerWaalsContact O-CG 3.31Å; F232-L236 WeakPolarHBondContact O-CG 3.48Å; F232-L236 PolarHBondContact O-N 3.33Å
233C97.7Very high94.7Very high1 Ų127.5 Ų27.51%0.00714%0.142CC..Hα-helixtrans-56.3-48.8177-70.30000112.3L135 V137 Y202 F229 V230 N237L135-C233 HydrophobicContact CD1-CB 4.04Å; L135-C233 WeakPolarHBondContact CD1-O 3.42Å; V137-C233 HydrophobicContact CG2-CB 3.95Å; Y202-C233 HydrophobicContact CD1-CB 4.34Å; Y202-C233 VanDerWaalsContact CD1-SG 3.56Å; Y202-C233 HydrophobicContact CE1-CB 4.01Å; F229-C233 VanDerWaalsContact CE2-SG 3.58Å; F229-C233 WeakPolarHBondContact CZ-SG 3.25Å; F229-C233 PolarHBondContact O-N 3.11Å; F229-C233 PolarHBondContact O-SG 3.22Å; F229-C233 VanDerWaalsContact O-SG 3.35Å; V230-C233 PolarHBondContact O-N 3.35Å; C233-N237 VanDerWaalsContact O-CB 3.26Å; C233-N237 WeakPolarHBondContact O-CB 3.3Å; C233-N237 PolarHBondContact O-N 3.06Å; C233-N237 VanDerWaalsContact O-N 3.08Å
234N97.6Very high94.2Very high9 Ų927.4 Ų27.45%0.04814%0.141CC..Hα-helixtrans-70.3-39.5-178.1-77.7-83.3000112.5I131 N133 D134 L135 V230 A231 F232 N237 R238I131-N234 HydrophobicContact CG2-CB 3.79Å; N133-N234 VanDerWaalsContact C-OD1 3.31Å; N133-N234 WeakPolarHBondContact CA-OD1 3.34Å; N133-N234 PolarHBondContact OD1-ND2 3.26Å; D134-N234 PolarHBondContact N-OD1 3.36Å; L135-N234 WeakPolarHBondContact CB-OD1 3.47Å; L135-N234 PolarHBondContact N-OD1 2.81Å; V230-N234 PolarHBondContact O-N 3Å; V230-N234 VanDerWaalsContact O-N 3.12Å; V230-N234 PolarHBondContact O-ND2 2.96Å; A231-N234 PolarHBondContact O-N 2.96Å; F232-N234 PolarHBondContact O-N 2.84Å; N234-N237 PolarHBondContact O-N 3.34Å; N234-R238 PolarHBondContact O-N 3.4Å
235L96.6Very high93.6Very high1 Ų122 Ų221%0.00511%0.111CC..Hα-helixtrans-64.2-50.5178-173.162.1000110.5I131 V215 A231 F232 N237 R238 L241 L292 W306 F309 L310I131-L235 HydrophobicContact CG2-CB 4.44Å; V215-L235 HydrophobicContact CG1-CD2 3.97Å; A231-L235 WeakPolarHBondContact O-CB 2.82Å; A231-L235 PolarHBondContact O-N 3.07Å; F232-L235 PolarHBondContact O-N 2.88Å; L235-N237 PolarHBondContact O-N 2.83Å; L235-R238 VanDerWaalsContact O-CB 3.27Å; L235-R238 WeakPolarHBondContact O-CB 3.39Å; L235-R238 WeakPolarHBondContact O-CG 3.23Å; L235-R238 PolarHBondContact O-N 3.05Å; L235-L241 HydrophobicContact CD1-CD1 4.36Å; L235-L241 HydrophobicContact CG-CD1 3.89Å; L235-L241 WeakPolarHBondContact O-CD1 3.5Å; L235-L292 HydrophobicContact CD1-CD1 4.45Å; L235-L292 HydrophobicContact CD2-CD1 3.63Å; L235-L292 HydrophobicContact CG-CD1 4.19Å; L235-W306 HydrophobicContact CD2-CH2 4.17Å; L235-W306 HydrophobicContact CD2-CZ3 4.24Å; L235-F309 HydrophobicContact CD1-CE2 3.94Å; L235-F309 HydrophobicContact CD1-CZ 4.04Å; L235-L310 HydrophobicContact CD1-CD2 4.43Å
236L95.4Very high92.9Very high1 Ų123.7 Ų23.71%0.00511%0.113CC..Hα-helixtrans-63.6-25.4178.1-68.4-164.9000113.3Y199 M212 V215 F232 R238 L241 L242 F245Y199-L236 HydrophobicContact CD1-CD1 4.35Å; Y199-L236 HydrophobicContact CD2-CD1 4.23Å; Y199-L236 HydrophobicContact CE1-CD1 3.83Å; Y199-L236 HydrophobicContact CE2-CB 4.12Å; Y199-L236 HydrophobicContact CE2-CD1 3.68Å; Y199-L236 HydrophobicContact CE2-CG 4.44Å; Y199-L236 VanDerWaalsContact CZ-CD1 3.45Å; M212-L236 HydrophobicContact CE-CD1 3.87Å; M212-L236 HydrophobicContact CG-CD1 4.22Å; M212-L236 HydrophobicContact SD-CD1 4.08Å; V215-L236 HydrophobicContact CG1-CD2 4.42Å; F232-L236 HydrophobicContact CD1-CD1 4.11Å; F232-L236 HydrophobicContact CD2-CD1 4.11Å; F232-L236 HydrophobicContact CD2-CG 4.12Å; F232-L236 HydrophobicContact CE1-CD1 3.56Å; F232-L236 HydrophobicContact CE1-CG 4.5Å; F232-L236 HydrophobicContact CE2-CD1 3.56Å; F232-L236 HydrophobicContact CE2-CD2 4.27Å; F232-L236 HydrophobicContact CE2-CG 3.93Å; F232-L236 HydrophobicContact CG-CD1 4.37Å; F232-L236 HydrophobicContact CG-CG 4.5Å; F232-L236 HydrophobicContact CZ-CD1 3.26Å; F232-L236 HydrophobicContact CZ-CG 4.14Å; F232-L236 WeakPolarHBondContact O-CB 3.29Å; F232-L236 VanDerWaalsContact O-CG 3.31Å; F232-L236 WeakPolarHBondContact O-CG 3.48Å; F232-L236 PolarHBondContact O-N 3.33Å; L236-R238 VanDerWaalsContact C-N 3.25Å; L236-R238 PolarHBondContact O-N 3.06Å; L236-L241 HydrophobicContact CD2-CD1 4.09Å; L236-L242 VanDerWaalsContact O-CD2 3.27Å; L236-L242 WeakPolarHBondContact O-CD2 3.27Å; L236-L242 VanDerWaalsContact O-CG 3.22Å; L236-L242 WeakPolarHBondContact O-CG 3.4Å; L236-F245 HydrophobicContact CD2-CD2 3.83Å; L236-F245 HydrophobicContact CD2-CE2 3.27Å; L236-F245 HydrophobicContact CD2-CZ 3.86Å
237N94Very high92.2Very high50 Ų5025.6 Ų25.627%0.26713%0.13SC..THydrogen-bonded Turntrans-78.4-5175-165.472000113.7L135 R203 C233 N234 L235 L242L135-N237 HydrophobicContact CD1-CB 3.79Å; L135-N237 HydrophobicContact CD2-CB 4.39Å; L135-N237 HydrophobicContact CG-CB 4.26Å; R203-N237 PolarHBondContact NH1-OD1 3.39Å; C233-N237 VanDerWaalsContact O-CB 3.26Å; C233-N237 WeakPolarHBondContact O-CB 3.3Å; C233-N237 PolarHBondContact O-N 3.06Å; C233-N237 VanDerWaalsContact O-N 3.08Å; N234-N237 PolarHBondContact O-N 3.34Å; L235-N237 PolarHBondContact O-N 2.83Å; N237-L242 VanDerWaalsContact O-CD1 3.23Å; N237-L242 WeakPolarHBondContact O-CD1 3.5Å
238R92Very high91.4Very high50 Ų5025.8 Ų25.819%0.18913%0.131CC..SBendtrans-63.4142.4174.2-70.5-170.6174.2-171.4-2.4110.6A130 N234 L235 L236 T240 L241 L242 D314A130-R238 PolarHBondContact O-NH2 2.77Å; A130-R238 VanDerWaalsContact O-NH2 3.14Å; N234-R238 PolarHBondContact O-N 3.4Å; L235-R238 VanDerWaalsContact O-CB 3.27Å; L235-R238 WeakPolarHBondContact O-CB 3.39Å; L235-R238 WeakPolarHBondContact O-CG 3.23Å; L235-R238 PolarHBondContact O-N 3.05Å; L236-R238 VanDerWaalsContact C-N 3.25Å; L236-R238 PolarHBondContact O-N 3.06Å; R238-T240 PolarHBondContact O-N 3.19Å; R238-T240 VanDerWaalsContact O-N 3.09Å; R238-L241 PolarHBondContact O-N 3.45Å; R238-L241 VanDerWaalsContact O-N 3.09Å; R238-L242 PolarHBondContact O-N 3.42Å; R238-D314 IonicContact NH1-OD1 2.78Å
239P87.2Confident90.7Very high72 Ų7231 Ų3147%0.46816%0.155SC..Hα-helixtrans-54.5-36.8-173.7-25.932.9000114.2A243 R382P239-A243 PolarHBondContact O-N 2.61Å; P239-R382 PolarHBondContact O-NH1 3.11Å
240T85.9Confident90.2Very high7 Ų734 Ų344%0.04318%0.178CC..Hα-helixtrans-64.7-53177.7-52.10000111.4R238 A243 F244 Y255 D314R238-T240 PolarHBondContact O-N 3.19Å; R238-T240 VanDerWaalsContact O-N 3.09Å; T240-A243 WeakPolarHBondContact O-CB 3.42Å; T240-A243 PolarHBondContact O-N 3.21Å; T240-F244 HydrophobicContact CG2-CD2 4.44Å; T240-F244 HydrophobicContact CG2-CE2 3.96Å; T240-F244 WeakPolarHBondContact O-CD2 3.49Å; T240-Y255 WeakPolarHBondContact CA-OH 3.36Å; T240-Y255 WeakPolarHBondContact CB-OH 3.33Å; T240-Y255 HydrophobicContact CG2-CE1 4.04Å; T240-Y255 HydrophobicContact CG2-CE2 4.07Å; T240-Y255 PolarHBondContact N-OH 3.05Å; T240-Y255 PolarHBondContact OG1-OH 3.37Å; T240-D314 WeakPolarHBondContact CB-OD2 3.34Å; T240-D314 HydrophobicContact CG2-CB 4.45Å; T240-D314 PolarHBondContact OG1-OD2 2.82Å
241L89.5Confident89.6Confident5 Ų534.6 Ų34.63%0.02618%0.18CC..Hα-helixtrans-67.8-40.4-178.9-69.3-175000112.2L235 L236 R238 A243 F244 F245 L292L235-L241 HydrophobicContact CD1-CD1 4.36Å; L235-L241 HydrophobicContact CG-CD1 3.89Å; L235-L241 WeakPolarHBondContact O-CD1 3.5Å; L236-L241 HydrophobicContact CD2-CD1 4.09Å; R238-L241 PolarHBondContact O-N 3.45Å; R238-L241 VanDerWaalsContact O-N 3.09Å; L241-A243 VanDerWaalsContact C-N 3.26Å; L241-A243 PolarHBondContact O-N 3.39Å; L241-F244 PolarHBondContact O-N 3.36Å; L241-F244 VanDerWaalsContact O-N 3.14Å; L241-F245 HydrophobicContact CB-CD2 4.02Å; L241-F245 HydrophobicContact CB-CE2 4.08Å; L241-F245 HydrophobicContact CD2-CE2 4.21Å; L241-F245 WeakPolarHBondContact O-CD2 3.47Å; L241-F245 PolarHBondContact O-N 2.97Å; L241-L292 HydrophobicContact CD1-CD1 4.07Å; L241-L292 HydrophobicContact CD1-CD2 4.24Å; L241-L292 HydrophobicContact CD1-CG 4.31Å; L241-L292 HydrophobicContact CD2-CD2 3.92Å; L241-L292 HydrophobicContact CD2-CG 4.28Å; L241-L292 HydrophobicContact CG-CD2 4.49Å
242L87.8Confident89.1Confident23 Ų2335 Ų3512%0.1218%0.182CC..Hα-helixtrans-57-39.4175.5-80-178.5000112.7V206 L236 N237 R238 F244 F245 R246V206-L242 HydrophobicContact CG2-CD2 4.45Å; L236-L242 VanDerWaalsContact O-CD2 3.27Å; L236-L242 WeakPolarHBondContact O-CD2 3.27Å; L236-L242 VanDerWaalsContact O-CG 3.22Å; L236-L242 WeakPolarHBondContact O-CG 3.4Å; N237-L242 VanDerWaalsContact O-CD1 3.23Å; N237-L242 WeakPolarHBondContact O-CD1 3.5Å; R238-L242 PolarHBondContact O-N 3.42Å; L242-F244 VanDerWaalsContact C-N 3.3Å; L242-F244 PolarHBondContact O-N 3.13Å; L242-F245 PolarHBondContact O-N 3.27Å; L242-R246 VanDerWaalsContact O-CB 3.27Å; L242-R246 WeakPolarHBondContact O-CB 3.41Å; L242-R246 PolarHBondContact O-N 2.94Å
243A86.4Confident88.8Confident0 Ų039.7 Ų39.70%020%0.204CC..Hα-helixtrans-59.7-41.7178.400000112P239 T240 L241 V247 Q248 D251 Y255P239-A243 PolarHBondContact O-N 2.61Å; T240-A243 WeakPolarHBondContact O-CB 3.42Å; T240-A243 PolarHBondContact O-N 3.21Å; L241-A243 VanDerWaalsContact C-N 3.26Å; L241-A243 PolarHBondContact O-N 3.39Å; A243-V247 PolarHBondContact O-N 2.88Å; A243-Q248 PolarHBondContact O-N 2.75Å; A243-D251 HydrophobicContact CB-CB 3.6Å; A243-Y255 HydrophobicContact CB-CD2 4.48Å; A243-Y255 HydrophobicContact CB-CE2 3.97Å
244F86.6Confident88.4Confident11 Ų1143.1 Ų43.15%0.04822%0.217CC..Hα-helixtrans-74.7-46.1177.8-66.9-75.7000112.3T240 L241 L242 R246 V247 M252 Y255 F256 L289T240-F244 HydrophobicContact CG2-CD2 4.44Å; T240-F244 HydrophobicContact CG2-CE2 3.96Å; T240-F244 WeakPolarHBondContact O-CD2 3.49Å; L241-F244 PolarHBondContact O-N 3.36Å; L241-F244 VanDerWaalsContact O-N 3.14Å; L242-F244 VanDerWaalsContact C-N 3.3Å; L242-F244 PolarHBondContact O-N 3.13Å; F244-R246 PolarHBondContact O-N 3.49Å; F244-V247 PolarHBondContact O-N 3.42Å; F244-M252 HydrophobicContact CD1-CG 3.74Å; F244-M252 HydrophobicContact CD1-SD 3.73Å; F244-M252 HydrophobicContact CE1-CB 4.29Å; F244-M252 HydrophobicContact CE1-CG 3.96Å; F244-M252 HydrophobicContact CE1-SD 4.32Å; F244-M252 HydrophobicContact CG-CG 4.4Å; F244-Y255 AromaticContact CE2-CD2 3.99Å; F244-Y255 HydrophobicContact CE2-CD2 3.99Å; F244-Y255 HydrophobicContact CE2-CE2 4.4Å; F244-Y255 HydrophobicContact CE2-CG 4.47Å; F244-Y255 HydrophobicContact CZ-CD2 4.08Å; F244-Y255 HydrophobicContact CZ-CG 4.35Å; F244-F256 HydrophobicContact CE1-CE1 4.15Å; F244-F256 AromaticContact CE1-CZ 3.88Å; F244-F256 HydrophobicContact CE1-CZ 3.88Å; F244-L289 HydrophobicContact CE1-CD1 4.4Å; F244-L289 HydrophobicContact CE2-CB 4.2Å; F244-L289 HydrophobicContact CE2-CD1 4.07Å; F244-L289 HydrophobicContact CZ-CB 4.27Å; F244-L289 HydrophobicContact CZ-CD1 3.61Å
245F84.7Confident88Confident7 Ų743 Ų433%0.03122%0.215CC..Hα-helixtrans-71.1-28.9-177-74-62.4000113.6V206 V209 M212 L236 L241 L242 V247 Y290V206-F245 HydrophobicContact CG1-CB 4.33Å; V209-F245 HydrophobicContact CB-CD1 3.79Å; V209-F245 HydrophobicContact CB-CE1 4.39Å; V209-F245 HydrophobicContact CG1-CD1 3.94Å; V209-F245 HydrophobicContact CG2-CD1 4.31Å; M212-F245 HydrophobicContact CE-CB 4.13Å; M212-F245 HydrophobicContact CE-CD1 3.57Å; M212-F245 HydrophobicContact CE-CD2 4.46Å; M212-F245 HydrophobicContact CE-CE1 4Å; M212-F245 HydrophobicContact CE-CG 3.81Å; M212-F245 HydrophobicContact CG-CD1 4.02Å; M212-F245 HydrophobicContact CG-CE1 3.45Å; M212-F245 VanDerWaalsContact CG-CE1 3.45Å; M212-F245 HydrophobicContact CG-CZ 3.91Å; L236-F245 HydrophobicContact CD2-CD2 3.83Å; L236-F245 HydrophobicContact CD2-CE2 3.27Å; L236-F245 HydrophobicContact CD2-CZ 3.86Å; L241-F245 HydrophobicContact CB-CD2 4.02Å; L241-F245 HydrophobicContact CB-CE2 4.08Å; L241-F245 HydrophobicContact CD2-CE2 4.21Å; L241-F245 WeakPolarHBondContact O-CD2 3.47Å; L241-F245 PolarHBondContact O-N 2.97Å; L242-F245 PolarHBondContact O-N 3.27Å; F245-V247 VanDerWaalsContact C-N 3.26Å; F245-Y290 HydrophobicContact CD1-CD2 4.2Å; F245-Y290 AromaticContact CE1-CD2 3.39Å; F245-Y290 HydrophobicContact CE1-CD2 3.39Å; F245-Y290 AromaticContact CE1-CE2 3.86Å; F245-Y290 HydrophobicContact CE1-CE2 3.86Å; F245-Y290 HydrophobicContact CE1-CG 4.48Å; F245-Y290 HydrophobicContact CE2-CD2 4.48Å; F245-Y290 AromaticContact CZ-CD2 3.58Å; F245-Y290 HydrophobicContact CZ-CD2 3.58Å; F245-Y290 HydrophobicContact CZ-CE2 4.33Å; F245-Y290 VanDerWaalsContact CZ-O 3.29Å; F245-Y290 WeakPolarHBondContact CZ-O 3.39Å
246R84.1Confident87.8Confident106 Ų10643.2 Ų43.240%0.422%0.216SC..THydrogen-bonded Turntrans-84.61.7170.8-70.1-179.6163.8177.5-5.1113.5R203 D205 V206 L242 F244 Q248R203-R246 VanDerWaalsContact NH2-NH2 3.18Å; D205-R246 IonicContact OD2-CZ 2.88Å; D205-R246 IonicContact OD2-NE 3.78Å; D205-R246 IonicContact OD2-NH2 3.75Å; D205-R246 PolarHBondContact OD2-NH2 3.12Å; V206-R246 HydrophobicContact CG2-CG 4.24Å; L242-R246 VanDerWaalsContact O-CB 3.27Å; L242-R246 WeakPolarHBondContact O-CB 3.41Å; L242-R246 PolarHBondContact O-N 2.94Å; F244-R246 PolarHBondContact O-N 3.49Å; R246-Q248 HydrophobicContact CB-CG 3.9Å; R246-Q248 PolarHBondContact O-N 3.25Å
247V81.4Confident87.6Confident100 Ų10048.8 Ų48.861%0.60625%0.246SC*.THydrogen-bonded Turntrans52.141.4-178-161.70000111.2A243 F244 F245 Q249 M252A243-V247 PolarHBondContact O-N 2.88Å; F244-V247 PolarHBondContact O-N 3.42Å; F245-V247 VanDerWaalsContact C-N 3.26Å; V247-Q249 PolarHBondContact O-N 2.93Å; V247-M252 HydrophobicContact CG1-CE 3.93Å
248Q81.5Confident87.4Confident71 Ų7146.7 Ų46.733%0.33224%0.235SC..  trans-7891.7179.2-73.6-177.7-28.800109.3A243 R246 S250 D251 M252A243-Q248 PolarHBondContact O-N 2.75Å; R246-Q248 HydrophobicContact CB-CG 3.9Å; R246-Q248 PolarHBondContact O-N 3.25Å; Q248-S250 VanDerWaalsContact C-N 3.3Å; Q248-S250 PolarHBondContact O-N 3.05Å; Q248-D251 HydrophobicContact CB-CB 4.1Å; Q248-D251 PolarHBondContact O-N 3.19Å; Q248-D251 PolarHBondContact OE1-OD2 3.39Å; Q248-M252 WeakPolarHBondContact O-CG 3.3Å; Q248-M252 PolarHBondContact O-N 2.94Å
249Q84.2Confident87.4Confident109 Ų10944.3 Ų44.351%0.50923%0.226SC..Hα-helixtrans-49.6-46.7-173.1-17463.322.700113.2V247 D251 M252 E253V247-Q249 PolarHBondContact O-N 2.93Å; Q249-D251 VanDerWaalsContact C-N 3.3Å; Q249-D251 PolarHBondContact O-N 3.3Å; Q249-M252 PolarHBondContact O-N 3.41Å; Q249-E253 WeakPolarHBondContact CG-OE1 3.35Å; Q249-E253 PolarHBondContact NE2-OE1 2.96Å; Q249-E253 WeakPolarHBondContact O-CB 3.33Å; Q249-E253 VanDerWaalsContact O-CG 3.29Å; Q249-E253 WeakPolarHBondContact O-CG 3.38Å; Q249-E253 PolarHBondContact O-N 3.34Å
250S86.6Confident87.8Confident72 Ų7243.1 Ų43.150%0.50322%0.216SC..Hα-helixtrans-61.1-37.5179.656.10000113.4Q248 R254Q248-S250 VanDerWaalsContact C-N 3.3Å; Q248-S250 PolarHBondContact O-N 3.05Å; S250-R254 WeakPolarHBondContact O-CG 3.48Å; S250-R254 PolarHBondContact O-N 3.45Å
251D86.1Confident88.1Confident28 Ų2845.4 Ų45.415%0.1523%0.23CC..Hα-helixtrans-78.6-37.7-177.6-73.77.9000110.9A243 Q248 Q249 R254 Y255 R382A243-D251 HydrophobicContact CB-CB 3.6Å; Q248-D251 HydrophobicContact CB-CB 4.1Å; Q248-D251 PolarHBondContact O-N 3.19Å; Q248-D251 PolarHBondContact OE1-OD2 3.39Å; Q249-D251 VanDerWaalsContact C-N 3.3Å; Q249-D251 PolarHBondContact O-N 3.3Å; D251-R254 PolarHBondContact O-N 2.92Å; D251-Y255 WeakPolarHBondContact O-CD2 3.38Å; D251-Y255 PolarHBondContact O-N 3.05Å; D251-R382 IonicContact OD2-NH2 3.95Å
252M88.8Confident88.2Confident13 Ų1345.6 Ų45.66%0.06423%0.23CC..Hα-helixtrans-62.2-45.6172.7-65.4-169.3-6700111F244 V247 Q248 Q249 R254 Y255 F256F244-M252 HydrophobicContact CD1-CG 3.74Å; F244-M252 HydrophobicContact CD1-SD 3.73Å; F244-M252 HydrophobicContact CE1-CB 4.29Å; F244-M252 HydrophobicContact CE1-CG 3.96Å; F244-M252 HydrophobicContact CE1-SD 4.32Å; F244-M252 HydrophobicContact CG-CG 4.4Å; V247-M252 HydrophobicContact CG1-CE 3.93Å; Q248-M252 WeakPolarHBondContact O-CG 3.3Å; Q248-M252 PolarHBondContact O-N 2.94Å; Q249-M252 PolarHBondContact O-N 3.41Å; M252-R254 VanDerWaalsContact C-N 3.29Å; M252-R254 PolarHBondContact O-N 3.41Å; M252-Y255 WeakPolarHBondContact O-CB 3.29Å; M252-Y255 PolarHBondContact O-N 2.8Å; M252-F256 VanDerWaalsContact C-CD2 3.49Å; M252-F256 HydrophobicContact CB-CD2 4.34Å; M252-F256 HydrophobicContact CB-CE2 3.66Å; M252-F256 HydrophobicContact CB-CZ 4.22Å; M252-F256 WeakPolarHBondContact O-CD2 3.08Å; M252-F256 WeakPolarHBondContact O-CG 3.44Å; M252-F256 PolarHBondContact O-N 3.49Å
253E90.3Very high88.5Confident97 Ų9744.6 Ų44.645%0.45323%0.225SC..Hα-helixtrans-57.1-39.9176.3-77.5172.6-172.300112.7Q249 Y255 F256 L257Q249-E253 WeakPolarHBondContact CG-OE1 3.35Å; Q249-E253 PolarHBondContact NE2-OE1 2.96Å; Q249-E253 WeakPolarHBondContact O-CB 3.33Å; Q249-E253 VanDerWaalsContact O-CG 3.29Å; Q249-E253 WeakPolarHBondContact O-CG 3.38Å; Q249-E253 PolarHBondContact O-N 3.34Å; E253-Y255 VanDerWaalsContact C-N 3.33Å; E253-Y255 PolarHBondContact O-N 2.87Å; E253-F256 PolarHBondContact O-N 3.39Å; E253-L257 WeakPolarHBondContact O-CB 3.48Å; E253-L257 PolarHBondContact O-N 3.27Å
254R88.8Confident88.9Confident74 Ų7450.6 Ų50.628%0.27925%0.251SS..Hα-helixtrans-59.8-43.8174.1-72.2173.2179.5-153.41111.5S250 D251 M252 A258 L378 D381S250-R254 WeakPolarHBondContact O-CG 3.48Å; S250-R254 PolarHBondContact O-N 3.45Å; D251-R254 PolarHBondContact O-N 2.92Å; M252-R254 VanDerWaalsContact C-N 3.29Å; M252-R254 PolarHBondContact O-N 3.41Å; R254-A258 VanDerWaalsContact O-CB 3.29Å; R254-A258 WeakPolarHBondContact O-CB 3.49Å; R254-A258 PolarHBondContact O-N 2.73Å; R254-L378 HydrophobicContact CB-CD2 3.99Å; R254-D381 PolarHBondContact NH1-O 3.39Å
255Y89.7Confident89.2Confident6 Ų654.3 Ų54.32%0.02427%0.271CS..Hα-helixtrans-67.3-40.5176.6-73.2-61.6000112.8T240 A243 F244 D251 M252 E253 A258 Y259 F318 L378 R382T240-Y255 WeakPolarHBondContact CA-OH 3.36Å; T240-Y255 WeakPolarHBondContact CB-OH 3.33Å; T240-Y255 HydrophobicContact CG2-CE1 4.04Å; T240-Y255 HydrophobicContact CG2-CE2 4.07Å; T240-Y255 PolarHBondContact N-OH 3.05Å; T240-Y255 PolarHBondContact OG1-OH 3.37Å; A243-Y255 HydrophobicContact CB-CD2 4.48Å; A243-Y255 HydrophobicContact CB-CE2 3.97Å; F244-Y255 AromaticContact CE2-CD2 3.99Å; F244-Y255 HydrophobicContact CE2-CD2 3.99Å; F244-Y255 HydrophobicContact CE2-CE2 4.4Å; F244-Y255 HydrophobicContact CE2-CG 4.47Å; F244-Y255 HydrophobicContact CZ-CD2 4.08Å; F244-Y255 HydrophobicContact CZ-CG 4.35Å; D251-Y255 WeakPolarHBondContact O-CD2 3.38Å; D251-Y255 PolarHBondContact O-N 3.05Å; M252-Y255 WeakPolarHBondContact O-CB 3.29Å; M252-Y255 PolarHBondContact O-N 2.8Å; E253-Y255 VanDerWaalsContact C-N 3.33Å; E253-Y255 PolarHBondContact O-N 2.87Å; Y255-A258 PolarHBondContact O-N 3.22Å; Y255-Y259 VanDerWaalsContact O-CB 3.28Å; Y255-Y259 WeakPolarHBondContact O-CB 3.37Å; Y255-Y259 PolarHBondContact O-N 3.05Å; Y255-F318 AromaticContact CD1-CZ 3.83Å; Y255-F318 HydrophobicContact CD1-CZ 3.83Å; Y255-F318 HydrophobicContact CG-CZ 4.44Å; Y255-L378 HydrophobicContact CD1-CD1 4.18Å; Y255-L378 HydrophobicContact CE1-CD1 4.38Å; Y255-R382 PolarHBondContact OH-NH2 2.82Å
256F92.7Very high89.7Confident6 Ų654 Ų543%0.02627%0.27CS..Hα-helixtrans-63.8-44.8176.4-61.3-49.1000112F244 M252 E253 A258 Y259 D260 P281 E282 L285 I286F244-F256 HydrophobicContact CE1-CE1 4.15Å; F244-F256 AromaticContact CE1-CZ 3.88Å; F244-F256 HydrophobicContact CE1-CZ 3.88Å; M252-F256 VanDerWaalsContact C-CD2 3.49Å; M252-F256 HydrophobicContact CB-CD2 4.34Å; M252-F256 HydrophobicContact CB-CE2 3.66Å; M252-F256 HydrophobicContact CB-CZ 4.22Å; M252-F256 WeakPolarHBondContact O-CD2 3.08Å; M252-F256 WeakPolarHBondContact O-CG 3.44Å; M252-F256 PolarHBondContact O-N 3.49Å; E253-F256 PolarHBondContact O-N 3.39Å; F256-A258 VanDerWaalsContact C-N 3.33Å; F256-A258 PolarHBondContact O-N 3.45Å; F256-Y259 PolarHBondContact O-N 3.14Å; F256-D260 WeakPolarHBondContact O-CB 3.17Å; F256-D260 PolarHBondContact O-N 3.38Å; F256-P281 HydrophobicContact CD1-CB 4.34Å; F256-E282 HydrophobicContact CD1-CG 4.17Å; F256-E282 HydrophobicContact CD2-CG 3.45Å; F256-E282 VanDerWaalsContact CD2-CG 3.45Å; F256-E282 HydrophobicContact CE1-CG 4.25Å; F256-E282 HydrophobicContact CE2-CB 4.46Å; F256-E282 HydrophobicContact CE2-CG 3.53Å; F256-E282 HydrophobicContact CG-CG 3.82Å; F256-E282 HydrophobicContact CZ-CB 4.49Å; F256-E282 HydrophobicContact CZ-CG 3.97Å; F256-L285 HydrophobicContact CD1-CD2 4.04Å; F256-L285 HydrophobicContact CE1-CB 4.4Å; F256-L285 HydrophobicContact CE1-CD2 4.36Å; F256-I286 HydrophobicContact CE1-CG1 3.85Å; F256-I286 HydrophobicContact CE2-CG1 4.48Å; F256-I286 HydrophobicContact CZ-CD1 3.87Å; F256-I286 HydrophobicContact CZ-CG1 3.4Å; F256-I286 VanDerWaalsContact CZ-CG1 3.4Å
257L91.6Very high90.2Very high118 Ų11849 Ų4962%0.61825%0.251SS*.Hα-helixtrans-62.9-41.4177.6179.461.8000111.9E253 D260 T261E253-L257 WeakPolarHBondContact O-CB 3.48Å; E253-L257 PolarHBondContact O-N 3.27Å; L257-D260 PolarHBondContact O-N 3.07Å; L257-T261 PolarHBondContact O-N 3.15Å; L257-T261 PolarHBondContact O-OG1 2.86Å
258A89.9Confident91Very high6 Ų647.3 Ų47.35%0.0524%0.242CC..Hα-helixtrans-64.9-44.6176.700000112.2R254 Y255 F256 T261 Y262 F318 L374 L378R254-A258 VanDerWaalsContact O-CB 3.29Å; R254-A258 WeakPolarHBondContact O-CB 3.49Å; R254-A258 PolarHBondContact O-N 2.73Å; Y255-A258 PolarHBondContact O-N 3.22Å; F256-A258 VanDerWaalsContact C-N 3.33Å; F256-A258 PolarHBondContact O-N 3.45Å; A258-T261 PolarHBondContact O-N 3.46Å; A258-Y262 WeakPolarHBondContact O-CB 3.49Å; A258-Y262 PolarHBondContact O-N 3.47Å; A258-F318 HydrophobicContact CB-CE2 4.43Å; A258-L374 HydrophobicContact CB-CD2 3.37Å; A258-L378 HydrophobicContact CB-CD1 3.49Å; A258-L378 VanDerWaalsContact CB-CD1 3.49Å; A258-L378 HydrophobicContact CB-CD2 3.94Å; A258-L378 HydrophobicContact CB-CG 3.99Å
259Y92.6Very high91.8Very high0 Ų049.5 Ų49.50%026%0.256CS..Hα-helixtrans-62.1-42.7174.2174.1-90000111.8Y255 F256 T261 Y262 F263 P281 Y284 L285 F318 A321 L322 L325Y255-Y259 VanDerWaalsContact O-CB 3.28Å; Y255-Y259 WeakPolarHBondContact O-CB 3.37Å; Y255-Y259 PolarHBondContact O-N 3.05Å; F256-Y259 PolarHBondContact O-N 3.14Å; Y259-T261 VanDerWaalsContact C-N 3.35Å; Y259-T261 PolarHBondContact O-N 3.46Å; Y259-Y262 CarbonylContact O-C 3.54Å; Y259-Y262 WeakPolarHBondContact O-CA 3.21Å; Y259-Y262 WeakPolarHBondContact O-CB 3.29Å; Y259-Y262 PolarHBondContact O-N 2.74Å; Y259-Y262 VanDerWaalsContact O-N 3.13Å; Y259-F263 HydrophobicContact CE1-CB 4.21Å; Y259-F263 HydrophobicContact CE1-CD1 4.42Å; Y259-F263 WeakPolarHBondContact O-CB 3.5Å; Y259-F263 PolarHBondContact O-N 2.8Å; Y259-P281 HydrophobicContact CD1-CB 3.81Å; Y259-P281 HydrophobicContact CD1-CG 3.96Å; Y259-P281 HydrophobicContact CE1-CB 4.06Å; Y259-P281 HydrophobicContact CE1-CG 4.24Å; Y259-Y284 HydrophobicContact CE1-CE2 4.41Å; Y259-Y284 VanDerWaalsContact CE1-OH 3.27Å; Y259-Y284 WeakPolarHBondContact CE1-OH 2.99Å; Y259-Y284 PolarHBondContact OH-OH 3.27Å; Y259-L285 HydrophobicContact CD1-CD2 3.5Å; Y259-L285 HydrophobicContact CD2-CD1 4.25Å; Y259-L285 HydrophobicContact CD2-CD2 3.74Å; Y259-L285 HydrophobicContact CE1-CD2 3.97Å; Y259-L285 HydrophobicContact CE2-CD1 4.02Å; Y259-L285 HydrophobicContact CE2-CD2 4.18Å; Y259-L285 HydrophobicContact CG-CD2 3.35Å; Y259-F318 HydrophobicContact CD2-CB 4.09Å; Y259-F318 HydrophobicContact CD2-CD1 4.09Å; Y259-F318 HydrophobicContact CD2-CD2 4.48Å; Y259-F318 AromaticContact CD2-CG 3.98Å; Y259-F318 HydrophobicContact CD2-CG 3.98Å; Y259-A321 HydrophobicContact CE2-CB 3.64Å; Y259-L322 HydrophobicContact CE2-CD2 4Å; Y259-L322 HydrophobicContact CE2-CG 3.97Å; Y259-L325 VanDerWaalsContact OH-CD1 3.27Å; Y259-L325 WeakPolarHBondContact OH-CD1 3.27Å
260D94.7Very high92.4Very high47 Ų4744.3 Ų44.325%0.25123%0.231SC..Hα-helixtrans-63.2-41.6179.6-172.765.3000111.8F256 L257 Y262 F263 K264 H271 P281F256-D260 WeakPolarHBondContact O-CB 3.17Å; F256-D260 PolarHBondContact O-N 3.38Å; L257-D260 PolarHBondContact O-N 3.07Å; D260-Y262 VanDerWaalsContact C-N 3.29Å; D260-Y262 PolarHBondContact O-N 2.92Å; D260-F263 WeakPolarHBondContact O-CB 3.23Å; D260-F263 PolarHBondContact O-N 3.46Å; D260-K264 WeakPolarHBondContact O-CB 3.37Å; D260-K264 PolarHBondContact O-N 2.99Å; D260-H271 VanDerWaalsContact CG-NE2 3.35Å; D260-H271 IonicContact OD1-CD2 2.75Å; D260-H271 PolarHBondContact OD1-CD2 3.35Å; D260-H271 IonicContact OD1-NE2 3.61Å; D260-H271 PolarHBondContact OD1-NE2 3.41Å; D260-H271 IonicContact OD2-CE1 3.97Å; D260-H271 IonicContact OD2-NE2 3.08Å; D260-H271 PolarHBondContact OD2-NE2 2.72Å; D260-P281 HydrophobicContact CB-CG 4.24Å
261T92Very high93Very high54 Ų5441.5 Ų41.533%0.33121%0.21SC..Hα-helixtrans-60.3-43.4173.4-56.70000110.9L257 A258 Y259 L265 L374L257-T261 PolarHBondContact O-N 3.15Å; L257-T261 PolarHBondContact O-OG1 2.86Å; A258-T261 PolarHBondContact O-N 3.46Å; Y259-T261 VanDerWaalsContact C-N 3.35Å; Y259-T261 PolarHBondContact O-N 3.46Å; T261-L265 HydrophobicContact CG2-CD1 4.49Å; T261-L265 WeakPolarHBondContact O-CG 3.24Å; T261-L265 PolarHBondContact O-N 3.31Å; T261-L374 HydrophobicContact CG2-CD1 3.5Å; T261-L374 VanDerWaalsContact CG2-CD1 3.5Å
262Y91.2Very high93.6Very high10 Ų1043 Ų434%0.03922%0.224CC..Hα-helixtrans-64.6-44.7176.9-171.8-173.3000111.2A258 Y259 D260 K264 L265 S266 F318 D319 L322 V367A258-Y262 WeakPolarHBondContact O-CB 3.49Å; A258-Y262 PolarHBondContact O-N 3.47Å; Y259-Y262 CarbonylContact O-C 3.54Å; Y259-Y262 WeakPolarHBondContact O-CA 3.21Å; Y259-Y262 WeakPolarHBondContact O-CB 3.29Å; Y259-Y262 PolarHBondContact O-N 2.74Å; Y259-Y262 VanDerWaalsContact O-N 3.13Å; D260-Y262 VanDerWaalsContact C-N 3.29Å; D260-Y262 PolarHBondContact O-N 2.92Å; Y262-K264 PolarHBondContact O-N 3.23Å; Y262-L265 PolarHBondContact O-N 3.24Å; Y262-L265 VanDerWaalsContact O-N 3.12Å; Y262-S266 WeakPolarHBondContact CD2-OG 3.28Å; Y262-S266 WeakPolarHBondContact CE2-OG 3.42Å; Y262-S266 PolarHBondContact O-N 3.05Å; Y262-S266 PolarHBondContact O-OG 2.83Å; Y262-F318 HydrophobicContact CD1-CB 3.87Å; Y262-F318 HydrophobicContact CD1-CD2 4.37Å; Y262-F318 HydrophobicContact CE1-CB 3.95Å; Y262-D319 VanDerWaalsContact CE1-OD1 3.25Å; Y262-D319 WeakPolarHBondContact CE1-OD1 3.46Å; Y262-D319 VanDerWaalsContact CZ-OD1 3.28Å; Y262-D319 PolarHBondContact OH-OD1 2.82Å; Y262-L322 HydrophobicContact CD1-CD1 3.63Å; Y262-L322 HydrophobicContact CD2-CD1 3.46Å; Y262-L322 VanDerWaalsContact CD2-CD1 3.46Å; Y262-L322 HydrophobicContact CE1-CD1 3.65Å; Y262-L322 HydrophobicContact CE2-CD1 3.34Å; Y262-L322 HydrophobicContact CG-CD1 3.55Å; Y262-V367 HydrophobicContact CD2-CB 4.23Å; Y262-V367 HydrophobicContact CD2-CG1 4.09Å; Y262-V367 HydrophobicContact CD2-CG2 3.87Å; Y262-V367 HydrophobicContact CE2-CB 3.83Å; Y262-V367 HydrophobicContact CE2-CG1 3.88Å; Y262-V367 HydrophobicContact CE2-CG2 3.03Å; Y262-V367 WeakPolarHBondContact OH-CG2 3.48Å
263F95.2Very high94.1Very high2 Ų244.3 Ų44.31%0.00923%0.229CC..Hα-helixtrans-57.4-46.9177.4179.8-157.7000112Y259 D260 L265 S266 L267 L270 H271 F274 L322 L325Y259-F263 HydrophobicContact CE1-CB 4.21Å; Y259-F263 HydrophobicContact CE1-CD1 4.42Å; Y259-F263 WeakPolarHBondContact O-CB 3.5Å; Y259-F263 PolarHBondContact O-N 2.8Å; D260-F263 WeakPolarHBondContact O-CB 3.23Å; D260-F263 PolarHBondContact O-N 3.46Å; F263-L265 VanDerWaalsContact C-N 3.29Å; F263-L265 PolarHBondContact O-N 3.47Å; F263-S266 PolarHBondContact O-N 2.82Å; F263-L267 HydrophobicContact CD2-CB 3.99Å; F263-L267 HydrophobicContact CD2-CD1 4.29Å; F263-L267 HydrophobicContact CE2-CB 3.83Å; F263-L267 HydrophobicContact CE2-CD1 4.11Å; F263-L267 PolarHBondContact O-N 3.43Å; F263-L270 HydrophobicContact CE2-CB 4.08Å; F263-L270 HydrophobicContact CE2-CD2 4.02Å; F263-L270 HydrophobicContact CE2-CG 4.04Å; F263-L270 HydrophobicContact CZ-CB 4.26Å; F263-L270 HydrophobicContact CZ-CD2 4.19Å; F263-L270 HydrophobicContact CZ-CG 3.92Å; F263-H271 HydrophobicContact CD1-CB 4.29Å; F263-H271 AromaticContact CD1-CD2 3.53Å; F263-H271 HydrophobicContact CD2-CB 4.22Å; F263-H271 HydrophobicContact CE1-CB 4.19Å; F263-H271 AromaticContact CE1-CD2 3.98Å; F263-H271 HydrophobicContact CE2-CB 4.12Å; F263-H271 HydrophobicContact CG-CB 4.29Å; F263-H271 AromaticContact CG-CD2 3.88Å; F263-H271 HydrophobicContact CZ-CB 4.1Å; F263-F274 HydrophobicContact CE1-CB 4.15Å; F263-F274 AromaticContact CE1-CD2 3.55Å; F263-F274 HydrophobicContact CE1-CD2 3.55Å; F263-F274 HydrophobicContact CE1-CE2 4.14Å; F263-F274 AromaticContact CE1-CG 3.99Å; F263-F274 HydrophobicContact CE1-CG 3.99Å; F263-F274 HydrophobicContact CZ-CB 4.47Å; F263-F274 AromaticContact CZ-CD2 3.8Å; F263-F274 HydrophobicContact CZ-CD2 3.8Å; F263-F274 HydrophobicContact CZ-CE2 4.1Å; F263-F274 HydrophobicContact CZ-CG 4.04Å; F263-L322 HydrophobicContact CB-CD2 3.74Å; F263-L322 HydrophobicContact CD2-CD2 3.72Å; F263-L322 HydrophobicContact CG-CD2 3.98Å; F263-L325 HydrophobicContact CD2-CD1 4.07Å; F263-L325 HydrophobicContact CE1-CD1 4.27Å; F263-L325 HydrophobicContact CE2-CD1 3.76Å; F263-L325 HydrophobicContact CG-CD1 4.48Å; F263-L325 HydrophobicContact CZ-CD1 3.86Å
264K94.9Very high94.5Very high126 Ų12639.8 Ų39.855%0.54821%0.208SC..Hα-helixtrans-56.3-41.3175.3-174.7175-178.9174.70113.1D260 Y262 P268 H271D260-K264 WeakPolarHBondContact O-CB 3.37Å; D260-K264 PolarHBondContact O-N 2.99Å; Y262-K264 PolarHBondContact O-N 3.23Å; K264-P268 WeakPolarHBondContact O-CA 3.16Å; K264-P268 WeakPolarHBondContact O-CB 3.35Å; K264-H271 HydrophobicContact CB-CB 4.45Å
265L93Very high94.9Very high89 Ų8940.4 Ų40.447%0.46622%0.22SC..Hα-helixtrans-73.1-39-179.9-67.5171.9000112.2T261 Y262 F263 V367 E370T261-L265 HydrophobicContact CG2-CD1 4.49Å; T261-L265 WeakPolarHBondContact O-CG 3.24Å; T261-L265 PolarHBondContact O-N 3.31Å; Y262-L265 PolarHBondContact O-N 3.24Å; Y262-L265 VanDerWaalsContact O-N 3.12Å; F263-L265 VanDerWaalsContact C-N 3.29Å; F263-L265 PolarHBondContact O-N 3.47Å; L265-V367 HydrophobicContact CB-CG1 3.83Å; L265-E370 HydrophobicContact CD1-CB 4Å; L265-E370 HydrophobicContact CD1-CG 4.16Å
266S93.5Very high95.3Very high1 Ų146.6 Ų46.61%0.00725%0.253CS..Hα-helixtrans-81.2-38.7-175.2-67.50000114.6Y262 F263 R366 V367Y262-S266 WeakPolarHBondContact CD2-OG 3.28Å; Y262-S266 WeakPolarHBondContact CE2-OG 3.42Å; Y262-S266 PolarHBondContact O-N 3.05Å; Y262-S266 PolarHBondContact O-OG 2.83Å; F263-S266 PolarHBondContact O-N 2.82Å; S266-R366 PolarHBondContact O-NH1 3.03Å; S266-V367 WeakPolarHBondContact OG-CG1 3.5Å
267L96Very high95.6Very high0 Ų048.6 Ų48.60%026%0.264CS..  trans-137.361.8-171.5-58.6172.7000110F263 N269 L270 H271 L322 L325 C326 V363F263-L267 HydrophobicContact CD2-CB 3.99Å; F263-L267 HydrophobicContact CD2-CD1 4.29Å; F263-L267 HydrophobicContact CE2-CB 3.83Å; F263-L267 HydrophobicContact CE2-CD1 4.11Å; F263-L267 PolarHBondContact O-N 3.43Å; L267-N269 VanDerWaalsContact C-N 3.29Å; L267-N269 PolarHBondContact O-N 2.78Å; L267-L270 HydrophobicContact CB-CB 4.14Å; L267-L270 HydrophobicContact CD1-CD2 4.18Å; L267-L270 PolarHBondContact O-N 3.35Å; L267-L270 VanDerWaalsContact O-N 3.11Å; L267-H271 WeakPolarHBondContact O-CB 3.47Å; L267-H271 PolarHBondContact O-N 2.84Å; L267-L322 HydrophobicContact CD1-CD2 4.48Å; L267-L325 HydrophobicContact CD1-CB 3.81Å; L267-C326 HydrophobicContact CD1-CB 4.06Å; L267-C326 HydrophobicContact CD2-CB 3.91Å; L267-V363 HydrophobicContact CD2-CG1 4.43Å
268P96.7Very high95.9Very high65 Ų6548.1 Ų48.142%0.42226%0.262SS..Hα-helixtrans-59.1-35.3-169.221.7-34.1000114.2K264 S272K264-P268 WeakPolarHBondContact O-CA 3.16Å; K264-P268 WeakPolarHBondContact O-CB 3.35Å; P268-S272 WeakPolarHBondContact O-CB 3.45Å; P268-S272 PolarHBondContact O-N 2.71Å; P268-S272 PolarHBondContact O-OG 3.18Å
269N98.3Very high96.3Very high116 Ų11648.2 Ų48.262%0.6226%0.262SS*.Hα-helixtrans-67.9-45.9178.3-65.1-21.4000111.1L267 S272 H273L267-N269 VanDerWaalsContact C-N 3.29Å; L267-N269 PolarHBondContact O-N 2.78Å; N269-S272 PolarHBondContact O-N 3.15Å; N269-H273 PolarHBondContact O-N 3.14Å
270L98.6Very high96.5Very high0 Ų054.5 Ų54.50%029%0.286CS..Hα-helixtrans-69.1-39.1178.4-171.965000111.6F263 L267 H273 F274 L325 E329 L332 L333F263-L270 HydrophobicContact CE2-CB 4.08Å; F263-L270 HydrophobicContact CE2-CD2 4.02Å; F263-L270 HydrophobicContact CE2-CG 4.04Å; F263-L270 HydrophobicContact CZ-CB 4.26Å; F263-L270 HydrophobicContact CZ-CD2 4.19Å; F263-L270 HydrophobicContact CZ-CG 3.92Å; L267-L270 HydrophobicContact CB-CB 4.14Å; L267-L270 HydrophobicContact CD1-CD2 4.18Å; L267-L270 PolarHBondContact O-N 3.35Å; L267-L270 VanDerWaalsContact O-N 3.11Å; L270-H273 WeakPolarHBondContact O-CB 3.45Å; L270-H273 PolarHBondContact O-N 3.34Å; L270-F274 HydrophobicContact CD1-CD1 4.09Å; L270-F274 HydrophobicContact CD1-CE1 3.6Å; L270-F274 HydrophobicContact CD1-CZ 4.33Å; L270-F274 HydrophobicContact CG-CD1 4.26Å; L270-F274 HydrophobicContact CG-CE1 3.94Å; L270-F274 HydrophobicContact CG-CZ 4.37Å; L270-F274 WeakPolarHBondContact O-CD1 3.05Å; L270-F274 PolarHBondContact O-N 3.3Å; L270-L325 HydrophobicContact CD2-CB 3.93Å; L270-E329 HydrophobicContact CB-CG 4.36Å; L270-E329 HydrophobicContact CD2-CB 4.5Å; L270-E329 HydrophobicContact CD2-CG 4.36Å; L270-L332 HydrophobicContact CD1-CB 3.68Å; L270-L332 HydrophobicContact CD1-CD1 4.46Å; L270-L332 HydrophobicContact CD2-CD1 4.06Å; L270-L333 HydrophobicContact CD1-CD2 4Å; L270-L333 HydrophobicContact CD1-CG 4.01Å
271H98.6Very high96.6Very high13 Ų1352.8 Ų52.86%0.0628%0.277CS..Hα-helixtrans-58.5-49.2173.1178.9-90.6000111.2D260 F263 K264 L267 H273 F274 V275D260-H271 VanDerWaalsContact CG-NE2 3.35Å; D260-H271 IonicContact OD1-CD2 2.75Å; D260-H271 PolarHBondContact OD1-CD2 3.35Å; D260-H271 IonicContact OD1-NE2 3.61Å; D260-H271 PolarHBondContact OD1-NE2 3.41Å; D260-H271 IonicContact OD2-CE1 3.97Å; D260-H271 IonicContact OD2-NE2 3.08Å; D260-H271 PolarHBondContact OD2-NE2 2.72Å; F263-H271 HydrophobicContact CD1-CB 4.29Å; F263-H271 AromaticContact CD1-CD2 3.53Å; F263-H271 HydrophobicContact CD2-CB 4.22Å; F263-H271 HydrophobicContact CE1-CB 4.19Å; F263-H271 AromaticContact CE1-CD2 3.98Å; F263-H271 HydrophobicContact CE2-CB 4.12Å; F263-H271 HydrophobicContact CG-CB 4.29Å; F263-H271 AromaticContact CG-CD2 3.88Å; F263-H271 HydrophobicContact CZ-CB 4.1Å; K264-H271 HydrophobicContact CB-CB 4.45Å; L267-H271 WeakPolarHBondContact O-CB 3.47Å; L267-H271 PolarHBondContact O-N 2.84Å; H271-H273 VanDerWaalsContact C-N 3.27Å; H271-H273 PolarHBondContact O-N 3.41Å; H271-F274 PolarHBondContact O-N 2.92Å; H271-F274 VanDerWaalsContact O-N 3.09Å; H271-V275 VanDerWaalsContact CE1-CG2 3.47Å; H271-V275 WeakPolarHBondContact CE1-CG2 3.41Å; H271-V275 WeakPolarHBondContact O-CG2 3.23Å; H271-V275 PolarHBondContact O-N 3.02Å
272S98.6Very high96.7Very high61 Ų6152.7 Ų52.743%0.42727%0.273SS..Hα-helixtrans-59.9-38.8177.4-58.50000112P268 N269 N276P268-S272 WeakPolarHBondContact O-CB 3.45Å; P268-S272 PolarHBondContact O-N 2.71Å; P268-S272 PolarHBondContact O-OG 3.18Å; N269-S272 PolarHBondContact O-N 3.15Å; S272-N276 WeakPolarHBondContact O-CB 3.43Å; S272-N276 PolarHBondContact O-N 3.47Å; S272-N276 PolarHBondContact O-ND2 3.31Å
273H98.7Very high96.9Very high40 Ų4055.1 Ų55.119%0.18529%0.286CS..Hα-helixtrans-62.1-45.4174-174.464.5000112N269 L270 H271 N276 L277 L332 L333 M335N269-H273 PolarHBondContact O-N 3.14Å; L270-H273 WeakPolarHBondContact O-CB 3.45Å; L270-H273 PolarHBondContact O-N 3.34Å; H271-H273 VanDerWaalsContact C-N 3.27Å; H271-H273 PolarHBondContact O-N 3.41Å; H273-N276 PolarHBondContact O-N 3.44Å; H273-L277 VanDerWaalsContact NE2-CD1 3.27Å; H273-L277 WeakPolarHBondContact NE2-CD1 3.48Å; H273-L277 WeakPolarHBondContact O-CG 3.29Å; H273-L277 PolarHBondContact O-N 2.94Å; H273-L332 PolarHBondContact NE2-O 2.92Å; H273-L333 HydrophobicContact CB-CD2 3.85Å; H273-M335 PolarHBondContact NE2-O 2.93Å
274F98.6Very high96.9Very high2 Ų255.2 Ų55.21%0.00929%0.287CS..Hα-helixtrans-65.1-41.8178.8-81.929.1000111.7F263 L270 H271 N276 L277 D278 V279 Y284 L325 L332 V340 L344F263-F274 HydrophobicContact CE1-CB 4.15Å; F263-F274 AromaticContact CE1-CD2 3.55Å; F263-F274 HydrophobicContact CE1-CD2 3.55Å; F263-F274 HydrophobicContact CE1-CE2 4.14Å; F263-F274 AromaticContact CE1-CG 3.99Å; F263-F274 HydrophobicContact CE1-CG 3.99Å; F263-F274 HydrophobicContact CZ-CB 4.47Å; F263-F274 AromaticContact CZ-CD2 3.8Å; F263-F274 HydrophobicContact CZ-CD2 3.8Å; F263-F274 HydrophobicContact CZ-CE2 4.1Å; F263-F274 HydrophobicContact CZ-CG 4.04Å; L270-F274 HydrophobicContact CD1-CD1 4.09Å; L270-F274 HydrophobicContact CD1-CE1 3.6Å; L270-F274 HydrophobicContact CD1-CZ 4.33Å; L270-F274 HydrophobicContact CG-CD1 4.26Å; L270-F274 HydrophobicContact CG-CE1 3.94Å; L270-F274 HydrophobicContact CG-CZ 4.37Å; L270-F274 WeakPolarHBondContact O-CD1 3.05Å; L270-F274 PolarHBondContact O-N 3.3Å; H271-F274 PolarHBondContact O-N 2.92Å; H271-F274 VanDerWaalsContact O-N 3.09Å; F274-N276 PolarHBondContact O-N 3.3Å; F274-L277 CarbonylContact O-C 3.55Å; F274-L277 PolarHBondContact O-N 3.26Å; F274-D278 PolarHBondContact O-N 2.78Å; F274-V279 HydrophobicContact CB-CB 4.09Å; F274-V279 HydrophobicContact CD2-CB 4.04Å; F274-V279 HydrophobicContact CD2-CG1 3.71Å; F274-V279 HydrophobicContact CE2-CG1 4Å; F274-V279 HydrophobicContact CG-CB 4.03Å; F274-V279 HydrophobicContact CG-CG1 4.2Å; F274-V279 PolarHBondContact O-N 3.22Å; F274-Y284 HydrophobicContact CD2-CE1 4.45Å; F274-Y284 HydrophobicContact CE2-CE1 4.11Å; F274-L325 HydrophobicContact CE2-CD2 4.35Å; F274-L325 HydrophobicContact CZ-CD2 4.33Å; F274-L332 HydrophobicContact CE1-CB 4.38Å; F274-L332 HydrophobicContact CZ-CD1 4.33Å; F274-V340 HydrophobicContact CE1-CG1 3.83Å; F274-V340 HydrophobicContact CE1-CG2 4.29Å; F274-V340 HydrophobicContact CE2-CG1 4.12Å; F274-V340 HydrophobicContact CZ-CG1 3.59Å; F274-L344 HydrophobicContact CE2-CD1 3.81Å; F274-L344 HydrophobicContact CZ-CD1 3.87Å
275V98.3Very high97Very high87 Ų8749.2 Ų49.253%0.52726%0.26SS..Hα-helixtrans-60-44.9174.2171.30000111.2H271 L277 D278H271-V275 VanDerWaalsContact CE1-CG2 3.47Å; H271-V275 WeakPolarHBondContact CE1-CG2 3.41Å; H271-V275 WeakPolarHBondContact O-CG2 3.23Å; H271-V275 PolarHBondContact O-N 3.02Å; V275-L277 PolarHBondContact O-N 2.91Å; V275-D278 PolarHBondContact O-N 2.98Å; V275-D278 VanDerWaalsContact O-N 3.16Å
276N98.5Very high96.9Very high136 Ų13647.8 Ų47.873%0.72725%0.253SS*.Hα-helixtrans-64.4-28.5178.3-70.6-23.6000113S272 H273 F274S272-N276 WeakPolarHBondContact O-CB 3.43Å; S272-N276 PolarHBondContact O-N 3.47Å; S272-N276 PolarHBondContact O-ND2 3.31Å; H273-N276 PolarHBondContact O-N 3.44Å; F274-N276 PolarHBondContact O-N 3.3Å
277L98.3Very high96.8Very high47 Ų4749.6 Ų49.625%0.24626%0.262CS..Hα-helixtrans-90.9-4.4177-68.1-179.8000113.9H273 F274 V275 V279 M335 F337 V340H273-L277 VanDerWaalsContact NE2-CD1 3.27Å; H273-L277 WeakPolarHBondContact NE2-CD1 3.48Å; H273-L277 WeakPolarHBondContact O-CG 3.29Å; H273-L277 PolarHBondContact O-N 2.94Å; F274-L277 CarbonylContact O-C 3.55Å; F274-L277 PolarHBondContact O-N 3.26Å; V275-L277 PolarHBondContact O-N 2.91Å; L277-V279 HydrophobicContact CB-CG2 3.9Å; L277-V279 PolarHBondContact O-N 3.03Å; L277-M335 WeakPolarHBondContact CD1-O 3.08Å; L277-F337 VanDerWaalsContact O-CD2 3.25Å; L277-F337 WeakPolarHBondContact O-CD2 3.1Å; L277-V340 HydrophobicContact CD1-CG2 4.35Å
278D97.9Very high96.9Very high108 Ų10849.6 Ų49.658%0.57826%0.262SS*.THydrogen-bonded Turntrans58.232.4-170.1-163.737.7000114F274 V275 R280F274-D278 PolarHBondContact O-N 2.78Å; V275-D278 PolarHBondContact O-N 2.98Å; V275-D278 VanDerWaalsContact O-N 3.16Å; D278-R280 PolarHBondContact O-N 3.34Å
279V98.4Very high96.7Very high8 Ų846.6 Ų46.65%0.04824%0.243CC..  trans-82.8101.3172.1179.80000109.1F274 L277 Y284 F337 V340F274-V279 HydrophobicContact CB-CB 4.09Å; F274-V279 HydrophobicContact CD2-CB 4.04Å; F274-V279 HydrophobicContact CD2-CG1 3.71Å; F274-V279 HydrophobicContact CE2-CG1 4Å; F274-V279 HydrophobicContact CG-CB 4.03Å; F274-V279 HydrophobicContact CG-CG1 4.2Å; F274-V279 PolarHBondContact O-N 3.22Å; L277-V279 HydrophobicContact CB-CG2 3.9Å; L277-V279 PolarHBondContact O-N 3.03Å; V279-Y284 HydrophobicContact CG1-CE1 4.46Å; V279-F337 HydrophobicContact CG2-CD2 3.62Å; V279-F337 HydrophobicContact CG2-CE2 4.23Å; V279-F337 HydrophobicContact CG2-CG 4.46Å; V279-V340 HydrophobicContact CB-CG1 4.43Å; V279-V340 HydrophobicContact CG1-CG1 3.78Å; V279-V340 HydrophobicContact CG2-CB 4.17Å; V279-V340 HydrophobicContact CG2-CG1 4Å
280R96.6Very high96.4Very high132 Ų13242.3 Ų42.350%0.49822%0.218SC..  trans-88.9147180-52.5-178.7-74.5147.7-2112.1D278 E282 L283D278-R280 PolarHBondContact O-N 3.34Å; R280-E282 WeakPolarHBondContact CB-OE2 3.39Å; R280-E282 PolarHBondContact O-N 3Å; R280-E282 VanDerWaalsContact O-N 3.14Å; R280-L283 WeakPolarHBondContact O-CB 3.3Å; R280-L283 PolarHBondContact O-N 3.07Å; R280-L283 VanDerWaalsContact O-N 3.13Å
281P96.2Very high96.3Very high11 Ų1142.3 Ų42.37%0.07122%0.218CC..THydrogen-bonded Turntrans-52.3-35.3-179-28.936.3000114.7F256 Y259 D260 L283 Y284 L285F256-P281 HydrophobicContact CD1-CB 4.34Å; Y259-P281 HydrophobicContact CD1-CB 3.81Å; Y259-P281 HydrophobicContact CD1-CG 3.96Å; Y259-P281 HydrophobicContact CE1-CB 4.06Å; Y259-P281 HydrophobicContact CE1-CG 4.24Å; D260-P281 HydrophobicContact CB-CG 4.24Å; P281-L283 PolarHBondContact O-N 3.3Å; P281-L283 VanDerWaalsContact O-N 3.08Å; P281-Y284 PolarHBondContact O-N 3.23Å; P281-Y284 VanDerWaalsContact O-N 3.16Å; P281-L285 HydrophobicContact CB-CB 4.39Å; P281-L285 HydrophobicContact CB-CD2 4.21Å; P281-L285 WeakPolarHBondContact O-CB 3.22Å; P281-L285 PolarHBondContact O-N 3.16Å
282E94Very high96.2Very high53 Ų5341.8 Ų41.825%0.24822%0.216CC..Hα-helixtrans-52.5-32.7-179.9-6584.5167.500112.8F256 R280 Y284 I286F256-E282 HydrophobicContact CD1-CG 4.17Å; F256-E282 HydrophobicContact CD2-CG 3.45Å; F256-E282 VanDerWaalsContact CD2-CG 3.45Å; F256-E282 HydrophobicContact CE1-CG 4.25Å; F256-E282 HydrophobicContact CE2-CB 4.46Å; F256-E282 HydrophobicContact CE2-CG 3.53Å; F256-E282 HydrophobicContact CG-CG 3.82Å; F256-E282 HydrophobicContact CZ-CB 4.49Å; F256-E282 HydrophobicContact CZ-CG 3.97Å; R280-E282 WeakPolarHBondContact CB-OE2 3.39Å; R280-E282 PolarHBondContact O-N 3Å; R280-E282 VanDerWaalsContact O-N 3.14Å; E282-Y284 PolarHBondContact O-N 3.09Å; E282-I286 HydrophobicContact CB-CD1 4.38Å; E282-I286 WeakPolarHBondContact O-CD1 3.33Å
283L95.8Very high96.2Very high60 Ų6038.9 Ų38.931%0.31420%0.196SC..Hα-helixtrans-68.3-20.5-175-62.4175.8000113.7R280 P281 F337 V341 T345R280-L283 WeakPolarHBondContact O-CB 3.3Å; R280-L283 PolarHBondContact O-N 3.07Å; R280-L283 VanDerWaalsContact O-N 3.13Å; P281-L283 PolarHBondContact O-N 3.3Å; P281-L283 VanDerWaalsContact O-N 3.08Å; L283-F337 HydrophobicContact CD1-CE2 3.84Å; L283-F337 HydrophobicContact CD1-CZ 4.05Å; L283-V341 HydrophobicContact CD1-CG2 3.88Å; L283-T345 WeakPolarHBondContact O-CG2 3.27Å
284Y96.3Very high96.2Very high4 Ų437 Ų372%0.01619%0.187CC..Hα-helixtrans-134.9-30-178.164.1-93.2000113.5Y259 F274 V279 P281 E282 W288 L344Y259-Y284 HydrophobicContact CE1-CE2 4.41Å; Y259-Y284 VanDerWaalsContact CE1-OH 3.27Å; Y259-Y284 WeakPolarHBondContact CE1-OH 2.99Å; Y259-Y284 PolarHBondContact OH-OH 3.27Å; F274-Y284 HydrophobicContact CD2-CE1 4.45Å; F274-Y284 HydrophobicContact CE2-CE1 4.11Å; V279-Y284 HydrophobicContact CG1-CE1 4.46Å; P281-Y284 PolarHBondContact O-N 3.23Å; P281-Y284 VanDerWaalsContact O-N 3.16Å; E282-Y284 PolarHBondContact O-N 3.09Å; Y284-W288 HydrophobicContact CD2-CD2 4.15Å; Y284-W288 AromaticContact CD2-CE3 3.79Å; Y284-W288 HydrophobicContact CD2-CE3 3.79Å; Y284-W288 AromaticContact CD2-CH2 3.5Å; Y284-W288 HydrophobicContact CD2-CH2 3.5Å; Y284-W288 AromaticContact CD2-CZ2 3.85Å; Y284-W288 HydrophobicContact CD2-CZ2 3.85Å; Y284-W288 AromaticContact CD2-CZ3 3.47Å; Y284-W288 HydrophobicContact CD2-CZ3 3.47Å; Y284-W288 VanDerWaalsContact CD2-CZ3 3.47Å; Y284-W288 HydrophobicContact CE2-CE3 4.13Å; Y284-W288 AromaticContact CE2-CH2 3.91Å; Y284-W288 HydrophobicContact CE2-CH2 3.91Å; Y284-W288 AromaticContact CE2-CZ3 3.59Å; Y284-W288 HydrophobicContact CE2-CZ3 3.59Å; Y284-W288 HydrophobicContact CG-CH2 4.44Å; Y284-L344 HydrophobicContact CD1-CD1 3.66Å; Y284-L344 HydrophobicContact CD2-CD1 4.28Å; Y284-L344 HydrophobicContact CE1-CD1 3.97Å; Y284-L344 HydrophobicContact CG-CB 4.09Å; Y284-L344 HydrophobicContact CG-CD1 3.81Å
285L95.2Very high96Very high0 Ų041.8 Ų41.80%021%0.205CC..Hα-helixtrans-74.9-29.7-170.2-171.263.5000112.5F256 Y259 P281 W288 L289 A321F256-L285 HydrophobicContact CD1-CD2 4.04Å; F256-L285 HydrophobicContact CE1-CB 4.4Å; F256-L285 HydrophobicContact CE1-CD2 4.36Å; Y259-L285 HydrophobicContact CD1-CD2 3.5Å; Y259-L285 HydrophobicContact CD2-CD1 4.25Å; Y259-L285 HydrophobicContact CD2-CD2 3.74Å; Y259-L285 HydrophobicContact CE1-CD2 3.97Å; Y259-L285 HydrophobicContact CE2-CD1 4.02Å; Y259-L285 HydrophobicContact CE2-CD2 4.18Å; Y259-L285 HydrophobicContact CG-CD2 3.35Å; P281-L285 HydrophobicContact CB-CB 4.39Å; P281-L285 HydrophobicContact CB-CD2 4.21Å; P281-L285 WeakPolarHBondContact O-CB 3.22Å; P281-L285 PolarHBondContact O-N 3.16Å; L285-W288 HydrophobicContact CD1-CE3 4.1Å; L285-W288 PolarHBondContact O-N 2.93Å; L285-L289 HydrophobicContact CD1-CD1 4.07Å; L285-L289 HydrophobicContact CD1-CD2 4.06Å; L285-L289 HydrophobicContact CD1-CG 3.82Å; L285-L289 HydrophobicContact CD2-CD1 3.86Å; L285-L289 HydrophobicContact CG-CD1 3.6Å; L285-L289 HydrophobicContact CG-CD2 4.5Å; L285-L289 HydrophobicContact CG-CG 3.78Å; L285-L289 WeakPolarHBondContact O-CG 3.34Å; L285-L289 PolarHBondContact O-N 3.13Å; L285-A321 HydrophobicContact CD1-CB 3.7Å
286I92.6Very high95.9Very high60 Ų6038.8 Ų38.831%0.30819%0.188SC..Hα-helixtrans-52.7-61.3178.1-71.4172.4000109.4F256 E282 W288 L289 Y290F256-I286 HydrophobicContact CE1-CG1 3.85Å; F256-I286 HydrophobicContact CE2-CG1 4.48Å; F256-I286 HydrophobicContact CZ-CD1 3.87Å; F256-I286 HydrophobicContact CZ-CG1 3.4Å; F256-I286 VanDerWaalsContact CZ-CG1 3.4Å; E282-I286 HydrophobicContact CB-CD1 4.38Å; E282-I286 WeakPolarHBondContact O-CD1 3.33Å; I286-W288 PolarHBondContact O-N 3.09Å; I286-W288 VanDerWaalsContact O-N 3.11Å; I286-L289 PolarHBondContact O-N 3.08Å; I286-L289 VanDerWaalsContact O-N 3.12Å; I286-Y290 HydrophobicContact CG2-CD1 3.71Å; I286-Y290 HydrophobicContact CG2-CE1 4.04Å; I286-Y290 WeakPolarHBondContact O-CD1 3.28Å; I286-Y290 PolarHBondContact O-N 3.14Å; I286-Y290 VanDerWaalsContact O-N 3.07Å
287D91.5Very high95.9Very high38 Ų3832.7 Ų32.720%0.20316%0.155CC..Hα-helixtrans-56.1-32.7-178.3-84.4-34.8000112.8Y290 T291 R295D287-Y290 WeakPolarHBondContact OD1-CE1 3.33Å; D287-T291 WeakPolarHBondContact O-CB 3.35Å; D287-T291 PolarHBondContact O-OG1 3.04Å; D287-R295 IonicContact OD1-CZ 3.12Å; D287-R295 IonicContact OD1-NH1 2.63Å; D287-R295 PolarHBondContact OD1-NH1 3.43Å; D287-R295 IonicContact OD2-NH1 3.4Å
288W96.8Very high95.8Very high1 Ų132.5 Ų32.50%0.00416%0.157CC..Hα-helixtrans-74.2-44.3179.4-64.63.4000112.4Y284 L285 I286 L292 F293 S296 A321 V324 L325 L344 L347Y284-W288 HydrophobicContact CD2-CD2 4.15Å; Y284-W288 AromaticContact CD2-CE3 3.79Å; Y284-W288 HydrophobicContact CD2-CE3 3.79Å; Y284-W288 AromaticContact CD2-CH2 3.5Å; Y284-W288 HydrophobicContact CD2-CH2 3.5Å; Y284-W288 AromaticContact CD2-CZ2 3.85Å; Y284-W288 HydrophobicContact CD2-CZ2 3.85Å; Y284-W288 AromaticContact CD2-CZ3 3.47Å; Y284-W288 HydrophobicContact CD2-CZ3 3.47Å; Y284-W288 VanDerWaalsContact CD2-CZ3 3.47Å; Y284-W288 HydrophobicContact CE2-CE3 4.13Å; Y284-W288 AromaticContact CE2-CH2 3.91Å; Y284-W288 HydrophobicContact CE2-CH2 3.91Å; Y284-W288 AromaticContact CE2-CZ3 3.59Å; Y284-W288 HydrophobicContact CE2-CZ3 3.59Å; Y284-W288 HydrophobicContact CG-CH2 4.44Å; L285-W288 HydrophobicContact CD1-CE3 4.1Å; L285-W288 PolarHBondContact O-N 2.93Å; I286-W288 PolarHBondContact O-N 3.09Å; I286-W288 VanDerWaalsContact O-N 3.11Å; W288-L292 CarbonylContact O-C 3.48Å; W288-L292 PolarHBondContact O-N 3.31Å; W288-F293 HydrophobicContact CB-CD1 3.92Å; W288-F293 HydrophobicContact CB-CE1 3.59Å; W288-F293 HydrophobicContact CB-CZ 3.94Å; W288-F293 AromaticContact CD2-CE1 3.9Å; W288-F293 HydrophobicContact CD2-CE1 3.9Å; W288-F293 AromaticContact CE3-CE1 3.87Å; W288-F293 HydrophobicContact CE3-CE1 3.87Å; W288-F293 HydrophobicContact CE3-CZ 4.37Å; W288-F293 HydrophobicContact CG-CD1 4.12Å; W288-F293 AromaticContact CG-CE1 3.8Å; W288-F293 HydrophobicContact CG-CE1 3.8Å; W288-F293 PolarHBondContact O-N 3.45Å; W288-S296 VanDerWaalsContact CD1-OG 3.23Å; W288-A321 HydrophobicContact CE3-CB 3.67Å; W288-A321 HydrophobicContact CZ3-CB 3.86Å; W288-V324 HydrophobicContact CH2-CB 4.36Å; W288-V324 HydrophobicContact CH2-CG1 3.88Å; W288-V324 HydrophobicContact CZ2-CG1 4.3Å; W288-V324 HydrophobicContact CZ3-CB 4.45Å; W288-V324 HydrophobicContact CZ3-CG1 4.45Å; W288-L325 HydrophobicContact CH2-CD2 4.12Å; W288-L344 HydrophobicContact CH2-CD2 4Å; W288-L344 HydrophobicContact CZ2-CB 4.12Å; W288-L344 HydrophobicContact CZ2-CD2 4.16Å; W288-L344 WeakPolarHBondContact CZ2-O 3.34Å; W288-L344 PolarHBondContact NE1-O 3.12Å; W288-L347 HydrophobicContact CZ2-CD1 4.04Å; W288-L347 HydrophobicContact CZ2-CD2 4.15Å; W288-L347 HydrophobicContact CZ2-CG 4.3Å
289L93.7Very high95.7Very high2 Ų229 Ų291%0.0114%0.138CC..Hα-helixtrans-76.9-51.8-174.7-64.5-179.6000112.1F244 L285 I286 T291 L292 L317 F318F244-L289 HydrophobicContact CE1-CD1 4.4Å; F244-L289 HydrophobicContact CE2-CB 4.2Å; F244-L289 HydrophobicContact CE2-CD1 4.07Å; F244-L289 HydrophobicContact CZ-CB 4.27Å; F244-L289 HydrophobicContact CZ-CD1 3.61Å; L285-L289 HydrophobicContact CD1-CD1 4.07Å; L285-L289 HydrophobicContact CD1-CD2 4.06Å; L285-L289 HydrophobicContact CD1-CG 3.82Å; L285-L289 HydrophobicContact CD2-CD1 3.86Å; L285-L289 HydrophobicContact CG-CD1 3.6Å; L285-L289 HydrophobicContact CG-CD2 4.5Å; L285-L289 HydrophobicContact CG-CG 3.78Å; L285-L289 WeakPolarHBondContact O-CG 3.34Å; L285-L289 PolarHBondContact O-N 3.13Å; I286-L289 PolarHBondContact O-N 3.08Å; I286-L289 VanDerWaalsContact O-N 3.12Å; L289-T291 VanDerWaalsContact C-N 3.32Å; L289-T291 PolarHBondContact O-N 2.85Å; L289-L292 PolarHBondContact O-N 3.11Å; L289-L317 HydrophobicContact CD2-CB 3.59Å; L289-L317 HydrophobicContact CD2-CD1 4.42Å; L289-F318 HydrophobicContact CD1-CD1 4.35Å; L289-F318 HydrophobicContact CD1-CE1 3.67Å; L289-F318 HydrophobicContact CD2-CD1 3.9Å; L289-F318 HydrophobicContact CD2-CE1 3.97Å; L289-F318 HydrophobicContact CG-CE1 4.49Å
290Y92Very high95.5Very high25 Ų2534.9 Ų34.910%0.09817%0.165CC..Hα-helixtrans-72.7-28.8-17092.3-101.3000112Q210 F245 I286 D287 L292Q210-Y290 WeakPolarHBondContact O-CE2 3.49Å; Q210-Y290 PolarHBondContact O-OH 3.27Å; F245-Y290 HydrophobicContact CD1-CD2 4.2Å; F245-Y290 AromaticContact CE1-CD2 3.39Å; F245-Y290 HydrophobicContact CE1-CD2 3.39Å; F245-Y290 AromaticContact CE1-CE2 3.86Å; F245-Y290 HydrophobicContact CE1-CE2 3.86Å; F245-Y290 HydrophobicContact CE1-CG 4.48Å; F245-Y290 HydrophobicContact CE2-CD2 4.48Å; F245-Y290 AromaticContact CZ-CD2 3.58Å; F245-Y290 HydrophobicContact CZ-CD2 3.58Å; F245-Y290 HydrophobicContact CZ-CE2 4.33Å; F245-Y290 VanDerWaalsContact CZ-O 3.29Å; F245-Y290 WeakPolarHBondContact CZ-O 3.39Å; I286-Y290 HydrophobicContact CG2-CD1 3.71Å; I286-Y290 HydrophobicContact CG2-CE1 4.04Å; I286-Y290 WeakPolarHBondContact O-CD1 3.28Å; I286-Y290 PolarHBondContact O-N 3.14Å; I286-Y290 VanDerWaalsContact O-N 3.07Å; D287-Y290 WeakPolarHBondContact OD1-CE1 3.33Å; Y290-L292 VanDerWaalsContact C-N 3.29Å
291T95.6Very high95.6Very high0 Ų028.9 Ų28.90%014%0.143CC..THydrogen-bonded Turntrans-87.84.6170.775.90000113.2D287 L289 F293 A294 R295D287-T291 WeakPolarHBondContact O-CB 3.35Å; D287-T291 PolarHBondContact O-OG1 3.04Å; L289-T291 VanDerWaalsContact C-N 3.32Å; L289-T291 PolarHBondContact O-N 2.85Å; T291-F293 PolarHBondContact O-N 3.25Å; T291-A294 WeakPolarHBondContact O-CB 3.3Å; T291-A294 PolarHBondContact O-N 3.35Å; T291-R295 HydrophobicContact CG2-CB 3.97Å; T291-R295 WeakPolarHBondContact OG1-CB 3.19Å; T291-R295 PolarHBondContact OG1-N 3.09Å
292L97.4Very high95.7Very high3 Ų328.4 Ų28.42%0.01614%0.139CC..THydrogen-bonded Turntrans49.743.7-176.4-57.3171.7000112.1V215 L235 L241 W288 L289 Y290 A294 W306 F309 L317V215-L292 HydrophobicContact CG1-CD1 4.22Å; V215-L292 HydrophobicContact CG2-CD1 4.43Å; L235-L292 HydrophobicContact CD1-CD1 4.45Å; L235-L292 HydrophobicContact CD2-CD1 3.63Å; L235-L292 HydrophobicContact CG-CD1 4.19Å; L241-L292 HydrophobicContact CD1-CD1 4.07Å; L241-L292 HydrophobicContact CD1-CD2 4.24Å; L241-L292 HydrophobicContact CD1-CG 4.31Å; L241-L292 HydrophobicContact CD2-CD2 3.92Å; L241-L292 HydrophobicContact CD2-CG 4.28Å; L241-L292 HydrophobicContact CG-CD2 4.49Å; W288-L292 CarbonylContact O-C 3.48Å; W288-L292 PolarHBondContact O-N 3.31Å; L289-L292 PolarHBondContact O-N 3.11Å; Y290-L292 VanDerWaalsContact C-N 3.29Å; L292-A294 PolarHBondContact O-N 2.83Å; L292-W306 HydrophobicContact CB-CZ2 3.8Å; L292-W306 HydrophobicContact CD1-CH2 4.07Å; L292-W306 HydrophobicContact CD1-CZ2 3.6Å; L292-W306 HydrophobicContact CG-CZ2 4.35Å; L292-W306 PolarHBondContact O-NE1 3.21Å; L292-F309 HydrophobicContact CD1-CE1 4.14Å; L292-F309 HydrophobicContact CD1-CZ 3.94Å; L292-L317 HydrophobicContact CD2-CD1 3.56Å; L292-L317 HydrophobicContact CD2-CD2 4.03Å; L292-L317 HydrophobicContact CD2-CG 4.44Å
293F97.9Very high95.9Very high0 Ų026 Ų260%013%0.129CC..THydrogen-bonded Turntrans61.8-1.6-174-65.8-90.3000116.4W288 T291 R295 S296 L297 V305 L317 T320 A321W288-F293 HydrophobicContact CB-CD1 3.92Å; W288-F293 HydrophobicContact CB-CE1 3.59Å; W288-F293 HydrophobicContact CB-CZ 3.94Å; W288-F293 AromaticContact CD2-CE1 3.9Å; W288-F293 HydrophobicContact CD2-CE1 3.9Å; W288-F293 AromaticContact CE3-CE1 3.87Å; W288-F293 HydrophobicContact CE3-CE1 3.87Å; W288-F293 HydrophobicContact CE3-CZ 4.37Å; W288-F293 HydrophobicContact CG-CD1 4.12Å; W288-F293 AromaticContact CG-CE1 3.8Å; W288-F293 HydrophobicContact CG-CE1 3.8Å; W288-F293 PolarHBondContact O-N 3.45Å; T291-F293 PolarHBondContact O-N 3.25Å; F293-R295 PolarHBondContact O-N 3.13Å; F293-R295 VanDerWaalsContact O-N 3.17Å; F293-S296 PolarHBondContact O-N 3.17Å; F293-L297 HydrophobicContact CB-CB 4.32Å; F293-L297 HydrophobicContact CB-CD1 3.66Å; F293-L297 HydrophobicContact CB-CG 3.91Å; F293-L297 HydrophobicContact CD1-CD1 3.6Å; F293-L297 HydrophobicContact CD1-CG 3.89Å; F293-L297 HydrophobicContact CE1-CD1 4.46Å; F293-L297 HydrophobicContact CG-CD1 3.81Å; F293-L297 HydrophobicContact CG-CG 4.3Å; F293-L297 PolarHBondContact O-N 3.37Å; F293-V305 HydrophobicContact CD2-CG1 4.07Å; F293-L317 HydrophobicContact CD2-CD2 4.11Å; F293-L317 HydrophobicContact CE2-CB 4.2Å; F293-L317 HydrophobicContact CE2-CD2 4.06Å; F293-L317 WeakPolarHBondContact CZ-O 3.44Å; F293-T320 HydrophobicContact CD1-CG2 4.2Å; F293-T320 HydrophobicContact CD2-CG2 3.94Å; F293-T320 HydrophobicContact CE1-CG2 3.85Å; F293-T320 HydrophobicContact CE2-CG2 3.6Å; F293-T320 HydrophobicContact CG-CG2 4.23Å; F293-T320 HydrophobicContact CZ-CG2 3.54Å; F293-A321 HydrophobicContact CZ-CB 3.97Å
294A97.7Very high96Very high1 Ų125.3 Ų25.31%0.00812%0.122CC..THydrogen-bonded Turntrans-63.5-26.6-174.200000113.6F176 F214 V218 T291 L292 T302F176-A294 WeakPolarHBondContact CE1-O 3.49Å; F176-A294 HydrophobicContact CZ-CB 4.1Å; F176-A294 VanDerWaalsContact CZ-O 3.31Å; F176-A294 WeakPolarHBondContact CZ-O 3.49Å; F214-A294 HydrophobicContact CB-CB 3.77Å; V218-A294 HydrophobicContact CG2-CB 3.75Å; T291-A294 WeakPolarHBondContact O-CB 3.3Å; T291-A294 PolarHBondContact O-N 3.35Å; L292-A294 PolarHBondContact O-N 2.83Å; A294-T302 HydrophobicContact CB-CG2 3.76Å
295R95.8Very high96.1Very high102 Ų10225.1 Ų25.139%0.38512%0.121SC..THydrogen-bonded Turntrans-79.1-30.5172.4-177.6178.9175.6-171.2-1.4113.4F214 D287 T291 F293F214-R295 HydrophobicContact CD1-CB 4.12Å; F214-R295 HydrophobicContact CD2-CB 4.16Å; F214-R295 HydrophobicContact CD2-CG 4.47Å; F214-R295 HydrophobicContact CE1-CB 4.18Å; F214-R295 HydrophobicContact CE1-CG 4.23Å; F214-R295 HydrophobicContact CE2-CB 4.24Å; F214-R295 HydrophobicContact CE2-CG 4.06Å; F214-R295 HydrophobicContact CG-CB 4.11Å; F214-R295 HydrophobicContact CZ-CB 4.25Å; F214-R295 HydrophobicContact CZ-CG 3.93Å; D287-R295 IonicContact OD1-CZ 3.12Å; D287-R295 IonicContact OD1-NH1 2.63Å; D287-R295 PolarHBondContact OD1-NH1 3.43Å; D287-R295 IonicContact OD2-NH1 3.4Å; T291-R295 HydrophobicContact CG2-CB 3.97Å; T291-R295 WeakPolarHBondContact OG1-CB 3.19Å; T291-R295 PolarHBondContact OG1-N 3.09Å; F293-R295 PolarHBondContact O-N 3.13Å; F293-R295 VanDerWaalsContact O-N 3.17Å
296S96.3Very high96.2Very high24 Ų2425.1 Ų25.117%0.16812%0.121CC..THydrogen-bonded Turntrans-106.7-22.7-163.2-580000114.1W288 F293W288-S296 VanDerWaalsContact CD1-OG 3.23Å; F293-S296 PolarHBondContact O-N 3.17Å
297L97.2Very high96.5Very high8 Ų822.3 Ų22.34%0.04211%0.106CC..SBendtrans-113.8151.2178.9-62.8-178.8000111.4F293 I301 T302 V305 T320 V324 L347 I351F293-L297 HydrophobicContact CB-CB 4.32Å; F293-L297 HydrophobicContact CB-CD1 3.66Å; F293-L297 HydrophobicContact CB-CG 3.91Å; F293-L297 HydrophobicContact CD1-CD1 3.6Å; F293-L297 HydrophobicContact CD1-CG 3.89Å; F293-L297 HydrophobicContact CE1-CD1 4.46Å; F293-L297 HydrophobicContact CG-CD1 3.81Å; F293-L297 HydrophobicContact CG-CG 4.3Å; F293-L297 PolarHBondContact O-N 3.37Å; L297-I301 HydrophobicContact CB-CB 4.48Å; L297-I301 HydrophobicContact CB-CG2 4.28Å; L297-I301 HydrophobicContact CD1-CG2 3.84Å; L297-T302 PolarHBondContact O-OG1 3.01Å; L297-T302 VanDerWaalsContact O-OG1 3.12Å; L297-V305 HydrophobicContact CD1-CG2 4.21Å; L297-T320 HydrophobicContact CD1-CG2 4.34Å; L297-V324 HydrophobicContact CD2-CG2 4.34Å; L297-L347 HydrophobicContact CD2-CD1 3.81Å; L297-I351 HydrophobicContact CD2-CD1 3.56Å
298P96.3Very high96.8Very high43 Ų4320.7 Ų20.728%0.27910%0.098SC..  trans-55.5142.3171-25.334.6000112.1E300 I301 T302 E349P298-E300 VanDerWaalsContact C-N 3.3Å; P298-E300 PolarHBondContact O-N 3.25Å; P298-E300 VanDerWaalsContact O-N 3.13Å; P298-I301 HydrophobicContact CG-CD1 4.27Å; P298-I301 WeakPolarHBondContact O-CA 3.42Å; P298-I301 WeakPolarHBondContact O-CB 3.42Å; P298-I301 PolarHBondContact O-N 3.35Å; P298-T302 PolarHBondContact O-N 2.81Å; P298-T302 PolarHBondContact O-OG1 3.07Å; P298-E349 VanDerWaalsContact CG-O 3.3Å; P298-E349 WeakPolarHBondContact CG-O 3.17Å
299L96.1Very high96.8Very high34 Ų3420.6 Ų20.618%0.17810%0.098CC..Hα-helixtrans-48.8-45.5-173.7176.463.1000113.9F176 L179 V218 L221 I301 T302 C303F176-L299 HydrophobicContact CE1-CB 4.24Å; F176-L299 HydrophobicContact CE1-CD1 4.31Å; F176-L299 HydrophobicContact CE2-CD1 4.3Å; F176-L299 HydrophobicContact CZ-CD1 3.98Å; L179-L299 HydrophobicContact CD1-CD2 3.85Å; V218-L299 HydrophobicContact CG2-CD1 4.19Å; L221-L299 HydrophobicContact CD1-CD1 3.75Å; L221-L299 HydrophobicContact CD1-CD2 3.59Å; L221-L299 HydrophobicContact CD1-CG 4.32Å; L299-I301 VanDerWaalsContact C-N 3.31Å; L299-I301 PolarHBondContact O-N 3.12Å; L299-T302 WeakPolarHBondContact O-CB 3.39Å; L299-T302 PolarHBondContact O-N 2.94Å; L299-C303 PolarHBondContact O-N 3.09Å; L299-C303 PolarHBondContact O-SG 2.8Å; L299-C303 VanDerWaalsContact O-SG 3.38Å
300E95Very high96.9Very high131 Ų13121.1 Ų21.161%0.61210%0.1SC*.Hα-helixtrans-62-37.9179.6-68.1-60.3151.100113P298 R304P298-E300 VanDerWaalsContact C-N 3.3Å; P298-E300 PolarHBondContact O-N 3.25Å; P298-E300 VanDerWaalsContact O-N 3.13Å; E300-R304 PolarHBondContact O-N 3.18Å
301I97.8Very high97.1Very high7 Ų722 Ų224%0.03610%0.103CC..Hα-helixtrans-71.1-45175.4-63.3-178.7000109.2L297 P298 L299 C303 R304 V305 I351 A353 L356 F357L297-I301 HydrophobicContact CB-CB 4.48Å; L297-I301 HydrophobicContact CB-CG2 4.28Å; L297-I301 HydrophobicContact CD1-CG2 3.84Å; P298-I301 HydrophobicContact CG-CD1 4.27Å; P298-I301 WeakPolarHBondContact O-CA 3.42Å; P298-I301 WeakPolarHBondContact O-CB 3.42Å; P298-I301 PolarHBondContact O-N 3.35Å; L299-I301 VanDerWaalsContact C-N 3.31Å; L299-I301 PolarHBondContact O-N 3.12Å; I301-C303 PolarHBondContact O-N 2.84Å; I301-R304 PolarHBondContact O-N 3.37Å; I301-R304 VanDerWaalsContact O-N 3.09Å; I301-V305 HydrophobicContact CG2-CG2 4.31Å; I301-V305 WeakPolarHBondContact O-CG2 3.43Å; I301-V305 PolarHBondContact O-N 3.33Å; I301-I351 HydrophobicContact CD1-CB 3.72Å; I301-I351 HydrophobicContact CD1-CG2 4.05Å; I301-A353 HydrophobicContact CD1-CB 4.1Å; I301-A353 HydrophobicContact CG1-CB 3.88Å; I301-L356 HydrophobicContact CD1-CD2 4.5Å; I301-L356 HydrophobicContact CG2-CD2 3.6Å; I301-F357 HydrophobicContact CG2-CE2 4.17Å; I301-F357 HydrophobicContact CG2-CZ 4.26Å
302T98Very high97Very high0 Ų023.9 Ų23.90%011%0.114CC..Hα-helixtrans-53-51175.2-60.40000111V218 A294 L297 P298 L299 R304 V305 W306V218-T302 HydrophobicContact CG2-CG2 4.05Å; A294-T302 HydrophobicContact CB-CG2 3.76Å; L297-T302 PolarHBondContact O-OG1 3.01Å; L297-T302 VanDerWaalsContact O-OG1 3.12Å; P298-T302 PolarHBondContact O-N 2.81Å; P298-T302 PolarHBondContact O-OG1 3.07Å; L299-T302 WeakPolarHBondContact O-CB 3.39Å; L299-T302 PolarHBondContact O-N 2.94Å; T302-R304 VanDerWaalsContact C-N 3.28Å; T302-R304 PolarHBondContact O-N 3.39Å; T302-V305 WeakPolarHBondContact O-CB 3.4Å; T302-V305 PolarHBondContact O-N 2.86Å; T302-V305 VanDerWaalsContact O-N 3.12Å; T302-W306 WeakPolarHBondContact O-CB 3.37Å; T302-W306 PolarHBondContact O-N 2.83Å
303C98.2Very high96.7Very high4 Ų425 Ų253%0.02713%0.126CC..Hα-helixtrans-58.7-38.8177.9-68.90000112.4W127 L299 I301 W306 D307W127-C303 HydrophobicContact CH2-CB 4.36Å; W127-C303 HydrophobicContact CZ2-CB 4.37Å; L299-C303 PolarHBondContact O-N 3.09Å; L299-C303 PolarHBondContact O-SG 2.8Å; L299-C303 VanDerWaalsContact O-SG 3.38Å; I301-C303 PolarHBondContact O-N 2.84Å; C303-W306 WeakPolarHBondContact O-CA 3.37Å; C303-W306 WeakPolarHBondContact O-CB 3.38Å; C303-W306 PolarHBondContact O-N 3.4Å; C303-D307 PolarHBondContact O-N 3.13Å
304R97.8Very high96.3Very high45 Ų4526.2 Ų26.217%0.1713%0.132CC..Hα-helixtrans-73.4-33176.9-173.9172.3171.8-175.46.5113E115 E300 I301 T302 L308 F357E115-R304 PolarHBondContact O-NH2 3.29Å; E115-R304 VanDerWaalsContact O-NH2 3.16Å; E300-R304 PolarHBondContact O-N 3.18Å; I301-R304 PolarHBondContact O-N 3.37Å; I301-R304 VanDerWaalsContact O-N 3.09Å; T302-R304 VanDerWaalsContact C-N 3.28Å; T302-R304 PolarHBondContact O-N 3.39Å; R304-L308 WeakPolarHBondContact O-CG 3.47Å; R304-L308 PolarHBondContact O-N 3.13Å; R304-F357 HydrophobicContact CB-CE1 4.3Å; R304-F357 HydrophobicContact CB-CE2 3.84Å; R304-F357 HydrophobicContact CB-CZ 3.51Å; R304-F357 HydrophobicContact CG-CD1 4.42Å; R304-F357 HydrophobicContact CG-CD2 4.3Å; R304-F357 HydrophobicContact CG-CE1 3.76Å; R304-F357 HydrophobicContact CG-CE2 3.68Å; R304-F357 HydrophobicContact CG-CZ 3.38Å
305V98.5Very high95.8Very high0 Ų027.1 Ų27.10%014%0.137CC..Hα-helixtrans-61.4-39.8167.8170.90000109.5F293 L297 I301 T302 L308 F309 Y316 L317 T320 F357F293-V305 HydrophobicContact CD2-CG1 4.07Å; L297-V305 HydrophobicContact CD1-CG2 4.21Å; I301-V305 HydrophobicContact CG2-CG2 4.31Å; I301-V305 WeakPolarHBondContact O-CG2 3.43Å; I301-V305 PolarHBondContact O-N 3.33Å; T302-V305 WeakPolarHBondContact O-CB 3.4Å; T302-V305 PolarHBondContact O-N 2.86Å; T302-V305 VanDerWaalsContact O-N 3.12Å; V305-L308 PolarHBondContact O-N 3.37Å; V305-F309 PolarHBondContact O-N 3.33Å; V305-Y316 HydrophobicContact CG1-CE1 4.45Å; V305-L317 HydrophobicContact CG1-CD2 4.43Å; V305-T320 HydrophobicContact CG1-CG2 3.98Å; V305-T320 HydrophobicContact CG2-CG2 3.68Å; V305-F357 HydrophobicContact CG2-CE1 4.11Å; V305-F357 HydrophobicContact CG2-CZ 3.91Å
306W98.5Very high95.7Very high0 Ų022.6 Ų22.60%012%0.12CC..Hα-helixtrans-63.1-46.5177.4-77.540.1000113.7W127 V215 V218 L219 L235 L292 T302 C303 L308 F309 L310W127-W306 HydrophobicContact CE3-CE3 4.13Å; W127-W306 HydrophobicContact CH2-CB 4.06Å; W127-W306 HydrophobicContact CH2-CD2 4.45Å; W127-W306 AromaticContact CH2-CE3 3.94Å; W127-W306 HydrophobicContact CH2-CE3 3.94Å; W127-W306 HydrophobicContact CZ2-CB 3.66Å; W127-W306 HydrophobicContact CZ2-CE3 4.46Å; W127-W306 AromaticContact CZ3-CE3 3.76Å; W127-W306 HydrophobicContact CZ3-CE3 3.76Å; W127-W306 HydrophobicContact CZ3-CZ3 4.26Å; V215-W306 HydrophobicContact CB-CH2 4.44Å; V215-W306 HydrophobicContact CG1-CH2 3.81Å; V215-W306 HydrophobicContact CG1-CZ2 4.26Å; V218-W306 HydrophobicContact CB-CE3 4.38Å; V218-W306 HydrophobicContact CB-CH2 3.67Å; V218-W306 HydrophobicContact CB-CZ2 3.85Å; V218-W306 HydrophobicContact CB-CZ3 3.96Å; V218-W306 HydrophobicContact CG1-CD2 3.63Å; V218-W306 HydrophobicContact CG1-CE3 3.5Å; V218-W306 VanDerWaalsContact CG1-CE3 3.5Å; V218-W306 HydrophobicContact CG1-CG 4.38Å; V218-W306 HydrophobicContact CG1-CH2 3.72Å; V218-W306 HydrophobicContact CG1-CZ2 3.86Å; V218-W306 HydrophobicContact CG1-CZ3 3.55Å; V218-W306 HydrophobicContact CG2-CZ2 4.26Å; L219-W306 HydrophobicContact CD2-CH2 4.5Å; L219-W306 HydrophobicContact CD2-CZ3 3.7Å; L219-W306 HydrophobicContact CG-CH2 4.16Å; L219-W306 HydrophobicContact CG-CZ3 3.8Å; L235-W306 HydrophobicContact CD2-CH2 4.17Å; L235-W306 HydrophobicContact CD2-CZ3 4.24Å; L292-W306 HydrophobicContact CB-CZ2 3.8Å; L292-W306 HydrophobicContact CD1-CH2 4.07Å; L292-W306 HydrophobicContact CD1-CZ2 3.6Å; L292-W306 HydrophobicContact CG-CZ2 4.35Å; L292-W306 PolarHBondContact O-NE1 3.21Å; T302-W306 WeakPolarHBondContact O-CB 3.37Å; T302-W306 PolarHBondContact O-N 2.83Å; C303-W306 WeakPolarHBondContact O-CA 3.37Å; C303-W306 WeakPolarHBondContact O-CB 3.38Å; C303-W306 PolarHBondContact O-N 3.4Å; W306-L308 PolarHBondContact O-N 3.15Å; W306-F309 VanDerWaalsContact CA-CE1 3.5Å; W306-F309 HydrophobicContact CB-CD1 4.12Å; W306-F309 HydrophobicContact CB-CE1 3.74Å; W306-F309 AromaticContact CD1-CD1 3.93Å; W306-F309 AromaticContact CD1-CE1 3.57Å; W306-F309 AromaticContact CD2-CE1 3.58Å; W306-F309 HydrophobicContact CD2-CE1 3.58Å; W306-F309 HydrophobicContact CD2-CZ 4.26Å; W306-F309 AromaticContact CE2-CE1 3.95Å; W306-F309 HydrophobicContact CE3-CE1 4.16Å; W306-F309 HydrophobicContact CE3-CZ 4.43Å; W306-F309 AromaticContact CG-CD1 3.99Å; W306-F309 HydrophobicContact CG-CD1 3.99Å; W306-F309 AromaticContact CG-CE1 3.37Å; W306-F309 HydrophobicContact CG-CE1 3.37Å; W306-F309 HydrophobicContact CG-CZ 4.41Å; W306-F309 AromaticContact NE1-CE1 3.91Å; W306-F309 PolarHBondContact O-N 3Å; W306-L310 WeakPolarHBondContact O-CB 3.46Å; W306-L310 VanDerWaalsContact O-CG 3.29Å; W306-L310 WeakPolarHBondContact O-CG 3.08Å; W306-L310 PolarHBondContact O-N 2.97Å
307D98.3Very high95.7Very high0 Ų021.5 Ų21.50%011%0.112CC..Hα-helixtrans-49.4-45.9172.5-64.1-19.2000110.7W114 L118 R123 W127 C303W114-D307 WeakPolarHBondContact CZ2-O 3.39Å; W114-D307 VanDerWaalsContact NE1-C 3.35Å; W114-D307 PolarHBondContact NE1-O 3.02Å; L118-D307 WeakPolarHBondContact CB-OD2 3.27Å; L118-D307 HydrophobicContact CD1-CB 4.18Å; L118-D307 WeakPolarHBondContact CD1-OD1 3.04Å; L118-D307 HydrophobicContact CG-CB 4.04Å; L118-D307 PolarHBondContact N-OD2 2.53Å; R123-D307 IonicContact NE-OD1 2.8Å; R123-D307 IonicContact NE-OD2 2.65Å; R123-D307 IonicContact NH2-OD2 3.42Å; W127-D307 PolarHBondContact NE1-OD1 3.08Å; C303-D307 PolarHBondContact O-N 3.13Å
308L97.9Very high95.5Very high4 Ų421.5 Ų21.52%0.02111%0.112CC..Hα-helixtrans-86.5-34.9-171.8-59.6177.2000113.7W114 R304 V305 W306 L310 R311 D312 Y316 F357W114-L308 WeakPolarHBondContact O-CD2 3.48Å; R304-L308 WeakPolarHBondContact O-CG 3.47Å; R304-L308 PolarHBondContact O-N 3.13Å; V305-L308 PolarHBondContact O-N 3.37Å; W306-L308 PolarHBondContact O-N 3.15Å; L308-L310 VanDerWaalsContact C-N 3.34Å; L308-R311 PolarHBondContact O-N 3.37Å; L308-D312 WeakPolarHBondContact O-CB 3.27Å; L308-D312 PolarHBondContact O-N 3.24Å; L308-Y316 HydrophobicContact CB-CD1 3.84Å; L308-Y316 HydrophobicContact CB-CD2 4.2Å; L308-Y316 HydrophobicContact CB-CE1 3.38Å; L308-Y316 HydrophobicContact CB-CE2 3.76Å; L308-Y316 HydrophobicContact CB-CG 4.24Å; L308-Y316 HydrophobicContact CD1-CE1 4.23Å; L308-Y316 HydrophobicContact CD1-CE2 4.28Å; L308-Y316 WeakPolarHBondContact CD1-OH 3.48Å; L308-Y316 HydrophobicContact CG-CE1 4.4Å; L308-F357 HydrophobicContact CD1-CD1 4.01Å; L308-F357 HydrophobicContact CD1-CE1 3.95Å
309F96.4Very high95.5Very high0 Ų019.4 Ų19.40%010%0.098CC..Hα-helixtrans-67.4-38.6174.795-114.3000111.2L235 L292 V305 W306 R311 D312 G313 Y316 L317L235-F309 HydrophobicContact CD1-CE2 3.94Å; L235-F309 HydrophobicContact CD1-CZ 4.04Å; L292-F309 HydrophobicContact CD1-CE1 4.14Å; L292-F309 HydrophobicContact CD1-CZ 3.94Å; V305-F309 PolarHBondContact O-N 3.33Å; W306-F309 VanDerWaalsContact CA-CE1 3.5Å; W306-F309 HydrophobicContact CB-CD1 4.12Å; W306-F309 HydrophobicContact CB-CE1 3.74Å; W306-F309 AromaticContact CD1-CD1 3.93Å; W306-F309 AromaticContact CD1-CE1 3.57Å; W306-F309 AromaticContact CD2-CE1 3.58Å; W306-F309 HydrophobicContact CD2-CE1 3.58Å; W306-F309 HydrophobicContact CD2-CZ 4.26Å; W306-F309 AromaticContact CE2-CE1 3.95Å; W306-F309 HydrophobicContact CE3-CE1 4.16Å; W306-F309 HydrophobicContact CE3-CZ 4.43Å; W306-F309 AromaticContact CG-CD1 3.99Å; W306-F309 HydrophobicContact CG-CD1 3.99Å; W306-F309 AromaticContact CG-CE1 3.37Å; W306-F309 HydrophobicContact CG-CE1 3.37Å; W306-F309 HydrophobicContact CG-CZ 4.41Å; W306-F309 AromaticContact NE1-CE1 3.91Å; W306-F309 PolarHBondContact O-N 3Å; F309-R311 PolarHBondContact O-N 3.08Å; F309-D312 PolarHBondContact O-N 3.25Å; F309-G313 CarbonylContact O-C 3.51Å; F309-G313 VanDerWaalsContact O-CA 3.27Å; F309-G313 WeakPolarHBondContact O-CA 3.19Å; F309-G313 PolarHBondContact O-N 2.93Å; F309-Y316 HydrophobicContact CB-CD1 3.97Å; F309-Y316 HydrophobicContact CB-CG 4.4Å; F309-L317 HydrophobicContact CB-CD2 4Å; F309-L317 HydrophobicContact CB-CG 4.39Å; F309-L317 HydrophobicContact CD1-CD2 4.17Å; F309-L317 HydrophobicContact CG-CD2 4.16Å
310L97.1Very high95.6Very high12 Ų1217.8 Ų17.86%0.0639%0.09CC..Hα-helixtrans-65.5-29.2179.2-73.7172.4000111.9W127 A130 I131 L235 W306 L308W127-L310 HydrophobicContact CB-CD1 3.78Å; W127-L310 VanDerWaalsContact CD1-CD1 3.46Å; W127-L310 HydrophobicContact CD2-CD1 3.99Å; W127-L310 HydrophobicContact CG-CD1 3.45Å; W127-L310 VanDerWaalsContact CG-CD1 3.45Å; A130-L310 HydrophobicContact CB-CB 3.95Å; I131-L310 HydrophobicContact CD1-CD1 4.4Å; I131-L310 HydrophobicContact CD1-CD2 4.12Å; I131-L310 HydrophobicContact CG1-CD1 4.33Å; I131-L310 HydrophobicContact CG1-CD2 3.42Å; I131-L310 VanDerWaalsContact CG1-CD2 3.42Å; L235-L310 HydrophobicContact CD1-CD2 4.43Å; W306-L310 WeakPolarHBondContact O-CB 3.46Å; W306-L310 VanDerWaalsContact O-CG 3.29Å; W306-L310 WeakPolarHBondContact O-CG 3.08Å; W306-L310 PolarHBondContact O-N 2.97Å; L308-L310 VanDerWaalsContact C-N 3.34Å
311R95.6Very high95.7Very high43 Ų4311.6 Ų11.616%0.1626%0.061CC..Hα-helixtrans-80.9-48.5175.2-170.9-170.172.2-171.5-0.5113.4K111 W114 L308 F309K111-R311 PolarHBondContact O-NH1 3.43Å; W114-R311 HydrophobicContact CD2-CB 3.94Å; W114-R311 VanDerWaalsContact CD2-CD 3.5Å; W114-R311 HydrophobicContact CD2-CG 3.86Å; W114-R311 HydrophobicContact CE3-CB 4.02Å; W114-R311 VanDerWaalsContact CE3-CD 3.47Å; W114-R311 HydrophobicContact CE3-CG 3.56Å; W114-R311 HydrophobicContact CH2-CB 3.73Å; W114-R311 HydrophobicContact CH2-CG 3.98Å; W114-R311 HydrophobicContact CZ2-CB 3.66Å; W114-R311 HydrophobicContact CZ2-CG 4.28Å; W114-R311 HydrophobicContact CZ3-CB 3.92Å; W114-R311 HydrophobicContact CZ3-CG 3.62Å; L308-R311 PolarHBondContact O-N 3.37Å; F309-R311 PolarHBondContact O-N 3.08Å
312D92.8Very high95.7Very high41 Ų4111.2 Ų11.222%0.2196%0.059CC..Hα-helixtrans-97.9-3.6-167.7-68.9-11.3000113.4L308 F309 Y316 R364L308-D312 WeakPolarHBondContact O-CB 3.27Å; L308-D312 PolarHBondContact O-N 3.24Å; F309-D312 PolarHBondContact O-N 3.25Å; D312-Y316 HydrophobicContact CB-CD2 4.11Å; D312-Y316 HydrophobicContact CB-CG 4.44Å; D312-R364 IonicContact OD2-CZ 3.19Å; D312-R364 IonicContact OD2-NH1 3.55Å; D312-R364 PolarHBondContact OD2-NH1 3.39Å; D312-R364 IonicContact OD2-NH2 3.98Å
313G91.6Very high95.7Very high27 Ų2711.2 Ų11.228%0.2786%0.059SC..  trans84177.4-179.600000114F309 L315 Y316F309-G313 CarbonylContact O-C 3.51Å; F309-G313 VanDerWaalsContact O-CA 3.27Å; F309-G313 WeakPolarHBondContact O-CA 3.19Å; F309-G313 PolarHBondContact O-N 2.93Å; G313-L315 PolarHBondContact O-N 3.12Å; G313-L315 VanDerWaalsContact O-N 3.1Å; G313-Y316 VanDerWaalsContact O-CB 3.23Å; G313-Y316 WeakPolarHBondContact O-CB 3.4Å; G313-Y316 PolarHBondContact O-N 3Å
314D89Confident95.7Very high25 Ų2511.1 Ų11.113%0.1346%0.058CC..THydrogen-bonded Turntrans-60.5-26.5-170-60.7-2.6000113.6R238 T240 Y316 L317 F375R238-D314 IonicContact NH1-OD1 2.78Å; T240-D314 WeakPolarHBondContact CB-OD2 3.34Å; T240-D314 HydrophobicContact CG2-CB 4.45Å; T240-D314 PolarHBondContact OG1-OD2 2.82Å; D314-Y316 PolarHBondContact O-N 3.41Å; D314-Y316 VanDerWaalsContact O-N 3.13Å; D314-L317 VanDerWaalsContact O-CB 3.26Å; D314-L317 WeakPolarHBondContact O-CB 3.42Å; D314-L317 WeakPolarHBondContact O-CG 3.31Å; D314-L317 PolarHBondContact O-N 3.48Å; D314-F375 HydrophobicContact CB-CZ 4.47Å
315L88.2Confident95.7Very high19 Ų199 Ų910%0.0995%0.05CC..Hα-helixtrans-56.7-27.6172.8-81-177.6000113.9G313 L317 F318 D319 R371 F375G313-L315 PolarHBondContact O-N 3.12Å; G313-L315 VanDerWaalsContact O-N 3.1Å; L315-L317 PolarHBondContact O-N 3.3Å; L315-F318 HydrophobicContact CD2-CD2 3.95Å; L315-F318 HydrophobicContact CD2-CE2 4.35Å; L315-F318 WeakPolarHBondContact O-CB 3.37Å; L315-F318 PolarHBondContact O-N 2.82Å; L315-D319 PolarHBondContact O-N 3.38Å; L315-D319 VanDerWaalsContact O-N 3.13Å; L315-R371 HydrophobicContact CD1-CG 3.89Å; L315-F375 HydrophobicContact CD1-CB 3.35Å; L315-F375 HydrophobicContact CD1-CD1 3.92Å; L315-F375 HydrophobicContact CD1-CD2 3.9Å; L315-F375 HydrophobicContact CD1-CG 3.46Å; L315-F375 VanDerWaalsContact CD1-CG 3.46Å; L315-F375 HydrophobicContact CD2-CB 3.81Å; L315-F375 HydrophobicContact CD2-CD2 3.11Å; L315-F375 HydrophobicContact CD2-CE2 3.73Å; L315-F375 HydrophobicContact CD2-CG 3.63Å; L315-F375 HydrophobicContact CG-CB 3.8Å; L315-F375 HydrophobicContact CG-CD1 3.97Å; L315-F375 HydrophobicContact CG-CD2 3.29Å; L315-F375 HydrophobicContact CG-CE1 4.34Å; L315-F375 HydrophobicContact CG-CE2 3.7Å; L315-F375 HydrophobicContact CG-CG 3.41Å; L315-F375 VanDerWaalsContact CG-CG 3.41Å; L315-F375 HydrophobicContact CG-CZ 4.21Å
316Y93.8Very high95.7Very high7 Ų79.1 Ų9.13%0.0275%0.051CC..Hα-helixtrans-61.8-25177-167.7-92.5000112.2V305 L308 F309 D312 G313 D314 F318 D319 T320 I360V305-Y316 HydrophobicContact CG1-CE1 4.45Å; L308-Y316 HydrophobicContact CB-CD1 3.84Å; L308-Y316 HydrophobicContact CB-CD2 4.2Å; L308-Y316 HydrophobicContact CB-CE1 3.38Å; L308-Y316 HydrophobicContact CB-CE2 3.76Å; L308-Y316 HydrophobicContact CB-CG 4.24Å; L308-Y316 HydrophobicContact CD1-CE1 4.23Å; L308-Y316 HydrophobicContact CD1-CE2 4.28Å; L308-Y316 WeakPolarHBondContact CD1-OH 3.48Å; L308-Y316 HydrophobicContact CG-CE1 4.4Å; F309-Y316 HydrophobicContact CB-CD1 3.97Å; F309-Y316 HydrophobicContact CB-CG 4.4Å; D312-Y316 HydrophobicContact CB-CD2 4.11Å; D312-Y316 HydrophobicContact CB-CG 4.44Å; G313-Y316 VanDerWaalsContact O-CB 3.23Å; G313-Y316 WeakPolarHBondContact O-CB 3.4Å; G313-Y316 PolarHBondContact O-N 3Å; D314-Y316 PolarHBondContact O-N 3.41Å; D314-Y316 VanDerWaalsContact O-N 3.13Å; Y316-F318 VanDerWaalsContact C-N 3.31Å; Y316-F318 PolarHBondContact O-N 2.95Å; Y316-D319 WeakPolarHBondContact CA-OD2 3.41Å; Y316-D319 HydrophobicContact CD2-CB 4.46Å; Y316-D319 WeakPolarHBondContact O-CB 3.05Å; Y316-D319 PolarHBondContact O-N 3.1Å; Y316-T320 VanDerWaalsContact CE1-OG1 3.28Å; Y316-T320 WeakPolarHBondContact CE1-OG1 3.4Å; Y316-T320 WeakPolarHBondContact O-CB 3.4Å; Y316-T320 PolarHBondContact O-N 2.83Å; Y316-T320 PolarHBondContact O-OG1 3.1Å; Y316-I360 HydrophobicContact CE2-CG2 4.13Å
317L95Very high95.7Very high2 Ų210.9 Ų10.91%0.016%0.062CC..Hα-helixtrans-66.7-34.8173.9-57.6173.6000111.3L289 L292 F293 V305 F309 D314 L315 T320 A321L289-L317 HydrophobicContact CD2-CB 3.59Å; L289-L317 HydrophobicContact CD2-CD1 4.42Å; L292-L317 HydrophobicContact CD2-CD1 3.56Å; L292-L317 HydrophobicContact CD2-CD2 4.03Å; L292-L317 HydrophobicContact CD2-CG 4.44Å; F293-L317 HydrophobicContact CD2-CD2 4.11Å; F293-L317 HydrophobicContact CE2-CB 4.2Å; F293-L317 HydrophobicContact CE2-CD2 4.06Å; F293-L317 WeakPolarHBondContact CZ-O 3.44Å; V305-L317 HydrophobicContact CG1-CD2 4.43Å; F309-L317 HydrophobicContact CB-CD2 4Å; F309-L317 HydrophobicContact CB-CG 4.39Å; F309-L317 HydrophobicContact CD1-CD2 4.17Å; F309-L317 HydrophobicContact CG-CD2 4.16Å; D314-L317 VanDerWaalsContact O-CB 3.26Å; D314-L317 WeakPolarHBondContact O-CB 3.42Å; D314-L317 WeakPolarHBondContact O-CG 3.31Å; D314-L317 PolarHBondContact O-N 3.48Å; L315-L317 PolarHBondContact O-N 3.3Å; L317-T320 WeakPolarHBondContact O-CB 3.26Å; L317-T320 PolarHBondContact O-N 3.11Å; L317-A321 PolarHBondContact O-N 2.96Å
318F94.2Very high95.7Very high7 Ų712.5 Ų12.53%0.0317%0.069CC..Hα-helixtrans-70.4-42.1173.8-64.7-2.2000110.9Y255 A258 Y259 Y262 L289 L315 Y316 T320 A321 L322Y255-F318 AromaticContact CD1-CZ 3.83Å; Y255-F318 HydrophobicContact CD1-CZ 3.83Å; Y255-F318 HydrophobicContact CG-CZ 4.44Å; A258-F318 HydrophobicContact CB-CE2 4.43Å; Y259-F318 HydrophobicContact CD2-CB 4.09Å; Y259-F318 HydrophobicContact CD2-CD1 4.09Å; Y259-F318 HydrophobicContact CD2-CD2 4.48Å; Y259-F318 AromaticContact CD2-CG 3.98Å; Y259-F318 HydrophobicContact CD2-CG 3.98Å; Y262-F318 HydrophobicContact CD1-CB 3.87Å; Y262-F318 HydrophobicContact CD1-CD2 4.37Å; Y262-F318 HydrophobicContact CE1-CB 3.95Å; L289-F318 HydrophobicContact CD1-CD1 4.35Å; L289-F318 HydrophobicContact CD1-CE1 3.67Å; L289-F318 HydrophobicContact CD2-CD1 3.9Å; L289-F318 HydrophobicContact CD2-CE1 3.97Å; L289-F318 HydrophobicContact CG-CE1 4.49Å; L315-F318 HydrophobicContact CD2-CD2 3.95Å; L315-F318 HydrophobicContact CD2-CE2 4.35Å; L315-F318 WeakPolarHBondContact O-CB 3.37Å; L315-F318 PolarHBondContact O-N 2.82Å; Y316-F318 VanDerWaalsContact C-N 3.31Å; Y316-F318 PolarHBondContact O-N 2.95Å; F318-T320 PolarHBondContact O-N 3.08Å; F318-A321 PolarHBondContact O-N 2.92Å; F318-L322 WeakPolarHBondContact O-CG 3.46Å; F318-L322 PolarHBondContact O-N 2.91Å
319D95.4Very high95.7Very high0 Ų014.2 Ų14.20%08%0.076CC..Hα-helixtrans-56.8-41.6173.5-56.8-32.5000110.5Y262 L315 Y316 G323 I360 R371Y262-D319 VanDerWaalsContact CE1-OD1 3.25Å; Y262-D319 WeakPolarHBondContact CE1-OD1 3.46Å; Y262-D319 VanDerWaalsContact CZ-OD1 3.28Å; Y262-D319 PolarHBondContact OH-OD1 2.82Å; L315-D319 PolarHBondContact O-N 3.38Å; L315-D319 VanDerWaalsContact O-N 3.13Å; Y316-D319 WeakPolarHBondContact CA-OD2 3.41Å; Y316-D319 HydrophobicContact CD2-CB 4.46Å; Y316-D319 WeakPolarHBondContact O-CB 3.05Å; Y316-D319 PolarHBondContact O-N 3.1Å; D319-G323 PolarHBondContact O-N 3.33Å; D319-I360 HydrophobicContact CB-CG2 3.98Å; D319-R371 IonicContact OD1-NE 3.64Å; D319-R371 PolarHBondContact OD1-NE 2.94Å; D319-R371 VanDerWaalsContact OD1-NE 3.08Å; D319-R371 IonicContact OD2-CZ 2.8Å; D319-R371 VanDerWaalsContact OD2-CZ 3.26Å; D319-R371 IonicContact OD2-NE 3.88Å; D319-R371 PolarHBondContact OD2-NE 3.33Å; D319-R371 VanDerWaalsContact OD2-NE 3.08Å; D319-R371 IonicContact OD2-NH2 3.33Å; D319-R371 PolarHBondContact OD2-NH2 3.44Å
320T97.9Very high95.8Very high0 Ų019 Ų190%011%0.11CC..Hα-helixtrans-64.7-49.5177.5-580000111.4F293 L297 V305 Y316 L317 F318 L322 G323 V324 I360F293-T320 HydrophobicContact CD1-CG2 4.2Å; F293-T320 HydrophobicContact CD2-CG2 3.94Å; F293-T320 HydrophobicContact CE1-CG2 3.85Å; F293-T320 HydrophobicContact CE2-CG2 3.6Å; F293-T320 HydrophobicContact CG-CG2 4.23Å; F293-T320 HydrophobicContact CZ-CG2 3.54Å; L297-T320 HydrophobicContact CD1-CG2 4.34Å; V305-T320 HydrophobicContact CG1-CG2 3.98Å; V305-T320 HydrophobicContact CG2-CG2 3.68Å; Y316-T320 VanDerWaalsContact CE1-OG1 3.28Å; Y316-T320 WeakPolarHBondContact CE1-OG1 3.4Å; Y316-T320 WeakPolarHBondContact O-CB 3.4Å; Y316-T320 PolarHBondContact O-N 2.83Å; Y316-T320 PolarHBondContact O-OG1 3.1Å; L317-T320 WeakPolarHBondContact O-CB 3.26Å; L317-T320 PolarHBondContact O-N 3.11Å; F318-T320 PolarHBondContact O-N 3.08Å; T320-L322 PolarHBondContact O-N 3.14Å; T320-G323 WeakPolarHBondContact O-CA 3.25Å; T320-G323 PolarHBondContact O-N 2.93Å; T320-G323 VanDerWaalsContact O-N 3.12Å; T320-V324 WeakPolarHBondContact O-CG2 3.43Å; T320-V324 PolarHBondContact O-N 3.41Å; T320-I360 HydrophobicContact CG2-CD1 4.09Å
321A98Very high95.8Very high0 Ų021.4 Ų21.40%013%0.125CC..Hα-helixtrans-58.1-45.6177.600000111.9Y259 L285 W288 F293 L317 F318 G323 V324 L325Y259-A321 HydrophobicContact CE2-CB 3.64Å; L285-A321 HydrophobicContact CD1-CB 3.7Å; W288-A321 HydrophobicContact CE3-CB 3.67Å; W288-A321 HydrophobicContact CZ3-CB 3.86Å; F293-A321 HydrophobicContact CZ-CB 3.97Å; L317-A321 PolarHBondContact O-N 2.96Å; F318-A321 PolarHBondContact O-N 2.92Å; A321-G323 VanDerWaalsContact C-N 3.33Å; A321-G323 PolarHBondContact O-N 2.94Å; A321-V324 WeakPolarHBondContact O-CB 3.38Å; A321-V324 PolarHBondContact O-N 3.39Å; A321-L325 WeakPolarHBondContact O-CG 3.39Å; A321-L325 PolarHBondContact O-N 3.28Å
322L97.6Very high96Very high0 Ų019.4 Ų19.40%012%0.118CC..Hα-helixtrans-67.9-33.3176.1-67.6175.5000112.6Y259 Y262 F263 L267 F318 T320 V324 L325 C326 V363Y259-L322 HydrophobicContact CE2-CD2 4Å; Y259-L322 HydrophobicContact CE2-CG 3.97Å; Y262-L322 HydrophobicContact CD1-CD1 3.63Å; Y262-L322 HydrophobicContact CD2-CD1 3.46Å; Y262-L322 VanDerWaalsContact CD2-CD1 3.46Å; Y262-L322 HydrophobicContact CE1-CD1 3.65Å; Y262-L322 HydrophobicContact CE2-CD1 3.34Å; Y262-L322 HydrophobicContact CG-CD1 3.55Å; F263-L322 HydrophobicContact CB-CD2 3.74Å; F263-L322 HydrophobicContact CD2-CD2 3.72Å; F263-L322 HydrophobicContact CG-CD2 3.98Å; L267-L322 HydrophobicContact CD1-CD2 4.48Å; F318-L322 WeakPolarHBondContact O-CG 3.46Å; F318-L322 PolarHBondContact O-N 2.91Å; T320-L322 PolarHBondContact O-N 3.14Å; L322-V324 VanDerWaalsContact C-N 3.34Å; L322-L325 HydrophobicContact CD2-CD1 4.34Å; L322-L325 PolarHBondContact O-N 3.16Å; L322-C326 VanDerWaalsContact O-CB 3.23Å; L322-C326 WeakPolarHBondContact O-CB 3.23Å; L322-C326 PolarHBondContact O-N 3.31Å; L322-V363 HydrophobicContact CB-CB 4.21Å; L322-V363 HydrophobicContact CB-CG1 4.34Å; L322-V363 HydrophobicContact CB-CG2 3.93Å
323G98Very high96.2Very high0 Ų020.7 Ų20.70%012%0.124CC..Hα-helixtrans-62.5-40.2172.100000112.5D319 T320 A321 C326 T327D319-G323 PolarHBondContact O-N 3.33Å; T320-G323 WeakPolarHBondContact O-CA 3.25Å; T320-G323 PolarHBondContact O-N 2.93Å; T320-G323 VanDerWaalsContact O-N 3.12Å; A321-G323 VanDerWaalsContact C-N 3.33Å; A321-G323 PolarHBondContact O-N 2.94Å; G323-C326 PolarHBondContact O-N 3.18Å; G323-T327 WeakPolarHBondContact O-CB 3.47Å; G323-T327 PolarHBondContact O-N 3.48Å; G323-T327 PolarHBondContact O-OG1 3.01Å
324V98.5Very high96.6Very high1 Ų124.7 Ų24.71%0.00614%0.143CC..Hα-helixtrans-61.6-50.8172.6172.80000110.3W288 L297 T320 A321 L322 C326 T327 Y328 L347 L356W288-V324 HydrophobicContact CH2-CB 4.36Å; W288-V324 HydrophobicContact CH2-CG1 3.88Å; W288-V324 HydrophobicContact CZ2-CG1 4.3Å; W288-V324 HydrophobicContact CZ3-CB 4.45Å; W288-V324 HydrophobicContact CZ3-CG1 4.45Å; L297-V324 HydrophobicContact CD2-CG2 4.34Å; T320-V324 WeakPolarHBondContact O-CG2 3.43Å; T320-V324 PolarHBondContact O-N 3.41Å; A321-V324 WeakPolarHBondContact O-CB 3.38Å; A321-V324 PolarHBondContact O-N 3.39Å; L322-V324 VanDerWaalsContact C-N 3.34Å; V324-C326 VanDerWaalsContact C-N 3.32Å; V324-C326 PolarHBondContact O-N 2.94Å; V324-T327 WeakPolarHBondContact O-CB 3.26Å; V324-T327 PolarHBondContact O-N 3.41Å; V324-T327 VanDerWaalsContact O-N 3.12Å; V324-Y328 HydrophobicContact CG1-CD2 4.23Å; V324-Y328 HydrophobicContact CG1-CE2 4.4Å; V324-Y328 WeakPolarHBondContact O-CD2 3.43Å; V324-Y328 PolarHBondContact O-N 2.88Å; V324-L347 HydrophobicContact CG1-CD1 3.83Å; V324-L347 HydrophobicContact CG1-CD2 3.79Å; V324-L347 HydrophobicContact CG1-CG 4.5Å; V324-L356 HydrophobicContact CB-CD1 4.49Å; V324-L356 HydrophobicContact CG2-CD1 3.84Å
325L98.4Very high97Very high0 Ų025 Ų250%015%0.145CC..Hα-helixtrans-58.8-43.5177.6-65.8-173000112.2Y259 F263 L267 L270 F274 W288 A321 L322 T327 Y328 E329 L332 L344Y259-L325 VanDerWaalsContact OH-CD1 3.27Å; Y259-L325 WeakPolarHBondContact OH-CD1 3.27Å; F263-L325 HydrophobicContact CD2-CD1 4.07Å; F263-L325 HydrophobicContact CE1-CD1 4.27Å; F263-L325 HydrophobicContact CE2-CD1 3.76Å; F263-L325 HydrophobicContact CG-CD1 4.48Å; F263-L325 HydrophobicContact CZ-CD1 3.86Å; L267-L325 HydrophobicContact CD1-CB 3.81Å; L270-L325 HydrophobicContact CD2-CB 3.93Å; F274-L325 HydrophobicContact CE2-CD2 4.35Å; F274-L325 HydrophobicContact CZ-CD2 4.33Å; W288-L325 HydrophobicContact CH2-CD2 4.12Å; A321-L325 WeakPolarHBondContact O-CG 3.39Å; A321-L325 PolarHBondContact O-N 3.28Å; L322-L325 HydrophobicContact CD2-CD1 4.34Å; L322-L325 PolarHBondContact O-N 3.16Å; L325-T327 VanDerWaalsContact C-N 3.3Å; L325-T327 PolarHBondContact O-N 2.98Å; L325-Y328 CarbonylContact O-C 3.48Å; L325-Y328 PolarHBondContact O-N 3.19Å; L325-E329 WeakPolarHBondContact O-CA 3.13Å; L325-E329 PolarHBondContact O-N 3.45Å; L325-L332 HydrophobicContact CD2-CD1 3.97Å; L325-L344 HydrophobicContact CD2-CD1 3.97Å; L325-L344 HydrophobicContact CD2-CD2 3.65Å
326C98Very high97.5Very high4 Ų427.4 Ų27.43%0.02716%0.157CC..Hα-helixtrans-65.5-33.2177.6-170.50000112.4L267 L322 G323 V324 Y328 R359 V363L267-C326 HydrophobicContact CD1-CB 4.06Å; L267-C326 HydrophobicContact CD2-CB 3.91Å; L322-C326 VanDerWaalsContact O-CB 3.23Å; L322-C326 WeakPolarHBondContact O-CB 3.23Å; L322-C326 PolarHBondContact O-N 3.31Å; G323-C326 PolarHBondContact O-N 3.18Å; V324-C326 VanDerWaalsContact C-N 3.32Å; V324-C326 PolarHBondContact O-N 2.94Å; C326-Y328 VanDerWaalsContact C-N 3.27Å; C326-Y328 PolarHBondContact O-N 2.9Å; C326-R359 HydrophobicContact CB-CB 4.32Å; C326-V363 HydrophobicContact CB-CG1 3.77Å
327T98.2Very high97.7Very high37 Ų3730.7 Ų30.723%0.22717%0.172CC..Hα-helixtrans-63.6-35.2176-59.50000111.5G323 V324 L325G323-T327 WeakPolarHBondContact O-CB 3.47Å; G323-T327 PolarHBondContact O-N 3.48Å; G323-T327 PolarHBondContact O-OG1 3.01Å; V324-T327 WeakPolarHBondContact O-CB 3.26Å; V324-T327 PolarHBondContact O-N 3.41Å; V324-T327 VanDerWaalsContact O-N 3.12Å; L325-T327 VanDerWaalsContact C-N 3.3Å; L325-T327 PolarHBondContact O-N 2.98Å
328Y98.1Very high97.9Very high34 Ų3436.1 Ų36.113%0.13320%0.201CC..THydrogen-bonded Turntrans-109.113.3-177.3-61.8-67.9000114V324 L325 C326 S330 T331 L332 F343 P348V324-Y328 HydrophobicContact CG1-CD2 4.23Å; V324-Y328 HydrophobicContact CG1-CE2 4.4Å; V324-Y328 WeakPolarHBondContact O-CD2 3.43Å; V324-Y328 PolarHBondContact O-N 2.88Å; L325-Y328 CarbonylContact O-C 3.48Å; L325-Y328 PolarHBondContact O-N 3.19Å; C326-Y328 VanDerWaalsContact C-N 3.27Å; C326-Y328 PolarHBondContact O-N 2.9Å; Y328-S330 PolarHBondContact O-N 2.77Å; Y328-T331 WeakPolarHBondContact O-CA 3.42Å; Y328-T331 WeakPolarHBondContact O-CB 3.49Å; Y328-T331 PolarHBondContact O-N 2.96Å; Y328-L332 WeakPolarHBondContact O-CG 3.27Å; Y328-L332 PolarHBondContact O-N 3.4Å; Y328-F343 HydrophobicContact CD1-CE1 4.17Å; Y328-F343 AromaticContact CD1-CZ 3.66Å; Y328-F343 HydrophobicContact CD1-CZ 3.66Å; Y328-F343 AromaticContact CD2-CE1 3.88Å; Y328-F343 HydrophobicContact CD2-CE1 3.88Å; Y328-F343 HydrophobicContact CD2-CZ 4.1Å; Y328-F343 HydrophobicContact CE1-CZ 4Å; Y328-F343 HydrophobicContact CE2-CE1 4.46Å; Y328-F343 HydrophobicContact CE2-CZ 4.4Å; Y328-F343 AromaticContact CG-CE1 3.71Å; Y328-F343 HydrophobicContact CG-CE1 3.71Å; Y328-F343 AromaticContact CG-CZ 3.71Å; Y328-F343 HydrophobicContact CG-CZ 3.71Å; Y328-P348 HydrophobicContact CE1-CG 4.13Å
329E98.2Very high98.1Very high39 Ų3942.7 Ų42.718%0.18223%0.226CC..Hα-helixtrans-53-50.2-171.4179.7174.7-170.700112.5L270 L325 T331 L332 L333L270-E329 HydrophobicContact CB-CG 4.36Å; L270-E329 HydrophobicContact CD2-CB 4.5Å; L270-E329 HydrophobicContact CD2-CG 4.36Å; L325-E329 WeakPolarHBondContact O-CA 3.13Å; L325-E329 PolarHBondContact O-N 3.45Å; E329-T331 VanDerWaalsContact C-N 3.26Å; E329-T331 PolarHBondContact O-N 3.31Å; E329-L332 PolarHBondContact O-N 3.19Å; E329-L333 HydrophobicContact CG-CD1 4.06Å; E329-L333 VanDerWaalsContact O-CG 3.3Å; E329-L333 WeakPolarHBondContact O-CG 3.36Å; E329-L333 PolarHBondContact O-N 3.33Å
330S98Very high98.2Very high101 Ų10142.7 Ų42.771%0.70623%0.226SC*.Hα-helixtrans-61.7-34.2179.5-54.50000113Y328 T334Y328-S330 PolarHBondContact O-N 2.77Å; S330-T334 WeakPolarHBondContact O-CG2 3.25Å
331T98.1Very high98.2Very high63 Ų6344.2 Ų44.239%0.38724%0.235SC..Hα-helixtrans-73.3-47.3177.3-56.80000110.5Y328 E329 L333 T334 M335Y328-T331 WeakPolarHBondContact O-CA 3.42Å; Y328-T331 WeakPolarHBondContact O-CB 3.49Å; Y328-T331 PolarHBondContact O-N 2.96Å; E329-T331 VanDerWaalsContact C-N 3.26Å; E329-T331 PolarHBondContact O-N 3.31Å; T331-L333 VanDerWaalsContact C-N 3.32Å; T331-L333 PolarHBondContact O-N 2.79Å; T331-T334 PolarHBondContact O-N 2.89Å; T331-T334 VanDerWaalsContact O-N 3.07Å; T331-T334 PolarHBondContact O-OG1 3.4Å; T331-M335 HydrophobicContact CG2-CE 3.6Å; T331-M335 HydrophobicContact CG2-SD 4.42Å
332L98.6Very high98.2Very high0 Ų050.9 Ų50.90%027%0.266CS..Hα-helixtrans-63.1-36.2-177.7-68.5167.8000112.5L270 H273 F274 L325 Y328 E329 T334 M335 V340 F343 L344L270-L332 HydrophobicContact CD1-CB 3.68Å; L270-L332 HydrophobicContact CD1-CD1 4.46Å; L270-L332 HydrophobicContact CD2-CD1 4.06Å; H273-L332 PolarHBondContact NE2-O 2.92Å; F274-L332 HydrophobicContact CE1-CB 4.38Å; F274-L332 HydrophobicContact CZ-CD1 4.33Å; L325-L332 HydrophobicContact CD2-CD1 3.97Å; Y328-L332 WeakPolarHBondContact O-CG 3.27Å; Y328-L332 PolarHBondContact O-N 3.4Å; E329-L332 PolarHBondContact O-N 3.19Å; L332-T334 PolarHBondContact O-N 3.39Å; L332-T334 VanDerWaalsContact O-N 3.11Å; L332-M335 HydrophobicContact CD2-SD 4.11Å; L332-M335 WeakPolarHBondContact O-CB 3.46Å; L332-M335 PolarHBondContact O-N 3.26Å; L332-M335 VanDerWaalsContact O-N 3.07Å; L332-V340 HydrophobicContact CD2-CG1 4.42Å; L332-V340 HydrophobicContact CD2-CG2 4.49Å; L332-F343 HydrophobicContact CD2-CD1 3.8Å; L332-F343 HydrophobicContact CD2-CE1 4.31Å; L332-L344 HydrophobicContact CD1-CD2 4.27Å; L332-L344 HydrophobicContact CD2-CD2 3.97Å; L332-L344 HydrophobicContact CD2-CG 4.26Å
333L98.5Very high98.3Very high68 Ų6852.6 Ų52.636%0.35627%0.274SS..THydrogen-bonded Turntrans-62.2-16.3175.6-74.6170000113.9L270 H273 E329 T331L270-L333 HydrophobicContact CD1-CD2 4Å; L270-L333 HydrophobicContact CD1-CG 4.01Å; H273-L333 HydrophobicContact CB-CD2 3.85Å; E329-L333 HydrophobicContact CG-CD1 4.06Å; E329-L333 VanDerWaalsContact O-CG 3.3Å; E329-L333 WeakPolarHBondContact O-CG 3.36Å; E329-L333 PolarHBondContact O-N 3.33Å; T331-L333 VanDerWaalsContact C-N 3.32Å; T331-L333 PolarHBondContact O-N 2.79Å
334T98.4Very high98.3Very high111 Ų11152.6 Ų52.668%0.68127%0.274SS*.THydrogen-bonded Turntrans-97.1-4.6177.970.20000113.6S330 T331 L332S330-T334 WeakPolarHBondContact O-CG2 3.25Å; T331-T334 PolarHBondContact O-N 2.89Å; T331-T334 VanDerWaalsContact O-N 3.07Å; T331-T334 PolarHBondContact O-OG1 3.4Å; L332-T334 PolarHBondContact O-N 3.39Å; L332-T334 VanDerWaalsContact O-N 3.11Å
335M98.6Very high98.1Very high33 Ų3355.8 Ų55.816%0.16329%0.293CS..  trans-96.2149-174.5-70.6174.9167.200111.2H273 L277 T331 L332 R339 V340 F343H273-M335 PolarHBondContact NE2-O 2.93Å; L277-M335 WeakPolarHBondContact CD1-O 3.08Å; T331-M335 HydrophobicContact CG2-CE 3.6Å; T331-M335 HydrophobicContact CG2-SD 4.42Å; L332-M335 HydrophobicContact CD2-SD 4.11Å; L332-M335 WeakPolarHBondContact O-CB 3.46Å; L332-M335 PolarHBondContact O-N 3.26Å; L332-M335 VanDerWaalsContact O-N 3.07Å; M335-R339 HydrophobicContact CB-CB 3.78Å; M335-R339 HydrophobicContact CG-CB 3.84Å; M335-R339 HydrophobicContact SD-CB 4.23Å; M335-V340 HydrophobicContact CB-CG2 3.56Å; M335-F343 HydrophobicContact CE-CB 4.22Å; M335-F343 HydrophobicContact CE-CD2 3.86Å; M335-F343 HydrophobicContact CE-CG 4.11Å; M335-F343 HydrophobicContact SD-CB 4.09Å; M335-F343 HydrophobicContact SD-CG 4.28Å
336D98.2Very high98Very high69 Ų6965 Ų6537%0.36933%0.328SS..  trans-85178.7165.654.520.7000110.6D338 R339 V340D336-D338 PolarHBondContact O-N 3.24Å; D336-R339 PolarHBondContact O-N 3.41Å; D336-R339 VanDerWaalsContact OD1-CB 3.23Å; D336-R339 WeakPolarHBondContact OD1-CB 3.47Å; D336-R339 WeakPolarHBondContact OD1-CD 3.09Å; D336-R339 WeakPolarHBondContact OD1-CG 3.47Å; D336-R339 PolarHBondContact OD1-N 2.79Å; D336-R339 VanDerWaalsContact OD1-N 3.09Å; D336-R339 IonicContact OD1-NE 3.25Å; D336-R339 IonicContact OD2-NE 2.71Å; D336-V340 WeakPolarHBondContact O-CG2 3.48Å; D336-V340 PolarHBondContact O-N 2.97Å
337F98.4Very high97.9Very high75 Ų7565.6 Ų65.633%0.32933%0.33SS..Hα-helixtrans-50.6-55-177.8173.4-94.1000112.6L277 V279 L283 R339 V340 V341L277-F337 VanDerWaalsContact O-CD2 3.25Å; L277-F337 WeakPolarHBondContact O-CD2 3.1Å; V279-F337 HydrophobicContact CG2-CD2 3.62Å; V279-F337 HydrophobicContact CG2-CE2 4.23Å; V279-F337 HydrophobicContact CG2-CG 4.46Å; L283-F337 HydrophobicContact CD1-CE2 3.84Å; L283-F337 HydrophobicContact CD1-CZ 4.05Å; F337-R339 VanDerWaalsContact C-N 3.35Å; F337-R339 PolarHBondContact O-N 3.46Å; F337-V340 PolarHBondContact O-N 3.07Å; F337-V341 HydrophobicContact CD2-CG2 4.34Å; F337-V341 HydrophobicContact CE1-CG2 4.22Å; F337-V341 HydrophobicContact CE2-CG2 3.99Å; F337-V341 HydrophobicContact CZ-CG2 3.92Å; F337-V341 WeakPolarHBondContact O-CG2 3.4Å; F337-V341 PolarHBondContact O-N 2.9Å
338D98.2Very high97.7Very high117 Ų11765.9 Ų65.963%0.62633%0.333SS*.Hα-helixtrans-61.3-43.1-175.1-65.1-50.2000111.8D336 V341 Q342D336-D338 PolarHBondContact O-N 3.24Å; D338-V341 PolarHBondContact O-N 3.46Å; D338-Q342 VanDerWaalsContact O-CB 3.24Å; D338-Q342 WeakPolarHBondContact O-CB 3.43Å; D338-Q342 PolarHBondContact O-N 3.14Å
339R98.4Very high97.4Very high145 Ų14572 Ų7255%0.54736%0.363SS..Hα-helixtrans-68-38.7178.8-69.9173.3-171.1-168.82.3112.2M335 D336 F337 F343M335-R339 HydrophobicContact CB-CB 3.78Å; M335-R339 HydrophobicContact CG-CB 3.84Å; M335-R339 HydrophobicContact SD-CB 4.23Å; D336-R339 PolarHBondContact O-N 3.41Å; D336-R339 VanDerWaalsContact OD1-CB 3.23Å; D336-R339 WeakPolarHBondContact OD1-CB 3.47Å; D336-R339 WeakPolarHBondContact OD1-CD 3.09Å; D336-R339 WeakPolarHBondContact OD1-CG 3.47Å; D336-R339 PolarHBondContact OD1-N 2.79Å; D336-R339 VanDerWaalsContact OD1-N 3.09Å; D336-R339 IonicContact OD1-NE 3.25Å; D336-R339 IonicContact OD2-NE 2.71Å; F337-R339 VanDerWaalsContact C-N 3.35Å; F337-R339 PolarHBondContact O-N 3.46Å; R339-F343 WeakPolarHBondContact O-CB 3.36Å; R339-F343 PolarHBondContact O-N 3.46Å
340V98.6Very high97.1Very high0 Ų081 Ų810%040%0.395CS..Hα-helixtrans-62.1-51.4175.8171.40000109.9F274 L277 V279 L332 M335 D336 F337 Q342 F343 L344F274-V340 HydrophobicContact CE1-CG1 3.83Å; F274-V340 HydrophobicContact CE1-CG2 4.29Å; F274-V340 HydrophobicContact CE2-CG1 4.12Å; F274-V340 HydrophobicContact CZ-CG1 3.59Å; L277-V340 HydrophobicContact CD1-CG2 4.35Å; V279-V340 HydrophobicContact CB-CG1 4.43Å; V279-V340 HydrophobicContact CG1-CG1 3.78Å; V279-V340 HydrophobicContact CG2-CB 4.17Å; V279-V340 HydrophobicContact CG2-CG1 4Å; L332-V340 HydrophobicContact CD2-CG1 4.42Å; L332-V340 HydrophobicContact CD2-CG2 4.49Å; M335-V340 HydrophobicContact CB-CG2 3.56Å; D336-V340 WeakPolarHBondContact O-CG2 3.48Å; D336-V340 PolarHBondContact O-N 2.97Å; F337-V340 PolarHBondContact O-N 3.07Å; V340-Q342 PolarHBondContact O-N 2.98Å; V340-F343 PolarHBondContact O-N 2.75Å; V340-L344 HydrophobicContact CG1-CD1 3.72Å; V340-L344 HydrophobicContact CG1-CG 4.23Å; V340-L344 WeakPolarHBondContact O-CB 3.41Å; V340-L344 WeakPolarHBondContact O-CG 3.39Å; V340-L344 PolarHBondContact O-N 3.45Å
341V98.1Very high97Very high32 Ų3277.1 Ų77.119%0.19437%0.366CS..Hα-helixtrans-61.7-46.7-178.71750000110.7L283 F337 D338 F343 L344 T345L283-V341 HydrophobicContact CD1-CG2 3.88Å; F337-V341 HydrophobicContact CD2-CG2 4.34Å; F337-V341 HydrophobicContact CE1-CG2 4.22Å; F337-V341 HydrophobicContact CE2-CG2 3.99Å; F337-V341 HydrophobicContact CZ-CG2 3.92Å; F337-V341 WeakPolarHBondContact O-CG2 3.4Å; F337-V341 PolarHBondContact O-N 2.9Å; D338-V341 PolarHBondContact O-N 3.46Å; V341-F343 VanDerWaalsContact C-N 3.32Å; V341-F343 PolarHBondContact O-N 3.13Å; V341-L344 PolarHBondContact O-N 3.47Å; V341-T345 HydrophobicContact CG1-CG2 4.24Å; V341-T345 WeakPolarHBondContact O-CB 3.5Å; V341-T345 VanDerWaalsContact O-CG2 3.23Å; V341-T345 WeakPolarHBondContact O-CG2 3.38Å; V341-T345 PolarHBondContact O-N 2.9Å; V341-T345 PolarHBondContact O-OG1 3.41Å
342Q97.8Very high96.9Very high140 Ų14079 Ų7965%0.65437%0.374SS*.Hα-helixtrans-60.5-41.2177.2-173.7-179.127.300112.3D338 V340 T345 R346D338-Q342 VanDerWaalsContact O-CB 3.24Å; D338-Q342 WeakPolarHBondContact O-CB 3.43Å; D338-Q342 PolarHBondContact O-N 3.14Å; V340-Q342 PolarHBondContact O-N 2.98Å; Q342-T345 PolarHBondContact O-OG1 3.42Å; Q342-R346 PolarHBondContact O-N 2.88Å
343F98.1Very high96.8Very high36 Ų3680.5 Ų80.516%0.15839%0.386CS..Hα-helixtrans-69.5-43.7-179.3-176.8-88.5000112.2Y328 L332 M335 R339 V340 V341 R346 L347 P348Y328-F343 HydrophobicContact CD1-CE1 4.17Å; Y328-F343 AromaticContact CD1-CZ 3.66Å; Y328-F343 HydrophobicContact CD1-CZ 3.66Å; Y328-F343 AromaticContact CD2-CE1 3.88Å; Y328-F343 HydrophobicContact CD2-CE1 3.88Å; Y328-F343 HydrophobicContact CD2-CZ 4.1Å; Y328-F343 HydrophobicContact CE1-CZ 4Å; Y328-F343 HydrophobicContact CE2-CE1 4.46Å; Y328-F343 HydrophobicContact CE2-CZ 4.4Å; Y328-F343 AromaticContact CG-CE1 3.71Å; Y328-F343 HydrophobicContact CG-CE1 3.71Å; Y328-F343 AromaticContact CG-CZ 3.71Å; Y328-F343 HydrophobicContact CG-CZ 3.71Å; L332-F343 HydrophobicContact CD2-CD1 3.8Å; L332-F343 HydrophobicContact CD2-CE1 4.31Å; M335-F343 HydrophobicContact CE-CB 4.22Å; M335-F343 HydrophobicContact CE-CD2 3.86Å; M335-F343 HydrophobicContact CE-CG 4.11Å; M335-F343 HydrophobicContact SD-CB 4.09Å; M335-F343 HydrophobicContact SD-CG 4.28Å; R339-F343 WeakPolarHBondContact O-CB 3.36Å; R339-F343 PolarHBondContact O-N 3.46Å; V340-F343 PolarHBondContact O-N 2.75Å; V341-F343 VanDerWaalsContact C-N 3.32Å; V341-F343 PolarHBondContact O-N 3.13Å; F343-R346 CarbonylContact O-C 3.57Å; F343-R346 PolarHBondContact O-N 3.25Å; F343-R346 VanDerWaalsContact O-O 3.09Å; F343-L347 HydrophobicContact CE1-CD2 4.27Å; F343-L347 PolarHBondContact O-N 2.96Å; F343-P348 HydrophobicContact CE2-CG 3.96Å; F343-P348 HydrophobicContact CZ-CG 3.87Å
344L98Very high96.6Very high0 Ų082.9 Ų82.90%040%0.399CS..Hα-helixtrans-75.8-30.8-177.1-64.2-178.7000113.1F274 Y284 W288 L325 L332 V340 V341 R346 L347F274-L344 HydrophobicContact CE2-CD1 3.81Å; F274-L344 HydrophobicContact CZ-CD1 3.87Å; Y284-L344 HydrophobicContact CD1-CD1 3.66Å; Y284-L344 HydrophobicContact CD2-CD1 4.28Å; Y284-L344 HydrophobicContact CE1-CD1 3.97Å; Y284-L344 HydrophobicContact CG-CB 4.09Å; Y284-L344 HydrophobicContact CG-CD1 3.81Å; W288-L344 HydrophobicContact CH2-CD2 4Å; W288-L344 HydrophobicContact CZ2-CB 4.12Å; W288-L344 HydrophobicContact CZ2-CD2 4.16Å; W288-L344 WeakPolarHBondContact CZ2-O 3.34Å; W288-L344 PolarHBondContact NE1-O 3.12Å; L325-L344 HydrophobicContact CD2-CD1 3.97Å; L325-L344 HydrophobicContact CD2-CD2 3.65Å; L332-L344 HydrophobicContact CD1-CD2 4.27Å; L332-L344 HydrophobicContact CD2-CD2 3.97Å; L332-L344 HydrophobicContact CD2-CG 4.26Å; V340-L344 HydrophobicContact CG1-CD1 3.72Å; V340-L344 HydrophobicContact CG1-CG 4.23Å; V340-L344 WeakPolarHBondContact O-CB 3.41Å; V340-L344 WeakPolarHBondContact O-CG 3.39Å; V340-L344 PolarHBondContact O-N 3.45Å; V341-L344 PolarHBondContact O-N 3.47Å; L344-R346 VanDerWaalsContact C-N 3.28Å; L344-L347 HydrophobicContact CD2-CD2 4.4Å
345T96.1Very high96.6Very high67 Ų6780 Ų8041%0.41138%0.378SS..Hα-helixtrans-73.5-21.3173.154.10000112.6L283 V341 Q342L283-T345 WeakPolarHBondContact O-CG2 3.27Å; V341-T345 HydrophobicContact CG1-CG2 4.24Å; V341-T345 WeakPolarHBondContact O-CB 3.5Å; V341-T345 VanDerWaalsContact O-CG2 3.23Å; V341-T345 WeakPolarHBondContact O-CG2 3.38Å; V341-T345 PolarHBondContact O-N 2.9Å; V341-T345 PolarHBondContact O-OG1 3.41Å; Q342-T345 PolarHBondContact O-OG1 3.42Å
346R95.3Very high96.5Very high194 Ų19478.4 Ų78.473%0.73237%0.37SS*.SBendtrans-137.379.9175.3-168.8180-179.4-179.6-0.1111.2Q342 F343 L344Q342-R346 PolarHBondContact O-N 2.88Å; F343-R346 CarbonylContact O-C 3.57Å; F343-R346 PolarHBondContact O-N 3.25Å; F343-R346 VanDerWaalsContact O-O 3.09Å; L344-R346 VanDerWaalsContact C-N 3.28Å
347L96.6Very high96.5Very high16 Ų1675.3 Ų75.38%0.08435%0.354CS..  trans-59.1154.2176.3-65.1175.4000111.9W288 L297 V324 F343 L344 E349 I351W288-L347 HydrophobicContact CZ2-CD1 4.04Å; W288-L347 HydrophobicContact CZ2-CD2 4.15Å; W288-L347 HydrophobicContact CZ2-CG 4.3Å; L297-L347 HydrophobicContact CD2-CD1 3.81Å; V324-L347 HydrophobicContact CG1-CD1 3.83Å; V324-L347 HydrophobicContact CG1-CD2 3.79Å; V324-L347 HydrophobicContact CG1-CG 4.5Å; F343-L347 HydrophobicContact CE1-CD2 4.27Å; F343-L347 PolarHBondContact O-N 2.96Å; L344-L347 HydrophobicContact CD2-CD2 4.4Å; L347-E349 PolarHBondContact O-N 3.06Å; L347-I351 HydrophobicContact CB-CD1 4.48Å
348P94.1Very high96.5Very high43 Ų4376 Ų7628%0.27936%0.356SS..  trans-58.1138176.1-24.735.1000112.5Y328 F343 R350 I351Y328-P348 HydrophobicContact CE1-CG 4.13Å; F343-P348 HydrophobicContact CE2-CG 3.96Å; F343-P348 HydrophobicContact CZ-CG 3.87Å; P348-R350 PolarHBondContact O-N 2.78Å; P348-I351 WeakPolarHBondContact O-CG1 3.08Å
349E90.5Very high96.4Very high162 Ų16273.8 Ų73.876%0.75734%0.339SS*.SBendtrans-62.9-28177.9-66.6179.6-178.500113.1P298 L347P298-E349 VanDerWaalsContact CG-O 3.3Å; P298-E349 WeakPolarHBondContact CG-O 3.17Å; L347-E349 PolarHBondContact O-N 3.06Å
350R92.4Very high96.4Very high230 Ų23067 Ų6787%0.86831%0.314SS*.  trans-106.4106.8178.3-64.7-174.4-177.5-162.80.6109.3P348P348-R350 PolarHBondContact O-N 2.78Å
351I95.8Very high96.2Very high19 Ų1972.9 Ų72.910%0.09734%0.336CS..  trans-118.6130.3175.1-51.4-177.9000107.4L297 I301 L347 P348 A353 L356L297-I351 HydrophobicContact CD2-CD1 3.56Å; I301-I351 HydrophobicContact CD1-CB 3.72Å; I301-I351 HydrophobicContact CD1-CG2 4.05Å; L347-I351 HydrophobicContact CB-CD1 4.48Å; P348-I351 WeakPolarHBondContact O-CG1 3.08Å; I351-A353 PolarHBondContact O-N 3.13Å; I351-A353 VanDerWaalsContact O-N 3.1Å; I351-L356 HydrophobicContact CG2-CB 4.24Å; I351-L356 HydrophobicContact CG2-CD2 4.22Å
352D96.3Very high96Very high101 Ų10174.1 Ų74.154%0.5434%0.34SS..  trans-70.5106.5171.9-175.6-29000108.7N354 E355 L356D352-N354 VanDerWaalsContact C-N 3.29Å; D352-N354 PolarHBondContact O-N 2.75Å; D352-N354 WeakPolarHBondContact OD1-CA 3.28Å; D352-N354 WeakPolarHBondContact OD1-CB 3.4Å; D352-N354 PolarHBondContact OD1-N 3.35Å; D352-E355 HydrophobicContact CB-CB 4.03Å; D352-E355 PolarHBondContact O-N 3.45Å; D352-E355 PolarHBondContact OD1-N 3.2Å; D352-E355 VanDerWaalsContact OD1-N 3.13Å; D352-L356 WeakPolarHBondContact O-CB 3.47Å; D352-L356 PolarHBondContact O-N 3.3Å
353A95.9Very high95.8Very high32 Ų3267.4 Ų67.426%0.26431%0.308SS..Hα-helixtrans-57.5-41.8179.900000111.9I301 I351 E355 L356 F357I301-A353 HydrophobicContact CD1-CB 4.1Å; I301-A353 HydrophobicContact CG1-CB 3.88Å; I351-A353 PolarHBondContact O-N 3.13Å; I351-A353 VanDerWaalsContact O-N 3.1Å; A353-E355 PolarHBondContact O-N 2.93Å; A353-L356 PolarHBondContact O-N 3.09Å; A353-F357 HydrophobicContact CB-CD2 4.45Å; A353-F357 HydrophobicContact CB-CE2 4.48Å; A353-F357 WeakPolarHBondContact O-CD2 3.37Å; A353-F357 PolarHBondContact O-N 3.09Å
354N95.1Very high95.5Very high118 Ų11868.8 Ų68.863%0.63131%0.312SS*.Hα-helixtrans-66.3-42.1-177-68.8-43.3000111.4D352 K358D352-N354 VanDerWaalsContact C-N 3.29Å; D352-N354 PolarHBondContact O-N 2.75Å; D352-N354 WeakPolarHBondContact OD1-CA 3.28Å; D352-N354 WeakPolarHBondContact OD1-CB 3.4Å; D352-N354 PolarHBondContact OD1-N 3.35Å; N354-K358 VanDerWaalsContact O-CB 3.27Å; N354-K358 WeakPolarHBondContact O-CB 3.49Å; N354-K358 PolarHBondContact O-N 3.43Å
355E97.2Very high95.1Very high50 Ų5073.1 Ų73.123%0.23434%0.343CS..Hα-helixtrans-66.9-44.2175.7-174.361.8-171.500110.8D352 A353 F357 K358 R359D352-E355 HydrophobicContact CB-CB 4.03Å; D352-E355 PolarHBondContact O-N 3.45Å; D352-E355 PolarHBondContact OD1-N 3.2Å; D352-E355 VanDerWaalsContact OD1-N 3.13Å; A353-E355 PolarHBondContact O-N 2.93Å; E355-F357 PolarHBondContact O-N 2.57Å; E355-K358 WeakPolarHBondContact O-CB 3.48Å; E355-K358 PolarHBondContact O-N 3.38Å; E355-K358 WeakPolarHBondContact OE2-CD 3.23Å; E355-K358 IonicContact OE2-NZ 3.54Å; E355-K358 PolarHBondContact OE2-NZ 3.04Å; E355-R359 HydrophobicContact CG-CG 4.43Å; E355-R359 VanDerWaalsContact O-CG 3.27Å; E355-R359 WeakPolarHBondContact O-CG 3.15Å; E355-R359 PolarHBondContact O-N 3.46Å; E355-R359 IonicContact OE1-CZ 3.64Å; E355-R359 IonicContact OE1-NE 3.69Å; E355-R359 PolarHBondContact OE1-NE 2.86Å; E355-R359 IonicContact OE1-NH2 3.08Å; E355-R359 PolarHBondContact OE1-NH2 2.87Å
356L98.3Very high94.6Very high1 Ų176 Ų761%0.00535%0.346CS..Hα-helixtrans-57.2-52.9177.1177.863.5000111.8I301 V324 I351 D352 A353 K358 R359 I360I301-L356 HydrophobicContact CD1-CD2 4.5Å; I301-L356 HydrophobicContact CG2-CD2 3.6Å; V324-L356 HydrophobicContact CB-CD1 4.49Å; V324-L356 HydrophobicContact CG2-CD1 3.84Å; I351-L356 HydrophobicContact CG2-CB 4.24Å; I351-L356 HydrophobicContact CG2-CD2 4.22Å; D352-L356 WeakPolarHBondContact O-CB 3.47Å; D352-L356 PolarHBondContact O-N 3.3Å; A353-L356 PolarHBondContact O-N 3.09Å; L356-K358 PolarHBondContact O-N 2.82Å; L356-R359 WeakPolarHBondContact O-CA 3.22Å; L356-R359 WeakPolarHBondContact O-CB 3.44Å; L356-R359 PolarHBondContact O-N 3.09Å; L356-I360 HydrophobicContact CD1-CD1 4.28Å; L356-I360 HydrophobicContact CD1-CG1 4.36Å; L356-I360 HydrophobicContact CG-CD1 3.99Å; L356-I360 HydrophobicContact CG-CG1 4.48Å; L356-I360 WeakPolarHBondContact O-CG1 3.49Å; L356-I360 PolarHBondContact O-N 3.27Å
357F97.8Very high93.8Very high4 Ų466.9 Ų66.92%0.01831%0.312CS..Hα-helixtrans-67-25.4-180-74.3-72.2000112.9I301 R304 V305 L308 A353 E355 I360 R361I301-F357 HydrophobicContact CG2-CE2 4.17Å; I301-F357 HydrophobicContact CG2-CZ 4.26Å; R304-F357 HydrophobicContact CB-CE1 4.3Å; R304-F357 HydrophobicContact CB-CE2 3.84Å; R304-F357 HydrophobicContact CB-CZ 3.51Å; R304-F357 HydrophobicContact CG-CD1 4.42Å; R304-F357 HydrophobicContact CG-CD2 4.3Å; R304-F357 HydrophobicContact CG-CE1 3.76Å; R304-F357 HydrophobicContact CG-CE2 3.68Å; R304-F357 HydrophobicContact CG-CZ 3.38Å; V305-F357 HydrophobicContact CG2-CE1 4.11Å; V305-F357 HydrophobicContact CG2-CZ 3.91Å; L308-F357 HydrophobicContact CD1-CD1 4.01Å; L308-F357 HydrophobicContact CD1-CE1 3.95Å; A353-F357 HydrophobicContact CB-CD2 4.45Å; A353-F357 HydrophobicContact CB-CE2 4.48Å; A353-F357 WeakPolarHBondContact O-CD2 3.37Å; A353-F357 PolarHBondContact O-N 3.09Å; E355-F357 PolarHBondContact O-N 2.57Å; F357-I360 HydrophobicContact CD1-CD1 3.92Å; F357-I360 HydrophobicContact CE1-CD1 4.11Å; F357-R361 WeakPolarHBondContact O-CG 3.29Å; F357-R361 PolarHBondContact O-N 2.84Å; F357-R361 PolarHBondContact O-NE 3.36Å
358K97.2Very high92.9Very high88 Ų8869.3 Ų69.338%0.38333%0.325SS..Hα-helixtrans-68.9-42.5168.6178.1-174.6164.4-157.10111.3N354 E355 L356 R361 Q362N354-K358 VanDerWaalsContact O-CB 3.27Å; N354-K358 WeakPolarHBondContact O-CB 3.49Å; N354-K358 PolarHBondContact O-N 3.43Å; E355-K358 WeakPolarHBondContact O-CB 3.48Å; E355-K358 PolarHBondContact O-N 3.38Å; E355-K358 WeakPolarHBondContact OE2-CD 3.23Å; E355-K358 IonicContact OE2-NZ 3.54Å; E355-K358 PolarHBondContact OE2-NZ 3.04Å; L356-K358 PolarHBondContact O-N 2.82Å; K358-R361 PolarHBondContact O-N 2.82Å; K358-Q362 WeakPolarHBondContact O-CG 3.27Å; K358-Q362 PolarHBondContact O-N 3.43Å
359R97.8Very high92.2Very high72 Ų7275 Ų7527%0.27235%0.345SS..Hα-helixtrans-65.1-41.4176.2-64.8-69.3169.3167.67.4112C326 E355 L356 R361 Q362 V363C326-R359 HydrophobicContact CB-CB 4.32Å; E355-R359 HydrophobicContact CG-CG 4.43Å; E355-R359 VanDerWaalsContact O-CG 3.27Å; E355-R359 WeakPolarHBondContact O-CG 3.15Å; E355-R359 PolarHBondContact O-N 3.46Å; E355-R359 IonicContact OE1-CZ 3.64Å; E355-R359 IonicContact OE1-NE 3.69Å; E355-R359 PolarHBondContact OE1-NE 2.86Å; E355-R359 IonicContact OE1-NH2 3.08Å; E355-R359 PolarHBondContact OE1-NH2 2.87Å; L356-R359 WeakPolarHBondContact O-CA 3.22Å; L356-R359 WeakPolarHBondContact O-CB 3.44Å; L356-R359 PolarHBondContact O-N 3.09Å; R359-R361 VanDerWaalsContact C-N 3.33Å; R359-R361 PolarHBondContact O-N 2.99Å; R359-Q362 WeakPolarHBondContact O-CB 3.15Å; R359-Q362 PolarHBondContact O-N 3.29Å; R359-Q362 VanDerWaalsContact O-N 3.14Å; R359-V363 PolarHBondContact O-N 3.18Å
360I97.2Very high91.5Very high1 Ų171.7 Ų71.71%0.00533%0.33CS..Hα-helixtrans-56.3-47173.5-65.6170.4000110.8Y316 D319 T320 L356 F357 Q362 V363 R364Y316-I360 HydrophobicContact CE2-CG2 4.13Å; D319-I360 HydrophobicContact CB-CG2 3.98Å; T320-I360 HydrophobicContact CG2-CD1 4.09Å; L356-I360 HydrophobicContact CD1-CD1 4.28Å; L356-I360 HydrophobicContact CD1-CG1 4.36Å; L356-I360 HydrophobicContact CG-CD1 3.99Å; L356-I360 HydrophobicContact CG-CG1 4.48Å; L356-I360 WeakPolarHBondContact O-CG1 3.49Å; L356-I360 PolarHBondContact O-N 3.27Å; F357-I360 HydrophobicContact CD1-CD1 3.92Å; F357-I360 HydrophobicContact CE1-CD1 4.11Å; I360-Q362 VanDerWaalsContact C-N 3.34Å; I360-Q362 PolarHBondContact O-N 3.3Å; I360-V363 WeakPolarHBondContact O-CG2 3.29Å; I360-V363 PolarHBondContact O-N 3.2Å; I360-R364 WeakPolarHBondContact O-CB 3.2Å; I360-R364 PolarHBondContact O-N 3.35Å
361R95.2Very high90.6Very high124 Ų12461.6 Ų61.647%0.46829%0.292SS..Hα-helixtrans-63.1-39.9176.7-72.1179.6-62.6159.6-5.6112.5E115 F357 K358 R359 S365E115-R361 WeakPolarHBondContact OE1-CD 3.43Å; F357-R361 WeakPolarHBondContact O-CG 3.29Å; F357-R361 PolarHBondContact O-N 2.84Å; F357-R361 PolarHBondContact O-NE 3.36Å; K358-R361 PolarHBondContact O-N 2.82Å; R359-R361 VanDerWaalsContact C-N 3.33Å; R359-R361 PolarHBondContact O-N 2.99Å; R361-S365 WeakPolarHBondContact O-CB 3.42Å; R361-S365 PolarHBondContact O-N 2.92Å; R361-S365 PolarHBondContact O-OG 3.25Å
362Q94.1Very high89.6Confident58 Ų5866.3 Ų66.327%0.27131%0.313SS..Hα-helixtrans-62.8-50.2176.9-73.9177-3.800111.9K358 R359 I360 R364 S365 R366K358-Q362 WeakPolarHBondContact O-CG 3.27Å; K358-Q362 PolarHBondContact O-N 3.43Å; R359-Q362 WeakPolarHBondContact O-CB 3.15Å; R359-Q362 PolarHBondContact O-N 3.29Å; R359-Q362 VanDerWaalsContact O-N 3.14Å; I360-Q362 VanDerWaalsContact C-N 3.34Å; I360-Q362 PolarHBondContact O-N 3.3Å; Q362-R364 VanDerWaalsContact C-N 3.34Å; Q362-R364 PolarHBondContact O-N 3.34Å; Q362-S365 PolarHBondContact O-N 2.89Å; Q362-S365 PolarHBondContact O-OG 3.3Å; Q362-R366 WeakPolarHBondContact O-CG 3.37Å; Q362-R366 PolarHBondContact O-N 3.45Å
363V93.4Very high88.7Confident0 Ų065.9 Ų65.90%031%0.31CS..Hα-helixtrans-62.2-43.5-179.9-62.60000111.1L267 L322 C326 R359 I360 S365 R366L267-V363 HydrophobicContact CD2-CG1 4.43Å; L322-V363 HydrophobicContact CB-CB 4.21Å; L322-V363 HydrophobicContact CB-CG1 4.34Å; L322-V363 HydrophobicContact CB-CG2 3.93Å; C326-V363 HydrophobicContact CB-CG1 3.77Å; R359-V363 PolarHBondContact O-N 3.18Å; I360-V363 WeakPolarHBondContact O-CG2 3.29Å; I360-V363 PolarHBondContact O-N 3.2Å; V363-S365 VanDerWaalsContact C-N 3.34Å; V363-S365 PolarHBondContact O-N 2.98Å; V363-R366 WeakPolarHBondContact O-CB 3.5Å; V363-R366 PolarHBondContact O-N 2.99Å; V363-R366 VanDerWaalsContact O-N 3.15Å
364R91.4Very high87.6Confident64 Ų6466.5 Ų66.524%0.24231%0.309CS..Hα-helixtrans-59.8-41.9176.7-179.6177.4167.9178.12.5112.5D312 I360 Q362 R366 V367 D368D312-R364 IonicContact OD2-CZ 3.19Å; D312-R364 IonicContact OD2-NH1 3.55Å; D312-R364 PolarHBondContact OD2-NH1 3.39Å; D312-R364 IonicContact OD2-NH2 3.98Å; I360-R364 WeakPolarHBondContact O-CB 3.2Å; I360-R364 PolarHBondContact O-N 3.35Å; Q362-R364 VanDerWaalsContact C-N 3.34Å; Q362-R364 PolarHBondContact O-N 3.34Å; R364-R366 PolarHBondContact O-N 2.91Å; R364-V367 PolarHBondContact O-N 3.28Å; R364-D368 PolarHBondContact O-N 3.33Å
365S89.2Confident86.4Confident91 Ų9163.1 Ų63.164%0.63629%0.289SS*.Hα-helixtrans-65.2-21.5179.872.30000114.2R361 Q362 V363 V367R361-S365 WeakPolarHBondContact O-CB 3.42Å; R361-S365 PolarHBondContact O-N 2.92Å; R361-S365 PolarHBondContact O-OG 3.25Å; Q362-S365 PolarHBondContact O-N 2.89Å; Q362-S365 PolarHBondContact O-OG 3.3Å; V363-S365 VanDerWaalsContact C-N 3.34Å; V363-S365 PolarHBondContact O-N 2.98Å; S365-V367 VanDerWaalsContact C-N 3.34Å
366R86Confident85.3Confident129 Ų12963.3 Ų63.349%0.48730%0.295SS..THydrogen-bonded Turntrans-77.3-18.7-178-70.1173.9-175.6178.72113.5S266 Q362 V363 R364S266-R366 PolarHBondContact O-NH1 3.03Å; Q362-R366 WeakPolarHBondContact O-CG 3.37Å; Q362-R366 PolarHBondContact O-N 3.45Å; V363-R366 WeakPolarHBondContact O-CB 3.5Å; V363-R366 PolarHBondContact O-N 2.99Å; V363-R366 VanDerWaalsContact O-N 3.15Å; R364-R366 PolarHBondContact O-N 2.91Å
367V78.7Confident84.1Confident2 Ų270.8 Ų70.81%0.01232%0.323CS..SBendtrans-139.712.4-163.5-63.70000114Y262 L265 S266 R364 S365 K369 E370 R371Y262-V367 HydrophobicContact CD2-CB 4.23Å; Y262-V367 HydrophobicContact CD2-CG1 4.09Å; Y262-V367 HydrophobicContact CD2-CG2 3.87Å; Y262-V367 HydrophobicContact CE2-CB 3.83Å; Y262-V367 HydrophobicContact CE2-CG1 3.88Å; Y262-V367 HydrophobicContact CE2-CG2 3.03Å; Y262-V367 WeakPolarHBondContact OH-CG2 3.48Å; L265-V367 HydrophobicContact CB-CG1 3.83Å; S266-V367 WeakPolarHBondContact OG-CG1 3.5Å; R364-V367 PolarHBondContact O-N 3.28Å; S365-V367 VanDerWaalsContact C-N 3.34Å; V367-K369 PolarHBondContact O-N 3.47Å; V367-E370 PolarHBondContact O-N 3.04Å; V367-E370 VanDerWaalsContact O-N 3.09Å; V367-R371 HydrophobicContact CG2-CB 4.25Å; V367-R371 WeakPolarHBondContact O-CB 3.24Å; V367-R371 PolarHBondContact O-N 2.91Å
368D77.6Confident82.9Confident66 Ų6671.4 Ų71.435%0.35333%0.327SS..Hα-helixtrans-58.6-31.1-162.4-167.742.7000113.1R364 R371 Q372R364-D368 PolarHBondContact O-N 3.33Å; D368-R371 IonicContact OD1-NH1 3.86Å; D368-Q372 WeakPolarHBondContact O-CG 3.44Å; D368-Q372 PolarHBondContact O-N 2.97Å
369K78.1Confident81.4Confident162 Ų16270 Ų7070%0.70433%0.326SS*.Hα-helixtrans-73.1-50.1175.7-67.4-177.7179.7178.90112V367 R371 Q372 I373V367-K369 PolarHBondContact O-N 3.47Å; K369-R371 VanDerWaalsContact C-N 3.28Å; K369-R371 PolarHBondContact O-N 3.28Å; K369-Q372 PolarHBondContact O-N 2.91Å; K369-I373 WeakPolarHBondContact O-CG1 3.46Å; K369-I373 PolarHBondContact O-N 3.01Å
370E77.2Confident79.7Confident93 Ų9370.7 Ų70.744%0.43533%0.334SS..Hα-helixtrans-62.1-39.7179.9-65.876.1-170.700110.7L265 V367 Q372 I373 L374L265-E370 HydrophobicContact CD1-CB 4Å; L265-E370 HydrophobicContact CD1-CG 4.16Å; V367-E370 PolarHBondContact O-N 3.04Å; V367-E370 VanDerWaalsContact O-N 3.09Å; E370-Q372 PolarHBondContact O-N 3.02Å; E370-I373 PolarHBondContact O-N 2.67Å; E370-L374 VanDerWaalsContact O-CB 3.24Å; E370-L374 WeakPolarHBondContact O-CB 3.44Å; E370-L374 PolarHBondContact O-N 3.48Å
371R73.3Confident77.9Confident19 Ų1974.6 Ų74.67%0.07236%0.355CS..Hα-helixtrans-55.2-47.2176176.2178.3173.2-93.3-4.8112.3L315 D319 V367 D368 K369 F375L315-R371 HydrophobicContact CD1-CG 3.89Å; D319-R371 IonicContact OD1-NE 3.64Å; D319-R371 PolarHBondContact OD1-NE 2.94Å; D319-R371 VanDerWaalsContact OD1-NE 3.08Å; D319-R371 IonicContact OD2-CZ 2.8Å; D319-R371 VanDerWaalsContact OD2-CZ 3.26Å; D319-R371 IonicContact OD2-NE 3.88Å; D319-R371 PolarHBondContact OD2-NE 3.33Å; D319-R371 VanDerWaalsContact OD2-NE 3.08Å; D319-R371 IonicContact OD2-NH2 3.33Å; D319-R371 PolarHBondContact OD2-NH2 3.44Å; V367-R371 HydrophobicContact CG2-CB 4.25Å; V367-R371 WeakPolarHBondContact O-CB 3.24Å; V367-R371 PolarHBondContact O-N 2.91Å; D368-R371 IonicContact OD1-NH1 3.86Å; K369-R371 VanDerWaalsContact C-N 3.28Å; K369-R371 PolarHBondContact O-N 3.28Å; R371-F375 PolarHBondContact O-N 3.27Å
372Q75.4Confident75.9Confident118 Ų11871 Ų7155%0.55134%0.342SS*.Hα-helixtrans-67.8-43.1-179.7-69.9176.519.900112D368 K369 E370 S376D368-Q372 WeakPolarHBondContact O-CG 3.44Å; D368-Q372 PolarHBondContact O-N 2.97Å; K369-Q372 PolarHBondContact O-N 2.91Å; E370-Q372 PolarHBondContact O-N 3.02Å; Q372-S376 PolarHBondContact O-N 3.21Å
373I77.4Confident73.6Confident92 Ų9273.5 Ų73.547%0.47236%0.356SS..Hα-helixtrans-64.8-41.3179.3-64.9167.4000111.2K369 E370 F375 S376 R377K369-I373 WeakPolarHBondContact O-CG1 3.46Å; K369-I373 PolarHBondContact O-N 3.01Å; E370-I373 PolarHBondContact O-N 2.67Å; I373-F375 VanDerWaalsContact C-N 3.34Å; I373-S376 PolarHBondContact O-OG 3.29Å; I373-R377 WeakPolarHBondContact O-CG 3.36Å; I373-R377 PolarHBondContact O-N 3.33Å
374L72.6Confident71.1Confident44 Ų4478.3 Ų78.323%0.2339%0.385CS..Hα-helixtrans-71.4-34.4-175.1-156.3135.5000111.3A258 T261 E370 L378A258-L374 HydrophobicContact CB-CD2 3.37Å; T261-L374 HydrophobicContact CG2-CD1 3.5Å; T261-L374 VanDerWaalsContact CG2-CD1 3.5Å; E370-L374 VanDerWaalsContact O-CB 3.24Å; E370-L374 WeakPolarHBondContact O-CB 3.44Å; E370-L374 PolarHBondContact O-N 3.48Å; L374-L378 PolarHBondContact O-N 3.27Å
375F69.5Low68.6Low48 Ų4881.9 Ų81.921%0.21141%0.407CS..Hα-helixtrans-78-35.4175.9-162.6-107.7000114.1D314 L315 R371 I373 R377 L378 V379D314-F375 HydrophobicContact CB-CZ 4.47Å; L315-F375 HydrophobicContact CD1-CB 3.35Å; L315-F375 HydrophobicContact CD1-CD1 3.92Å; L315-F375 HydrophobicContact CD1-CD2 3.9Å; L315-F375 HydrophobicContact CD1-CG 3.46Å; L315-F375 VanDerWaalsContact CD1-CG 3.46Å; L315-F375 HydrophobicContact CD2-CB 3.81Å; L315-F375 HydrophobicContact CD2-CD2 3.11Å; L315-F375 HydrophobicContact CD2-CE2 3.73Å; L315-F375 HydrophobicContact CD2-CG 3.63Å; L315-F375 HydrophobicContact CG-CB 3.8Å; L315-F375 HydrophobicContact CG-CD1 3.97Å; L315-F375 HydrophobicContact CG-CD2 3.29Å; L315-F375 HydrophobicContact CG-CE1 4.34Å; L315-F375 HydrophobicContact CG-CE2 3.7Å; L315-F375 HydrophobicContact CG-CG 3.41Å; L315-F375 VanDerWaalsContact CG-CG 3.41Å; L315-F375 HydrophobicContact CG-CZ 4.21Å; R371-F375 PolarHBondContact O-N 3.27Å; I373-F375 VanDerWaalsContact C-N 3.34Å; F375-R377 PolarHBondContact O-N 3.03Å; F375-L378 HydrophobicContact CD2-CB 4.35Å; F375-L378 HydrophobicContact CD2-CD1 3.79Å; F375-L378 HydrophobicContact CE2-CD1 4.36Å; F375-L378 WeakPolarHBondContact O-CB 3.36Å; F375-L378 PolarHBondContact O-N 3.4Å; F375-V379 HydrophobicContact CD1-CG2 3.8Å; F375-V379 HydrophobicContact CE1-CG2 3.53Å; F375-V379 HydrophobicContact CZ-CG2 4.06Å; F375-V379 WeakPolarHBondContact O-CG2 3.26Å; F375-V379 PolarHBondContact O-N 3.26Å
376S73.2Confident66.3Low53 Ų5382 Ų8237%0.37141%0.413SS..Hα-helixtrans-56.9-39.9174.369.20000110.1Q372 I373 V379 D380Q372-S376 PolarHBondContact O-N 3.21Å; I373-S376 PolarHBondContact O-OG 3.29Å; S376-V379 PolarHBondContact O-N 2.95Å; S376-D380 VanDerWaalsContact O-CB 3.31Å; S376-D380 WeakPolarHBondContact O-CB 3.32Å; S376-D380 PolarHBondContact O-N 3.03Å
377R73.4Confident63.6Low159 Ų15981.5 Ų81.560%0.645%0.448SS*.Hα-helixtrans-62-45.3172.5-67176.1-177.8179.40.4113.3I373 F375 V379 D380 D381I373-R377 WeakPolarHBondContact O-CG 3.36Å; I373-R377 PolarHBondContact O-N 3.33Å; F375-R377 PolarHBondContact O-N 3.03Å; R377-V379 PolarHBondContact O-N 3.19Å; R377-D380 PolarHBondContact O-N 2.98Å; R377-D381 VanDerWaalsContact O-CB 3.27Å; R377-D381 WeakPolarHBondContact O-CB 3.34Å; R377-D381 PolarHBondContact O-N 3.06Å
378L72.6Confident62.9Low17 Ų1785.5 Ų85.59%0.08947%0.47CS..Hα-helixtrans-58-34.6176.3-78.3173.6000113R254 Y255 A258 L374 F375R254-L378 HydrophobicContact CB-CD2 3.99Å; Y255-L378 HydrophobicContact CD1-CD1 4.18Å; Y255-L378 HydrophobicContact CE1-CD1 4.38Å; A258-L378 HydrophobicContact CB-CD1 3.49Å; A258-L378 VanDerWaalsContact CB-CD1 3.49Å; A258-L378 HydrophobicContact CB-CD2 3.94Å; A258-L378 HydrophobicContact CB-CG 3.99Å; L374-L378 PolarHBondContact O-N 3.27Å; F375-L378 HydrophobicContact CD2-CB 4.35Å; F375-L378 HydrophobicContact CD2-CD1 3.79Å; F375-L378 HydrophobicContact CE2-CD1 4.36Å; F375-L378 WeakPolarHBondContact O-CB 3.36Å; F375-L378 PolarHBondContact O-N 3.4Å
379V66.7Low62.1Low59 Ų5986.5 Ų86.536%0.35848%0.476SS..Hα-helixtrans-81.7-45.7179.1177.20000111.3F375 S376 R377 D381 R382 I383F375-V379 HydrophobicContact CD1-CG2 3.8Å; F375-V379 HydrophobicContact CE1-CG2 3.53Å; F375-V379 HydrophobicContact CZ-CG2 4.06Å; F375-V379 WeakPolarHBondContact O-CG2 3.26Å; F375-V379 PolarHBondContact O-N 3.26Å; S376-V379 PolarHBondContact O-N 2.95Å; R377-V379 PolarHBondContact O-N 3.19Å; V379-D381 VanDerWaalsContact C-N 3.33Å; V379-D381 PolarHBondContact O-N 3.22Å; V379-R382 WeakPolarHBondContact O-CB 3.31Å; V379-R382 PolarHBondContact O-N 3.24Å; V379-I383 HydrophobicContact CG1-CD1 4.39Å; V379-I383 PolarHBondContact O-N 3.38Å
380D62.5Low61.2Low85 Ų8582.3 Ų82.346%0.45546%0.463SS..Hα-helixtrans-63.2-38.2-179.5-68.5-24.7000111.8S376 R377 R382 I383 T384S376-D380 VanDerWaalsContact O-CB 3.31Å; S376-D380 WeakPolarHBondContact O-CB 3.32Å; S376-D380 PolarHBondContact O-N 3.03Å; R377-D380 PolarHBondContact O-N 2.98Å; D380-R382 PolarHBondContact O-N 3.22Å; D380-I383 PolarHBondContact O-N 2.96Å; D380-T384 PolarHBondContact O-N 3.46Å; D380-T384 VanDerWaalsContact O-N 3.07Å; D380-T384 PolarHBondContact O-OG1 2.9Å
381D57.5Low60.3Low83 Ų8381.7 Ų81.744%0.44447%0.465SS..Hα-helixtrans-69.2-11.3176.2-69.9-14.4000113.2R254 R377 V379 T384 M385R254-D381 PolarHBondContact NH1-O 3.39Å; R377-D381 VanDerWaalsContact O-CB 3.27Å; R377-D381 WeakPolarHBondContact O-CB 3.34Å; R377-D381 PolarHBondContact O-N 3.06Å; V379-D381 VanDerWaalsContact C-N 3.33Å; V379-D381 PolarHBondContact O-N 3.22Å; D381-T384 VanDerWaalsContact CA-OG1 3.32Å; D381-T384 WeakPolarHBondContact CA-OG1 3.27Å; D381-M385 VanDerWaalsContact O-CG 3.26Å; D381-M385 WeakPolarHBondContact O-CG 3.39Å
382R53.6Low59.5Low48 Ų4885.6 Ų85.618%0.18149%0.49CS..Hα-helixtrans-89-41.5169.6-71.1177.4-179-115.4-13.8111.7P239 D251 Y255 V379 D380 T384 M385 A386P239-R382 PolarHBondContact O-NH1 3.11Å; D251-R382 IonicContact OD2-NH2 3.95Å; Y255-R382 PolarHBondContact OH-NH2 2.82Å; V379-R382 WeakPolarHBondContact O-CB 3.31Å; V379-R382 PolarHBondContact O-N 3.24Å; D380-R382 PolarHBondContact O-N 3.22Å; R382-T384 VanDerWaalsContact C-N 3.25Å; R382-T384 PolarHBondContact O-N 3.06Å; R382-M385 PolarHBondContact O-N 3.21Å; R382-A386 WeakPolarHBondContact O-CB 3.45Å; R382-A386 PolarHBondContact O-N 3.43Å
383I45.5Very low58.4Low112 Ų11283.5 Ų83.557%0.57449%0.485SS*.Hα-helixtrans-61.4-39.2178-62.5172.3000110.1V379 D380 M385V379-I383 HydrophobicContact CG1-CD1 4.39Å; V379-I383 PolarHBondContact O-N 3.38Å; D380-I383 PolarHBondContact O-N 2.96Å; I383-M385 VanDerWaalsContact C-N 3.34Å; I383-M385 PolarHBondContact O-N 3.07Å
384T41.3Very low57Low100 Ų10082.9 Ų82.961%0.61349%0.486SS*.Hα-helixtrans-72.3-19.5178.543.50000115D380 D381 R382D380-T384 PolarHBondContact O-N 3.46Å; D380-T384 VanDerWaalsContact O-N 3.07Å; D380-T384 PolarHBondContact O-OG1 2.9Å; D381-T384 VanDerWaalsContact CA-OG1 3.32Å; D381-T384 WeakPolarHBondContact CA-OG1 3.27Å; R382-T384 VanDerWaalsContact C-N 3.25Å; R382-T384 PolarHBondContact O-N 3.06Å
385M39.5Very low55.8Low140 Ų14085.8 Ų85.869%0.6951%0.506SS*.Hα-helixtrans-98.6-20.1178.1-70.5-85.7-68.900113D381 R382 I383D381-M385 VanDerWaalsContact O-CG 3.26Å; D381-M385 WeakPolarHBondContact O-CG 3.39Å; R382-M385 PolarHBondContact O-N 3.21Å; I383-M385 VanDerWaalsContact C-N 3.34Å; I383-M385 PolarHBondContact O-N 3.07Å
386A40.2Very low54.7Low93 Ų9389 Ų8977%0.76953%0.531SS*.Hα-helixtrans-89.1-12.2-179.800000113.8R382R382-A386 WeakPolarHBondContact O-CB 3.45Å; R382-A386 PolarHBondContact O-N 3.43Å
387G30.2Very low53Low119 Ų11992.3 Ų92.3100%1.22755%0.545SS*.  trans-96.80167.900000111

Retrieved 387 of 387 residues in 176.9 ms (Link to these results)